data_RS4223_OE166V_SGS4_2_4_refine _cell.volume 273829.576 _cell.length_a 46.184 _cell.length_b 53.461 _cell.length_c 113.242 _cell.angle_beta 101.660 _cell.angle_gamma 90.000 _cell.angle_alpha 90.000 _space_group.name_H-M_alt 'P 1 21 1' _space_group.name_Hall ' P 2yb' _space_group.IT_number 4 _space_group.crystal_system monoclinic _symmetry.Int_Tables_number 4 _symmetry.space_group_name_H-M 'P 1 21 1' _symmetry.space_group_name_Hall ' P 2yb' _reflns.B_iso_Wilson_estimate 29.34 _refine.ls_percent_reflns_R_free 4.67 _refine.pdbx_overall_phase_error 28.0598 _refine.solvent_model_details 'FLAT BULK SOLVENT MODEL' _refine.pdbx_ls_cross_valid_method 'FREE R-VALUE' _refine.pdbx_refine_id 'X-RAY DIFFRACTION' _refine.ls_R_factor_obs 0.2014 _refine.B_iso_mean 34.13 _refine.ls_number_reflns_R_free 1372 _refine.ls_percent_reflns_obs 98.29 _refine.ls_R_factor_R_work 0.1991 _refine.pdbx_solvent_shrinkage_radii 0.9000 _refine.ls_d_res_high 2.15 _refine.ls_number_reflns_obs 29367 _refine.pdbx_ls_sigma_F 1.33 _refine.ls_number_reflns_R_work 27995 _refine.ls_d_res_low 34.53 _refine.pdbx_stereochemistry_target_values 'GeoStd + Monomer Library + CDL v1.2' _refine.ls_R_factor_R_free 0.2490 _refine.overall_SU_ML 0.3202 _refine.pdbx_solvent_vdw_probe_radii 1.1000 _exptl.method 'X-RAY DIFFRACTION' loop_ _space_group_symop.id _space_group_symop.operation_xyz 1 x,y,z 2 -x,y+1/2,-z loop_ _software.pdbx_ordinal _software.name _software.version _software.type _software.contact_author _software.contact_author_email _software.location _software.classification _software.citation_id _software.language 1 phenix.refine 1.20.1_4487 program 'Paul D. Adams' pdadams@lbl.gov https://www.phenix-online.org/ refinement phenix.refine Python/C++ 2 Phenix 1.20.1_4487 program 'Paul D. Adams' pdadams@lbl.gov https://www.phenix-online.org/ refinement phenix Python/C++ loop_ _citation.id _citation.title _citation.journal_abbrev _citation.journal_volume _citation.page_first _citation.page_last _citation.year _citation.journal_id_ASTM _citation.journal_id_ISSN _citation.journal_id_CSD phenix.refine 'Towards automated crystallographic structure refinement with phenix.refine.' 'Acta Crystallogr., Sect. D: Biol. Crystallogr.' 68 352 67 2012 ABCRE6 0907-4449 0766 phenix 'Macromolecular structure determination using X-rays, neutrons and electrons: recent developments in Phenix' 'Acta Crystallogr., Sect. D: Biol. Crystallogr.' 75 861 877 2019 ABCRE6 0907-4449 0766 loop_ _refine_ls_restr.pdbx_refine_id _refine_ls_restr.type _refine_ls_restr.number _refine_ls_restr.dev_ideal _refine_ls_restr.weight _refine_ls_restr.pdbx_restraint_function 'X-RAY DIFFRACTION' f_bond_d 4923 0.0036 ? ? 'X-RAY DIFFRACTION' f_angle_d 6702 0.5695 ? ? 'X-RAY DIFFRACTION' f_chiral_restr 752 0.0429 ? ? 'X-RAY DIFFRACTION' f_plane_restr 866 0.0042 ? ? 'X-RAY DIFFRACTION' f_dihedral_angle_d 1739 13.8710 ? ? loop_ _refine_ls_shell.pdbx_refine_id _refine_ls_shell.d_res_high _refine_ls_shell.d_res_low _refine_ls_shell.number_reflns_R_work _refine_ls_shell.R_factor_R_work _refine_ls_shell.percent_reflns_obs _refine_ls_shell.R_factor_R_free _refine_ls_shell.number_reflns_R_free 'X-RAY DIFFRACTION' 4.62 34.53 2884 0.1736 98.15 0.1829 144 'X-RAY DIFFRACTION' 3.67 4.62 2859 0.1461 99.17 0.2039 124 'X-RAY DIFFRACTION' 3.21 3.67 2818 0.1793 98.93 0.2121 144 'X-RAY DIFFRACTION' 2.91 3.21 2804 0.1978 99.36 0.2798 132 'X-RAY DIFFRACTION' 2.70 2.91 2793 0.2294 98.60 0.2602 166 'X-RAY DIFFRACTION' 2.54 2.70 2789 0.2406 98.28 0.3067 121 'X-RAY DIFFRACTION' 2.42 2.54 2807 0.2476 98.75 0.3330 118 'X-RAY DIFFRACTION' 2.31 2.42 2777 0.2633 98.82 0.3322 147 'X-RAY DIFFRACTION' 2.22 2.31 2704 0.2729 97.18 0.3496 159 'X-RAY DIFFRACTION' 2.15 2.22 2760 0.2684 95.74 0.3254 117 loop_ _pdbx_refine_tls.id _pdbx_refine_tls.details _pdbx_refine_tls.pdbx_refine_id _pdbx_refine_tls.method _pdbx_refine_tls.origin_x _pdbx_refine_tls.origin_y _pdbx_refine_tls.origin_z _pdbx_refine_tls.T[1][1] _pdbx_refine_tls.T[2][2] _pdbx_refine_tls.T[3][3] _pdbx_refine_tls.T[1][2] _pdbx_refine_tls.T[1][3] _pdbx_refine_tls.T[2][3] _pdbx_refine_tls.L[1][1] _pdbx_refine_tls.L[2][2] _pdbx_refine_tls.L[3][3] _pdbx_refine_tls.L[1][2] _pdbx_refine_tls.L[1][3] _pdbx_refine_tls.L[2][3] _pdbx_refine_tls.S[1][1] _pdbx_refine_tls.S[1][2] _pdbx_refine_tls.S[1][3] _pdbx_refine_tls.S[2][1] _pdbx_refine_tls.S[2][2] _pdbx_refine_tls.S[2][3] _pdbx_refine_tls.S[3][1] _pdbx_refine_tls.S[3][2] _pdbx_refine_tls.S[3][3] 1 ? 'X-RAY DIFFRACTION' refined -6.80405992064 12.5280012018 -42.2074722252 0.244311772366 0.1954888569 0.26881716404 0.0170290922493 0.00167751897464 0.0160910999747 2.28041997337 2.18579151069 3.7230301659 -0.259300863729 1.5713488839 -0.177562194396 -0.172183270116 -0.0910918487264 0.291567128635 -0.0800373494335 0.0140202094423 0.329126463629 -0.322292877718 -0.268521309981 0.141015089126 2 ? 'X-RAY DIFFRACTION' refined 0.525411628013 1.81224888101 -36.4972875846 0.197877954848 0.180774868552 0.242607649601 -0.00475428228712 0.00660858054884 0.00417124689962 2.54170871231 2.69310795274 3.98345929785 -0.697968581505 1.23794374901 0.969635656578 -0.111864298518 -0.0926214318813 0.0166161545023 0.217862402101 0.122425492098 -0.267519257572 0.0343941855511 0.0394488746485 -0.0239135752731 3 ? 'X-RAY DIFFRACTION' refined 1.0334072806 -4.46013528069 -43.5745927069 0.187763721847 0.174965283292 0.17685749674 -0.00998329776805 0.0470487725465 0.00445375804771 1.92360366152 1.00551809319 0.832439085004 -0.901017144862 0.847754944167 0.167445435136 -0.0219312712613 0.118510092897 -0.0738385610214 -0.151416544382 -0.0147603719884 0.0238786924465 0.0558821408114 0.025159005576 0.0142328882411 4 ? 'X-RAY DIFFRACTION' refined 18.4642217322 -15.7301685332 -38.6362191889 0.267900842759 0.258629086022 0.266528222978 0.0444798240946 -0.0103443277888 -0.00604398855512 3.66829991081 2.65653650877 5.2095458763 0.811100285341 1.12783789314 0.370320666277 0.126701654401 0.0177788605813 -0.161626341976 0.211194314905 0.19717495793 -0.0486643014869 0.52443074447 0.377064597359 -0.21327100671 5 ? 'X-RAY DIFFRACTION' refined 16.5790327224 9.45846052099 -13.7662542162 0.169960278118 0.180605013662 0.182171117057 -0.00360760146359 0.0294955214747 -0.00262287199298 1.79731316994 2.02924775193 2.61479677479 0.753188061099 1.11073123388 0.613189797807 -0.0832637789937 0.0611834584699 0.0606676465069 -0.0789746700542 0.0181690835209 -0.0721428409316 -0.214372314849 0.16022321667 0.0475856890181 6 ? 'X-RAY DIFFRACTION' refined 10.1429690335 -2.85800901995 -13.306105597 0.215761825425 0.237549115458 0.210140557817 0.00273394763278 0.0410072493766 -0.0114628290303 1.49736381601 1.79431958806 1.49169147043 1.26095482484 1.14007860748 0.88693304586 0.0513562414706 -0.0547235600925 0.0526095348627 0.0793481901282 -0.00806876913301 0.0114227131488 0.0585305697875 -0.0416868280883 -0.0166912574741 7 ? 'X-RAY DIFFRACTION' refined -6.596439785 -16.9006202482 -17.4024534549 0.202149796921 0.277006609697 0.185410200525 -0.0778444599923 0.0165623503787 0.00160210023529 3.53280531676 3.2564712732 3.29539838948 0.525238325243 0.643975490141 -0.0828378805986 0.148250886464 -0.199882285705 -0.0684008300086 -0.0150990446974 -0.0704654873381 -0.0160995988551 0.205168324625 -0.29418119919 -0.0603560307036 loop_ _pdbx_refine_tls_group.id _pdbx_refine_tls_group.refine_tls_id _pdbx_refine_tls_group.pdbx_refine_id _pdbx_refine_tls_group.beg_auth_asym_id _pdbx_refine_tls_group.beg_auth_seq_id _pdbx_refine_tls_group.beg_label_asym_id _pdbx_refine_tls_group.beg_label_seq_id _pdbx_refine_tls_group.end_auth_asym_id _pdbx_refine_tls_group.end_auth_seq_id _pdbx_refine_tls_group.end_label_asym_id _pdbx_refine_tls_group.end_label_seq_id _pdbx_refine_tls_group.selection _pdbx_refine_tls_group.selection_details 1 1 'X-RAY DIFFRACTION' A 1 A 1 A 110 A 110 . "chain 'A' and (resid 1 through 110 )" 2 2 'X-RAY DIFFRACTION' A 111 A 111 A 155 A 155 . "chain 'A' and (resid 111 through 155 )" 3 3 'X-RAY DIFFRACTION' A 156 A 156 A 213 A 213 . "chain 'A' and (resid 156 through 213 )" 4 4 'X-RAY DIFFRACTION' A 214 A 214 A 305 A 305 . "chain 'A' and (resid 214 through 305 )" 5 5 'X-RAY DIFFRACTION' B 1 C 1 B 139 C 139 . "chain 'B' and (resid 1 through 139 )" 6 6 'X-RAY DIFFRACTION' B 140 C 140 B 213 C 213 . "chain 'B' and (resid 140 through 213 )" 7 7 'X-RAY DIFFRACTION' B 214 C 214 B 305 C 305 . "chain 'B' and (resid 214 through 305 )" loop_ _struct_asym.id A B C D E loop_ _struct_conn.id _struct_conn.conn_type_id _struct_conn.ptnr1_auth_comp_id _struct_conn.ptnr1_auth_asym_id _struct_conn.ptnr1_auth_seq_id _struct_conn.ptnr1_auth_atom_id _struct_conn.ptnr1_label_comp_id _struct_conn.ptnr1_label_asym_id _struct_conn.ptnr1_label_seq_id _struct_conn.ptnr1_label_atom_id _struct_conn.ptnr1_role _struct_conn.ptnr2_auth_comp_id _struct_conn.ptnr2_auth_asym_id _struct_conn.ptnr2_auth_seq_id _struct_conn.ptnr2_auth_atom_id _struct_conn.ptnr2_label_comp_id _struct_conn.ptnr2_label_asym_id _struct_conn.ptnr2_label_seq_id _struct_conn.ptnr2_label_atom_id _struct_conn.ptnr2_role _struct_conn.details C00001 covale CYS A 145 SG CYS A 145 SG . ZQ8 A 401 C01 ZQ8 B . C01 . www.phenix-online.org/documentation/reference/refinement.html#definition-of-custom-bonds-and-angles C00002 covale CYS B 145 SG CYS C 145 SG . ZQ8 B 401 C01 ZQ8 D . C01 . www.phenix-online.org/documentation/reference/refinement.html#definition-of-custom-bonds-and-angles loop_ _atom_type.symbol _atom_type.scat_dispersion_real _atom_type.scat_dispersion_imag _atom_type.scat_Cromer_Mann_a1 _atom_type.scat_Cromer_Mann_a2 _atom_type.scat_Cromer_Mann_a3 _atom_type.scat_Cromer_Mann_a4 _atom_type.scat_Cromer_Mann_b1 _atom_type.scat_Cromer_Mann_b2 _atom_type.scat_Cromer_Mann_b3 _atom_type.scat_Cromer_Mann_b4 _atom_type.scat_Cromer_Mann_c _atom_type.scat_source _atom_type.scat_dispersion_source C . . 3.54356 2.42580 . . 25.62398 1.50364 . . 0.0 ; 2-Gaussian fit: Grosse-Kunstleve RW, Sauter NK, Adams PD: Newsletter of the IUCr Commission on Crystallographic Computing 2004, 3, 22-31. ; . Cl . . 9.50761 7.44341 . . 1.04373 23.83732 . . 0.0 ; 2-Gaussian fit: Grosse-Kunstleve RW, Sauter NK, Adams PD: Newsletter of the IUCr Commission on Crystallographic Computing 2004, 3, 22-31. ; . S . . 9.55732 6.39887 . . 1.23737 29.19336 . . 0.0 ; 2-Gaussian fit: Grosse-Kunstleve RW, Sauter NK, Adams PD: Newsletter of the IUCr Commission on Crystallographic Computing 2004, 3, 22-31. ; . O . . 4.49882 3.47563 . . 15.80542 1.70748 . . 0.0 ; 2-Gaussian fit: Grosse-Kunstleve RW, Sauter NK, Adams PD: Newsletter of the IUCr Commission on Crystallographic Computing 2004, 3, 22-31. ; . N . . 4.01032 2.96436 . . 19.97189 1.75589 . . 0.0 ; 2-Gaussian fit: Grosse-Kunstleve RW, Sauter NK, Adams PD: Newsletter of the IUCr Commission on Crystallographic Computing 2004, 3, 22-31. ; . Si . . 9.56315 4.39227 . . 1.74258 45.67701 . . 0.0 ; 2-Gaussian fit: Grosse-Kunstleve RW, Sauter NK, Adams PD: Newsletter of the IUCr Commission on Crystallographic Computing 2004, 3, 22-31. ; . loop_ _chem_comp.id ALA ARG ASN ASP CYS GLN GLU GLY HIS HOH ILE LEU LYS MET PHE PRO SER THR TRP TYR VAL ZQ8 loop_ _atom_site.group_PDB _atom_site.id _atom_site.label_atom_id _atom_site.label_alt_id _atom_site.label_comp_id _atom_site.auth_asym_id _atom_site.auth_seq_id _atom_site.pdbx_PDB_ins_code _atom_site.Cartn_x _atom_site.Cartn_y _atom_site.Cartn_z _atom_site.occupancy _atom_site.B_iso_or_equiv _atom_site.type_symbol _atom_site.pdbx_formal_charge _atom_site.label_asym_id _atom_site.label_entity_id _atom_site.label_seq_id _atom_site.pdbx_PDB_model_num ATOM 1 N . SER A 1 ? 20.81607 -5.02683 -20.78238 1.000 43.61473 N ? A ? 1 1 ATOM 2 CA . SER A 1 ? 20.70205 -5.94264 -21.91501 1.000 55.29829 C ? A ? 1 1 ATOM 3 C . SER A 1 ? 19.23790 -6.15179 -22.31278 1.000 50.82754 C ? A ? 1 1 ATOM 4 O . SER A 1 ? 18.41409 -5.25130 -22.16250 1.000 39.49454 O ? A ? 1 1 ATOM 5 CB . SER A 1 ? 21.36367 -7.27984 -21.58081 1.000 60.77168 C ? A ? 1 1 ATOM 6 OG . SER A 1 ? 22.71721 -7.09247 -21.20161 1.000 60.68078 O ? A ? 1 1 ATOM 7 N . GLY A 2 ? 18.92399 -7.33889 -22.82917 1.000 55.34429 N ? A ? 2 1 ATOM 8 CA . GLY A 2 ? 17.56318 -7.69709 -23.16857 1.000 43.55877 C ? A ? 2 1 ATOM 9 C . GLY A 2 ? 17.17167 -7.28858 -24.57826 1.000 51.72300 C ? A ? 2 1 ATOM 10 O . GLY A 2 ? 17.86882 -6.54076 -25.26957 1.000 56.95661 O ? A ? 2 1 ATOM 11 N . PHE A 3 ? 16.01689 -7.80060 -25.00877 1.000 49.62877 N ? A ? 3 1 ATOM 12 CA . PHE A 3 ? 15.49315 -7.50543 -26.33999 1.000 38.11914 C ? A ? 3 1 ATOM 13 C . PHE A 3 ? 13.97366 -7.46874 -26.27817 1.000 37.34421 C ? A ? 3 1 ATOM 14 O . PHE A 3 ? 13.34075 -8.47009 -25.93062 1.000 42.89694 O ? A ? 3 1 ATOM 15 CB . PHE A 3 ? 15.96849 -8.54152 -27.36237 1.000 43.03180 C ? A ? 3 1 ATOM 16 CG . PHE A 3 ? 15.94903 -8.04456 -28.78059 1.000 37.50808 C ? A ? 3 1 ATOM 17 CD1 . PHE A 3 ? 16.88351 -7.11496 -29.21381 1.000 38.86950 C ? A ? 3 1 ATOM 18 CD2 . PHE A 3 ? 14.99839 -8.50142 -29.67919 1.000 37.11264 C ? A ? 3 1 ATOM 19 CE1 . PHE A 3 ? 16.87182 -6.64949 -30.51292 1.000 35.00543 C ? A ? 3 1 ATOM 20 CE2 . PHE A 3 ? 14.98016 -8.03895 -30.98352 1.000 34.27562 C ? A ? 3 1 ATOM 21 CZ . PHE A 3 ? 15.91905 -7.11120 -31.40063 1.000 41.36497 C ? A ? 3 1 ATOM 22 N . ARG A 4 ? 13.39764 -6.31990 -26.62890 1.000 39.13007 N ? A ? 4 1 ATOM 23 CA . ARG A 4 ? 11.96230 -6.08502 -26.57695 1.000 32.95960 C ? A ? 4 1 ATOM 24 C . ARG A 4 ? 11.48849 -5.50854 -27.90306 1.000 40.80568 C ? A ? 4 1 ATOM 25 O . ARG A 4 ? 12.26395 -4.91894 -28.65839 1.000 43.72849 O ? A ? 4 1 ATOM 26 CB . ARG A 4 ? 11.59104 -5.10770 -25.45619 1.000 33.68366 C ? A ? 4 1 ATOM 27 CG . ARG A 4 ? 12.05468 -5.52615 -24.08450 1.000 44.14328 C ? A ? 4 1 ATOM 28 CD . ARG A 4 ? 11.00840 -6.38554 -23.42993 1.000 45.37745 C ? A ? 4 1 ATOM 29 NE . ARG A 4 ? 9.69193 -5.78910 -23.60219 1.000 40.48411 N ? A ? 4 1 ATOM 30 CZ . ARG A 4 ? 8.64234 -6.05805 -22.84026 1.000 49.27604 C ? A ? 4 1 ATOM 31 NH1 . ARG A 4 ? 8.72515 -6.90249 -21.82408 1.000 41.98216 N ? A ? 4 1 ATOM 32 NH2 . ARG A 4 ? 7.48240 -5.45950 -23.10111 1.000 53.34474 N ? A ? 4 1 ATOM 33 N . LYS A 5 ? 10.19478 -5.66762 -28.17473 1.000 36.13425 N ? A ? 5 1 ATOM 34 CA . LYS A 5 ? 9.56657 -4.98801 -29.30286 1.000 27.96418 C ? A ? 5 1 ATOM 35 C . LYS A 5 ? 9.38054 -3.52395 -28.92028 1.000 35.17530 C ? A ? 5 1 ATOM 36 O . LYS A 5 ? 8.61429 -3.20358 -28.00493 1.000 35.67549 O ? A ? 5 1 ATOM 37 CB . LYS A 5 ? 8.24009 -5.64809 -29.66380 1.000 28.81182 C ? A ? 5 1 ATOM 38 CG . LYS A 5 ? 7.93440 -5.63694 -31.15161 1.000 39.25206 C ? A ? 5 1 ATOM 39 CD . LYS A 5 ? 6.56409 -6.23022 -31.44197 1.000 39.34016 C ? A ? 5 1 ATOM 40 CE . LYS A 5 ? 6.53531 -7.73730 -31.26014 1.000 45.34569 C ? A ? 5 1 ATOM 41 NZ . LYS A 5 ? 7.33142 -8.43190 -32.30539 1.000 48.27909 N ? A ? 5 1 ATOM 42 N . MET A 6 ? 10.09677 -2.63746 -29.60455 1.000 26.12734 N ? A ? 6 1 ATOM 43 CA . MET A 6 ? 10.26510 -1.25500 -29.18005 1.000 26.18505 C ? A ? 6 1 ATOM 44 C . MET A 6 ? 9.70053 -0.31046 -30.23040 1.000 25.21902 C ? A ? 6 1 ATOM 45 O . MET A 6 ? 10.01272 -0.43779 -31.41882 1.000 28.92696 O ? A ? 6 1 ATOM 46 CB . MET A 6 ? 11.74603 -0.95821 -28.93931 1.000 25.00275 C ? A ? 6 1 ATOM 47 CG . MET A 6 ? 12.04569 0.41872 -28.39905 1.000 30.99128 C ? A ? 6 1 ATOM 48 SD . MET A 6 ? 13.77060 0.53982 -27.88075 1.000 42.71963 S ? A ? 6 1 ATOM 49 CE . MET A 6 ? 13.93780 -0.98304 -26.95549 1.000 32.03205 C ? A ? 6 1 ATOM 50 N . ALA A 7 ? 8.88128 0.63700 -29.79005 1.000 21.73734 N ? A ? 7 1 ATOM 51 CA . ALA A 7 ? 8.31875 1.65009 -30.66646 1.000 20.58998 C ? A ? 7 1 ATOM 52 C . ALA A 7 ? 9.10383 2.94887 -30.53516 1.000 22.30663 C ? A ? 7 1 ATOM 53 O . ALA A 7 ? 9.76592 3.19259 -29.52428 1.000 26.74382 O ? A ? 7 1 ATOM 54 CB . ALA A 7 ? 6.84446 1.89156 -30.34132 1.000 21.57135 C ? A ? 7 1 ATOM 55 N . PHE A 8 ? 9.03744 3.77592 -31.57667 1.000 22.18910 N ? A ? 8 1 ATOM 56 CA . PHE A 8 ? 9.66327 5.08581 -31.51828 1.000 24.07590 C ? A ? 8 1 ATOM 57 C . PHE A 8 ? 8.91955 5.97613 -30.52699 1.000 22.88053 C ? A ? 8 1 ATOM 58 O . PHE A 8 ? 7.72200 5.78921 -30.29144 1.000 22.81987 O ? A ? 8 1 ATOM 59 CB . PHE A 8 ? 9.65869 5.76095 -32.88800 1.000 25.22823 C ? A ? 8 1 ATOM 60 CG . PHE A 8 ? 10.54782 5.10676 -33.89737 1.000 20.87662 C ? A ? 8 1 ATOM 61 CD1 . PHE A 8 ? 11.90130 5.39635 -33.94364 1.000 30.53326 C ? A ? 8 1 ATOM 62 CD2 . PHE A 8 ? 10.02515 4.21583 -34.81629 1.000 25.66859 C ? A ? 8 1 ATOM 63 CE1 . PHE A 8 ? 12.71755 4.79444 -34.88333 1.000 32.03301 C ? A ? 8 1 ATOM 64 CE2 . PHE A 8 ? 10.83167 3.61480 -35.75367 1.000 26.29071 C ? A ? 8 1 ATOM 65 CZ . PHE A 8 ? 12.18172 3.90382 -35.78834 1.000 28.97642 C ? A ? 8 1 ATOM 66 N . PRO A 9 ? 9.60349 6.95480 -29.93711 1.000 22.23869 N ? A ? 9 1 ATOM 67 CA . PRO A 9 ? 8.88861 7.97634 -29.16202 1.000 27.44300 C ? A ? 9 1 ATOM 68 C . PRO A 9 ? 7.86647 8.68100 -30.04554 1.000 26.19537 C ? A ? 9 1 ATOM 69 O . PRO A 9 ? 8.16132 9.06756 -31.17809 1.000 23.01180 O ? A ? 9 1 ATOM 70 CB . PRO A 9 ? 10.00502 8.92226 -28.70240 1.000 28.18471 C ? A ? 9 1 ATOM 71 CG . PRO A 9 ? 11.26628 8.11745 -28.80843 1.000 27.29041 C ? A ? 9 1 ATOM 72 CD . PRO A 9 ? 11.05703 7.19383 -29.96447 1.000 27.26262 C ? A ? 9 1 ATOM 73 N . SER A 10 ? 6.65083 8.82937 -29.52485 1.000 22.33515 N ? A ? 10 1 ATOM 74 CA . SER A 10 ? 5.51220 9.27457 -30.31447 1.000 22.18861 C ? A ? 10 1 ATOM 75 C . SER A 10 ? 5.19066 10.75305 -30.13163 1.000 23.41188 C ? A ? 10 1 ATOM 76 O . SER A 10 ? 4.17853 11.21986 -30.66288 1.000 21.10269 O ? A ? 10 1 ATOM 77 CB . SER A 10 ? 4.28511 8.43392 -29.96596 1.000 20.62088 C ? A ? 10 1 ATOM 78 OG . SER A 10 ? 3.92612 8.61112 -28.60949 1.000 21.11712 O ? A ? 10 1 ATOM 79 N . GLY A 11 ? 6.02195 11.49540 -29.39501 1.000 25.64150 N ? A ? 11 1 ATOM 80 CA . GLY A 11 ? 5.68943 12.87747 -29.08108 1.000 22.39820 C ? A ? 11 1 ATOM 81 C . GLY A 11 ? 5.49436 13.74249 -30.31180 1.000 25.83647 C ? A ? 11 1 ATOM 82 O . GLY A 11 ? 4.54045 14.52000 -30.38827 1.000 25.69297 O ? A ? 11 1 ATOM 83 N . LYS A 12 ? 6.39099 13.61547 -31.29353 1.000 22.75232 N ? A ? 12 1 ATOM 84 CA . LYS A 12 ? 6.29002 14.43060 -32.50019 1.000 28.97070 C ? A ? 12 1 ATOM 85 C . LYS A 12 ? 5.01013 14.14257 -33.27857 1.000 29.13540 C ? A ? 12 1 ATOM 86 O . LYS A 12 ? 4.49703 15.02878 -33.97018 1.000 30.05462 O ? A ? 12 1 ATOM 87 CB . LYS A 12 ? 7.51581 14.20292 -33.38503 1.000 31.58816 C ? A ? 12 1 ATOM 88 CG . LYS A 12 ? 8.76883 14.88550 -32.88488 1.000 29.94536 C ? A ? 12 1 ATOM 89 CD . LYS A 12 ? 9.99787 14.43117 -33.64975 1.000 38.57947 C ? A ? 12 1 ATOM 90 CE . LYS A 12 ? 11.07331 15.50080 -33.60287 1.000 53.71030 C ? A ? 12 1 ATOM 91 NZ . LYS A 12 ? 11.05906 16.22731 -32.29755 1.000 48.75055 N ? A ? 12 1 ATOM 92 N . VAL A 13 ? 4.47666 12.92557 -33.17715 1.000 25.14327 N ? A ? 13 1 ATOM 93 CA . VAL A 13 ? 3.25278 12.58819 -33.89556 1.000 29.15475 C ? A ? 13 1 ATOM 94 C . VAL A 13 ? 2.00496 12.94508 -33.09010 1.000 24.42048 C ? A ? 13 1 ATOM 95 O . VAL A 13 ? 0.97652 13.29538 -33.67673 1.000 20.88271 O ? A ? 13 1 ATOM 96 CB . VAL A 13 ? 3.25655 11.09806 -34.28357 1.000 26.05196 C ? A ? 13 1 ATOM 97 CG1 . VAL A 13 ? 1.98135 10.73406 -35.04227 1.000 19.62505 C ? A ? 13 1 ATOM 98 CG2 . VAL A 13 ? 4.48525 10.77685 -35.11879 1.000 17.78752 C ? A ? 13 1 ATOM 99 N . GLU A 14 ? 2.07373 12.86361 -31.75565 1.000 22.69379 N ? A ? 14 1 ATOM 100 CA . GLU A 14 ? 0.91418 13.17948 -30.92315 1.000 23.36844 C ? A ? 14 1 ATOM 101 C . GLU A 14 ? 0.35257 14.56229 -31.23893 1.000 28.22876 C ? A ? 14 1 ATOM 102 O . GLU A 14 ? -0.86866 14.74899 -31.29517 1.000 24.79793 O ? A ? 14 1 ATOM 103 CB . GLU A 14 ? 1.28483 13.08621 -29.44102 1.000 23.07079 C ? A ? 14 1 ATOM 104 CG . GLU A 14 ? 1.57080 11.67770 -28.94952 1.000 25.54011 C ? A ? 14 1 ATOM 105 CD . GLU A 14 ? 2.03054 11.64619 -27.50238 1.000 26.57635 C ? A ? 14 1 ATOM 106 OE1 . GLU A 14 ? 1.35041 12.23924 -26.64052 1.000 35.47474 O ? A ? 14 1 ATOM 107 OE2 . GLU A 14 ? 3.08247 11.03666 -27.22519 1.000 28.83978 O ? A ? 14 1 ATOM 108 N . GLY A 15 ? 1.22721 15.53844 -31.46841 1.000 26.87512 N ? A ? 15 1 ATOM 109 CA . GLY A 15 ? 0.79765 16.89166 -31.77033 1.000 24.39180 C ? A ? 15 1 ATOM 110 C . GLY A 15 ? 0.17693 17.08500 -33.13607 1.000 28.95482 C ? A ? 15 1 ATOM 111 O . GLY A 15 ? -0.18956 18.21419 -33.47809 1.000 26.52493 O ? A ? 15 1 ATOM 112 N . CYS A 16 ? 0.04682 16.01916 -33.92686 1.000 24.93931 N ? A ? 16 1 ATOM 113 CA . CYS A 16 ? -0.54331 16.10542 -35.25290 1.000 23.27064 C ? A ? 16 1 ATOM 114 C . CYS A 16 ? -1.90310 15.43201 -35.36002 1.000 24.09075 C ? A ? 16 1 ATOM 115 O . CYS A 16 ? -2.53158 15.51575 -36.42058 1.000 27.91570 O ? A ? 16 1 ATOM 116 CB . CYS A 16 ? 0.39528 15.48392 -36.29688 1.000 24.44694 C ? A ? 16 1 ATOM 117 SG . CYS A 16 ? 2.05073 16.19058 -36.36952 1.000 29.20229 S ? A ? 16 1 ATOM 118 N . MET A 17 ? -2.37011 14.76347 -34.31058 1.000 27.76956 N ? A ? 17 1 ATOM 119 CA . MET A 17 ? -3.60850 13.99918 -34.37693 1.000 22.76814 C ? A ? 17 1 ATOM 120 C . MET A 17 ? -4.78955 14.90436 -34.05033 1.000 24.68455 C ? A ? 17 1 ATOM 121 O . MET A 17 ? -4.80870 15.56120 -33.00393 1.000 26.03005 O ? A ? 17 1 ATOM 122 CB . MET A 17 ? -3.56822 12.80317 -33.42489 1.000 21.65085 C ? A ? 17 1 ATOM 123 CG . MET A 17 ? -2.43638 11.82641 -33.69517 1.000 22.25951 C ? A ? 17 1 ATOM 124 SD . MET A 17 ? -2.27898 11.33893 -35.42599 1.000 24.60665 S ? A ? 17 1 ATOM 125 CE . MET A 17 ? -3.90689 10.65512 -35.75893 1.000 18.81389 C ? A ? 17 1 ATOM 126 N . VAL A 18 ? -5.76981 14.93262 -34.94892 1.000 21.99944 N ? A ? 18 1 ATOM 127 CA . VAL A 18 ? -7.00691 15.67472 -34.74603 1.000 26.39352 C ? A ? 18 1 ATOM 128 C . VAL A 18 ? -8.18078 14.72406 -34.93060 1.000 24.28286 C ? A ? 18 1 ATOM 129 O . VAL A 18 ? -8.00568 13.56470 -35.32305 1.000 22.40621 O ? A ? 18 1 ATOM 130 CB . VAL A 18 ? -7.11571 16.87079 -35.71025 1.000 24.28695 C ? A ? 18 1 ATOM 131 CG1 . VAL A 18 ? -5.95113 17.82517 -35.51761 1.000 24.60153 C ? A ? 18 1 ATOM 132 CG2 . VAL A 18 ? -7.17437 16.38351 -37.14963 1.000 23.21487 C ? A ? 18 1 ATOM 133 N . GLN A 19 ? -9.38307 15.21146 -34.65315 1.000 27.75701 N ? A ? 19 1 ATOM 134 CA . GLN A 19 ? -10.60648 14.44413 -34.82310 1.000 31.84298 C ? A ? 19 1 ATOM 135 C . GLN A 19 ? -11.37815 14.99268 -36.01301 1.000 36.14273 C ? A ? 19 1 ATOM 136 O . GLN A 19 ? -11.59016 16.20591 -36.11355 1.000 35.46274 O ? A ? 19 1 ATOM 137 CB . GLN A 19 ? -11.46755 14.50462 -33.56492 1.000 28.32129 C ? A ? 19 1 ATOM 138 CG . GLN A 19 ? -12.86427 13.96333 -33.76736 1.000 34.41740 C ? A ? 19 1 ATOM 139 CD . GLN A 19 ? -13.78307 14.31356 -32.62263 1.000 38.10286 C ? A ? 19 1 ATOM 140 OE1 . GLN A 19 ? -13.77170 13.65944 -31.58283 1.000 46.09903 O ? A ? 19 1 ATOM 141 NE2 . GLN A 19 ? -14.58529 15.35711 -32.80520 1.000 52.67804 N ? A ? 19 1 ATOM 142 N . VAL A 20 ? -11.79296 14.10503 -36.91062 1.000 25.69373 N ? A ? 20 1 ATOM 143 CA . VAL A 20 ? -12.50893 14.49304 -38.11865 1.000 29.96999 C ? A ? 20 1 ATOM 144 C . VAL A 20 ? -13.87862 13.83267 -38.09771 1.000 35.20756 C ? A ? 20 1 ATOM 145 O . VAL A 20 ? -13.98290 12.59932 -38.07607 1.000 32.40401 O ? A ? 20 1 ATOM 146 CB . VAL A 20 ? -11.73565 14.11516 -39.38913 1.000 24.57074 C ? A ? 20 1 ATOM 147 CG1 . VAL A 20 ? -12.42914 14.69338 -40.60852 1.000 28.15594 C ? A ? 20 1 ATOM 148 CG2 . VAL A 20 ? -10.30573 14.61451 -39.29688 1.000 23.51745 C ? A ? 20 1 ATOM 149 N . THR A 21 ? -14.92483 14.65142 -38.11020 1.000 32.62137 N ? A ? 21 1 ATOM 150 CA . THR A 21 ? -16.29708 14.17345 -38.12639 1.000 31.15881 C ? A ? 21 1 ATOM 151 C . THR A 21 ? -16.98360 14.69615 -39.37853 1.000 43.17660 C ? A ? 21 1 ATOM 152 O . THR A 21 ? -16.88793 15.88701 -39.69604 1.000 41.45175 O ? A ? 21 1 ATOM 153 CB . THR A 21 ? -17.05314 14.61517 -36.86969 1.000 33.43695 C ? A ? 21 1 ATOM 154 OG1 . THR A 21 ? -16.37063 14.12602 -35.71027 1.000 38.12169 O ? A ? 21 1 ATOM 155 CG2 . THR A 21 ? -18.46735 14.05880 -36.87337 1.000 35.46470 C ? A ? 21 1 ATOM 156 N . CYS A 22 ? -17.65889 13.80035 -40.09504 1.000 35.56462 N ? A ? 22 1 ATOM 157 CA . CYS A 22 ? -18.43998 14.15412 -41.27734 1.000 41.15435 C ? A ? 22 1 ATOM 158 C . CYS A 22 ? -19.81641 13.52277 -41.10664 1.000 44.96854 C ? A ? 22 1 ATOM 159 O . CYS A 22 ? -20.02900 12.35852 -41.45569 1.000 47.10641 O ? A ? 22 1 ATOM 160 CB . CYS A 22 ? -17.76037 13.69485 -42.55343 1.000 39.34361 C ? A ? 22 1 ATOM 161 SG . CYS A 22 ? -18.66190 14.18834 -44.02601 1.000 52.10412 S ? A ? 22 1 ATOM 162 N . GLY A 23 ? -20.74884 14.29912 -40.56681 1.000 47.63376 N ? A ? 23 1 ATOM 163 CA . GLY A 23 ? -22.07883 13.79977 -40.30011 1.000 44.35675 C ? A ? 23 1 ATOM 164 C . GLY A 23 ? -22.10156 12.83729 -39.13389 1.000 49.99624 C ? A ? 23 1 ATOM 165 O . GLY A 23 ? -21.91428 13.23870 -37.98195 1.000 54.89803 O ? A ? 23 1 ATOM 166 N . THR A 24 ? -22.31651 11.55697 -39.42414 1.000 50.29040 N ? A ? 24 1 ATOM 167 CA . THR A 24 ? -22.42688 10.53533 -38.39455 1.000 53.74192 C ? A ? 24 1 ATOM 168 C . THR A 24 ? -21.13133 9.76681 -38.16416 1.000 55.69051 C ? A ? 24 1 ATOM 169 O . THR A 24 ? -21.03619 9.02856 -37.17824 1.000 55.54704 O ? A ? 24 1 ATOM 170 CB . THR A 24 ? -23.54627 9.54896 -38.75328 1.000 55.68431 C ? A ? 24 1 ATOM 171 OG1 . THR A 24 ? -23.56854 8.47745 -37.80246 1.000 64.84946 O ? A ? 24 1 ATOM 172 CG2 . THR A 24 ? -23.33220 8.98355 -40.15095 1.000 63.54044 C ? A ? 24 1 ATOM 173 N . THR A 25 ? -20.13760 9.92299 -39.03245 1.000 48.33058 N ? A ? 25 1 ATOM 174 CA . THR A 25 ? -18.88971 9.17718 -38.93881 1.000 48.61737 C ? A ? 25 1 ATOM 175 C . THR A 25 ? -17.79100 10.07336 -38.38206 1.000 46.31081 C ? A ? 25 1 ATOM 176 O . THR A 25 ? -17.59864 11.19761 -38.85740 1.000 41.45476 O ? A ? 25 1 ATOM 177 CB . THR A 25 ? -18.48421 8.62736 -40.30883 1.000 42.03543 C ? A ? 25 1 ATOM 178 OG1 . THR A 25 ? -19.41617 7.61675 -40.71490 1.000 53.12299 O ? A ? 25 1 ATOM 179 CG2 . THR A 25 ? -17.08067 8.03488 -40.26478 1.000 35.57015 C ? A ? 25 1 ATOM 180 N . THR A 26 ? -17.08033 9.57673 -37.37168 1.000 38.41120 N ? A ? 26 1 ATOM 181 CA . THR A 26 ? -15.94183 10.27982 -36.79760 1.000 41.24206 C ? A ? 26 1 ATOM 182 C . THR A 26 ? -14.73070 9.35827 -36.80334 1.000 33.95292 C ? A ? 26 1 ATOM 183 O . THR A 26 ? -14.82970 8.19082 -36.41053 1.000 34.53699 O ? A ? 26 1 ATOM 184 CB . THR A 26 ? -16.23734 10.77097 -35.37075 1.000 41.48608 C ? A ? 26 1 ATOM 185 OG1 . THR A 26 ? -15.03107 11.26011 -34.76871 1.000 48.54314 O ? A ? 26 1 ATOM 186 CG2 . THR A 26 ? -16.81361 9.65158 -34.50900 1.000 46.43685 C ? A ? 26 1 ATOM 187 N . LEU A 27 ? -13.59843 9.88035 -37.26629 1.000 26.10609 N ? A ? 27 1 ATOM 188 CA . LEU A 27 ? -12.33253 9.15622 -37.24663 1.000 30.54374 C ? A ? 27 1 ATOM 189 C . LEU A 27 ? -11.21394 10.15732 -36.96943 1.000 28.01173 C ? A ? 27 1 ATOM 190 O . LEU A 27 ? -11.46520 11.32382 -36.65322 1.000 30.60159 O ? A ? 27 1 ATOM 191 CB . LEU A 27 ? -12.12551 8.37539 -38.55323 1.000 22.85636 C ? A ? 27 1 ATOM 192 CG . LEU A 27 ? -12.51800 8.99548 -39.89705 1.000 25.08625 C ? A ? 27 1 ATOM 193 CD1 . LEU A 27 ? -11.65204 10.19394 -40.25651 1.000 25.21253 C ? A ? 27 1 ATOM 194 CD2 . LEU A 27 ? -12.44595 7.94198 -40.99475 1.000 23.29792 C ? A ? 27 1 ATOM 195 N . ASN A 28 ? -9.97383 9.70004 -37.09425 1.000 24.81779 N ? A ? 28 1 ATOM 196 CA . ASN A 28 ? -8.80428 10.50728 -36.78393 1.000 32.42205 C ? A ? 28 1 ATOM 197 C . ASN A 28 ? -8.21002 11.09673 -38.05770 1.000 23.33433 C ? A ? 28 1 ATOM 198 O . ASN A 28 ? -8.34067 10.53157 -39.14643 1.000 23.33647 O ? A ? 28 1 ATOM 199 CB . ASN A 28 ? -7.74123 9.67488 -36.05615 1.000 29.40400 C ? A ? 28 1 ATOM 200 CG . ASN A 28 ? -8.29475 8.93778 -34.84924 1.000 25.70073 C ? A ? 28 1 ATOM 201 OD1 . ASN A 28 ? -8.44133 9.51233 -33.77096 1.000 30.21730 O ? A ? 28 1 ATOM 202 ND2 . ASN A 28 ? -8.59893 7.65633 -35.02474 1.000 21.42534 N ? A ? 28 1 ATOM 203 N . GLY A 29 ? -7.54987 12.24565 -37.90645 1.000 22.52543 N ? A ? 29 1 ATOM 204 CA . GLY A 29 ? -6.88097 12.88621 -39.01397 1.000 24.27649 C ? A ? 29 1 ATOM 205 C . GLY A 29 ? -5.47724 13.31861 -38.62775 1.000 27.74189 C ? A ? 29 1 ATOM 206 O . GLY A 29 ? -5.15365 13.48109 -37.45174 1.000 24.16446 O ? A ? 29 1 ATOM 207 N . LEU A 30 ? -4.64382 13.50175 -39.65048 1.000 23.44767 N ? A ? 30 1 ATOM 208 CA . LEU A 30 ? -3.25054 13.90590 -39.48233 1.000 26.48778 C ? A ? 30 1 ATOM 209 C . LEU A 30 ? -3.10352 15.35727 -39.91760 1.000 20.50690 C ? A ? 30 1 ATOM 210 O . LEU A 30 ? -3.29361 15.67313 -41.09568 1.000 22.10088 O ? A ? 30 1 ATOM 211 CB . LEU A 30 ? -2.31597 13.00977 -40.29566 1.000 17.76967 C ? A ? 30 1 ATOM 212 CG . LEU A 30 ? -0.81656 13.20478 -40.05915 1.000 21.39151 C ? A ? 30 1 ATOM 213 CD1 . LEU A 30 ? -0.49274 12.94291 -38.60325 1.000 20.40128 C ? A ? 30 1 ATOM 214 CD2 . LEU A 30 ? 0.01304 12.29448 -40.95614 1.000 17.47611 C ? A ? 30 1 ATOM 215 N . TRP A 31 ? -2.75170 16.23178 -38.97591 1.000 25.79581 N ? A ? 31 1 ATOM 216 CA . TRP A 31 ? -2.69347 17.67496 -39.21886 1.000 21.94469 C ? A ? 31 1 ATOM 217 C . TRP A 31 ? -1.23587 18.08872 -39.40821 1.000 24.00793 C ? A ? 31 1 ATOM 218 O . TRP A 31 ? -0.48665 18.23397 -38.43896 1.000 27.20314 O ? A ? 31 1 ATOM 219 CB . TRP A 31 ? -3.34666 18.43624 -38.07059 1.000 24.65467 C ? A ? 31 1 ATOM 220 CG . TRP A 31 ? -3.44289 19.92549 -38.27440 1.000 27.96167 C ? A ? 31 1 ATOM 221 CD1 . TRP A 31 ? -3.41794 20.60565 -39.46070 1.000 25.67158 C ? A ? 31 1 ATOM 222 CD2 . TRP A 31 ? -3.57887 20.91413 -37.24882 1.000 27.64685 C ? A ? 31 1 ATOM 223 NE1 . TRP A 31 ? -3.53290 21.96045 -39.23278 1.000 27.67374 N ? A ? 31 1 ATOM 224 CE2 . TRP A 31 ? -3.63281 22.17365 -37.88231 1.000 28.31819 C ? A ? 31 1 ATOM 225 CE3 . TRP A 31 ? -3.66035 20.85629 -35.85349 1.000 27.10299 C ? A ? 31 1 ATOM 226 CZ2 . TRP A 31 ? -3.76595 23.36214 -37.16691 1.000 30.44720 C ? A ? 31 1 ATOM 227 CZ3 . TRP A 31 ? -3.79169 22.03921 -35.14559 1.000 34.87929 C ? A ? 31 1 ATOM 228 CH2 . TRP A 31 ? -3.84229 23.27344 -35.80334 1.000 30.84176 C ? A ? 31 1 ATOM 229 N . LEU A 32 ? -0.84175 18.28157 -40.66427 1.000 22.33656 N ? A ? 32 1 ATOM 230 CA . LEU A 32 ? 0.49283 18.72768 -41.03554 1.000 22.96769 C ? A ? 32 1 ATOM 231 C . LEU A 32 ? 0.35793 19.98961 -41.87270 1.000 27.29670 C ? A ? 32 1 ATOM 232 O . LEU A 32 ? -0.37614 20.00037 -42.86776 1.000 27.82569 O ? A ? 32 1 ATOM 233 CB . LEU A 32 ? 1.23688 17.63985 -41.81823 1.000 29.35629 C ? A ? 32 1 ATOM 234 CG . LEU A 32 ? 1.41352 16.27165 -41.15168 1.000 21.05814 C ? A ? 32 1 ATOM 235 CD1 . LEU A 32 ? 1.86293 15.24344 -42.17281 1.000 21.80698 C ? A ? 32 1 ATOM 236 CD2 . LEU A 32 ? 2.40404 16.35135 -39.99959 1.000 25.76052 C ? A ? 32 1 ATOM 237 N . ASP A 33 ? 1.06262 21.04539 -41.46581 1.000 30.14151 N ? A ? 33 1 ATOM 238 CA . ASP A 33 ? 0.93972 22.37418 -42.07785 1.000 32.55042 C ? A ? 33 1 ATOM 239 C . ASP A 33 ? -0.54164 22.76211 -42.04201 1.000 36.37687 C ? A ? 33 1 ATOM 240 O . ASP A 33 ? -1.17952 22.60662 -40.99095 1.000 31.25772 O ? A ? 33 1 ATOM 241 CB . ASP A 33 ? 1.58694 22.35162 -43.44798 1.000 33.75760 C ? A ? 33 1 ATOM 242 CG . ASP A 33 ? 3.08225 21.99023 -43.39305 1.000 41.39600 C ? A ? 33 1 ATOM 243 OD1 . ASP A 33 ? 3.81941 22.65063 -42.61782 1.000 44.57455 O ? A ? 33 1 ATOM 244 OD2 . ASP A 33 ? 3.51711 21.04051 -44.10420 1.000 47.55788 O ? A ? 33 1 ATOM 245 N . ASP A 34 ? -1.12969 23.26096 -43.12971 1.000 31.23317 N ? A ? 34 1 ATOM 246 CA . ASP A 34 ? -2.53981 23.64101 -43.14846 1.000 37.95336 C ? A ? 34 1 ATOM 247 C . ASP A 34 ? -3.42108 22.58029 -43.80525 1.000 36.49565 C ? A ? 34 1 ATOM 248 O . ASP A 34 ? -4.43400 22.91046 -44.43389 1.000 36.92422 O ? A ? 34 1 ATOM 249 CB . ASP A 34 ? -2.71189 24.97546 -43.86712 1.000 33.14962 C ? A ? 34 1 ATOM 250 CG . ASP A 34 ? -2.18413 24.93273 -45.29289 1.000 46.44055 C ? A ? 34 1 ATOM 251 OD1 . ASP A 34 ? -1.63717 23.87961 -45.68912 1.000 42.68406 O ? A ? 34 1 ATOM 252 OD2 . ASP A 34 ? -2.31976 25.94084 -46.01335 1.000 34.77950 O ? A ? 34 1 ATOM 253 N . VAL A 35 ? -3.03025 21.31427 -43.71651 1.000 29.96942 N ? A ? 35 1 ATOM 254 CA . VAL A 35 ? -3.75268 20.22451 -44.35663 1.000 25.83483 C ? A ? 35 1 ATOM 255 C . VAL A 35 ? -3.99312 19.13512 -43.32476 1.000 27.26600 C ? A ? 35 1 ATOM 256 O . VAL A 35 ? -3.11171 18.82704 -42.51423 1.000 26.20726 O ? A ? 35 1 ATOM 257 CB . VAL A 35 ? -2.98476 19.66502 -45.57489 1.000 26.81874 C ? A ? 35 1 ATOM 258 CG1 . VAL A 35 ? -3.71731 18.46386 -46.17255 1.000 25.32242 C ? A ? 35 1 ATOM 259 CG2 . VAL A 35 ? -2.79246 20.74600 -46.62432 1.000 30.35071 C ? A ? 35 1 ATOM 260 N . VAL A 36 ? -5.19137 18.56127 -43.34926 1.000 23.70345 N ? A ? 36 1 ATOM 261 CA . VAL A 36 ? -5.54801 17.42530 -42.51137 1.000 27.80235 C ? A ? 36 1 ATOM 262 C . VAL A 36 ? -5.79403 16.23214 -43.42286 1.000 25.43364 C ? A ? 36 1 ATOM 263 O . VAL A 36 ? -6.58246 16.32130 -44.37095 1.000 24.24885 O ? A ? 36 1 ATOM 264 CB . VAL A 36 ? -6.78140 17.73043 -41.64426 1.000 31.32975 C ? A ? 36 1 ATOM 265 CG1 . VAL A 36 ? -7.19185 16.50137 -40.84837 1.000 23.05521 C ? A ? 36 1 ATOM 266 CG2 . VAL A 36 ? -6.49993 18.90711 -40.71414 1.000 24.56339 C ? A ? 36 1 ATOM 267 N . TYR A 37 ? -5.10257 15.12874 -43.14889 1.000 26.50022 N ? A ? 37 1 ATOM 268 CA . TYR A 37 ? -5.22824 13.89691 -43.91708 1.000 21.13926 C ? A ? 37 1 ATOM 269 C . TYR A 37 ? -6.04363 12.89317 -43.11301 1.000 22.51271 C ? A ? 37 1 ATOM 270 O . TYR A 37 ? -5.78127 12.69234 -41.92387 1.000 23.12746 O ? A ? 37 1 ATOM 271 CB . TYR A 37 ? -3.85359 13.30657 -44.24318 1.000 19.82951 C ? A ? 37 1 ATOM 272 CG . TYR A 37 ? -2.89727 14.25984 -44.93101 1.000 24.57770 C ? A ? 37 1 ATOM 273 CD1 . TYR A 37 ? -2.12488 15.15592 -44.19759 1.000 22.73742 C ? A ? 37 1 ATOM 274 CD2 . TYR A 37 ? -2.75191 14.25109 -46.31172 1.000 26.28115 C ? A ? 37 1 ATOM 275 CE1 . TYR A 37 ? -1.24594 16.02326 -44.82259 1.000 20.66129 C ? A ? 37 1 ATOM 276 CE2 . TYR A 37 ? -1.87469 15.11327 -46.94365 1.000 24.85340 C ? A ? 37 1 ATOM 277 CZ . TYR A 37 ? -1.12484 15.99695 -46.19522 1.000 27.39667 C ? A ? 37 1 ATOM 278 OH . TYR A 37 ? -0.25247 16.85667 -46.82860 1.000 30.31150 O ? A ? 37 1 ATOM 279 N . CYS A 38 ? -7.02063 12.26691 -43.76056 1.000 23.52631 N ? A ? 38 1 ATOM 280 CA . CYS A 38 ? -7.86233 11.25993 -43.12149 1.000 23.18531 C ? A ? 38 1 ATOM 281 C . CYS A 38 ? -8.34868 10.29549 -44.19455 1.000 20.90221 C ? A ? 38 1 ATOM 282 O . CYS A 38 ? -8.27940 10.59965 -45.38605 1.000 22.23856 O ? A ? 38 1 ATOM 283 CB . CYS A 38 ? -9.04988 11.90451 -42.39279 1.000 20.18524 C ? A ? 38 1 ATOM 284 SG . CYS A 38 ? -10.27419 12.67885 -43.47788 1.000 25.08306 S ? A ? 38 1 ATOM 285 N . PRO A 39 ? -8.82495 9.11036 -43.79832 1.000 23.64784 N ? A ? 39 1 ATOM 286 CA . PRO A 39 ? -9.40631 8.19522 -44.79074 1.000 26.78096 C ? A ? 39 1 ATOM 287 C . PRO A 39 ? -10.66007 8.78437 -45.41817 1.000 23.55179 C ? A ? 39 1 ATOM 288 O . PRO A 39 ? -11.45370 9.46136 -44.76115 1.000 25.32797 O ? A ? 39 1 ATOM 289 CB . PRO A 39 ? -9.73127 6.94037 -43.97055 1.000 21.96958 C ? A ? 39 1 ATOM 290 CG . PRO A 39 ? -8.85001 7.02381 -42.77724 1.000 18.75904 C ? A ? 39 1 ATOM 291 CD . PRO A 39 ? -8.71341 8.48330 -42.47313 1.000 22.76147 C ? A ? 39 1 ATOM 292 N . ARG A 40 ? -10.84010 8.50878 -46.71099 1.000 22.06189 N ? A ? 40 1 ATOM 293 CA . ARG A 40 ? -11.92387 9.13670 -47.45574 1.000 23.89559 C ? A ? 40 1 ATOM 294 C . ARG A 40 ? -13.29576 8.56546 -47.11445 1.000 29.21665 C ? A ? 40 1 ATOM 295 O . ARG A 40 ? -14.30591 9.19409 -47.44317 1.000 24.91269 O ? A ? 40 1 ATOM 296 CB . ARG A 40 ? -11.67725 9.01772 -48.96458 1.000 23.55211 C ? A ? 40 1 ATOM 297 CG . ARG A 40 ? -11.83632 7.62158 -49.53877 1.000 22.65797 C ? A ? 40 1 ATOM 298 CD . ARG A 40 ? -11.73660 7.64238 -51.05956 1.000 23.14460 C ? A ? 40 1 ATOM 299 NE . ARG A 40 ? -11.67419 6.30359 -51.63595 1.000 23.42666 N ? A ? 40 1 ATOM 300 CZ . ARG A 40 ? -11.61319 6.05301 -52.93712 1.000 25.08995 C ? A ? 40 1 ATOM 301 NH1 . ARG A 40 ? -11.60417 7.03154 -53.82997 1.000 24.73723 N ? A ? 40 1 ATOM 302 NH2 . ARG A 40 ? -11.56497 4.78989 -53.35364 1.000 24.65396 N ? A ? 40 1 ATOM 303 N . HIS A 41 ? -13.36823 7.40527 -46.45953 1.000 27.86007 N ? A ? 41 1 ATOM 304 CA . HIS A 41 ? -14.66733 6.82566 -46.13330 1.000 25.31671 C ? A ? 41 1 ATOM 305 C . HIS A 41 ? -15.33125 7.50232 -44.93894 1.000 29.40568 C ? A ? 41 1 ATOM 306 O . HIS A 41 ? -16.40688 7.06247 -44.51336 1.000 28.84211 O ? A ? 41 1 ATOM 307 CB . HIS A 41 ? -14.54566 5.31139 -45.89760 1.000 24.61607 C ? A ? 41 1 ATOM 308 CG . HIS A 41 ? -13.81403 4.93233 -44.64635 1.000 24.15159 C ? A ? 41 1 ATOM 309 ND1 . HIS A 41 ? -12.49518 4.52902 -44.64785 1.000 29.75015 N ? A ? 41 1 ATOM 310 CD2 . HIS A 41 ? -14.22712 4.86143 -43.35809 1.000 24.32473 C ? A ? 41 1 ATOM 311 CE1 . HIS A 41 ? -12.12231 4.24534 -43.41203 1.000 23.61573 C ? A ? 41 1 ATOM 312 NE2 . HIS A 41 ? -13.15457 4.43916 -42.61037 1.000 25.42138 N ? A ? 41 1 ATOM 313 N . VAL A 42 ? -14.71590 8.55702 -44.39545 1.000 27.35529 N ? A ? 42 1 ATOM 314 CA . VAL A 42 ? -15.39140 9.39277 -43.41158 1.000 28.73328 C ? A ? 42 1 ATOM 315 C . VAL A 42 ? -16.63517 10.04489 -44.00929 1.000 31.03195 C ? A ? 42 1 ATOM 316 O . VAL A 42 ? -17.57527 10.37847 -43.27826 1.000 32.95365 O ? A ? 42 1 ATOM 317 CB . VAL A 42 ? -14.40959 10.44793 -42.85590 1.000 27.15430 C ? A ? 42 1 ATOM 318 CG1 . VAL A 42 ? -13.98966 11.42510 -43.94626 1.000 24.69318 C ? A ? 42 1 ATOM 319 CG2 . VAL A 42 ? -15.00934 11.18256 -41.66343 1.000 32.94659 C ? A ? 42 1 ATOM 320 N . ILE A 43 ? -16.66970 10.23402 -45.33378 1.000 34.34893 N ? A ? 43 1 ATOM 321 CA . ILE A 43 ? -17.83216 10.83953 -45.98012 1.000 35.48187 C ? A ? 43 1 ATOM 322 C . ILE A 43 ? -18.94316 9.84053 -46.24769 1.000 34.17515 C ? A ? 43 1 ATOM 323 O . ILE A 43 ? -20.00404 10.23337 -46.75140 1.000 34.51798 O ? A ? 43 1 ATOM 324 CB . ILE A 43 ? -17.45737 11.51412 -47.31613 1.000 31.97687 C ? A ? 43 1 ATOM 325 CG1 . ILE A 43 ? -17.13421 10.45798 -48.37862 1.000 28.63707 C ? A ? 43 1 ATOM 326 CG2 . ILE A 43 ? -16.28737 12.47199 -47.12320 1.000 28.13069 C ? A ? 43 1 ATOM 327 CD1 . ILE A 43 ? -16.81301 11.03429 -49.74517 1.000 28.70857 C ? A ? 43 1 ATOM 328 N . CYS A 44 ? -18.73817 8.56534 -45.92825 1.000 30.44932 N ? A ? 44 1 ATOM 329 CA . CYS A 44 ? -19.71655 7.52713 -46.21958 1.000 34.85813 C ? A ? 44 1 ATOM 330 C . CYS A 44 ? -20.69799 7.35374 -45.07118 1.000 40.22311 C ? A ? 44 1 ATOM 331 O . CYS A 44 ? -20.32087 7.40867 -43.89660 1.000 51.92071 O ? A ? 44 1 ATOM 332 CB . CYS A 44 ? -19.03046 6.18790 -46.48744 1.000 31.99387 C ? A ? 44 1 ATOM 333 SG . CYS A 44 ? -18.16033 6.08851 -48.04661 1.000 38.12151 S ? A ? 44 1 ATOM 334 N . THR A 45 ? -21.96104 7.13295 -45.42177 1.000 51.67750 N ? A ? 45 1 ATOM 335 CA . THR A 45 ? -22.94017 6.66655 -44.45565 1.000 56.88591 C ? A ? 45 1 ATOM 336 C . THR A 45 ? -22.82008 5.15099 -44.31599 1.000 52.00792 C ? A ? 45 1 ATOM 337 O . THR A 45 ? -22.01805 4.50327 -44.99273 1.000 53.72191 O ? A ? 45 1 ATOM 338 CB . THR A 45 ? -24.34690 7.07718 -44.87905 1.000 53.71987 C ? A ? 45 1 ATOM 339 OG1 . THR A 45 ? -24.75578 6.28891 -46.00349 1.000 58.50370 O ? A ? 45 1 ATOM 340 CG2 . THR A 45 ? -24.36394 8.54531 -45.27529 1.000 42.60475 C ? A ? 45 1 ATOM 341 N . SER A 46 ? -23.62274 4.57010 -43.42264 1.000 66.94105 N ? A ? 46 1 ATOM 342 CA . SER A 46 ? -23.55470 3.12716 -43.21170 1.000 60.60534 C ? A ? 46 1 ATOM 343 C . SER A 46 ? -23.90797 2.36370 -44.48291 1.000 58.92454 C ? A ? 46 1 ATOM 344 O . SER A 46 ? -23.26213 1.36140 -44.81187 1.000 56.57390 O ? A ? 46 1 ATOM 345 CB . SER A 46 ? -24.47404 2.72398 -42.06061 1.000 65.62612 C ? A ? 46 1 ATOM 346 OG . SER A 46 ? -24.15056 3.45098 -40.88661 1.000 74.43575 O ? A ? 46 1 ATOM 347 N . GLU A 47 ? -24.91700 2.83325 -45.22205 1.000 58.01306 N ? A ? 47 1 ATOM 348 CA . GLU A 47 ? -25.31505 2.15677 -46.45218 1.000 55.16625 C ? A ? 47 1 ATOM 349 C . GLU A 47 ? -24.38173 2.46509 -47.61506 1.000 54.09750 C ? A ? 47 1 ATOM 350 O . GLU A 47 ? -24.25884 1.64747 -48.53358 1.000 54.07166 O ? A ? 47 1 ATOM 351 CB . GLU A 47 ? -26.74545 2.53815 -46.83421 1.000 57.94036 C ? A ? 47 1 ATOM 352 CG . GLU A 47 ? -26.94523 4.02268 -47.09397 1.000 72.85001 C ? A ? 47 1 ATOM 353 CD . GLU A 47 ? -27.57889 4.73975 -45.91714 1.000 85.61381 C ? A ? 47 1 ATOM 354 OE1 . GLU A 47 ? -27.79319 4.08984 -44.87092 1.000 86.07557 O ? A ? 47 1 ATOM 355 OE2 . GLU A 47 ? -27.87059 5.94937 -46.04112 1.000 80.15543 O ? A ? 47 1 ATOM 356 N . ASP A 48 ? -23.72378 3.62661 -47.60188 1.000 55.48464 N ? A ? 48 1 ATOM 357 CA . ASP A 48 ? -22.84179 3.98099 -48.70950 1.000 50.92572 C ? A ? 48 1 ATOM 358 C . ASP A 48 ? -21.64548 3.04620 -48.81231 1.000 49.52999 C ? A ? 48 1 ATOM 359 O . ASP A 48 ? -21.10417 2.85331 -49.90555 1.000 48.99043 O ? A ? 48 1 ATOM 360 CB . ASP A 48 ? -22.36049 5.42063 -48.56145 1.000 49.69246 C ? A ? 48 1 ATOM 361 CG . ASP A 48 ? -23.41760 6.42561 -48.95016 1.000 56.55069 C ? A ? 48 1 ATOM 362 OD1 . ASP A 48 ? -24.17113 6.14744 -49.91060 1.000 59.28699 O ? A ? 48 1 ATOM 363 OD2 . ASP A 48 ? -23.48904 7.49423 -48.30170 1.000 59.95333 O ? A ? 48 1 ATOM 364 N . MET A 49 ? -21.22544 2.44765 -47.69984 1.000 42.94463 N ? A ? 49 1 ATOM 365 CA . MET A 49 ? -20.00249 1.65732 -47.70740 1.000 48.88804 C ? A ? 49 1 ATOM 366 C . MET A 49 ? -20.13160 0.35925 -48.49541 1.000 40.28683 C ? A ? 49 1 ATOM 367 O . MET A 49 ? -19.10439 -0.24832 -48.81306 1.000 34.16309 O ? A ? 49 1 ATOM 368 CB . MET A 49 ? -19.57006 1.35976 -46.27217 1.000 36.53143 C ? A ? 49 1 ATOM 369 CG . MET A 49 ? -19.47255 2.60130 -45.41038 1.000 46.18858 C ? A ? 49 1 ATOM 370 SD . MET A 49 ? -18.49146 2.33787 -43.92619 1.000 57.36799 S ? A ? 49 1 ATOM 371 CE . MET A 49 ? -19.25132 3.51465 -42.80744 1.000 58.25728 C ? A ? 49 1 ATOM 372 N . LEU A 50 ? -21.34953 -0.07145 -48.83400 1.000 38.02186 N ? A ? 50 1 ATOM 373 CA . LEU A 50 ? -21.50953 -1.32899 -49.56151 1.000 39.07119 C ? A ? 50 1 ATOM 374 C . LEU A 50 ? -20.95975 -1.21968 -50.97913 1.000 42.92049 C ? A ? 50 1 ATOM 375 O . LEU A 50 ? -20.20156 -2.08684 -51.43300 1.000 39.55961 O ? A ? 50 1 ATOM 376 CB . LEU A 50 ? -22.98207 -1.74382 -49.58183 1.000 42.43700 C ? A ? 50 1 ATOM 377 CG . LEU A 50 ? -23.55455 -2.45329 -48.34783 1.000 53.10381 C ? A ? 50 1 ATOM 378 CD1 . LEU A 50 ? -22.70538 -3.65487 -47.95967 1.000 43.39512 C ? A ? 50 1 ATOM 379 CD2 . LEU A 50 ? -23.71458 -1.50304 -47.17111 1.000 50.22626 C ? A ? 50 1 ATOM 380 N . ASN A 51 ? -21.33171 -0.16084 -51.69849 1.000 41.26380 N ? A ? 51 1 ATOM 381 CA . ASN A 51 ? -20.83564 0.08135 -53.05412 1.000 45.76701 C ? A ? 51 1 ATOM 382 C . ASN A 51 ? -20.65768 1.58146 -53.24495 1.000 38.24275 C ? A ? 51 1 ATOM 383 O . ASN A 51 ? -21.44757 2.24169 -53.93034 1.000 40.09539 O ? A ? 51 1 ATOM 384 CB . ASN A 51 ? -21.78975 -0.50129 -54.09534 1.000 48.46933 C ? A ? 51 1 ATOM 385 CG . ASN A 51 ? -21.24546 -0.39719 -55.50363 1.000 55.93604 C ? A ? 51 1 ATOM 386 OD1 . ASN A 51 ? -20.04943 -0.18218 -55.70294 1.000 54.05868 O ? A ? 51 1 ATOM 387 ND2 . ASN A 51 ? -22.12110 -0.55386 -56.49143 1.000 50.26647 N ? A ? 51 1 ATOM 388 N . PRO A 52 ? -19.61207 2.15673 -52.64950 1.000 36.74362 N ? A ? 52 1 ATOM 389 CA . PRO A 52 ? -19.48813 3.62116 -52.62599 1.000 40.43231 C ? A ? 52 1 ATOM 390 C . PRO A 52 ? -18.94624 4.16393 -53.94029 1.000 40.93659 C ? A ? 52 1 ATOM 391 O . PRO A 52 ? -17.99323 3.62477 -54.50720 1.000 42.31827 O ? A ? 52 1 ATOM 392 CB . PRO A 52 ? -18.50892 3.87453 -51.47408 1.000 35.01496 C ? A ? 52 1 ATOM 393 CG . PRO A 52 ? -17.67242 2.63653 -51.42399 1.000 30.87569 C ? A ? 52 1 ATOM 394 CD . PRO A 52 ? -18.54985 1.49455 -51.87004 1.000 40.54925 C ? A ? 52 1 ATOM 395 N . ASN A 53 ? -19.56923 5.23613 -54.42360 1.000 35.56485 N ? A ? 53 1 ATOM 396 CA . ASN A 53 ? -19.03533 6.03697 -55.52394 1.000 38.16574 C ? A ? 53 1 ATOM 397 C . ASN A 53 ? -18.46854 7.30113 -54.88440 1.000 37.09739 C ? A ? 53 1 ATOM 398 O . ASN A 53 ? -19.17279 8.29404 -54.69640 1.000 35.95012 O ? A ? 53 1 ATOM 399 CB . ASN A 53 ? -20.11335 6.34293 -56.55897 1.000 36.11484 C ? A ? 53 1 ATOM 400 CG . ASN A 53 ? -19.55546 6.98444 -57.81921 1.000 39.77344 C ? A ? 53 1 ATOM 401 OD1 . ASN A 53 ? -18.60410 7.76454 -57.77139 1.000 42.54952 O ? A ? 53 1 ATOM 402 ND2 . ASN A 53 ? -20.15326 6.65744 -58.95735 1.000 43.82696 N ? A ? 53 1 ATOM 403 N . TYR A 54 ? -17.17599 7.25658 -54.54955 1.000 30.72289 N ? A ? 54 1 ATOM 404 CA . TYR A 54 ? -16.58004 8.31491 -53.74086 1.000 30.31160 C ? A ? 54 1 ATOM 405 C . TYR A 54 ? -16.59023 9.66325 -54.45019 1.000 32.84041 C ? A ? 54 1 ATOM 406 O . TYR A 54 ? -16.69867 10.70315 -53.79104 1.000 35.07218 O ? A ? 54 1 ATOM 407 CB . TYR A 54 ? -15.15836 7.92380 -53.34486 1.000 27.65818 C ? A ? 54 1 ATOM 408 CG . TYR A 54 ? -15.11243 6.87364 -52.26166 1.000 29.68234 C ? A ? 54 1 ATOM 409 CD1 . TYR A 54 ? -15.32117 7.21708 -50.93529 1.000 26.61243 C ? A ? 54 1 ATOM 410 CD2 . TYR A 54 ? -14.86690 5.54021 -52.56370 1.000 27.03870 C ? A ? 54 1 ATOM 411 CE1 . TYR A 54 ? -15.27832 6.26950 -49.93800 1.000 26.23067 C ? A ? 54 1 ATOM 412 CE2 . TYR A 54 ? -14.81880 4.57862 -51.56741 1.000 26.68165 C ? A ? 54 1 ATOM 413 CZ . TYR A 54 ? -15.02764 4.95064 -50.25692 1.000 26.26394 C ? A ? 54 1 ATOM 414 OH . TYR A 54 ? -14.98500 4.00972 -49.25395 1.000 27.23063 O ? A ? 54 1 ATOM 415 N . GLU A 55 ? -16.47963 9.67440 -55.78022 1.000 32.01137 N ? A ? 55 1 ATOM 416 CA . GLU A 55 ? -16.56374 10.93610 -56.50874 1.000 31.93711 C ? A ? 55 1 ATOM 417 C . GLU A 55 ? -17.92307 11.59368 -56.29616 1.000 37.03000 C ? A ? 55 1 ATOM 418 O . GLU A 55 ? -18.00556 12.78841 -55.98654 1.000 35.82063 O ? A ? 55 1 ATOM 419 CB . GLU A 55 ? -16.29108 10.70835 -57.99804 1.000 38.43944 C ? A ? 55 1 ATOM 420 CG . GLU A 55 ? -15.02098 9.91555 -58.29140 1.000 42.36446 C ? A ? 55 1 ATOM 421 CD . GLU A 55 ? -15.25477 8.40902 -58.28781 1.000 53.30030 C ? A ? 55 1 ATOM 422 OE1 . GLU A 55 ? -15.91138 7.90301 -59.22435 1.000 58.94968 O ? A ? 55 1 ATOM 423 OE2 . GLU A 55 ? -14.79240 7.73247 -57.34365 1.000 38.77979 O ? A ? 55 1 ATOM 424 N . ASP A 56 ? -19.00301 10.81681 -56.43723 1.000 34.86291 N ? A ? 56 1 ATOM 425 CA . ASP A 56 ? -20.34572 11.35213 -56.22729 1.000 37.77230 C ? A ? 56 1 ATOM 426 C . ASP A 56 ? -20.56219 11.76194 -54.77755 1.000 36.72795 C ? A ? 56 1 ATOM 427 O . ASP A 56 ? -21.16858 12.80457 -54.50431 1.000 37.68533 O ? A ? 56 1 ATOM 428 CB . ASP A 56 ? -21.39852 10.32079 -56.63322 1.000 41.31680 C ? A ? 56 1 ATOM 429 CG . ASP A 56 ? -21.40998 10.04544 -58.11979 1.000 43.02965 C ? A ? 56 1 ATOM 430 OD1 . ASP A 56 ? -20.68180 10.73303 -58.86348 1.000 42.63103 O ? A ? 56 1 ATOM 431 OD2 . ASP A 56 ? -22.15143 9.13253 -58.54225 1.000 53.43399 O ? A ? 56 1 ATOM 432 N . LEU A 57 ? -20.09461 10.94098 -53.83386 1.000 34.91140 N ? A ? 57 1 ATOM 433 CA . LEU A 57 ? -20.30466 11.24228 -52.42185 1.000 34.71977 C ? A ? 57 1 ATOM 434 C . LEU A 57 ? -19.54572 12.49659 -52.00558 1.000 34.02456 C ? A ? 57 1 ATOM 435 O . LEU A 57 ? -20.04444 13.29087 -51.19869 1.000 35.13912 O ? A ? 57 1 ATOM 436 CB . LEU A 57 ? -19.89093 10.04562 -51.56231 1.000 33.40165 C ? A ? 57 1 ATOM 437 CG . LEU A 57 ? -20.73780 8.77791 -51.72311 1.000 34.58461 C ? A ? 57 1 ATOM 438 CD1 . LEU A 57 ? -20.15499 7.61417 -50.92445 1.000 33.31126 C ? A ? 57 1 ATOM 439 CD2 . LEU A 57 ? -22.17858 9.04898 -51.31325 1.000 36.97258 C ? A ? 57 1 ATOM 440 N . LEU A 58 ? -18.34044 12.69476 -52.54715 1.000 32.49008 N ? A ? 58 1 ATOM 441 CA . LEU A 58 ? -17.57662 13.89167 -52.21544 1.000 31.99034 C ? A ? 58 1 ATOM 442 C . LEU A 58 ? -18.16941 15.12886 -52.87350 1.000 33.91187 C ? A ? 58 1 ATOM 443 O . LEU A 58 ? -18.08387 16.22799 -52.31507 1.000 39.16862 O ? A ? 58 1 ATOM 444 CB . LEU A 58 ? -16.11682 13.71419 -52.62643 1.000 30.26487 C ? A ? 58 1 ATOM 445 CG . LEU A 58 ? -15.17382 14.83181 -52.18504 1.000 29.73347 C ? A ? 58 1 ATOM 446 CD1 . LEU A 58 ? -15.24825 15.02800 -50.67986 1.000 32.57216 C ? A ? 58 1 ATOM 447 CD2 . LEU A 58 ? -13.75776 14.51781 -52.61025 1.000 28.30268 C ? A ? 58 1 ATOM 448 N . ILE A 59 ? -18.77575 14.97008 -54.05211 1.000 38.25269 N ? A ? 59 1 ATOM 449 CA . ILE A 59 ? -19.43433 16.09355 -54.71166 1.000 40.40309 C ? A ? 59 1 ATOM 450 C . ILE A 59 ? -20.60053 16.60180 -53.87268 1.000 40.66509 C ? A ? 59 1 ATOM 451 O . ILE A 59 ? -20.85800 17.81039 -53.81791 1.000 44.93832 O ? A ? 59 1 ATOM 452 CB . ILE A 59 ? -19.86921 15.68021 -56.13394 1.000 38.48951 C ? A ? 59 1 ATOM 453 CG1 . ILE A 59 ? -18.64554 15.64540 -57.05579 1.000 37.44945 C ? A ? 59 1 ATOM 454 CG2 . ILE A 59 ? -20.93842 16.62245 -56.68566 1.000 41.18498 C ? A ? 59 1 ATOM 455 CD1 . ILE A 59 ? -18.93245 15.15372 -58.45406 1.000 38.55898 C ? A ? 59 1 ATOM 456 N . ARG A 60 ? -21.29941 15.70467 -53.17779 1.000 41.13715 N ? A ? 60 1 ATOM 457 CA . ARG A 60 ? -22.40422 16.12389 -52.32186 1.000 43.50169 C ? A ? 60 1 ATOM 458 C . ARG A 60 ? -21.94725 16.80741 -51.03285 1.000 45.05827 C ? A ? 60 1 ATOM 459 O . ARG A 60 ? -22.80299 17.29952 -50.28681 1.000 46.89751 O ? A ? 60 1 ATOM 460 CB . ARG A 60 ? -23.29009 14.92363 -51.97622 1.000 44.45918 C ? A ? 60 1 ATOM 461 CG . ARG A 60 ? -23.84629 14.19188 -53.18503 1.000 47.70994 C ? A ? 60 1 ATOM 462 CD . ARG A 60 ? -24.36165 15.16874 -54.23003 1.000 61.71985 C ? A ? 60 1 ATOM 463 NE . ARG A 60 ? -25.79026 15.02021 -54.48093 1.000 70.14785 N ? A ? 60 1 ATOM 464 CZ . ARG A 60 ? -26.32089 14.06216 -55.22824 1.000 77.64281 C ? A ? 60 1 ATOM 465 NH1 . ARG A 60 ? -25.56951 13.11961 -55.77773 1.000 81.24380 N ? A ? 60 1 ATOM 466 NH2 . ARG A 60 ? -27.63734 14.04805 -55.42738 1.000 60.68263 N ? A ? 60 1 ATOM 467 N . LYS A 61 ? -20.64672 16.86059 -50.75186 1.000 39.23385 N ? A ? 61 1 ATOM 468 CA . LYS A 61 ? -20.13025 17.45161 -49.52506 1.000 45.54217 C ? A ? 61 1 ATOM 469 C . LYS A 61 ? -19.62306 18.87013 -49.76810 1.000 50.21462 C ? A ? 61 1 ATOM 470 O . LYS A 61 ? -19.14582 19.20610 -50.85640 1.000 43.25869 O ? A ? 61 1 ATOM 471 CB . LYS A 61 ? -19.00050 16.60005 -48.94227 1.000 45.54292 C ? A ? 61 1 ATOM 472 CG . LYS A 61 ? -19.42420 15.20369 -48.51859 1.000 42.94393 C ? A ? 61 1 ATOM 473 CD . LYS A 61 ? -20.45432 15.27037 -47.40945 1.000 43.62574 C ? A ? 61 1 ATOM 474 CE . LYS A 61 ? -20.83305 13.88712 -46.91971 1.000 35.91683 C ? A ? 61 1 ATOM 475 NZ . LYS A 61 ? -21.83741 13.96946 -45.82432 1.000 41.38470 N ? A ? 61 1 ATOM 476 N . SER A 62 ? -19.73703 19.70025 -48.73359 1.000 44.89731 N ? A ? 62 1 ATOM 477 CA . SER A 62 ? -19.21649 21.06031 -48.71285 1.000 45.64277 C ? A ? 62 1 ATOM 478 C . SER A 62 ? -18.14236 21.16562 -47.63817 1.000 44.05248 C ? A ? 62 1 ATOM 479 O . SER A 62 ? -17.91597 20.23118 -46.86798 1.000 44.12482 O ? A ? 62 1 ATOM 480 CB . SER A 62 ? -20.33489 22.08174 -48.45501 1.000 43.43127 C ? A ? 62 1 ATOM 481 OG . SER A 62 ? -21.24741 22.14130 -49.54020 1.000 51.58979 O ? A ? 62 1 ATOM 482 N . ASN A 63 ? -17.47727 22.32265 -47.58412 1.000 46.24455 N ? A ? 63 1 ATOM 483 CA . ASN A 63 ? -16.43055 22.51424 -46.58417 1.000 41.01929 C ? A ? 63 1 ATOM 484 C . ASN A 63 ? -16.99663 22.44626 -45.17031 1.000 40.51591 C ? A ? 63 1 ATOM 485 O . ASN A 63 ? -16.36294 21.88656 -44.26793 1.000 42.75229 O ? A ? 63 1 ATOM 486 CB . ASN A 63 ? -15.71258 23.84714 -46.81115 1.000 45.75399 C ? A ? 63 1 ATOM 487 CG . ASN A 63 ? -14.80697 23.82903 -48.03319 1.000 44.09792 C ? A ? 63 1 ATOM 488 OD1 . ASN A 63 ? -14.20106 22.80740 -48.35722 1.000 40.17488 O ? A ? 63 1 ATOM 489 ND2 . ASN A 63 ? -14.71028 24.96761 -48.71651 1.000 41.62144 N ? A ? 63 1 ATOM 490 N . HIS A 64 ? -18.19371 22.99960 -44.95882 1.000 44.15166 N ? A ? 64 1 ATOM 491 CA . HIS A 64 ? -18.78731 23.02918 -43.62644 1.000 46.71342 C ? A ? 64 1 ATOM 492 C . HIS A 64 ? -19.32240 21.67351 -43.17994 1.000 41.74739 C ? A ? 64 1 ATOM 493 O . HIS A 64 ? -19.72402 21.53997 -42.01948 1.000 49.48466 O ? A ? 64 1 ATOM 494 CB . HIS A 64 ? -19.90297 24.07998 -43.57080 1.000 46.54312 C ? A ? 64 1 ATOM 495 CG . HIS A 64 ? -20.88141 23.99258 -44.70354 1.000 61.34991 C ? A ? 64 1 ATOM 496 ND1 . HIS A 64 ? -21.86192 23.02524 -44.77079 1.000 57.40554 N ? A ? 64 1 ATOM 497 CD2 . HIS A 64 ? -21.03505 24.75967 -45.80976 1.000 61.58638 C ? A ? 64 1 ATOM 498 CE1 . HIS A 64 ? -22.57364 23.19711 -45.87098 1.000 54.59603 C ? A ? 64 1 ATOM 499 NE2 . HIS A 64 ? -22.09317 24.24339 -46.51880 1.000 61.99680 N ? A ? 64 1 ATOM 500 N . ASN A 65 ? -19.33615 20.67238 -44.05692 1.000 42.94762 N ? A ? 65 1 ATOM 501 CA . ASN A 65 ? -19.73380 19.32416 -43.67422 1.000 39.31632 C ? A ? 65 1 ATOM 502 C . ASN A 65 ? -18.61320 18.54030 -43.00531 1.000 44.10049 C ? A ? 65 1 ATOM 503 O . ASN A 65 ? -18.81673 17.36956 -42.66825 1.000 47.60252 O ? A ? 65 1 ATOM 504 CB . ASN A 65 ? -20.22985 18.55340 -44.89912 1.000 39.21193 C ? A ? 65 1 ATOM 505 CG . ASN A 65 ? -21.51295 19.11866 -45.45815 1.000 47.47518 C ? A ? 65 1 ATOM 506 OD1 . ASN A 65 ? -21.60232 19.42975 -46.64512 1.000 50.40212 O ? A ? 65 1 ATOM 507 ND2 . ASN A 65 ? -22.51796 19.26025 -44.60179 1.000 44.10187 N ? A ? 65 1 ATOM 508 N . PHE A 66 ? -17.44473 19.14370 -42.80519 1.000 38.68908 N ? A ? 66 1 ATOM 509 CA . PHE A 66 ? -16.29991 18.46592 -42.20415 1.000 39.27311 C ? A ? 66 1 ATOM 510 C . PHE A 66 ? -15.96856 19.13908 -40.87839 1.000 42.45678 C ? A ? 66 1 ATOM 511 O . PHE A 66 ? -15.56187 20.30529 -40.85426 1.000 39.95952 O ? A ? 66 1 ATOM 512 CB . PHE A 66 ? -15.09849 18.48736 -43.14640 1.000 40.16018 C ? A ? 66 1 ATOM 513 CG . PHE A 66 ? -15.32432 17.74814 -44.43801 1.000 41.88457 C ? A ? 66 1 ATOM 514 CD1 . PHE A 66 ? -15.27577 16.36226 -44.47725 1.000 32.76987 C ? A ? 66 1 ATOM 515 CD2 . PHE A 66 ? -15.57013 18.43872 -45.61395 1.000 33.80192 C ? A ? 66 1 ATOM 516 CE1 . PHE A 66 ? -15.47690 15.67941 -45.66433 1.000 32.21918 C ? A ? 66 1 ATOM 517 CE2 . PHE A 66 ? -15.77055 17.76255 -46.80308 1.000 44.69160 C ? A ? 66 1 ATOM 518 CZ . PHE A 66 ? -15.72238 16.37992 -46.82830 1.000 43.25634 C ? A ? 66 1 ATOM 519 N . LEU A 67 ? -16.14266 18.40330 -39.78145 1.000 44.37138 N ? A ? 67 1 ATOM 520 CA . LEU A 67 ? -15.87262 18.89714 -38.43480 1.000 43.34519 C ? A ? 67 1 ATOM 521 C . LEU A 67 ? -14.48231 18.44011 -38.01490 1.000 39.30586 C ? A ? 67 1 ATOM 522 O . LEU A 67 ? -14.28467 17.26978 -37.67729 1.000 42.48817 O ? A ? 67 1 ATOM 523 CB . LEU A 67 ? -16.92472 18.39084 -37.45030 1.000 49.24619 C ? A ? 67 1 ATOM 524 CG . LEU A 67 ? -18.10710 19.30721 -37.13807 1.000 54.65389 C ? A ? 67 1 ATOM 525 CD1 . LEU A 67 ? -17.60760 20.59747 -36.50927 1.000 63.09657 C ? A ? 67 1 ATOM 526 CD2 . LEU A 67 ? -18.92715 19.58290 -38.39097 1.000 59.35181 C ? A ? 67 1 ATOM 527 N . VAL A 68 ? -13.52474 19.36146 -38.02106 1.000 33.26601 N ? A ? 68 1 ATOM 528 CA . VAL A 68 ? -12.15799 19.08259 -37.59483 1.000 42.79349 C ? A ? 68 1 ATOM 529 C . VAL A 68 ? -11.92797 19.76152 -36.25272 1.000 41.92156 C ? A ? 68 1 ATOM 530 O . VAL A 68 ? -12.16583 20.96703 -36.11122 1.000 42.44211 O ? A ? 68 1 ATOM 531 CB . VAL A 68 ? -11.12872 19.55396 -38.63588 1.000 42.98441 C ? A ? 68 1 ATOM 532 CG1 . VAL A 68 ? -9.71479 19.23193 -38.16122 1.000 33.73939 C ? A ? 68 1 ATOM 533 CG2 . VAL A 68 ? -11.41369 18.90595 -39.98399 1.000 33.65062 C ? A ? 68 1 ATOM 534 N . GLN A 69 ? -11.47001 18.98956 -35.26834 1.000 40.98532 N ? A ? 69 1 ATOM 535 CA . GLN A 69 ? -11.22316 19.50337 -33.92807 1.000 43.86241 C ? A ? 69 1 ATOM 536 C . GLN A 69 ? -9.84452 19.06397 -33.45673 1.000 40.58367 C ? A ? 69 1 ATOM 537 O . GLN A 69 ? -9.51154 17.87585 -33.51915 1.000 31.95408 O ? A ? 69 1 ATOM 538 CB . GLN A 69 ? -12.29793 19.02510 -32.94945 1.000 38.84832 C ? A ? 69 1 ATOM 539 CG . GLN A 69 ? -12.75296 20.09504 -31.97756 1.000 57.49720 C ? A ? 69 1 ATOM 540 CD . GLN A 69 ? -13.84971 19.61034 -31.05881 1.000 65.37184 C ? A ? 69 1 ATOM 541 OE1 . GLN A 69 ? -15.03363 19.81768 -31.32491 1.000 70.19263 O ? A ? 69 1 ATOM 542 NE2 . GLN A 69 ? -13.46238 18.95632 -29.96819 1.000 66.05398 N ? A ? 69 1 ATOM 543 N . ALA A 70 ? -9.04988 20.02358 -32.98833 1.000 40.93377 N ? A ? 70 1 ATOM 544 CA . ALA A 70 ? -7.71960 19.77864 -32.43172 1.000 40.06178 C ? A ? 70 1 ATOM 545 C . ALA A 70 ? -7.78646 20.14032 -30.95094 1.000 47.13183 C ? A ? 70 1 ATOM 546 O . ALA A 70 ? -7.59184 21.29504 -30.56662 1.000 47.21569 O ? A ? 70 1 ATOM 547 CB . ALA A 70 ? -6.65113 20.58661 -33.16528 1.000 41.01829 C ? A ? 70 1 ATOM 548 N . GLY A 71 ? -8.06202 19.14022 -30.11904 1.000 42.07896 N ? A ? 71 1 ATOM 549 CA . GLY A 71 ? -8.36494 19.43323 -28.73073 1.000 46.88841 C ? A ? 71 1 ATOM 550 C . GLY A 71 ? -9.72011 20.10805 -28.62649 1.000 47.38091 C ? A ? 71 1 ATOM 551 O . GLY A 71 ? -10.69812 19.69232 -29.25687 1.000 55.26693 O ? A ? 71 1 ATOM 552 N . ASN A 72 ? -9.78578 21.17124 -27.82865 1.000 48.37684 N ? A ? 72 1 ATOM 553 CA . ASN A 72 ? -11.01573 21.94406 -27.70504 1.000 48.65740 C ? A ? 72 1 ATOM 554 C . ASN A 72 ? -11.15913 23.00126 -28.79269 1.000 52.74598 C ? A ? 72 1 ATOM 555 O . ASN A 72 ? -12.13236 23.76307 -28.77111 1.000 52.75614 O ? A ? 72 1 ATOM 556 CB . ASN A 72 ? -11.09295 22.60835 -26.32289 1.000 49.13138 C ? A ? 72 1 ATOM 557 CG . ASN A 72 ? -10.11941 23.77215 -26.16835 1.000 65.17639 C ? A ? 72 1 ATOM 558 OD1 . ASN A 72 ? -8.94609 23.67341 -26.53469 1.000 69.78069 O ? A ? 72 1 ATOM 559 ND2 . ASN A 72 ? -10.60923 24.88487 -25.62261 1.000 62.89127 N ? A ? 72 1 ATOM 560 N . VAL A 73 ? -10.22688 23.06537 -29.73877 1.000 52.80565 N ? A ? 73 1 ATOM 561 CA . VAL A 73 ? -10.24264 24.06839 -30.79677 1.000 56.38697 C ? A ? 73 1 ATOM 562 C . VAL A 73 ? -10.76966 23.42409 -32.07083 1.000 45.80563 C ? A ? 73 1 ATOM 563 O . VAL A 73 ? -10.33003 22.33264 -32.45277 1.000 42.42840 O ? A ? 73 1 ATOM 564 CB . VAL A 73 ? -8.84259 24.66877 -31.01524 1.000 58.50839 C ? A ? 73 1 ATOM 565 CG1 . VAL A 73 ? -8.88256 25.73996 -32.09230 1.000 56.99986 C ? A ? 73 1 ATOM 566 CG2 . VAL A 73 ? -8.30212 25.24179 -29.71164 1.000 47.44570 C ? A ? 73 1 ATOM 567 N . GLN A 74 ? -11.71546 24.09385 -32.72334 1.000 46.98137 N ? A ? 74 1 ATOM 568 CA . GLN A 74 ? -12.30382 23.62027 -33.96799 1.000 48.66239 C ? A ? 74 1 ATOM 569 C . GLN A 74 ? -11.65583 24.35222 -35.13609 1.000 50.98453 C ? A ? 74 1 ATOM 570 O . GLN A 74 ? -11.56418 25.58395 -35.12680 1.000 54.57330 O ? A ? 74 1 ATOM 571 CB . GLN A 74 ? -13.81834 23.83794 -33.96948 1.000 42.19678 C ? A ? 74 1 ATOM 572 CG . GLN A 74 ? -14.56570 23.02232 -35.01575 1.000 54.77000 C ? A ? 74 1 ATOM 573 CD . GLN A 74 ? -16.02919 23.41556 -35.13775 1.000 67.61973 C ? A ? 74 1 ATOM 574 OE1 . GLN A 74 ? -16.52556 23.66094 -36.23779 1.000 71.30024 O ? A ? 74 1 ATOM 575 NE2 . GLN A 74 ? -16.72778 23.47258 -34.00802 1.000 65.85397 N ? A ? 74 1 ATOM 576 N . LEU A 75 ? -11.19908 23.59421 -36.13076 1.000 47.85861 N ? A ? 75 1 ATOM 577 CA . LEU A 75 ? -10.50841 24.16291 -37.27994 1.000 45.67352 C ? A ? 75 1 ATOM 578 C . LEU A 75 ? -11.48661 24.39322 -38.42531 1.000 57.16612 C ? A ? 75 1 ATOM 579 O . LEU A 75 ? -12.38050 23.57680 -38.67195 1.000 51.39651 O ? A ? 75 1 ATOM 580 CB . LEU A 75 ? -9.36954 23.24560 -37.73503 1.000 44.91921 C ? A ? 75 1 ATOM 581 CG . LEU A 75 ? -8.32711 22.85810 -36.67766 1.000 41.25820 C ? A ? 75 1 ATOM 582 CD1 . LEU A 75 ? -7.19974 22.02165 -37.27724 1.000 30.29626 C ? A ? 75 1 ATOM 583 CD2 . LEU A 75 ? -7.76950 24.09381 -35.98309 1.000 46.92470 C ? A ? 75 1 ATOM 584 N . ARG A 76 ? -11.30866 25.51199 -39.12490 1.000 50.63766 N ? A ? 76 1 ATOM 585 CA . ARG A 76 ? -12.18125 25.88801 -40.23256 1.000 50.48366 C ? A ? 76 1 ATOM 586 C . ARG A 76 ? -11.62932 25.29921 -41.52713 1.000 46.90450 C ? A ? 76 1 ATOM 587 O . ARG A 76 ? -10.59168 25.74130 -42.02841 1.000 48.79026 O ? A ? 76 1 ATOM 588 CB . ARG A 76 ? -12.30743 27.40579 -40.32600 1.000 42.69771 C ? A ? 76 1 ATOM 589 CG . ARG A 76 ? -13.07027 27.90074 -41.54514 1.000 50.16922 C ? A ? 76 1 ATOM 590 CD . ARG A 76 ? -13.32621 29.39382 -41.45050 1.000 48.01198 C ? A ? 76 1 ATOM 591 NE . ARG A 76 ? -14.56625 29.69489 -40.74587 1.000 55.28635 N ? A ? 76 1 ATOM 592 CZ . ARG A 76 ? -14.79162 30.81541 -40.07456 1.000 57.79705 C ? A ? 76 1 ATOM 593 NH1 . ARG A 76 ? -13.85372 31.73820 -39.93679 1.000 71.13727 N ? A ? 76 1 ATOM 594 NH2 . ARG A 76 ? -15.98638 31.01348 -39.52379 1.000 59.11725 N ? A ? 76 1 ATOM 595 N . VAL A 77 ? -12.32411 24.30024 -42.06587 1.000 40.91323 N ? A ? 77 1 ATOM 596 CA . VAL A 77 ? -11.95058 23.71124 -43.34787 1.000 37.00494 C ? A ? 77 1 ATOM 597 C . VAL A 77 ? -12.30384 24.69017 -44.45996 1.000 41.15564 C ? A ? 77 1 ATOM 598 O . VAL A 77 ? -13.46864 25.07380 -44.62047 1.000 40.60967 O ? A ? 77 1 ATOM 599 CB . VAL A 77 ? -12.65400 22.36404 -43.55836 1.000 33.66335 C ? A ? 77 1 ATOM 600 CG1 . VAL A 77 ? -12.32531 21.80558 -44.93150 1.000 32.47582 C ? A ? 77 1 ATOM 601 CG2 . VAL A 77 ? -12.26497 21.38508 -42.46531 1.000 32.75720 C ? A ? 77 1 ATOM 602 N . ILE A 78 ? -11.30312 25.08794 -45.24286 1.000 36.76778 N ? A ? 78 1 ATOM 603 CA . ILE A 78 ? -11.49729 26.04020 -46.32866 1.000 39.35623 C ? A ? 78 1 ATOM 604 C . ILE A 78 ? -11.31426 25.38907 -47.69159 1.000 37.66142 C ? A ? 78 1 ATOM 605 O . ILE A 78 ? -11.25091 26.09181 -48.70582 1.000 46.74673 O ? A ? 78 1 ATOM 606 CB . ILE A 78 ? -10.57309 27.25917 -46.17578 1.000 42.62958 C ? A ? 78 1 ATOM 607 CG1 . ILE A 78 ? -9.10897 26.81827 -46.14154 1.000 39.89543 C ? A ? 78 1 ATOM 608 CG2 . ILE A 78 ? -10.92760 28.03964 -44.91813 1.000 42.01768 C ? A ? 78 1 ATOM 609 CD1 . ILE A 78 ? -8.12743 27.96606 -45.98066 1.000 40.13315 C ? A ? 78 1 ATOM 610 N . GLY A 79 ? -11.22952 24.06088 -47.74158 1.000 41.70407 N ? A ? 79 1 ATOM 611 CA . GLY A 79 ? -11.07027 23.33891 -48.98843 1.000 35.99993 C ? A ? 79 1 ATOM 612 C . GLY A 79 ? -11.02444 21.84140 -48.76721 1.000 36.31910 C ? A ? 79 1 ATOM 613 O . GLY A 79 ? -10.59117 21.38504 -47.70663 1.000 35.61929 O ? A ? 79 1 ATOM 614 N . HIS A 80 ? -11.47521 21.06442 -49.75103 1.000 45.40358 N ? A ? 80 1 ATOM 615 CA . HIS A 80 ? -11.48884 19.60990 -49.64621 1.000 36.50491 C ? A ? 80 1 ATOM 616 C . HIS A 80 ? -11.06683 18.99934 -50.97399 1.000 39.81478 C ? A ? 80 1 ATOM 617 O . HIS A 80 ? -11.50636 19.44532 -52.03818 1.000 37.51918 O ? A ? 80 1 ATOM 618 CB . HIS A 80 ? -12.87400 19.08626 -49.23318 1.000 39.67245 C ? A ? 80 1 ATOM 619 CG . HIS A 80 ? -13.96846 19.41746 -50.20153 1.000 43.31242 C ? A ? 80 1 ATOM 620 ND1 . HIS A 80 ? -14.75502 20.54327 -50.08034 1.000 43.58432 N ? A ? 80 1 ATOM 621 CD2 . HIS A 80 ? -14.41903 18.76080 -51.29724 1.000 42.08169 C ? A ? 80 1 ATOM 622 CE1 . HIS A 80 ? -15.63650 20.57029 -51.06427 1.000 37.72600 C ? A ? 80 1 ATOM 623 NE2 . HIS A 80 ? -15.45395 19.50033 -51.81688 1.000 44.71163 N ? A ? 80 1 ATOM 624 N . SER A 81 ? -10.21576 17.97966 -50.90354 1.000 36.69130 N ? A ? 81 1 ATOM 625 CA . SER A 81 ? -9.69168 17.30911 -52.08112 1.000 30.06656 C ? A ? 81 1 ATOM 626 C . SER A 81 ? -9.50592 15.83321 -51.76511 1.000 35.07508 C ? A ? 81 1 ATOM 627 O . SER A 81 ? -9.26314 15.45644 -50.61591 1.000 34.26071 O ? A ? 81 1 ATOM 628 CB . SER A 81 ? -8.36106 17.93348 -52.52702 1.000 36.98916 C ? A ? 81 1 ATOM 629 OG . SER A 81 ? -7.75092 17.16779 -53.54906 1.000 60.82068 O ? A ? 81 1 ATOM 630 N . MET A 82 ? -9.62444 14.99935 -52.79315 1.000 30.34701 N ? A ? 82 1 ATOM 631 CA . MET A 82 ? -9.46522 13.55721 -52.65729 1.000 29.38809 C ? A ? 82 1 ATOM 632 C . MET A 82 ? -8.23895 13.11666 -53.44038 1.000 28.97091 C ? A ? 82 1 ATOM 633 O . MET A 82 ? -8.11953 13.41278 -54.63318 1.000 36.71936 O ? A ? 82 1 ATOM 634 CB . MET A 82 ? -10.70770 12.81452 -53.14423 1.000 27.68699 C ? A ? 82 1 ATOM 635 CG . MET A 82 ? -10.59549 11.30069 -53.08961 1.000 33.05132 C ? A ? 82 1 ATOM 636 SD . MET A 82 ? -12.19106 10.47056 -53.25403 1.000 36.90043 S ? A ? 82 1 ATOM 637 CE . MET A 82 ? -12.89070 11.33041 -54.66239 1.000 36.84332 C ? A ? 82 1 ATOM 638 N . GLN A 83 ? -7.32928 12.42434 -52.76436 1.000 26.14378 N ? A ? 83 1 ATOM 639 CA . GLN A 83 ? -6.13230 11.85328 -53.37595 1.000 27.14624 C ? A ? 83 1 ATOM 640 C . GLN A 83 ? -6.19129 10.34892 -53.13067 1.000 23.12467 C ? A ? 83 1 ATOM 641 O . GLN A 83 ? -5.92543 9.88640 -52.01722 1.000 26.93159 O ? A ? 83 1 ATOM 642 CB . GLN A 83 ? -4.86811 12.47453 -52.79429 1.000 24.78385 C ? A ? 83 1 ATOM 643 CG . GLN A 83 ? -3.58230 11.94311 -53.40135 1.000 31.33504 C ? A ? 83 1 ATOM 644 CD . GLN A 83 ? -2.35104 12.65013 -52.86611 1.000 39.89629 C ? A ? 83 1 ATOM 645 OE1 . GLN A 83 ? -2.40715 13.31973 -51.83408 1.000 46.98125 O ? A ? 83 1 ATOM 646 NE2 . GLN A 83 ? -1.23096 12.50954 -53.57038 1.000 46.78317 N ? A ? 83 1 ATOM 647 N . ASN A 84 ? -6.55392 9.59403 -54.16786 1.000 24.35440 N ? A ? 84 1 ATOM 648 CA . ASN A 84 ? -6.80294 8.16234 -54.04365 1.000 23.26716 C ? A ? 84 1 ATOM 649 C . ASN A 84 ? -7.77633 7.88997 -52.90173 1.000 21.93392 C ? A ? 84 1 ATOM 650 O . ASN A 84 ? -8.93862 8.30004 -52.97331 1.000 25.17639 O ? A ? 84 1 ATOM 651 CB . ASN A 84 ? -5.48995 7.40338 -53.85488 1.000 24.23819 C ? A ? 84 1 ATOM 652 CG . ASN A 84 ? -4.49133 7.70526 -54.95252 1.000 27.68454 C ? A ? 84 1 ATOM 653 OD1 . ASN A 84 ? -4.73668 7.41262 -56.12212 1.000 32.78681 O ? A ? 84 1 ATOM 654 ND2 . ASN A 84 ? -3.36386 8.30892 -54.58460 1.000 26.88125 N ? A ? 84 1 ATOM 655 N . CYS A 85 ? -7.32076 7.22467 -51.83925 1.000 20.96574 N ? A ? 85 1 ATOM 656 CA . CYS A 85 ? -8.19981 6.81281 -50.74853 1.000 22.68665 C ? A ? 85 1 ATOM 657 C . CYS A 85 ? -8.07745 7.68213 -49.49786 1.000 24.92915 C ? A ? 85 1 ATOM 658 O . CYS A 85 ? -8.56462 7.28298 -48.43317 1.000 23.52883 O ? A ? 85 1 ATOM 659 CB . CYS A 85 ? -7.94223 5.35132 -50.37979 1.000 20.44404 C ? A ? 85 1 ATOM 660 SG . CYS A 85 ? -8.41582 4.16304 -51.65795 1.000 24.31201 S ? A ? 85 1 ATOM 661 N . VAL A 86 ? -7.45109 8.85316 -49.59128 1.000 19.84771 N ? A ? 86 1 ATOM 662 CA . VAL A 86 ? -7.37039 9.75698 -48.45172 1.000 23.39283 C ? A ? 86 1 ATOM 663 C . VAL A 86 ? -7.97555 11.09779 -48.83493 1.000 23.83585 C ? A ? 86 1 ATOM 664 O . VAL A 86 ? -7.93504 11.52086 -49.99527 1.000 25.14270 O ? A ? 86 1 ATOM 665 CB . VAL A 86 ? -5.92455 9.94292 -47.93565 1.000 25.78307 C ? A ? 86 1 ATOM 666 CG1 . VAL A 86 ? -5.40127 8.64878 -47.32634 1.000 24.55282 C ? A ? 86 1 ATOM 667 CG2 . VAL A 86 ? -5.02071 10.42543 -49.04847 1.000 29.90113 C ? A ? 86 1 ATOM 668 N . LEU A 87 ? -8.54927 11.76226 -47.84044 1.000 24.34130 N ? A ? 87 1 ATOM 669 CA . LEU A 87 ? -9.08816 13.09978 -48.00845 1.000 27.23059 C ? A ? 87 1 ATOM 670 C . LEU A 87 ? -8.05909 14.11952 -47.54894 1.000 28.83305 C ? A ? 87 1 ATOM 671 O . LEU A 87 ? -7.39836 13.93118 -46.52453 1.000 27.19383 O ? A ? 87 1 ATOM 672 CB . LEU A 87 ? -10.37652 13.26465 -47.20480 1.000 32.54898 C ? A ? 87 1 ATOM 673 CG . LEU A 87 ? -11.63165 13.68207 -47.95904 1.000 41.86770 C ? A ? 87 1 ATOM 674 CD1 . LEU A 87 ? -12.03567 12.61092 -48.95562 1.000 44.99013 C ? A ? 87 1 ATOM 675 CD2 . LEU A 87 ? -12.74001 13.93164 -46.96341 1.000 35.47202 C ? A ? 87 1 ATOM 676 N . LYS A 88 ? -7.92483 15.19869 -48.31322 1.000 30.69093 N ? A ? 88 1 ATOM 677 CA . LYS A 88 ? -7.02774 16.29848 -47.97656 1.000 28.85911 C ? A ? 88 1 ATOM 678 C . LYS A 88 ? -7.88258 17.52255 -47.67825 1.000 32.79353 C ? A ? 88 1 ATOM 679 O . LYS A 88 ? -8.45950 18.12059 -48.59210 1.000 36.33289 O ? A ? 88 1 ATOM 680 CB . LYS A 88 ? -6.03612 16.56834 -49.10837 1.000 26.02444 C ? A ? 88 1 ATOM 681 CG . LYS A 88 ? -5.29701 15.31968 -49.57265 1.000 37.94675 C ? A ? 88 1 ATOM 682 CD . LYS A 88 ? -3.84615 15.61491 -49.91751 1.000 35.52711 C ? A ? 88 1 ATOM 683 CE . LYS A 88 ? -3.72949 16.53004 -51.12024 1.000 35.81636 C ? A ? 88 1 ATOM 684 NZ . LYS A 88 ? -2.30846 16.88840 -51.40095 1.000 48.06151 N ? A ? 88 1 ATOM 685 N . LEU A 89 ? -7.97373 17.88425 -46.40197 1.000 32.83428 N ? A ? 89 1 ATOM 686 CA . LEU A 89 ? -8.77923 19.01337 -45.94849 1.000 34.14128 C ? A ? 89 1 ATOM 687 C . LEU A 89 ? -7.84828 20.17548 -45.62552 1.000 34.96667 C ? A ? 89 1 ATOM 688 O . LEU A 89 ? -7.05174 20.09475 -44.68359 1.000 34.86991 O ? A ? 89 1 ATOM 689 CB . LEU A 89 ? -9.60893 18.63270 -44.72557 1.000 29.33379 C ? A ? 89 1 ATOM 690 CG . LEU A 89 ? -10.48136 17.38557 -44.83925 1.000 29.95922 C ? A ? 89 1 ATOM 691 CD1 . LEU A 89 ? -11.19650 17.13913 -43.52265 1.000 26.99820 C ? A ? 89 1 ATOM 692 CD2 . LEU A 89 ? -11.47446 17.53312 -45.97822 1.000 26.71401 C ? A ? 89 1 ATOM 693 N . LYS A 90 ? -7.94437 21.25299 -46.40149 1.000 30.79599 N ? A ? 90 1 ATOM 694 CA . LYS A 90 ? -7.17941 22.45335 -46.09880 1.000 33.32224 C ? A ? 90 1 ATOM 695 C . LYS A 90 ? -7.88827 23.24112 -45.00264 1.000 38.87865 C ? A ? 90 1 ATOM 696 O . LYS A 90 ? -9.09348 23.50001 -45.08987 1.000 33.43667 O ? A ? 90 1 ATOM 697 CB . LYS A 90 ? -6.98829 23.31543 -47.34836 1.000 35.66225 C ? A ? 90 1 ATOM 698 CG . LYS A 90 ? -5.88284 24.35733 -47.19096 1.000 35.16980 C ? A ? 90 1 ATOM 699 CD . LYS A 90 ? -5.42524 24.93517 -48.52208 1.000 40.70938 C ? A ? 90 1 ATOM 700 CE . LYS A 90 ? -6.34247 26.05473 -48.99717 1.000 54.62323 C ? A ? 90 1 ATOM 701 NZ . LYS A 90 ? -5.82152 26.73750 -50.21732 1.000 52.34130 N ? A ? 90 1 ATOM 702 N . VAL A 91 ? -7.14088 23.60268 -43.96376 1.000 33.75553 N ? A ? 91 1 ATOM 703 CA . VAL A 91 ? -7.67714 24.32802 -42.82247 1.000 32.85333 C ? A ? 91 1 ATOM 704 C . VAL A 91 ? -7.07039 25.72648 -42.79004 1.000 40.46359 C ? A ? 91 1 ATOM 705 O . VAL A 91 ? -6.04470 26.00769 -43.41844 1.000 41.08458 O ? A ? 91 1 ATOM 706 CB . VAL A 91 ? -7.42096 23.58369 -41.49555 1.000 35.55327 C ? A ? 91 1 ATOM 707 CG1 . VAL A 91 ? -8.29181 22.33540 -41.40616 1.000 30.15613 C ? A ? 91 1 ATOM 708 CG2 . VAL A 91 ? -5.95124 23.21589 -41.36963 1.000 35.38905 C ? A ? 91 1 ATOM 709 N . ASP A 92 ? -7.72118 26.61510 -42.03322 1.000 42.91220 N ? A ? 92 1 ATOM 710 CA . ASP A 92 ? -7.32376 28.01779 -41.97793 1.000 53.29363 C ? A ? 92 1 ATOM 711 C . ASP A 92 ? -6.10988 28.26737 -41.09088 1.000 49.05434 C ? A ? 92 1 ATOM 712 O . ASP A 92 ? -5.55628 29.37138 -41.12645 1.000 47.34855 O ? A ? 92 1 ATOM 713 CB . ASP A 92 ? -8.50186 28.88714 -41.50650 1.000 42.19843 C ? A ? 92 1 ATOM 714 CG . ASP A 92 ? -8.90434 28.62271 -40.05640 1.000 54.81340 C ? A ? 92 1 ATOM 715 OD1 . ASP A 92 ? -8.58007 27.54638 -39.50839 1.000 50.48525 O ? A ? 92 1 ATOM 716 OD2 . ASP A 92 ? -9.56825 29.50140 -39.46665 1.000 63.06226 O ? A ? 92 1 ATOM 717 N . THR A 93 ? -5.67617 27.28099 -40.31093 1.000 48.63324 N ? A ? 93 1 ATOM 718 CA . THR A 93 ? -4.54062 27.44146 -39.41338 1.000 48.98849 C ? A ? 93 1 ATOM 719 C . THR A 93 ? -3.55091 26.31261 -39.65100 1.000 36.93382 C ? A ? 93 1 ATOM 720 O . THR A 93 ? -3.94287 25.14537 -39.72921 1.000 32.95148 O ? A ? 93 1 ATOM 721 CB . THR A 93 ? -4.98902 27.46234 -37.94439 1.000 48.43202 C ? A ? 93 1 ATOM 722 OG1 . THR A 93 ? -5.93303 26.40968 -37.71392 1.000 61.13498 O ? A ? 93 1 ATOM 723 CG2 . THR A 93 ? -5.63824 28.79455 -37.60672 1.000 50.49903 C ? A ? 93 1 ATOM 724 N . ALA A 94 ? -2.27691 26.66365 -39.78597 1.000 42.48001 N ? A ? 94 1 ATOM 725 CA . ALA A 94 ? -1.22748 25.66294 -39.89099 1.000 37.29615 C ? A ? 94 1 ATOM 726 C . ALA A 94 ? -0.89212 25.12911 -38.50810 1.000 32.62890 C ? A ? 94 1 ATOM 727 O . ALA A 94 ? -0.89544 25.87211 -37.52585 1.000 34.19775 O ? A ? 94 1 ATOM 728 CB . ALA A 94 ? 0.02326 26.25483 -40.53975 1.000 34.60552 C ? A ? 94 1 ATOM 729 N . ASN A 95 ? -0.61018 23.84154 -38.43382 1.000 30.38081 N ? A ? 95 1 ATOM 730 CA . ASN A 95 ? -0.24433 23.22001 -37.16832 1.000 29.59251 C ? A ? 95 1 ATOM 731 C . ASN A 95 ? 1.10753 23.74985 -36.70816 1.000 31.23849 C ? A ? 95 1 ATOM 732 O . ASN A 95 ? 2.12247 23.47106 -37.36189 1.000 30.21700 O ? A ? 95 1 ATOM 733 CB . ASN A 95 ? -0.21132 21.69760 -37.32185 1.000 29.42833 C ? A ? 95 1 ATOM 734 CG . ASN A 95 ? 0.01826 20.97830 -36.00756 1.000 30.84906 C ? A ? 95 1 ATOM 735 OD1 . ASN A 95 ? 0.11459 21.60017 -34.94604 1.000 28.15131 O ? A ? 95 1 ATOM 736 ND2 . ASN A 95 ? 0.09276 19.65309 -36.07107 1.000 28.63726 N ? A ? 95 1 ATOM 737 N . PRO A 96 ? 1.17563 24.51357 -35.61282 1.000 32.65066 N ? A ? 96 1 ATOM 738 CA . PRO A 96 ? 2.47379 25.00489 -35.13358 1.000 41.45650 C ? A ? 96 1 ATOM 739 C . PRO A 96 ? 3.32941 23.92282 -34.50429 1.000 31.99350 C ? A ? 96 1 ATOM 740 O . PRO A 96 ? 4.49353 24.18795 -34.17709 1.000 33.74733 O ? A ? 96 1 ATOM 741 CB . PRO A 96 ? 2.07682 26.06334 -34.09782 1.000 35.79731 C ? A ? 96 1 ATOM 742 CG . PRO A 96 ? 0.80513 25.52222 -33.53204 1.000 39.04067 C ? A ? 96 1 ATOM 743 CD . PRO A 96 ? 0.07655 24.91585 -34.71622 1.000 36.25732 C ? A ? 96 1 ATOM 744 N . LYS A 97 ? 2.78777 22.72208 -34.31752 1.000 32.81144 N ? A ? 97 1 ATOM 745 CA . LYS A 97 ? 3.54885 21.57897 -33.83949 1.000 34.71507 C ? A ? 97 1 ATOM 746 C . LYS A 97 ? 3.99330 20.66707 -34.97551 1.000 33.68468 C ? A ? 97 1 ATOM 747 O . LYS A 97 ? 4.44026 19.54389 -34.71568 1.000 27.79198 O ? A ? 97 1 ATOM 748 CB . LYS A 97 ? 2.72838 20.77883 -32.82339 1.000 35.01082 C ? A ? 97 1 ATOM 749 CG . LYS A 97 ? 2.24209 21.56818 -31.61388 1.000 35.22203 C ? A ? 97 1 ATOM 750 CD . LYS A 97 ? 2.54144 20.82097 -30.31851 1.000 43.20929 C ? A ? 97 1 ATOM 751 CE . LYS A 97 ? 1.45860 21.03151 -29.26733 1.000 47.59433 C ? A ? 97 1 ATOM 752 NZ . LYS A 97 ? 0.25030 20.20131 -29.54871 1.000 54.03140 N ? A ? 97 1 ATOM 753 N . THR A 98 ? 3.86838 21.11924 -36.22104 1.000 30.75924 N ? A ? 98 1 ATOM 754 CA . THR A 98 ? 4.26375 20.32388 -37.37606 1.000 27.08051 C ? A ? 98 1 ATOM 755 C . THR A 98 ? 5.74457 19.97575 -37.28429 1.000 27.28048 C ? A ? 98 1 ATOM 756 O . THR A 98 ? 6.58741 20.88648 -37.25215 1.000 28.90034 O ? A ? 98 1 ATOM 757 CB . THR A 98 ? 3.99057 21.07672 -38.67922 1.000 26.97426 C ? A ? 98 1 ATOM 758 OG1 . THR A 98 ? 2.60179 21.41677 -38.76389 1.000 29.55242 O ? A ? 98 1 ATOM 759 CG2 . THR A 98 ? 4.37231 20.22230 -39.88008 1.000 25.99136 C ? A ? 98 1 ATOM 760 N . PRO A 99 ? 6.10558 18.70141 -37.23086 1.000 25.31169 N ? A ? 99 1 ATOM 761 CA . PRO A 99 ? 7.51733 18.32685 -37.19678 1.000 25.41911 C ? A ? 99 1 ATOM 762 C . PRO A 99 ? 8.08044 18.26164 -38.61029 1.000 27.24385 C ? A ? 99 1 ATOM 763 O . PRO A 99 ? 7.35303 18.32955 -39.60257 1.000 25.38908 O ? A ? 99 1 ATOM 764 CB . PRO A 99 ? 7.48324 16.93525 -36.55557 1.000 27.45489 C ? A ? 99 1 ATOM 765 CG . PRO A 99 ? 6.19122 16.35567 -37.06396 1.000 25.91156 C ? A ? 99 1 ATOM 766 CD . PRO A 99 ? 5.22302 17.51969 -37.20018 1.000 26.44650 C ? A ? 99 1 ATOM 767 N . LYS A 100 ? 9.40149 18.14358 -38.67919 1.000 26.75463 N ? A ? 100 1 ATOM 768 CA . LYS A 100 ? 10.04545 17.78251 -39.93292 1.000 30.52405 C ? A ? 100 1 ATOM 769 C . LYS A 100 ? 9.55120 16.40543 -40.35474 1.000 30.93772 C ? A ? 100 1 ATOM 770 O . LYS A 100 ? 9.73353 15.42320 -39.62853 1.000 32.54351 O ? A ? 100 1 ATOM 771 CB . LYS A 100 ? 11.56141 17.78965 -39.75948 1.000 31.78386 C ? A ? 100 1 ATOM 772 CG . LYS A 100 ? 12.34154 18.03638 -41.03157 1.000 42.35450 C ? A ? 100 1 ATOM 773 CD . LYS A 100 ? 13.82864 18.15094 -40.73075 1.000 56.08920 C ? A ? 100 1 ATOM 774 CE . LYS A 100 ? 14.08851 19.09802 -39.56600 1.000 38.20898 C ? A ? 100 1 ATOM 775 NZ . LYS A 100 ? 15.54819 19.28025 -39.32354 1.000 49.82440 N ? A ? 100 1 ATOM 776 N . TYR A 101 ? 8.89446 16.33193 -41.50849 1.000 24.95192 N ? A ? 101 1 ATOM 777 CA . TYR A 101 ? 8.18415 15.11960 -41.88119 1.000 29.82125 C ? A ? 101 1 ATOM 778 C . TYR A 101 ? 8.40110 14.80729 -43.35179 1.000 28.07440 C ? A ? 101 1 ATOM 779 O . TYR A 101 ? 8.84194 15.64755 -44.13920 1.000 27.12013 O ? A ? 101 1 ATOM 780 CB . TYR A 101 ? 6.68132 15.22565 -41.58773 1.000 30.26948 C ? A ? 101 1 ATOM 781 CG . TYR A 101 ? 5.88800 16.07763 -42.56640 1.000 31.06092 C ? A ? 101 1 ATOM 782 CD1 . TYR A 101 ? 5.70370 17.43743 -42.34500 1.000 28.36975 C ? A ? 101 1 ATOM 783 CD2 . TYR A 101 ? 5.29884 15.51480 -43.69386 1.000 26.43020 C ? A ? 101 1 ATOM 784 CE1 . TYR A 101 ? 4.96976 18.21538 -43.22548 1.000 30.32338 C ? A ? 101 1 ATOM 785 CE2 . TYR A 101 ? 4.56596 16.28683 -44.58222 1.000 31.08409 C ? A ? 101 1 ATOM 786 CZ . TYR A 101 ? 4.40350 17.63532 -44.34188 1.000 31.22444 C ? A ? 101 1 ATOM 787 OH . TYR A 101 ? 3.67421 18.40780 -45.22048 1.000 42.62422 O ? A ? 101 1 ATOM 788 N . LYS A 102 ? 8.05388 13.57514 -43.70995 1.000 31.72629 N ? A ? 102 1 ATOM 789 CA . LYS A 102 ? 8.18196 13.06652 -45.06475 1.000 28.57882 C ? A ? 102 1 ATOM 790 C . LYS A 102 ? 7.20566 11.91032 -45.21358 1.000 29.35752 C ? A ? 102 1 ATOM 791 O . LYS A 102 ? 6.91977 11.20152 -44.24551 1.000 26.99934 O ? A ? 102 1 ATOM 792 CB . LYS A 102 ? 9.61870 12.61659 -45.34590 1.000 32.22478 C ? A ? 102 1 ATOM 793 CG . LYS A 102 ? 9.88345 12.14639 -46.75572 1.000 44.14060 C ? A ? 102 1 ATOM 794 CD . LYS A 102 ? 11.32955 11.70326 -46.89670 1.000 48.15762 C ? A ? 102 1 ATOM 795 CE . LYS A 102 ? 11.69118 10.67298 -45.83550 1.000 53.97623 C ? A ? 102 1 ATOM 796 NZ . LYS A 102 ? 12.98713 9.99548 -46.12965 1.000 51.18499 N ? A ? 102 1 ATOM 797 N . PHE A 103 ? 6.67729 11.74145 -46.42120 1.000 23.22314 N ? A ? 103 1 ATOM 798 CA . PHE A 103 ? 5.79802 10.62207 -46.73259 1.000 34.01240 C ? A ? 103 1 ATOM 799 C . PHE A 103 ? 6.58941 9.56489 -47.48959 1.000 31.05911 C ? A ? 103 1 ATOM 800 O . PHE A 103 ? 7.20629 9.86329 -48.51820 1.000 36.79747 O ? A ? 103 1 ATOM 801 CB . PHE A 103 ? 4.59241 11.06933 -47.56308 1.000 28.97558 C ? A ? 103 1 ATOM 802 CG . PHE A 103 ? 3.61235 11.92694 -46.81052 1.000 26.54031 C ? A ? 103 1 ATOM 803 CD1 . PHE A 103 ? 3.63880 11.99161 -45.42587 1.000 25.80086 C ? A ? 103 1 ATOM 804 CD2 . PHE A 103 ? 2.65585 12.66231 -47.49258 1.000 27.75746 C ? A ? 103 1 ATOM 805 CE1 . PHE A 103 ? 2.73467 12.77820 -44.73653 1.000 24.73525 C ? A ? 103 1 ATOM 806 CE2 . PHE A 103 ? 1.74750 13.45134 -46.80999 1.000 27.12127 C ? A ? 103 1 ATOM 807 CZ . PHE A 103 ? 1.78676 13.50918 -45.42976 1.000 24.23962 C ? A ? 103 1 ATOM 808 N . VAL A 104 ? 6.58232 8.33544 -46.97546 1.000 25.56589 N ? A ? 104 1 ATOM 809 CA . VAL A 104 ? 7.25807 7.22614 -47.63186 1.000 26.81843 C ? A ? 104 1 ATOM 810 C . VAL A 104 ? 6.27893 6.07308 -47.78391 1.000 25.89710 C ? A ? 104 1 ATOM 811 O . VAL A 104 ? 5.29725 5.95387 -47.04832 1.000 28.93988 O ? A ? 104 1 ATOM 812 CB . VAL A 104 ? 8.52000 6.75711 -46.87260 1.000 35.16517 C ? A ? 104 1 ATOM 813 CG1 . VAL A 104 ? 9.46701 7.92625 -46.64108 1.000 32.53946 C ? A ? 104 1 ATOM 814 CG2 . VAL A 104 ? 8.14154 6.07813 -45.55875 1.000 31.86846 C ? A ? 104 1 ATOM 815 N . ARG A 105 ? 6.55659 5.22629 -48.76845 1.000 30.83252 N ? A ? 105 1 ATOM 816 CA . ARG A 105 ? 5.81085 3.99288 -49.00030 1.000 24.77085 C ? A ? 105 1 ATOM 817 C . ARG A 105 ? 6.77784 2.83811 -48.77077 1.000 24.80173 C ? A ? 105 1 ATOM 818 O . ARG A 105 ? 7.64750 2.57670 -49.60657 1.000 25.04698 O ? A ? 105 1 ATOM 819 CB . ARG A 105 ? 5.22165 3.95651 -50.40325 1.000 25.72145 C ? A ? 105 1 ATOM 820 CG . ARG A 105 ? 4.42591 2.69770 -50.69104 1.000 28.96938 C ? A ? 105 1 ATOM 821 CD . ARG A 105 ? 3.77608 2.74926 -52.05846 1.000 26.42941 C ? A ? 105 1 ATOM 822 NE . ARG A 105 ? 2.99559 1.54844 -52.32606 1.000 31.32468 N ? A ? 105 1 ATOM 823 CZ . ARG A 105 ? 1.75556 1.35466 -51.90008 1.000 23.23075 C ? A ? 105 1 ATOM 824 NH1 . ARG A 105 ? 1.12379 2.26474 -51.17745 1.000 23.84390 N ? A ? 105 1 ATOM 825 NH2 . ARG A 105 ? 1.13563 0.21847 -52.20388 1.000 23.44928 N ? A ? 105 1 ATOM 826 N . ILE A 106 ? 6.62998 2.15018 -47.63960 1.000 26.95259 N ? A ? 106 1 ATOM 827 CA . ILE A 106 ? 7.59294 1.13056 -47.23968 1.000 27.35490 C ? A ? 106 1 ATOM 828 C . ILE A 106 ? 7.38488 -0.13568 -48.05624 1.000 25.10097 C ? A ? 106 1 ATOM 829 O . ILE A 106 ? 6.38830 -0.27398 -48.77297 1.000 26.21731 O ? A ? 106 1 ATOM 830 CB . ILE A 106 ? 7.50365 0.82828 -45.73181 1.000 27.71994 C ? A ? 106 1 ATOM 831 CG1 . ILE A 106 ? 6.10318 0.34059 -45.36596 1.000 27.51116 C ? A ? 106 1 ATOM 832 CG2 . ILE A 106 ? 7.87624 2.05294 -44.91469 1.000 24.51732 C ? A ? 106 1 ATOM 833 CD1 . ILE A 106 ? 5.98789 -0.12643 -43.93701 1.000 23.27653 C ? A ? 106 1 ATOM 834 N . GLN A 107 ? 8.33009 -1.05782 -47.95429 1.000 31.69275 N ? A ? 107 1 ATOM 835 CA . GLN A 107 ? 8.31791 -2.35753 -48.59882 1.000 28.93198 C ? A ? 107 1 ATOM 836 C . GLN A 107 ? 7.88546 -3.43063 -47.61495 1.000 31.67842 C ? A ? 107 1 ATOM 837 O . GLN A 107 ? 7.98504 -3.24883 -46.39800 1.000 25.74070 O ? A ? 107 1 ATOM 838 CB . GLN A 107 ? 9.71000 -2.69537 -49.14527 1.000 32.53610 C ? A ? 107 1 ATOM 839 CG . GLN A 107 ? 10.10932 -1.91989 -50.38616 1.000 39.51766 C ? A ? 107 1 ATOM 840 CD . GLN A 107 ? 10.77280 -2.80355 -51.42596 1.000 68.15764 C ? A ? 107 1 ATOM 841 OE1 . GLN A 107 ? 10.30118 -3.90579 -51.71125 1.000 75.59178 O ? A ? 107 1 ATOM 842 NE2 . GLN A 107 ? 11.87769 -2.32866 -51.99172 1.000 76.03408 N ? A ? 107 1 ATOM 843 N . PRO A 108 ? 7.38702 -4.56543 -48.10541 1.000 30.78363 N ? A ? 108 1 ATOM 844 CA . PRO A 108 ? 7.10541 -5.68633 -47.20243 1.000 28.07396 C ? A ? 108 1 ATOM 845 C . PRO A 108 ? 8.35965 -6.09710 -46.44456 1.000 30.55019 C ? A ? 108 1 ATOM 846 O . PRO A 108 ? 9.46415 -6.11781 -46.99262 1.000 30.59974 O ? A ? 108 1 ATOM 847 CB . PRO A 108 ? 6.61530 -6.79341 -48.14474 1.000 31.22511 C ? A ? 108 1 ATOM 848 CG . PRO A 108 ? 7.02868 -6.36066 -49.51919 1.000 34.56543 C ? A ? 108 1 ATOM 849 CD . PRO A 108 ? 7.01039 -4.86945 -49.49406 1.000 28.98805 C ? A ? 108 1 ATOM 850 N . GLY A 109 ? 8.17953 -6.39835 -45.16075 1.000 28.40414 N ? A ? 109 1 ATOM 851 CA . GLY A 109 ? 9.26696 -6.71445 -44.27061 1.000 29.22608 C ? A ? 109 1 ATOM 852 C . GLY A 109 ? 9.71370 -5.56450 -43.39165 1.000 27.80792 C ? A ? 109 1 ATOM 853 O . GLY A 109 ? 10.34172 -5.80636 -42.35859 1.000 35.68712 O ? A ? 109 1 ATOM 854 N . GLN A 110 ? 9.40488 -4.32627 -43.76546 1.000 31.64570 N ? A ? 110 1 ATOM 855 C . GLN A 110 ? 8.84150 -2.93702 -41.82499 1.000 27.32190 C ? A ? 110 1 ATOM 856 O . GLN A 110 ? 7.64541 -3.22251 -41.92411 1.000 28.58959 O ? A ? 110 1 ATOM 857 CA A GLN A 110 ? 9.81358 -3.17519 -42.97420 0.641 32.26534 C ? A ? 110 1 ATOM 858 CB A GLN A 110 ? 9.90632 -1.92265 -43.84766 0.641 30.02912 C ? A ? 110 1 ATOM 859 CG A GLN A 110 ? 11.03463 -1.96165 -44.87040 0.641 34.84656 C ? A ? 110 1 ATOM 860 CD A GLN A 110 ? 11.35040 -0.59396 -45.44901 0.641 36.63406 C ? A ? 110 1 ATOM 861 OE1 A GLN A 110 ? 10.72081 -0.15035 -46.40787 0.641 26.23606 O ? A ? 110 1 ATOM 862 NE2 A GLN A 110 ? 12.33206 0.08288 -44.86200 0.641 43.35830 N ? A ? 110 1 ATOM 863 CA B GLN A 110 ? 9.81581 -3.18034 -42.97026 0.359 32.15224 C ? A ? 110 1 ATOM 864 CB B GLN A 110 ? 9.92501 -1.93275 -43.84504 0.359 30.14031 C ? A ? 110 1 ATOM 865 CG B GLN A 110 ? 11.14088 -1.94896 -44.75308 0.359 34.72745 C ? A ? 110 1 ATOM 866 CD B GLN A 110 ? 12.42632 -2.18272 -43.98255 0.359 36.77138 C ? A ? 110 1 ATOM 867 OE1 B GLN A 110 ? 12.80869 -1.37762 -43.13295 0.359 36.15305 O ? A ? 110 1 ATOM 868 NE2 B GLN A 110 ? 13.09397 -3.29621 -44.26659 0.359 34.08091 N ? A ? 110 1 ATOM 869 N . THR A 111 ? 9.37090 -2.40332 -40.72884 1.000 26.16779 N ? A ? 111 1 ATOM 870 CA . THR A 111 ? 8.60199 -2.15125 -39.52108 1.000 25.42214 C ? A ? 111 1 ATOM 871 C . THR A 111 ? 8.35377 -0.66131 -39.33390 1.000 23.56567 C ? A ? 111 1 ATOM 872 O . THR A 111 ? 9.02186 0.18807 -39.93049 1.000 23.02999 O ? A ? 111 1 ATOM 873 CB . THR A 111 ? 9.31734 -2.70066 -38.28164 1.000 24.31899 C ? A ? 111 1 ATOM 874 OG1 . THR A 111 ? 10.62144 -2.11136 -38.18146 1.000 25.35473 O ? A ? 111 1 ATOM 875 CG2 . THR A 111 ? 9.43977 -4.21874 -38.35630 1.000 24.68854 C ? A ? 111 1 ATOM 876 N . PHE A 112 ? 7.38171 -0.36010 -38.47613 1.000 23.83785 N ? A ? 112 1 ATOM 877 CA . PHE A 112 ? 7.05086 1.01390 -38.12864 1.000 24.38842 C ? A ? 112 1 ATOM 878 C . PHE A 112 ? 6.26337 1.01010 -36.82752 1.000 25.15225 C ? A ? 112 1 ATOM 879 O . PHE A 112 ? 5.72425 -0.01872 -36.40861 1.000 28.10445 O ? A ? 112 1 ATOM 880 CB . PHE A 112 ? 6.26437 1.71060 -39.24724 1.000 19.97094 C ? A ? 112 1 ATOM 881 CG . PHE A 112 ? 5.01277 0.98688 -39.66312 1.000 18.86193 C ? A ? 112 1 ATOM 882 CD1 . PHE A 112 ? 5.05786 -0.01879 -40.61584 1.000 22.65636 C ? A ? 112 1 ATOM 883 CD2 . PHE A 112 ? 3.78746 1.32446 -39.11587 1.000 19.35363 C ? A ? 112 1 ATOM 884 CE1 . PHE A 112 ? 3.90307 -0.67941 -41.01058 1.000 21.28879 C ? A ? 112 1 ATOM 885 CE2 . PHE A 112 ? 2.62970 0.66904 -39.50349 1.000 23.73957 C ? A ? 112 1 ATOM 886 CZ . PHE A 112 ? 2.68722 -0.33498 -40.45208 1.000 24.31185 C ? A ? 112 1 ATOM 887 N . SER A 113 ? 6.22276 2.17476 -36.18487 1.000 20.17636 N ? A ? 113 1 ATOM 888 CA . SER A 113 ? 5.45322 2.36387 -34.96391 1.000 19.85174 C ? A ? 113 1 ATOM 889 C . SER A 113 ? 4.05749 2.87070 -35.30738 1.000 25.62375 C ? A ? 113 1 ATOM 890 O . SER A 113 ? 3.90008 3.76372 -36.14864 1.000 21.31392 O ? A ? 113 1 ATOM 891 CB . SER A 113 ? 6.15171 3.35188 -34.03041 1.000 20.85339 C ? A ? 113 1 ATOM 892 OG . SER A 113 ? 7.42244 2.87193 -33.63411 1.000 27.12430 O ? A ? 113 1 ATOM 893 N . VAL A 114 ? 3.04946 2.30523 -34.65092 1.000 18.46186 N ? A ? 114 1 ATOM 894 CA . VAL A 114 ? 1.66558 2.72784 -34.81833 1.000 17.71899 C ? A ? 114 1 ATOM 895 C . VAL A 114 ? 1.24782 3.50578 -33.58087 1.000 19.39386 C ? A ? 114 1 ATOM 896 O . VAL A 114 ? 1.46295 3.05195 -32.44938 1.000 19.23185 O ? A ? 114 1 ATOM 897 CB . VAL A 114 ? 0.73677 1.52369 -35.05287 1.000 19.76689 C ? A ? 114 1 ATOM 898 CG1 . VAL A 114 ? -0.72305 1.95196 -34.96403 1.000 18.35848 C ? A ? 114 1 ATOM 899 CG2 . VAL A 114 ? 1.02473 0.89510 -36.39974 1.000 16.98863 C ? A ? 114 1 ATOM 900 N . LEU A 115 ? 0.66567 4.68244 -33.79118 1.000 19.61537 N ? A ? 115 1 ATOM 901 CA . LEU A 115 ? 0.06823 5.46337 -32.71492 1.000 18.75220 C ? A ? 115 1 ATOM 902 C . LEU A 115 ? -1.44078 5.28194 -32.82986 1.000 20.01381 C ? A ? 115 1 ATOM 903 O . LEU A 115 ? -2.08812 5.90124 -33.67815 1.000 20.18604 O ? A ? 115 1 ATOM 904 CB . LEU A 115 ? 0.47510 6.92922 -32.80559 1.000 19.35619 C ? A ? 115 1 ATOM 905 CG . LEU A 115 ? -0.16696 7.82578 -31.74932 1.000 26.10262 C ? A ? 115 1 ATOM 906 CD1 . LEU A 115 ? 0.33832 7.46935 -30.35693 1.000 25.59600 C ? A ? 115 1 ATOM 907 CD2 . LEU A 115 ? 0.08265 9.29162 -32.06101 1.000 34.96010 C ? A ? 115 1 ATOM 908 N . ALA A 116 ? -1.99849 4.41687 -31.98520 1.000 19.68714 N ? A ? 116 1 ATOM 909 CA . ALA A 116 ? -3.42446 4.12655 -32.03369 1.000 24.67786 C ? A ? 116 1 ATOM 910 C . ALA A 116 ? -4.20422 5.27470 -31.41119 1.000 21.45228 C ? A ? 116 1 ATOM 911 O . ALA A 116 ? -3.88666 5.72537 -30.30645 1.000 30.28267 O ? A ? 116 1 ATOM 912 CB . ALA A 116 ? -3.73272 2.81684 -31.31179 1.000 27.89029 C ? A ? 116 1 ATOM 913 N . CYS A 117 ? -5.22072 5.75150 -32.12412 1.000 23.05379 N ? A ? 117 1 ATOM 914 CA . CYS A 117 ? -5.96745 6.93047 -31.71560 1.000 25.68163 C ? A ? 117 1 ATOM 915 C . CYS A 117 ? -7.46366 6.68604 -31.84330 1.000 28.05759 C ? A ? 117 1 ATOM 916 O . CYS A 117 ? -7.91857 5.92733 -32.70408 1.000 20.69592 O ? A ? 117 1 ATOM 917 CB . CYS A 117 ? -5.57426 8.15665 -32.54885 1.000 21.31695 C ? A ? 117 1 ATOM 918 SG . CYS A 117 ? -3.86146 8.67786 -32.33033 1.000 28.69109 S ? A ? 117 1 ATOM 919 N . TYR A 118 ? -8.22104 7.34109 -30.96486 1.000 26.37752 N ? A ? 118 1 ATOM 920 CA . TYR A 118 ? -9.67679 7.32053 -30.98965 1.000 27.11501 C ? A ? 118 1 ATOM 921 C . TYR A 118 ? -10.16977 8.71588 -30.64723 1.000 29.61339 C ? A ? 118 1 ATOM 922 O . TYR A 118 ? -9.75175 9.29052 -29.63713 1.000 29.52896 O ? A ? 118 1 ATOM 923 CB . TYR A 118 ? -10.23833 6.28197 -30.00972 1.000 26.80457 C ? A ? 118 1 ATOM 924 CG . TYR A 118 ? -9.76416 4.87744 -30.31954 1.000 29.55253 C ? A ? 118 1 ATOM 925 CD1 . TYR A 118 ? -8.58405 4.38523 -29.77765 1.000 26.10141 C ? A ? 118 1 ATOM 926 CD2 . TYR A 118 ? -10.48143 4.05636 -31.17859 1.000 31.07176 C ? A ? 118 1 ATOM 927 CE1 . TYR A 118 ? -8.14019 3.11123 -30.07172 1.000 35.16037 C ? A ? 118 1 ATOM 928 CE2 . TYR A 118 ? -10.04895 2.78101 -31.47358 1.000 30.91273 C ? A ? 118 1 ATOM 929 CZ . TYR A 118 ? -8.87691 2.31451 -30.92055 1.000 28.12493 C ? A ? 118 1 ATOM 930 OH . TYR A 118 ? -8.44149 1.04547 -31.21524 1.000 36.66063 O ? A ? 118 1 ATOM 931 N . ASN A 119 ? -11.03193 9.26360 -31.50785 1.000 34.50189 N ? A ? 119 1 ATOM 932 CA . ASN A 119 ? -11.55763 10.62182 -31.35220 1.000 31.28825 C ? A ? 119 1 ATOM 933 C . ASN A 119 ? -10.43462 11.65590 -31.32570 1.000 28.59255 C ? A ? 119 1 ATOM 934 O . ASN A 119 ? -10.51379 12.66483 -30.62449 1.000 28.22382 O ? A ? 119 1 ATOM 935 CB . ASN A 119 ? -12.43054 10.74145 -30.10095 1.000 30.94620 C ? A ? 119 1 ATOM 936 CG . ASN A 119 ? -13.72359 9.96445 -30.21870 1.000 41.49785 C ? A ? 119 1 ATOM 937 OD1 . ASN A 119 ? -14.43200 10.06206 -31.22270 1.000 45.78415 O ? A ? 119 1 ATOM 938 ND2 . ASN A 119 ? -14.03590 9.17906 -29.19464 1.000 49.63671 N ? A ? 119 1 ATOM 939 N . GLY A 120 ? -9.37793 11.40491 -32.09455 1.000 26.58448 N ? A ? 120 1 ATOM 940 CA . GLY A 120 ? -8.25915 12.32017 -32.17332 1.000 31.30055 C ? A ? 120 1 ATOM 941 C . GLY A 120 ? -7.29725 12.28225 -31.00616 1.000 32.20366 C ? A ? 120 1 ATOM 942 O . GLY A 120 ? -6.29761 13.00961 -31.02967 1.000 37.76149 O ? A ? 120 1 ATOM 943 N . SER A 121 ? -7.55688 11.46510 -29.98703 1.000 36.66543 N ? A ? 121 1 ATOM 944 CA . SER A 121 ? -6.68389 11.37944 -28.82565 1.000 26.66456 C ? A ? 121 1 ATOM 945 C . SER A 121 ? -5.89598 10.07856 -28.85029 1.000 39.35820 C ? A ? 121 1 ATOM 946 O . SER A 121 ? -6.48134 9.00531 -29.05346 1.000 29.82565 O ? A ? 121 1 ATOM 947 CB . SER A 121 ? -7.49541 11.47562 -27.52920 1.000 30.22549 C ? A ? 121 1 ATOM 948 OG . SER A 121 ? -8.10528 12.75092 -27.40065 1.000 41.66021 O ? A ? 121 1 ATOM 949 N . PRO A 122 ? -4.58041 10.12566 -28.65859 1.000 35.71360 N ? A ? 122 1 ATOM 950 CA . PRO A 122 ? -3.78534 8.89291 -28.70242 1.000 36.91990 C ? A ? 122 1 ATOM 951 C . PRO A 122 ? -4.05528 8.00654 -27.49503 1.000 34.16934 C ? A ? 122 1 ATOM 952 O . PRO A 122 ? -4.13527 8.47944 -26.35928 1.000 39.18915 O ? A ? 122 1 ATOM 953 CB . PRO A 122 ? -2.34163 9.40701 -28.71016 1.000 37.04512 C ? A ? 122 1 ATOM 954 CG . PRO A 122 ? -2.42631 10.73938 -28.02304 1.000 43.06955 C ? A ? 122 1 ATOM 955 CD . PRO A 122 ? -3.74240 11.32043 -28.46036 1.000 31.62856 C ? A ? 122 1 ATOM 956 N . SER A 123 ? -4.19061 6.70566 -27.75059 1.000 32.00983 N ? A ? 123 1 ATOM 957 CA . SER A 123 ? -4.42158 5.72867 -26.69440 1.000 30.61126 C ? A ? 123 1 ATOM 958 C . SER A 123 ? -3.22294 4.83750 -26.41695 1.000 35.17485 C ? A ? 123 1 ATOM 959 O . SER A 123 ? -3.07181 4.36268 -25.29000 1.000 37.24602 O ? A ? 123 1 ATOM 960 CB . SER A 123 ? -5.62564 4.84202 -27.03836 1.000 30.72745 C ? A ? 123 1 ATOM 961 OG . SER A 123 ? -5.35795 4.02738 -28.16500 1.000 40.68574 O ? A ? 123 1 ATOM 962 N . GLY A 124 ? -2.37054 4.60457 -27.40443 1.000 29.86333 N ? A ? 124 1 ATOM 963 CA . GLY A 124 ? -1.22290 3.74293 -27.20368 1.000 28.80277 C ? A ? 124 1 ATOM 964 C . GLY A 124 ? -0.35380 3.71776 -28.44245 1.000 27.72401 C ? A ? 124 1 ATOM 965 O . GLY A 124 ? -0.77172 4.12027 -29.53329 1.000 26.26101 O ? A ? 124 1 ATOM 966 N . VAL A 125 ? 0.87130 3.23757 -28.24909 1.000 24.01551 N ? A ? 125 1 ATOM 967 CA . VAL A 125 ? 1.85045 3.11827 -29.32068 1.000 25.79766 C ? A ? 125 1 ATOM 968 C . VAL A 125 ? 2.45108 1.71766 -29.27646 1.000 21.47605 C ? A ? 125 1 ATOM 969 O . VAL A 125 ? 2.70108 1.17066 -28.19683 1.000 25.63713 O ? A ? 125 1 ATOM 970 CB . VAL A 125 ? 2.94298 4.20783 -29.21558 1.000 21.75423 C ? A ? 125 1 ATOM 971 CG1 . VAL A 125 ? 3.67521 4.12498 -27.88614 1.000 27.49167 C ? A ? 125 1 ATOM 972 CG2 . VAL A 125 ? 3.91235 4.11185 -30.37766 1.000 23.56409 C ? A ? 125 1 ATOM 973 N . TYR A 126 ? 2.64992 1.12670 -30.45269 1.000 20.67929 N ? A ? 126 1 ATOM 974 CA . TYR A 126 ? 3.22975 -0.20582 -30.56137 1.000 23.54404 C ? A ? 126 1 ATOM 975 C . TYR A 126 ? 3.87236 -0.34419 -31.93297 1.000 23.44376 C ? A ? 126 1 ATOM 976 O . TYR A 126 ? 3.59513 0.43249 -32.85165 1.000 22.81680 O ? A ? 126 1 ATOM 977 CB . TYR A 126 ? 2.18329 -1.30675 -30.33760 1.000 23.41758 C ? A ? 126 1 ATOM 978 CG . TYR A 126 ? 0.96129 -1.18807 -31.22019 1.000 22.56594 C ? A ? 126 1 ATOM 979 CD1 . TYR A 126 ? 0.92429 -1.77687 -32.47780 1.000 21.52144 C ? A ? 126 1 ATOM 980 CD2 . TYR A 126 ? -0.15873 -0.49047 -30.79229 1.000 28.71132 C ? A ? 126 1 ATOM 981 CE1 . TYR A 126 ? -0.19344 -1.66775 -33.28511 1.000 21.51747 C ? A ? 126 1 ATOM 982 CE2 . TYR A 126 ? -1.28022 -0.37653 -31.59090 1.000 29.20083 C ? A ? 126 1 ATOM 983 CZ . TYR A 126 ? -1.29261 -0.96788 -32.83629 1.000 27.32701 C ? A ? 126 1 ATOM 984 OH . TYR A 126 ? -2.41011 -0.85779 -33.63356 1.000 27.80602 O ? A ? 126 1 ATOM 985 N . GLN A 127 ? 4.72669 -1.35337 -32.06052 1.000 23.17020 N ? A ? 127 1 ATOM 986 CA . GLN A 127 ? 5.50447 -1.57820 -33.27133 1.000 28.17100 C ? A ? 127 1 ATOM 987 C . GLN A 127 ? 4.85488 -2.65932 -34.13082 1.000 28.07894 C ? A ? 127 1 ATOM 988 O . GLN A 127 ? 4.40263 -3.68764 -33.61900 1.000 30.92364 O ? A ? 127 1 ATOM 989 CB . GLN A 127 ? 6.93934 -1.97909 -32.91563 1.000 26.27981 C ? A ? 127 1 ATOM 990 CG . GLN A 127 ? 7.92160 -1.95896 -34.07932 1.000 34.09193 C ? A ? 127 1 ATOM 991 CD . GLN A 127 ? 8.52405 -0.58105 -34.31310 1.000 35.39215 C ? A ? 127 1 ATOM 992 OE1 . GLN A 127 ? 8.01101 0.43183 -33.82625 1.000 29.70075 O ? A ? 127 1 ATOM 993 NE2 . GLN A 127 ? 9.62233 -0.53829 -35.06002 1.000 33.04299 N ? A ? 127 1 ATOM 994 N . CYS A 128 ? 4.81433 -2.41994 -35.44135 1.000 33.81421 N ? A ? 128 1 ATOM 995 CA . CYS A 128 ? 4.19028 -3.32109 -36.40238 1.000 28.52101 C ? A ? 128 1 ATOM 996 C . CYS A 128 ? 5.14028 -3.58742 -37.55927 1.000 22.93767 C ? A ? 128 1 ATOM 997 O . CYS A 128 ? 6.09799 -2.84692 -37.78605 1.000 28.83854 O ? A ? 128 1 ATOM 998 CB . CYS A 128 ? 2.88351 -2.74505 -36.96566 1.000 28.39900 C ? A ? 128 1 ATOM 999 SG . CYS A 128 ? 1.44986 -2.98584 -35.93392 1.000 39.16833 S ? A ? 128 1 ATOM 1000 N . ALA A 129 ? 4.84387 -4.64396 -38.31278 1.000 30.82083 N ? A ? 129 1 ATOM 1001 CA . ALA A 129 ? 5.60631 -4.99621 -39.50161 1.000 27.39448 C ? A ? 129 1 ATOM 1002 C . ALA A 129 ? 4.66678 -5.16565 -40.68687 1.000 30.82721 C ? A ? 129 1 ATOM 1003 O . ALA A 129 ? 3.59305 -5.76291 -40.56020 1.000 27.61291 O ? A ? 129 1 ATOM 1004 CB . ALA A 129 ? 6.41406 -6.28095 -39.28870 1.000 26.99687 C ? A ? 129 1 ATOM 1005 N . MET A 130 ? 5.07667 -4.63237 -41.83685 1.000 20.71485 N ? A ? 130 1 ATOM 1006 CA . MET A 130 ? 4.35067 -4.82825 -43.08607 1.000 20.50757 C ? A ? 130 1 ATOM 1007 C . MET A 130 ? 4.62103 -6.24433 -43.58259 1.000 28.25655 C ? A ? 130 1 ATOM 1008 O . MET A 130 ? 5.74928 -6.56956 -43.96688 1.000 24.53708 O ? A ? 130 1 ATOM 1009 CB . MET A 130 ? 4.77582 -3.78428 -44.11447 1.000 26.98219 C ? A ? 130 1 ATOM 1010 CG . MET A 130 ? 4.01281 -3.84774 -45.42748 1.000 28.17665 C ? A ? 130 1 ATOM 1011 SD . MET A 130 ? 2.23383 -3.60458 -45.24050 1.000 27.21993 S ? A ? 130 1 ATOM 1012 CE . MET A 130 ? 2.15973 -1.87575 -44.76753 1.000 21.23971 C ? A ? 130 1 ATOM 1013 N . ARG A 131 ? 3.59268 -7.09030 -43.56960 1.000 22.93647 N ? A ? 131 1 ATOM 1014 CA . ARG A 131 ? 3.77676 -8.49114 -43.91371 1.000 23.67938 C ? A ? 131 1 ATOM 1015 C . ARG A 131 ? 4.02617 -8.64828 -45.41394 1.000 25.89049 C ? A ? 131 1 ATOM 1016 O . ARG A 131 ? 3.87653 -7.71274 -46.20776 1.000 23.23806 O ? A ? 131 1 ATOM 1017 CB . ARG A 131 ? 2.55944 -9.31907 -43.49517 1.000 25.40028 C ? A ? 131 1 ATOM 1018 CG . ARG A 131 ? 2.06807 -9.07191 -42.07151 1.000 29.76293 C ? A ? 131 1 ATOM 1019 CD . ARG A 131 ? 3.01444 -9.61479 -41.03885 1.000 30.01945 C ? A ? 131 1 ATOM 1020 NE . ARG A 131 ? 3.08674 -11.06701 -41.10816 1.000 36.21231 N ? A ? 131 1 ATOM 1021 CZ . ARG A 131 ? 4.01807 -11.79253 -40.50812 1.000 41.61499 C ? A ? 131 1 ATOM 1022 NH1 . ARG A 131 ? 4.96217 -11.22907 -39.77115 1.000 32.45944 N ? A ? 131 1 ATOM 1023 NH2 . ARG A 131 ? 4.00689 -13.11414 -40.65766 1.000 45.20757 N ? A ? 131 1 ATOM 1024 N . HIS A 132 ? 4.41287 -9.86688 -45.79661 1.000 26.02643 N ? A ? 132 1 ATOM 1025 CA . HIS A 132 ? 4.63314 -10.17198 -47.20551 1.000 26.60759 C ? A ? 132 1 ATOM 1026 C . HIS A 132 ? 3.37246 -9.95208 -48.03568 1.000 28.83811 C ? A ? 132 1 ATOM 1027 O . HIS A 132 ? 3.46411 -9.60255 -49.21844 1.000 26.31780 O ? A ? 132 1 ATOM 1028 CB . HIS A 132 ? 5.12979 -11.61131 -47.34819 1.000 28.90653 C ? A ? 132 1 ATOM 1029 CG . HIS A 132 ? 5.11945 -12.11944 -48.75614 1.000 40.68385 C ? A ? 132 1 ATOM 1030 ND1 . HIS A 132 ? 6.12965 -11.84911 -49.65382 1.000 46.84138 N ? A ? 132 1 ATOM 1031 CD2 . HIS A 132 ? 4.22055 -12.88400 -49.42081 1.000 46.08752 C ? A ? 132 1 ATOM 1032 CE1 . HIS A 132 ? 5.85448 -12.42603 -50.81022 1.000 39.66439 C ? A ? 132 1 ATOM 1033 NE2 . HIS A 132 ? 4.70135 -13.05998 -50.69574 1.000 47.51673 N ? A ? 132 1 ATOM 1034 N . ASN A 133 ? 2.19196 -10.13857 -47.43882 1.000 25.04677 N ? A ? 133 1 ATOM 1035 CA . ASN A 133 ? 0.92409 -9.94439 -48.13172 1.000 26.89291 C ? A ? 133 1 ATOM 1036 C . ASN A 133 ? 0.33884 -8.54717 -47.91821 1.000 22.84096 C ? A ? 133 1 ATOM 1037 O . ASN A 133 ? -0.86062 -8.34482 -48.14500 1.000 22.39593 O ? A ? 133 1 ATOM 1038 CB . ASN A 133 ? -0.08479 -11.01741 -47.70549 1.000 25.21154 C ? A ? 133 1 ATOM 1039 CG . ASN A 133 ? -0.41546 -10.96534 -46.22327 1.000 25.73941 C ? A ? 133 1 ATOM 1040 OD1 . ASN A 133 ? 0.01875 -10.06660 -45.50457 1.000 24.76541 O ? A ? 133 1 ATOM 1041 ND2 . ASN A 133 ? -1.19612 -11.93554 -45.76057 1.000 27.21743 N ? A ? 133 1 ATOM 1042 N . PHE A 134 ? 1.16036 -7.59302 -47.47573 1.000 25.64265 N ? A ? 134 1 ATOM 1043 CA . PHE A 134 ? 0.77332 -6.18920 -47.31046 1.000 20.81374 C ? A ? 134 1 ATOM 1044 C . PHE A 134 ? -0.35598 -6.00654 -46.29900 1.000 25.96870 C ? A ? 134 1 ATOM 1045 O . PHE A 134 ? -1.20880 -5.12842 -46.45328 1.000 25.88486 O ? A ? 134 1 ATOM 1046 CB . PHE A 134 ? 0.41028 -5.54920 -48.65171 1.000 20.99902 C ? A ? 134 1 ATOM 1047 CG . PHE A 134 ? 1.59233 -5.34472 -49.55391 1.000 25.18720 C ? A ? 134 1 ATOM 1048 CD1 . PHE A 134 ? 2.50565 -4.32837 -49.30035 1.000 21.96549 C ? A ? 134 1 ATOM 1049 CD2 . PHE A 134 ? 1.80007 -6.17220 -50.64684 1.000 23.51795 C ? A ? 134 1 ATOM 1050 CE1 . PHE A 134 ? 3.60179 -4.13908 -50.12165 1.000 23.34672 C ? A ? 134 1 ATOM 1051 CE2 . PHE A 134 ? 2.89499 -5.98769 -51.47437 1.000 24.85420 C ? A ? 134 1 ATOM 1052 CZ . PHE A 134 ? 3.79643 -4.96977 -51.21161 1.000 24.80922 C ? A ? 134 1 ATOM 1053 N . THR A 135 ? -0.35767 -6.81832 -45.24862 1.000 25.09818 N ? A ? 135 1 ATOM 1054 CA . THR A 135 ? -1.20111 -6.61210 -44.08097 1.000 22.40145 C ? A ? 135 1 ATOM 1055 C . THR A 135 ? -0.32153 -6.34868 -42.86579 1.000 19.21675 C ? A ? 135 1 ATOM 1056 O . THR A 135 ? 0.90266 -6.47279 -42.91727 1.000 24.69357 O ? A ? 135 1 ATOM 1057 CB . THR A 135 ? -2.10684 -7.82452 -43.82364 1.000 21.71775 C ? A ? 135 1 ATOM 1058 OG1 . THR A 135 ? -1.30081 -8.96853 -43.52010 1.000 27.32581 O ? A ? 135 1 ATOM 1059 CG2 . THR A 135 ? -2.96063 -8.13000 -45.04181 1.000 23.49875 C ? A ? 135 1 ATOM 1060 N . ILE A 136 ? -0.95931 -5.96771 -41.75827 1.000 25.28705 N ? A ? 136 1 ATOM 1061 CA . ILE A 136 ? -0.27129 -5.80782 -40.48300 1.000 25.32176 C ? A ? 136 1 ATOM 1062 C . ILE A 136 ? -1.10511 -6.44665 -39.38312 1.000 25.06348 C ? A ? 136 1 ATOM 1063 O . ILE A 136 ? -2.31980 -6.62176 -39.50427 1.000 27.34415 O ? A ? 136 1 ATOM 1064 CB . ILE A 136 ? 0.01895 -4.33398 -40.11483 1.000 21.88270 C ? A ? 136 1 ATOM 1065 CG1 . ILE A 136 ? -1.28548 -3.57368 -39.85767 1.000 21.35740 C ? A ? 136 1 ATOM 1066 CG2 . ILE A 136 ? 0.86385 -3.66295 -41.18641 1.000 23.13252 C ? A ? 136 1 ATOM 1067 CD1 . ILE A 136 ? -1.06792 -2.13052 -39.45430 1.000 18.82683 C ? A ? 136 1 ATOM 1068 N . LYS A 137 ? -0.42669 -6.78757 -38.29699 1.000 26.08327 N ? A ? 137 1 ATOM 1069 CA . LYS A 137 ? -1.04009 -7.38733 -37.11933 1.000 29.29475 C ? A ? 137 1 ATOM 1070 C . LYS A 137 ? -0.99489 -6.32463 -36.02308 1.000 29.23711 C ? A ? 137 1 ATOM 1071 O . LYS A 137 ? -0.01861 -6.21263 -35.27987 1.000 32.70590 O ? A ? 137 1 ATOM 1072 CB . LYS A 137 ? -0.31381 -8.68172 -36.72742 1.000 23.87706 C ? A ? 137 1 ATOM 1073 CG . LYS A 137 ? -0.08434 -9.61381 -37.91935 1.000 35.56688 C ? A ? 137 1 ATOM 1074 CD . LYS A 137 ? 0.15382 -11.06920 -37.52421 1.000 32.84702 C ? A ? 137 1 ATOM 1075 CE . LYS A 137 ? 1.61674 -11.35073 -37.22094 1.000 41.76171 C ? A ? 137 1 ATOM 1076 NZ . LYS A 137 ? 1.88082 -12.81588 -37.06267 1.000 38.26981 N ? A ? 137 1 ATOM 1077 N . GLY A 138 ? -2.05592 -5.52563 -35.94776 1.000 25.88368 N ? A ? 138 1 ATOM 1078 CA . GLY A 138 ? -2.13102 -4.45819 -34.97320 1.000 28.01967 C ? A ? 138 1 ATOM 1079 C . GLY A 138 ? -3.25824 -4.63181 -33.97916 1.000 29.72643 C ? A ? 138 1 ATOM 1080 O . GLY A 138 ? -3.76342 -5.73880 -33.78537 1.000 30.33254 O ? A ? 138 1 ATOM 1081 N . SER A 139 ? -3.65596 -3.53898 -33.33769 1.000 24.91757 N ? A ? 139 1 ATOM 1082 CA . SER A 139 ? -4.74388 -3.53696 -32.36398 1.000 31.01399 C ? A ? 139 1 ATOM 1083 C . SER A 139 ? -5.59268 -2.30562 -32.66328 1.000 28.83757 C ? A ? 139 1 ATOM 1084 O . SER A 139 ? -5.25626 -1.19288 -32.24440 1.000 30.92781 O ? A ? 139 1 ATOM 1085 CB . SER A 139 ? -4.20903 -3.52586 -30.93608 1.000 27.93843 C ? A ? 139 1 ATOM 1086 OG . SER A 139 ? -5.25828 -3.65496 -29.98988 1.000 37.59544 O ? A ? 139 1 ATOM 1087 N . PHE A 140 ? -6.68128 -2.50762 -33.40341 1.000 23.98952 N ? A ? 140 1 ATOM 1088 CA . PHE A 140 ? -7.53984 -1.42573 -33.86753 1.000 26.35806 C ? A ? 140 1 ATOM 1089 C . PHE A 140 ? -8.99043 -1.76879 -33.56878 1.000 31.80756 C ? A ? 140 1 ATOM 1090 O . PHE A 140 ? -9.43606 -2.88664 -33.84760 1.000 30.14184 O ? A ? 140 1 ATOM 1091 CB . PHE A 140 ? -7.36235 -1.18120 -35.37115 1.000 23.94558 C ? A ? 140 1 ATOM 1092 CG . PHE A 140 ? -5.99991 -0.67210 -35.75266 1.000 26.98192 C ? A ? 140 1 ATOM 1093 CD1 . PHE A 140 ? -5.65366 0.65060 -35.53702 1.000 27.89068 C ? A ? 140 1 ATOM 1094 CD2 . PHE A 140 ? -5.07192 -1.51095 -36.34405 1.000 28.12913 C ? A ? 140 1 ATOM 1095 CE1 . PHE A 140 ? -4.40477 1.12277 -35.89350 1.000 22.77619 C ? A ? 140 1 ATOM 1096 CE2 . PHE A 140 ? -3.82408 -1.03944 -36.70235 1.000 25.14437 C ? A ? 140 1 ATOM 1097 CZ . PHE A 140 ? -3.49386 0.27919 -36.47668 1.000 20.72650 C ? A ? 140 1 ATOM 1098 N . LEU A 141 ? -9.71730 -0.80792 -33.00377 1.000 31.87579 N ? A ? 141 1 ATOM 1099 CA . LEU A 141 ? -11.13537 -0.91759 -32.70955 1.000 29.40698 C ? A ? 141 1 ATOM 1100 C . LEU A 141 ? -11.91207 0.00613 -33.64387 1.000 31.21409 C ? A ? 141 1 ATOM 1101 O . LEU A 141 ? -11.34042 0.64616 -34.53365 1.000 23.97582 O ? A ? 141 1 ATOM 1102 CB . LEU A 141 ? -11.40108 -0.57702 -31.24005 1.000 29.21883 C ? A ? 141 1 ATOM 1103 CG . LEU A 141 ? -10.79393 -1.45840 -30.14941 1.000 29.67183 C ? A ? 141 1 ATOM 1104 CD1 . LEU A 141 ? -11.08768 -0.86849 -28.78261 1.000 35.95376 C ? A ? 141 1 ATOM 1105 CD2 . LEU A 141 ? -11.33010 -2.87798 -30.23934 1.000 33.43711 C ? A ? 141 1 ATOM 1106 N . ASN A 142 ? -13.22416 0.08854 -33.42989 1.000 32.51897 N ? A ? 142 1 ATOM 1107 CA . ASN A 142 ? -14.03147 1.06026 -34.15513 1.000 34.42284 C ? A ? 142 1 ATOM 1108 C . ASN A 142 ? -13.56838 2.47214 -33.82313 1.000 30.84732 C ? A ? 142 1 ATOM 1109 O . ASN A 142 ? -13.32211 2.80244 -32.65923 1.000 28.11460 O ? A ? 142 1 ATOM 1110 CB . ASN A 142 ? -15.51020 0.89564 -33.80837 1.000 30.14072 C ? A ? 142 1 ATOM 1111 CG . ASN A 142 ? -16.14515 -0.29034 -34.50529 1.000 40.85528 C ? A ? 142 1 ATOM 1112 OD1 . ASN A 142 ? -15.78261 -0.63125 -35.63038 1.000 54.54937 O ? A ? 142 1 ATOM 1113 ND2 . ASN A 142 ? -17.10372 -0.92395 -33.83985 1.000 46.28427 N ? A ? 142 1 ATOM 1114 N . GLY A 143 ? -13.43572 3.30064 -34.85273 1.000 24.95673 N ? A ? 143 1 ATOM 1115 CA . GLY A 143 ? -12.98976 4.66344 -34.67255 1.000 30.18897 C ? A ? 143 1 ATOM 1116 C . GLY A 143 ? -11.49246 4.85619 -34.63984 1.000 27.64554 C ? A ? 143 1 ATOM 1117 O . GLY A 143 ? -11.03556 5.94909 -34.28791 1.000 27.53136 O ? A ? 143 1 ATOM 1118 N . SER A 144 ? -10.71153 3.83926 -34.99179 1.000 21.79255 N ? A ? 144 1 ATOM 1119 CA . SER A 144 ? -9.26317 3.97465 -35.01193 1.000 21.82377 C ? A ? 144 1 ATOM 1120 C . SER A 144 ? -8.72520 4.37645 -36.37713 1.000 23.15912 C ? A ? 144 1 ATOM 1121 O . SER A 144 ? -7.52094 4.62532 -36.49967 1.000 21.00787 O ? A ? 144 1 ATOM 1122 CB . SER A 144 ? -8.59715 2.66610 -34.56714 1.000 19.60171 C ? A ? 144 1 ATOM 1123 OG . SER A 144 ? -8.92422 1.60316 -35.44139 1.000 21.42684 O ? A ? 144 1 ATOM 1124 N . CYS A 145 ? -9.57995 4.44240 -37.39653 1.000 26.00551 N ? A ? 145 1 ATOM 1125 CA . CYS A 145 ? -9.13072 4.82892 -38.72664 1.000 21.39848 C ? A ? 145 1 ATOM 1126 C . CYS A 145 ? -8.57598 6.24500 -38.71348 1.000 21.71971 C ? A ? 145 1 ATOM 1127 O . CYS A 145 ? -9.07801 7.12226 -38.00583 1.000 19.30007 O ? A ? 145 1 ATOM 1128 CB . CYS A 145 ? -10.27921 4.71788 -39.72625 1.000 21.07535 C ? A ? 145 1 ATOM 1129 SG . CYS A 145 ? -10.67284 3.01193 -40.18471 1.000 25.42633 S ? A ? 145 1 ATOM 1130 N . GLY A 146 ? -7.53266 6.46446 -39.50961 1.000 17.84949 N ? A ? 146 1 ATOM 1131 CA . GLY A 146 ? -6.78042 7.69511 -39.45569 1.000 23.90970 C ? A ? 146 1 ATOM 1132 C . GLY A 146 ? -5.56685 7.64304 -38.55730 1.000 20.39086 C ? A ? 146 1 ATOM 1133 O . GLY A 146 ? -4.72437 8.54724 -38.63023 1.000 18.19754 O ? A ? 146 1 ATOM 1134 N . SER A 147 ? -5.46502 6.62583 -37.70068 1.000 20.23094 N ? A ? 147 1 ATOM 1135 CA . SER A 147 ? -4.22575 6.36003 -36.98566 1.000 17.93293 C ? A ? 147 1 ATOM 1136 C . SER A 147 ? -3.10465 6.10904 -37.98512 1.000 20.27952 C ? A ? 147 1 ATOM 1137 O . SER A 147 ? -3.32003 5.52456 -39.05057 1.000 18.98665 O ? A ? 147 1 ATOM 1138 CB . SER A 147 ? -4.39284 5.15115 -36.06238 1.000 17.87411 C ? A ? 147 1 ATOM 1139 OG . SER A 147 ? -5.36426 5.40538 -35.06441 1.000 19.49430 O ? A ? 147 1 ATOM 1140 N . VAL A 148 ? -1.90028 6.55533 -37.64657 1.000 17.45634 N ? A ? 148 1 ATOM 1141 CA . VAL A 148 ? -0.80571 6.53192 -38.60498 1.000 21.08897 C ? A ? 148 1 ATOM 1142 C . VAL A 148 ? 0.35345 5.70393 -38.06973 1.000 20.28509 C ? A ? 148 1 ATOM 1143 O . VAL A 148 ? 0.54940 5.55995 -36.85836 1.000 18.21296 O ? A ? 148 1 ATOM 1144 CB . VAL A 148 ? -0.33737 7.95742 -38.97085 1.000 23.44148 C ? A ? 148 1 ATOM 1145 CG1 . VAL A 148 ? -1.46895 8.72142 -39.65071 1.000 18.36440 C ? A ? 148 1 ATOM 1146 CG2 . VAL A 148 ? 0.16499 8.69685 -37.73552 1.000 18.83143 C ? A ? 148 1 ATOM 1147 N . GLY A 149 ? 1.11203 5.14000 -39.00470 1.000 19.25479 N ? A ? 149 1 ATOM 1148 CA . GLY A 149 ? 2.35477 4.45621 -38.70996 1.000 20.42530 C ? A ? 149 1 ATOM 1149 C . GLY A 149 ? 3.51434 5.30032 -39.20078 1.000 19.49491 C ? A ? 149 1 ATOM 1150 O . GLY A 149 ? 3.39735 6.01536 -40.19787 1.000 19.78990 O ? A ? 149 1 ATOM 1151 N . PHE A 150 ? 4.64001 5.21688 -38.49952 1.000 19.74671 N ? A ? 150 1 ATOM 1152 CA . PHE A 150 ? 5.72730 6.14697 -38.75829 1.000 20.78737 C ? A ? 150 1 ATOM 1153 C . PHE A 150 ? 7.04661 5.53448 -38.31570 1.000 21.76370 C ? A ? 150 1 ATOM 1154 O . PHE A 150 ? 7.08497 4.58997 -37.52333 1.000 21.39661 O ? A ? 150 1 ATOM 1155 CB . PHE A 150 ? 5.49114 7.48334 -38.04036 1.000 21.32521 C ? A ? 150 1 ATOM 1156 CG . PHE A 150 ? 5.43746 7.36394 -36.53994 1.000 21.25138 C ? A ? 150 1 ATOM 1157 CD1 . PHE A 150 ? 4.26704 6.98247 -35.89857 1.000 25.27268 C ? A ? 150 1 ATOM 1158 CD2 . PHE A 150 ? 6.56113 7.62587 -35.76930 1.000 25.60154 C ? A ? 150 1 ATOM 1159 CE1 . PHE A 150 ? 4.22218 6.86232 -34.51386 1.000 21.94417 C ? A ? 150 1 ATOM 1160 CE2 . PHE A 150 ? 6.52190 7.50906 -34.38596 1.000 22.70583 C ? A ? 150 1 ATOM 1161 CZ . PHE A 150 ? 5.35269 7.12660 -33.76033 1.000 21.64509 C ? A ? 150 1 ATOM 1162 N . ASN A 151 ? 8.12616 6.08793 -38.85775 1.000 23.31164 N ? A ? 151 1 ATOM 1163 CA . ASN A 151 ? 9.48190 5.90801 -38.36379 1.000 24.85742 C ? A ? 151 1 ATOM 1164 C . ASN A 151 ? 10.06243 7.28255 -38.06515 1.000 29.10779 C ? A ? 151 1 ATOM 1165 O . ASN A 151 ? 9.53309 8.30914 -38.49858 1.000 31.67956 O ? A ? 151 1 ATOM 1166 CB . ASN A 151 ? 10.36616 5.16267 -39.37666 1.000 27.44652 C ? A ? 151 1 ATOM 1167 CG . ASN A 151 ? 9.97746 3.70467 -39.53382 1.000 27.92585 C ? A ? 151 1 ATOM 1168 OD1 . ASN A 151 ? 10.44539 2.84468 -38.78979 1.000 28.76661 O ? A ? 151 1 ATOM 1169 ND2 . ASN A 151 ? 9.12430 3.41897 -40.51054 1.000 30.26214 N ? A ? 151 1 ATOM 1170 N . ILE A 152 ? 11.16305 7.30353 -37.31795 1.000 27.98810 N ? A ? 152 1 ATOM 1171 CA . ILE A 152 ? 11.83588 8.54934 -36.96835 1.000 29.93648 C ? A ? 152 1 ATOM 1172 C . ILE A 152 ? 13.32527 8.38767 -37.23012 1.000 38.65582 C ? A ? 152 1 ATOM 1173 O . ILE A 152 ? 13.94290 7.42751 -36.75833 1.000 45.86809 O ? A ? 152 1 ATOM 1174 CB . ILE A 152 ? 11.57674 8.95072 -35.50276 1.000 31.87886 C ? A ? 152 1 ATOM 1175 CG1 . ILE A 152 ? 10.08320 9.20993 -35.28865 1.000 36.08061 C ? A ? 152 1 ATOM 1176 CG2 . ILE A 152 ? 12.39523 10.17320 -35.13017 1.000 35.56653 C ? A ? 152 1 ATOM 1177 CD1 . ILE A 152 ? 9.73041 9.68304 -33.90550 1.000 29.59478 C ? A ? 152 1 ATOM 1178 N . ASP A 153 ? 13.89741 9.31902 -37.99025 1.000 49.22360 N ? A ? 153 1 ATOM 1179 CA . ASP A 153 ? 15.33453 9.37977 -38.25591 1.000 55.85149 C ? A ? 153 1 ATOM 1180 C . ASP A 153 ? 15.84300 10.67324 -37.62743 1.000 51.93073 C ? A ? 153 1 ATOM 1181 O . ASP A 153 ? 15.83381 11.72874 -38.26614 1.000 60.68858 O ? A ? 153 1 ATOM 1182 CB . ASP A 153 ? 15.62648 9.32506 -39.75080 1.000 60.62663 C ? A ? 153 1 ATOM 1183 CG . ASP A 153 ? 14.80824 8.26757 -40.46330 1.000 77.52164 C ? A ? 153 1 ATOM 1184 OD1 . ASP A 153 ? 14.84183 7.09295 -40.03316 1.000 78.26348 O ? A ? 153 1 ATOM 1185 OD2 . ASP A 153 ? 14.11442 8.61692 -41.44100 1.000 77.03000 O ? A ? 153 1 ATOM 1186 N . TYR A 154 ? 16.27914 10.57571 -36.37025 1.000 62.07718 N ? A ? 154 1 ATOM 1187 CA . TYR A 154 ? 16.68462 11.71836 -35.55812 1.000 52.42571 C ? A ? 154 1 ATOM 1188 C . TYR A 154 ? 15.50721 12.65572 -35.32137 1.000 54.12765 C ? A ? 154 1 ATOM 1189 O . TYR A 154 ? 14.75192 12.47857 -34.35969 1.000 57.83352 O ? A ? 154 1 ATOM 1190 CB . TYR A 154 ? 17.85344 12.47118 -36.20176 1.000 58.65742 C ? A ? 154 1 ATOM 1191 CG . TYR A 154 ? 18.62120 13.34387 -35.23112 1.000 62.44208 C ? A ? 154 1 ATOM 1192 CD1 . TYR A 154 ? 19.26816 12.78708 -34.13573 1.000 68.51787 C ? A ? 154 1 ATOM 1193 CD2 . TYR A 154 ? 18.70792 14.71975 -35.41386 1.000 61.49581 C ? A ? 154 1 ATOM 1194 CE1 . TYR A 154 ? 19.97476 13.57491 -33.24483 1.000 82.49291 C ? A ? 154 1 ATOM 1195 CE2 . TYR A 154 ? 19.41546 15.51761 -34.52719 1.000 72.26199 C ? A ? 154 1 ATOM 1196 CZ . TYR A 154 ? 20.04627 14.93840 -33.44499 1.000 71.24710 C ? A ? 154 1 ATOM 1197 OH . TYR A 154 ? 20.75012 15.71979 -32.55818 1.000 77.29084 O ? A ? 154 1 ATOM 1198 N . ASP A 155 ? 15.33695 13.65258 -36.18735 1.000 51.74374 N ? A ? 155 1 ATOM 1199 CA . ASP A 155 ? 14.28273 14.64215 -36.01780 1.000 55.49369 C ? A ? 155 1 ATOM 1200 C . ASP A 155 ? 13.23191 14.60290 -37.11973 1.000 46.35549 C ? A ? 155 1 ATOM 1201 O . ASP A 155 ? 12.26530 15.36983 -37.05717 1.000 46.76680 O ? A ? 155 1 ATOM 1202 CB . ASP A 155 ? 14.88914 16.05150 -35.92279 1.000 57.59145 C ? A ? 155 1 ATOM 1203 CG . ASP A 155 ? 15.74505 16.41136 -37.12862 1.000 58.22346 C ? A ? 155 1 ATOM 1204 OD1 . ASP A 155 ? 15.89638 15.56734 -38.03918 1.000 58.78250 O ? A ? 155 1 ATOM 1205 OD2 . ASP A 155 ? 16.26890 17.54720 -37.16313 1.000 60.77740 O ? A ? 155 1 ATOM 1206 N . CYS A 156 ? 13.38187 13.73048 -38.11393 1.000 42.52441 N ? A ? 156 1 ATOM 1207 CA . CYS A 156 ? 12.46805 13.65593 -39.24723 1.000 39.28950 C ? A ? 156 1 ATOM 1208 C . CYS A 156 ? 11.53279 12.46273 -39.09154 1.000 33.45742 C ? A ? 156 1 ATOM 1209 O . CYS A 156 ? 11.98932 11.32709 -38.91687 1.000 32.81331 O ? A ? 156 1 ATOM 1210 CB . CYS A 156 ? 13.23865 13.54666 -40.56454 1.000 39.04889 C ? A ? 156 1 ATOM 1211 SG . CYS A 156 ? 12.19663 13.59526 -42.04525 1.000 41.91284 S ? A ? 156 1 ATOM 1212 N . VAL A 157 ? 10.23040 12.72212 -39.17510 1.000 29.93000 N ? A ? 157 1 ATOM 1213 CA . VAL A 157 ? 9.20805 11.68123 -39.09313 1.000 25.31951 C ? A ? 157 1 ATOM 1214 C . VAL A 157 ? 8.83615 11.24516 -40.50815 1.000 27.21141 C ? A ? 157 1 ATOM 1215 O . VAL A 157 ? 8.35530 12.05356 -41.30898 1.000 27.76512 O ? A ? 157 1 ATOM 1216 CB . VAL A 157 ? 7.96713 12.17830 -38.33345 1.000 24.95743 C ? A ? 157 1 ATOM 1217 CG1 . VAL A 157 ? 6.96313 11.04152 -38.14502 1.000 23.52648 C ? A ? 157 1 ATOM 1218 CG2 . VAL A 157 ? 8.36007 12.78916 -36.99790 1.000 22.77392 C ? A ? 157 1 ATOM 1219 N . SER A 158 ? 9.05051 9.96604 -40.81704 1.000 27.06505 N ? A ? 158 1 ATOM 1220 CA . SER A 158 ? 8.62050 9.37182 -42.08443 1.000 29.63461 C ? A ? 158 1 ATOM 1221 C . SER A 158 ? 7.28737 8.66899 -41.85441 1.000 23.34101 C ? A ? 158 1 ATOM 1222 O . SER A 158 ? 7.24821 7.54722 -41.34406 1.000 24.47593 O ? A ? 158 1 ATOM 1223 CB . SER A 158 ? 9.65555 8.38871 -42.62317 1.000 25.65621 C ? A ? 158 1 ATOM 1224 OG . SER A 158 ? 10.75053 9.05071 -43.22427 1.000 42.19389 O ? A ? 158 1 ATOM 1225 N . PHE A 159 ? 6.19421 9.32653 -42.23384 1.000 24.57821 N ? A ? 159 1 ATOM 1226 CA . PHE A 159 ? 4.88235 8.69322 -42.19553 1.000 20.17857 C ? A ? 159 1 ATOM 1227 C . PHE A 159 ? 4.76959 7.68268 -43.32851 1.000 23.57207 C ? A ? 159 1 ATOM 1228 O . PHE A 159 ? 5.07530 8.00219 -44.48107 1.000 24.84700 O ? A ? 159 1 ATOM 1229 CB . PHE A 159 ? 3.77656 9.74095 -42.31307 1.000 24.00603 C ? A ? 159 1 ATOM 1230 CG . PHE A 159 ? 3.72088 10.69142 -41.15796 1.000 20.19468 C ? A ? 159 1 ATOM 1231 CD1 . PHE A 159 ? 3.08282 10.33081 -39.98224 1.000 25.31211 C ? A ? 159 1 ATOM 1232 CD2 . PHE A 159 ? 4.30583 11.94156 -41.24348 1.000 19.69581 C ? A ? 159 1 ATOM 1233 CE1 . PHE A 159 ? 3.02803 11.19955 -38.91213 1.000 24.67808 C ? A ? 159 1 ATOM 1234 CE2 . PHE A 159 ? 4.25604 12.81770 -40.17616 1.000 22.07122 C ? A ? 159 1 ATOM 1235 CZ . PHE A 159 ? 3.61597 12.44703 -39.00867 1.000 24.36791 C ? A ? 159 1 ATOM 1236 N . CYS A 160 ? 4.32183 6.46344 -43.00596 1.000 18.23953 N ? A ? 160 1 ATOM 1237 CA . CYS A 160 ? 4.21984 5.40963 -44.00719 1.000 21.34491 C ? A ? 160 1 ATOM 1238 C . CYS A 160 ? 2.87954 4.68694 -44.05530 1.000 22.06565 C ? A ? 160 1 ATOM 1239 O . CYS A 160 ? 2.65132 3.93658 -45.00945 1.000 20.44362 O ? A ? 160 1 ATOM 1240 CB . CYS A 160 ? 5.32477 4.36236 -43.79675 1.000 20.90510 C ? A ? 160 1 ATOM 1241 SG . CYS A 160 ? 5.29802 3.57502 -42.17146 1.000 22.11167 S ? A ? 160 1 ATOM 1242 N . TYR A 161 ? 1.99033 4.88262 -43.08444 1.000 18.46456 N ? A ? 161 1 ATOM 1243 CA . TYR A 161 ? 0.78069 4.07540 -43.00433 1.000 19.66194 C ? A ? 161 1 ATOM 1244 C . TYR A 161 ? -0.34914 4.89251 -42.39897 1.000 17.49057 C ? A ? 161 1 ATOM 1245 O . TYR A 161 ? -0.12406 5.68497 -41.48321 1.000 18.98562 O ? A ? 161 1 ATOM 1246 CB . TYR A 161 ? 1.02318 2.81516 -42.16122 1.000 16.08066 C ? A ? 161 1 ATOM 1247 CG . TYR A 161 ? -0.19297 1.92719 -41.96771 1.000 20.05120 C ? A ? 161 1 ATOM 1248 CD1 . TYR A 161 ? -0.57047 1.01634 -42.94208 1.000 23.25969 C ? A ? 161 1 ATOM 1249 CD2 . TYR A 161 ? -0.94686 1.98446 -40.80033 1.000 19.20767 C ? A ? 161 1 ATOM 1250 CE1 . TYR A 161 ? -1.67200 0.19553 -42.76849 1.000 20.60017 C ? A ? 161 1 ATOM 1251 CE2 . TYR A 161 ? -2.05109 1.16984 -40.61698 1.000 16.80652 C ? A ? 161 1 ATOM 1252 CZ . TYR A 161 ? -2.41005 0.27761 -41.60672 1.000 22.13187 C ? A ? 161 1 ATOM 1253 OH . TYR A 161 ? -3.50721 -0.54166 -41.43667 1.000 21.30943 O ? A ? 161 1 ATOM 1254 N . MET A 162 ? -1.56115 4.69135 -42.91415 1.000 21.44906 N ? A ? 162 1 ATOM 1255 CA . MET A 162 ? -2.77346 5.20609 -42.28800 1.000 22.42514 C ? A ? 162 1 ATOM 1256 C . MET A 162 ? -3.81310 4.09392 -42.27811 1.000 19.71100 C ? A ? 162 1 ATOM 1257 O . MET A 162 ? -4.06013 3.46359 -43.31141 1.000 18.89614 O ? A ? 162 1 ATOM 1258 CB . MET A 162 ? -3.29964 6.44871 -43.01812 1.000 20.22500 C ? A ? 162 1 ATOM 1259 CG . MET A 162 ? -4.64353 6.95725 -42.50665 1.000 23.71405 C ? A ? 162 1 ATOM 1260 SD . MET A 162 ? -5.10222 8.58209 -43.16462 1.000 24.77430 S ? A ? 162 1 ATOM 1261 CE . MET A 162 ? -4.15672 9.66994 -42.09297 1.000 16.39381 C ? A ? 162 1 ATOM 1262 N . HIS A 163 ? -4.40951 3.84551 -41.11329 1.000 19.43505 N ? A ? 163 1 ATOM 1263 CA . HIS A 163 ? -5.25937 2.67449 -40.93685 1.000 21.42797 C ? A ? 163 1 ATOM 1264 C . HIS A 163 ? -6.64102 2.87742 -41.55036 1.000 23.69389 C ? A ? 163 1 ATOM 1265 O . HIS A 163 ? -7.24791 3.94550 -41.41324 1.000 20.77721 O ? A ? 163 1 ATOM 1266 CB . HIS A 163 ? -5.41140 2.33761 -39.45659 1.000 19.56081 C ? A ? 163 1 ATOM 1267 CG . HIS A 163 ? -6.25570 1.12902 -39.21115 1.000 21.93989 C ? A ? 163 1 ATOM 1268 ND1 . HIS A 163 ? -5.91262 -0.12045 -39.68035 1.000 21.82017 N ? A ? 163 1 ATOM 1269 CD2 . HIS A 163 ? -7.43863 0.98002 -38.56965 1.000 22.67198 C ? A ? 163 1 ATOM 1270 CE1 . HIS A 163 ? -6.84117 -0.99036 -39.32546 1.000 24.70716 C ? A ? 163 1 ATOM 1271 NE2 . HIS A 163 ? -7.77843 -0.34834 -38.65094 1.000 25.15690 N ? A ? 163 1 ATOM 1272 N . HIS A 164 ? -7.15508 1.81701 -42.20525 1.000 20.17713 N ? A ? 164 1 ATOM 1273 CA . HIS A 164 ? -8.42476 1.86794 -42.92934 1.000 19.63545 C ? A ? 164 1 ATOM 1274 C . HIS A 164 ? -9.40454 0.75834 -42.56705 1.000 21.03182 C ? A ? 164 1 ATOM 1275 O . HIS A 164 ? -10.60490 1.02634 -42.47712 1.000 27.73063 O ? A ? 164 1 ATOM 1276 CB . HIS A 164 ? -8.18305 1.83593 -44.44391 1.000 16.12092 C ? A ? 164 1 ATOM 1277 CG . HIS A 164 ? -7.88322 3.17707 -45.03888 1.000 21.57710 C ? A ? 164 1 ATOM 1278 ND1 . HIS A 164 ? -6.68566 3.83061 -44.83802 1.000 21.63824 N ? A ? 164 1 ATOM 1279 CD2 . HIS A 164 ? -8.62252 3.98377 -45.83707 1.000 20.61517 C ? A ? 164 1 ATOM 1280 CE1 . HIS A 164 ? -6.70146 4.98272 -45.48491 1.000 20.34492 C ? A ? 164 1 ATOM 1281 NE2 . HIS A 164 ? -7.86544 5.09999 -46.09889 1.000 30.94622 N ? A ? 164 1 ATOM 1282 N . MET A 165 ? -8.94680 -0.48122 -42.38987 1.000 21.27868 N ? A ? 165 1 ATOM 1283 CA . MET A 165 ? -9.90552 -1.57246 -42.25813 1.000 21.78748 C ? A ? 165 1 ATOM 1284 C . MET A 165 ? -9.25822 -2.79267 -41.61772 1.000 24.54176 C ? A ? 165 1 ATOM 1285 O . MET A 165 ? -8.03412 -2.89918 -41.51111 1.000 23.21047 O ? A ? 165 1 ATOM 1286 CB . MET A 165 ? -10.49567 -1.94643 -43.61786 1.000 21.51015 C ? A ? 165 1 ATOM 1287 CG . MET A 165 ? -9.47933 -2.51941 -44.57096 1.000 22.93964 C ? A ? 165 1 ATOM 1288 SD . MET A 165 ? -10.16300 -2.77635 -46.21467 1.000 42.55245 S ? A ? 165 1 ATOM 1289 CE . MET A 165 ? -9.14213 -4.13386 -46.74482 1.000 38.55532 C ? A ? 165 1 ATOM 1290 N . VAL A 166 ? -10.11746 -3.71862 -41.19391 1.000 26.11987 N ? A ? 166 1 ATOM 1291 CA . VAL A 166 ? -9.71715 -5.01866 -40.67191 1.000 21.24594 C ? A ? 166 1 ATOM 1292 C . VAL A 166 ? -10.20826 -6.08458 -41.64302 1.000 23.27232 C ? A ? 166 1 ATOM 1293 O . VAL A 166 ? -11.26185 -5.92853 -42.27094 1.000 25.22482 O ? A ? 166 1 ATOM 1294 CB . VAL A 166 ? -10.26866 -5.24633 -39.24864 1.000 22.91920 C ? A ? 166 1 ATOM 1295 CG1 . VAL A 166 ? -11.79402 -5.16516 -39.23439 1.000 24.34791 C ? A ? 166 1 ATOM 1296 CG2 . VAL A 166 ? -9.77876 -6.57291 -38.67412 1.000 20.16302 C ? A ? 166 1 ATOM 1297 N . LEU A 167 ? -9.43612 -7.14937 -41.78446 1.000 24.03885 N ? A ? 167 1 ATOM 1298 CA . LEU A 167 ? -9.70572 -8.21119 -42.74075 1.000 25.24160 C ? A ? 167 1 ATOM 1299 C . LEU A 167 ? -10.34512 -9.40841 -42.05510 1.000 25.77782 C ? A ? 167 1 ATOM 1300 O . LEU A 167 ? -10.31065 -9.52135 -40.82609 1.000 29.64678 O ? A ? 167 1 ATOM 1301 CB . LEU A 167 ? -8.40681 -8.63330 -43.43487 1.000 23.56556 C ? A ? 167 1 ATOM 1302 CG . LEU A 167 ? -7.87783 -7.60133 -44.42564 1.000 30.15245 C ? A ? 167 1 ATOM 1303 CD1 . LEU A 167 ? -6.55260 -8.06059 -44.99204 1.000 31.07574 C ? A ? 167 1 ATOM 1304 CD2 . LEU A 167 ? -8.89487 -7.37751 -45.53208 1.000 35.13928 C ? A ? 167 1 ATOM 1305 N . PRO A 168 ? -10.95852 -10.32165 -42.82017 1.000 29.25558 N ? A ? 168 1 ATOM 1306 CA . PRO A 168 ? -11.62719 -11.47164 -42.18525 1.000 35.02440 C ? A ? 168 1 ATOM 1307 C . PRO A 168 ? -10.71633 -12.31034 -41.30485 1.000 36.07280 C ? A ? 168 1 ATOM 1308 O . PRO A 168 ? -11.20047 -12.94604 -40.36024 1.000 39.38994 O ? A ? 168 1 ATOM 1309 CB . PRO A 168 ? -12.14690 -12.27487 -43.38503 1.000 35.19699 C ? A ? 168 1 ATOM 1310 CG . PRO A 168 ? -12.34500 -11.25723 -44.45261 1.000 27.98198 C ? A ? 168 1 ATOM 1311 CD . PRO A 168 ? -11.21588 -10.27898 -44.27354 1.000 25.83927 C ? A ? 168 1 ATOM 1312 N . THR A 169 ? -9.41441 -12.32945 -41.57476 1.000 27.50244 N ? A ? 169 1 ATOM 1313 CA . THR A 169 ? -8.48702 -13.10318 -40.76091 1.000 33.36116 C ? A ? 169 1 ATOM 1314 C . THR A 169 ? -8.06957 -12.38195 -39.48539 1.000 34.36228 C ? A ? 169 1 ATOM 1315 O . THR A 169 ? -7.28769 -12.93711 -38.70785 1.000 30.40536 O ? A ? 169 1 ATOM 1316 CB . THR A 169 ? -7.24549 -13.46267 -41.58222 1.000 33.48010 C ? A ? 169 1 ATOM 1317 OG1 . THR A 169 ? -6.70542 -12.27778 -42.17936 1.000 27.23731 O ? A ? 169 1 ATOM 1318 CG2 . THR A 169 ? -7.60471 -14.45449 -42.67873 1.000 23.70032 C ? A ? 169 1 ATOM 1319 N . GLY A 170 ? -8.57006 -11.17139 -39.24524 1.000 30.47589 N ? A ? 170 1 ATOM 1320 CA . GLY A 170 ? -8.17773 -10.39478 -38.09139 1.000 24.75677 C ? A ? 170 1 ATOM 1321 C . GLY A 170 ? -7.01319 -9.45476 -38.31776 1.000 27.71710 C ? A ? 170 1 ATOM 1322 O . GLY A 170 ? -6.74037 -8.61395 -37.45277 1.000 32.17228 O ? A ? 170 1 ATOM 1323 N . VAL A 171 ? -6.31436 -9.56821 -39.44520 1.000 25.90286 N ? A ? 171 1 ATOM 1324 CA . VAL A 171 ? -5.20959 -8.66852 -39.75573 1.000 25.01809 C ? A ? 171 1 ATOM 1325 C . VAL A 171 ? -5.77766 -7.35938 -40.29019 1.000 23.73567 C ? A ? 171 1 ATOM 1326 O . VAL A 171 ? -6.97553 -7.26188 -40.58230 1.000 22.17468 O ? A ? 171 1 ATOM 1327 CB . VAL A 171 ? -4.22892 -9.31160 -40.75383 1.000 20.64590 C ? A ? 171 1 ATOM 1328 CG1 . VAL A 171 ? -3.61039 -10.56944 -40.15169 1.000 23.97419 C ? A ? 171 1 ATOM 1329 CG2 . VAL A 171 ? -4.93518 -9.63211 -42.06168 1.000 21.94173 C ? A ? 171 1 ATOM 1330 N . HIS A 172 ? -4.92837 -6.34517 -40.42193 1.000 22.97593 N ? A ? 172 1 ATOM 1331 CA . HIS A 172 ? -5.37490 -5.00741 -40.77532 1.000 25.87140 C ? A ? 172 1 ATOM 1332 C . HIS A 172 ? -4.71418 -4.54813 -42.06751 1.000 21.07587 C ? A ? 172 1 ATOM 1333 O . HIS A 172 ? -3.64218 -5.03047 -42.44671 1.000 21.19900 O ? A ? 172 1 ATOM 1334 CB . HIS A 172 ? -5.08035 -4.01906 -39.63727 1.000 20.23496 C ? A ? 172 1 ATOM 1335 CG . HIS A 172 ? -5.67960 -4.42660 -38.32759 1.000 25.64330 C ? A ? 172 1 ATOM 1336 ND1 . HIS A 172 ? -4.95953 -5.07465 -37.34764 1.000 16.38629 N ? A ? 172 1 ATOM 1337 CD2 . HIS A 172 ? -6.94054 -4.30661 -37.84997 1.000 23.67104 C ? A ? 172 1 ATOM 1338 CE1 . HIS A 172 ? -5.74750 -5.32482 -36.31749 1.000 22.69426 C ? A ? 172 1 ATOM 1339 NE2 . HIS A 172 ? -6.95504 -4.86994 -36.59697 1.000 24.11400 N ? A ? 172 1 ATOM 1340 N . ALA A 173 ? -5.37615 -3.60478 -42.74143 1.000 17.54702 N ? A ? 173 1 ATOM 1341 CA . ALA A 173 ? -4.90545 -3.07143 -44.01157 1.000 16.89995 C ? A ? 173 1 ATOM 1342 C . ALA A 173 ? -5.08993 -1.56060 -44.02940 1.000 22.58257 C ? A ? 173 1 ATOM 1343 O . ALA A 173 ? -5.96515 -1.01157 -43.35416 1.000 20.74210 O ? A ? 173 1 ATOM 1344 CB . ALA A 173 ? -5.64203 -3.70602 -45.19742 1.000 18.17559 C ? A ? 173 1 ATOM 1345 N . GLY A 174 ? -4.25740 -0.89357 -44.81803 1.000 22.24864 N ? A ? 174 1 ATOM 1346 CA . GLY A 174 ? -4.31885 0.55018 -44.88569 1.000 18.82990 C ? A ? 174 1 ATOM 1347 C . GLY A 174 ? -3.56165 1.07404 -46.08241 1.000 18.01045 C ? A ? 174 1 ATOM 1348 O . GLY A 174 ? -3.16638 0.32090 -46.97267 1.000 21.14391 O ? A ? 174 1 ATOM 1349 N . THR A 175 ? -3.36174 2.38608 -46.09036 1.000 18.38663 N ? A ? 175 1 ATOM 1350 CA . THR A 175 ? -2.74033 3.07033 -47.21046 1.000 16.90623 C ? A ? 175 1 ATOM 1351 C . THR A 175 ? -1.46505 3.76653 -46.75858 1.000 19.24387 C ? A ? 175 1 ATOM 1352 O . THR A 175 ? -1.18069 3.88918 -45.56456 1.000 24.40843 O ? A ? 175 1 ATOM 1353 CB . THR A 175 ? -3.69511 4.10124 -47.83286 1.000 16.24666 C ? A ? 175 1 ATOM 1354 OG1 . THR A 175 ? -3.91851 5.17365 -46.90892 1.000 20.14824 O ? A ? 175 1 ATOM 1355 CG2 . THR A 175 ? -5.02311 3.46613 -48.17454 1.000 16.24258 C ? A ? 175 1 ATOM 1356 N . ASP A 176 ? -0.68778 4.22139 -47.73780 1.000 21.69894 N ? A ? 176 1 ATOM 1357 CA . ASP A 176 ? 0.32726 5.22159 -47.45773 1.000 25.30762 C ? A ? 176 1 ATOM 1358 C . ASP A 176 ? -0.35236 6.58217 -47.30664 1.000 23.13354 C ? A ? 176 1 ATOM 1359 O . ASP A 176 ? -1.57792 6.70869 -47.38249 1.000 23.64108 O ? A ? 176 1 ATOM 1360 CB . ASP A 176 ? 1.40087 5.22496 -48.54935 1.000 23.86383 C ? A ? 176 1 ATOM 1361 CG . ASP A 176 ? 0.84295 5.50462 -49.94761 1.000 34.83155 C ? A ? 176 1 ATOM 1362 OD1 . ASP A 176 ? -0.16726 6.23125 -50.08142 1.000 23.16727 O ? A ? 176 1 ATOM 1363 OD2 . ASP A 176 ? 1.43462 4.98994 -50.92453 1.000 31.20821 O ? A ? 176 1 ATOM 1364 N . LEU A 177 ? 0.44553 7.62113 -47.10820 1.000 21.38469 N ? A ? 177 1 ATOM 1365 CA . LEU A 177 ? -0.13708 8.93429 -46.87050 1.000 23.73068 C ? A ? 177 1 ATOM 1366 C . LEU A 177 ? -0.52481 9.65302 -48.15700 1.000 24.30865 C ? A ? 177 1 ATOM 1367 O . LEU A 177 ? -0.96525 10.80532 -48.09585 1.000 24.86619 O ? A ? 177 1 ATOM 1368 CB . LEU A 177 ? 0.82084 9.79141 -46.03923 1.000 23.03208 C ? A ? 177 1 ATOM 1369 CG . LEU A 177 ? 0.55211 9.73069 -44.53189 1.000 20.60645 C ? A ? 177 1 ATOM 1370 CD1 . LEU A 177 ? -0.82657 10.28615 -44.23404 1.000 20.40655 C ? A ? 177 1 ATOM 1371 CD2 . LEU A 177 ? 0.67887 8.31234 -43.98515 1.000 24.36751 C ? A ? 177 1 ATOM 1372 N . GLU A 178 ? -0.38093 9.00447 -49.31104 1.000 23.65373 N ? A ? 178 1 ATOM 1373 CA . GLU A 178 ? -0.92209 9.50333 -50.56672 1.000 25.66794 C ? A ? 178 1 ATOM 1374 C . GLU A 178 ? -2.20654 8.79232 -50.97111 1.000 24.17791 C ? A ? 178 1 ATOM 1375 O . GLU A 178 ? -2.70919 9.02810 -52.07411 1.000 27.51814 O ? A ? 178 1 ATOM 1376 CB . GLU A 178 ? 0.11496 9.37498 -51.67947 1.000 23.88643 C ? A ? 178 1 ATOM 1377 CG . GLU A 178 ? 1.34828 10.20909 -51.43146 1.000 35.25501 C ? A ? 178 1 ATOM 1378 CD . GLU A 178 ? 2.10383 10.50307 -52.69970 1.000 56.07715 C ? A ? 178 1 ATOM 1379 OE1 . GLU A 178 ? 1.53620 10.27929 -53.79167 1.000 61.85522 O ? A ? 178 1 ATOM 1380 OE2 . GLU A 178 ? 3.26226 10.95918 -52.60421 1.000 64.77881 O ? A ? 178 1 ATOM 1381 N . GLY A 179 ? -2.74420 7.92915 -50.10699 1.000 20.73367 N ? A ? 179 1 ATOM 1382 CA . GLY A 179 ? -3.99572 7.24732 -50.36052 1.000 23.42865 C ? A ? 179 1 ATOM 1383 C . GLY A 179 ? -3.89083 5.92663 -51.09168 1.000 23.87544 C ? A ? 179 1 ATOM 1384 O . GLY A 179 ? -4.92833 5.31610 -51.37975 1.000 25.58878 O ? A ? 179 1 ATOM 1385 N . ASN A 180 ? -2.68417 5.46604 -51.41063 1.000 24.76435 N ? A ? 180 1 ATOM 1386 CA . ASN A 180 ? -2.51778 4.19336 -52.10199 1.000 24.34005 C ? A ? 180 1 ATOM 1387 C . ASN A 180 ? -2.52035 3.05832 -51.08789 1.000 23.42178 C ? A ? 180 1 ATOM 1388 O . ASN A 180 ? -1.66398 3.01391 -50.20000 1.000 24.46671 O ? A ? 180 1 ATOM 1389 CB . ASN A 180 ? -1.22122 4.17978 -52.90713 1.000 26.63244 C ? A ? 180 1 ATOM 1390 CG . ASN A 180 ? -1.16421 5.28597 -53.93732 1.000 28.20494 C ? A ? 180 1 ATOM 1391 OD1 . ASN A 180 ? -1.96444 5.32048 -54.87104 1.000 26.42504 O ? A ? 180 1 ATOM 1392 ND2 . ASN A 180 ? -0.20702 6.19508 -53.77744 1.000 28.75747 N ? A ? 180 1 ATOM 1393 N . PHE A 181 ? -3.47665 2.14382 -51.21962 1.000 21.92666 N ? A ? 181 1 ATOM 1394 CA . PHE A 181 ? -3.51323 0.98435 -50.34110 1.000 24.51380 C ? A ? 181 1 ATOM 1395 C . PHE A 181 ? -2.23730 0.16758 -50.48226 1.000 22.69690 C ? A ? 181 1 ATOM 1396 O . PHE A 181 ? -1.66182 0.06062 -51.56954 1.000 24.87414 O ? A ? 181 1 ATOM 1397 CB . PHE A 181 ? -4.72712 0.10610 -50.65528 1.000 20.09532 C ? A ? 181 1 ATOM 1398 CG . PHE A 181 ? -5.88543 0.30753 -49.71526 1.000 21.15681 C ? A ? 181 1 ATOM 1399 CD1 . PHE A 181 ? -5.94370 -0.37394 -48.50732 1.000 20.12250 C ? A ? 181 1 ATOM 1400 CD2 . PHE A 181 ? -6.92161 1.17245 -50.04301 1.000 19.46665 C ? A ? 181 1 ATOM 1401 CE1 . PHE A 181 ? -7.01218 -0.19159 -47.63770 1.000 23.40052 C ? A ? 181 1 ATOM 1402 CE2 . PHE A 181 ? -7.99225 1.36277 -49.17681 1.000 23.37380 C ? A ? 181 1 ATOM 1403 CZ . PHE A 181 ? -8.03657 0.67989 -47.97338 1.000 20.33131 C ? A ? 181 1 ATOM 1404 N . TYR A 182 ? -1.77526 -0.37627 -49.36071 1.000 21.92415 N ? A ? 182 1 ATOM 1405 CA . TYR A 182 ? -0.81390 -1.46819 -49.38563 1.000 22.70535 C ? A ? 182 1 ATOM 1406 C . TYR A 182 ? -1.58284 -2.75044 -49.67558 1.000 21.46267 C ? A ? 182 1 ATOM 1407 O . TYR A 182 ? -2.47897 -3.12048 -48.91178 1.000 24.88528 O ? A ? 182 1 ATOM 1408 CB . TYR A 182 ? -0.06861 -1.57244 -48.05557 1.000 23.12379 C ? A ? 182 1 ATOM 1409 CG . TYR A 182 ? 0.91040 -0.45221 -47.78180 1.000 20.43419 C ? A ? 182 1 ATOM 1410 CD1 . TYR A 182 ? 2.19316 -0.47824 -48.31676 1.000 20.80450 C ? A ? 182 1 ATOM 1411 CD2 . TYR A 182 ? 0.55776 0.62236 -46.97221 1.000 22.39086 C ? A ? 182 1 ATOM 1412 CE1 . TYR A 182 ? 3.09343 0.53885 -48.06332 1.000 23.10657 C ? A ? 182 1 ATOM 1413 CE2 . TYR A 182 ? 1.44996 1.64363 -46.71217 1.000 15.83118 C ? A ? 182 1 ATOM 1414 CZ . TYR A 182 ? 2.71729 1.59800 -47.26049 1.000 27.91546 C ? A ? 182 1 ATOM 1415 OH . TYR A 182 ? 3.61191 2.61468 -47.00563 1.000 23.34643 O ? A ? 182 1 ATOM 1416 N . GLY A 183 ? -1.26889 -3.40575 -50.78864 1.000 19.41051 N ? A ? 183 1 ATOM 1417 CA . GLY A 183 ? -1.93618 -4.63505 -51.15147 1.000 21.05982 C ? A ? 183 1 ATOM 1418 C . GLY A 183 ? -3.04409 -4.43359 -52.16561 1.000 24.96275 C ? A ? 183 1 ATOM 1419 O . GLY A 183 ? -3.18335 -3.35946 -52.75902 1.000 27.04828 O ? A ? 183 1 ATOM 1420 N . PRO A 184 ? -3.86158 -5.48128 -52.38865 1.000 28.44231 N ? A ? 184 1 ATOM 1421 CA . PRO A 184 ? -4.92911 -5.39375 -53.39640 1.000 26.03201 C ? A ? 184 1 ATOM 1422 C . PRO A 184 ? -6.24621 -4.88491 -52.83426 1.000 26.01196 C ? A ? 184 1 ATOM 1423 O . PRO A 184 ? -7.30074 -5.06623 -53.44743 1.000 31.84862 O ? A ? 184 1 ATOM 1424 CB . PRO A 184 ? -5.07281 -6.84583 -53.85595 1.000 26.47528 C ? A ? 184 1 ATOM 1425 CG . PRO A 184 ? -4.82973 -7.61537 -52.58783 1.000 27.78270 C ? A ? 184 1 ATOM 1426 CD . PRO A 184 ? -3.75069 -6.84597 -51.83708 1.000 20.20601 C ? A ? 184 1 ATOM 1427 N . PHE A 185 ? -6.20190 -4.25015 -51.67382 1.000 26.61115 N ? A ? 185 1 ATOM 1428 CA . PHE A 185 ? -7.40152 -3.95805 -50.90837 1.000 22.20363 C ? A ? 185 1 ATOM 1429 C . PHE A 185 ? -8.07682 -2.68144 -51.39697 1.000 27.69171 C ? A ? 185 1 ATOM 1430 O . PHE A 185 ? -7.41881 -1.74226 -51.85918 1.000 17.92738 O ? A ? 185 1 ATOM 1431 CB . PHE A 185 ? -7.04046 -3.85022 -49.42920 1.000 24.80907 C ? A ? 185 1 ATOM 1432 CG . PHE A 185 ? -6.26106 -5.03010 -48.92676 1.000 27.65035 C ? A ? 185 1 ATOM 1433 CD1 . PHE A 185 ? -6.86385 -6.27238 -48.82094 1.000 26.35752 C ? A ? 185 1 ATOM 1434 CD2 . PHE A 185 ? -4.92346 -4.91141 -48.59673 1.000 22.44277 C ? A ? 185 1 ATOM 1435 CE1 . PHE A 185 ? -6.15177 -7.37281 -48.38006 1.000 23.14998 C ? A ? 185 1 ATOM 1436 CE2 . PHE A 185 ? -4.20525 -6.00894 -48.15016 1.000 27.27432 C ? A ? 185 1 ATOM 1437 CZ . PHE A 185 ? -4.82178 -7.24011 -48.04186 1.000 21.04699 C ? A ? 185 1 ATOM 1438 N . VAL A 186 ? -9.41092 -2.66566 -51.30074 1.000 23.97179 N ? A ? 186 1 ATOM 1439 CA . VAL A 186 ? -10.22738 -1.51518 -51.67243 1.000 23.75951 C ? A ? 186 1 ATOM 1440 C . VAL A 186 ? -11.08415 -1.12036 -50.47853 1.000 23.08902 C ? A ? 186 1 ATOM 1441 O . VAL A 186 ? -11.44818 -1.96131 -49.64914 1.000 25.43814 O ? A ? 186 1 ATOM 1442 CB . VAL A 186 ? -11.11432 -1.79681 -52.90516 1.000 22.12807 C ? A ? 186 1 ATOM 1443 CG1 . VAL A 186 ? -10.25153 -2.12753 -54.11112 1.000 28.50502 C ? A ? 186 1 ATOM 1444 CG2 . VAL A 186 ? -12.09804 -2.92634 -52.61105 1.000 21.20086 C ? A ? 186 1 ATOM 1445 N . ASP A 187 ? -11.40537 0.17358 -50.39007 1.000 22.67117 N ? A ? 187 1 ATOM 1446 CA . ASP A 187 ? -12.20088 0.68311 -49.26961 1.000 17.92603 C ? A ? 187 1 ATOM 1447 C . ASP A 187 ? -13.68838 0.56155 -49.60587 1.000 25.18221 C ? A ? 187 1 ATOM 1448 O . ASP A 187 ? -14.41284 1.53353 -49.82804 1.000 23.37451 O ? A ? 187 1 ATOM 1449 CB . ASP A 187 ? -11.78953 2.10810 -48.89987 1.000 19.95748 C ? A ? 187 1 ATOM 1450 CG . ASP A 187 ? -11.80309 3.07301 -50.07486 1.000 26.42002 C ? A ? 187 1 ATOM 1451 OD1 . ASP A 187 ? -12.02240 2.64316 -51.22910 1.000 31.36985 O ? A ? 187 1 ATOM 1452 OD2 . ASP A 187 ? -11.58360 4.27918 -49.82851 1.000 23.47250 O ? A ? 187 1 ATOM 1453 N . ARG A 188 ? -14.13038 -0.69287 -49.62182 1.000 25.52575 N ? A ? 188 1 ATOM 1454 CA . ARG A 188 ? -15.50759 -1.07989 -49.87638 1.000 26.03680 C ? A ? 188 1 ATOM 1455 C . ARG A 188 ? -15.87498 -2.18963 -48.90207 1.000 32.40636 C ? A ? 188 1 ATOM 1456 O . ARG A 188 ? -15.07822 -3.10404 -48.67068 1.000 27.09988 O ? A ? 188 1 ATOM 1457 CB . ARG A 188 ? -15.68585 -1.55749 -51.31963 1.000 28.25780 C ? A ? 188 1 ATOM 1458 CG . ARG A 188 ? -16.99040 -2.27405 -51.56664 1.000 39.57415 C ? A ? 188 1 ATOM 1459 CD . ARG A 188 ? -17.16529 -2.58885 -53.03245 1.000 37.70782 C ? A ? 188 1 ATOM 1460 NE . ARG A 188 ? -16.84984 -3.97599 -53.34722 1.000 43.51307 N ? A ? 188 1 ATOM 1461 CZ . ARG A 188 ? -17.67592 -4.99344 -53.14384 1.000 46.07163 C ? A ? 188 1 ATOM 1462 NH1 . ARG A 188 ? -18.85334 -4.82188 -52.56353 1.000 52.18122 N ? A ? 188 1 ATOM 1463 NH2 . ARG A 188 ? -17.31482 -6.21233 -53.53783 1.000 51.06479 N ? A ? 188 1 ATOM 1464 N . GLN A 189 ? -17.07674 -2.10951 -48.33188 1.000 26.32841 N ? A ? 189 1 ATOM 1465 CA . GLN A 189 ? -17.48725 -3.06577 -47.31205 1.000 23.76034 C ? A ? 189 1 ATOM 1466 C . GLN A 189 ? -17.75362 -4.44673 -47.89981 1.000 28.67415 C ? A ? 189 1 ATOM 1467 O . GLN A 189 ? -18.86538 -4.72851 -48.36232 1.000 25.63184 O ? A ? 189 1 ATOM 1468 CB . GLN A 189 ? -18.72534 -2.54953 -46.58189 1.000 27.81279 C ? A ? 189 1 ATOM 1469 CG . GLN A 189 ? -19.17681 -3.42223 -45.43145 1.000 30.04922 C ? A ? 189 1 ATOM 1470 CD . GLN A 189 ? -20.32512 -2.80289 -44.66983 1.000 33.06057 C ? A ? 189 1 ATOM 1471 OE1 . GLN A 189 ? -20.19951 -1.70601 -44.12831 1.000 44.57743 O ? A ? 189 1 ATOM 1472 NE2 . GLN A 189 ? -21.46085 -3.49078 -44.64119 1.000 33.88149 N ? A ? 189 1 ATOM 1473 N . THR A 190 ? -16.74018 -5.31213 -47.86952 1.000 25.91906 N ? A ? 190 1 ATOM 1474 CA . THR A 190 ? -16.86701 -6.69224 -48.32059 1.000 26.10606 C ? A ? 190 1 ATOM 1475 C . THR A 190 ? -15.68695 -7.48748 -47.78145 1.000 28.98922 C ? A ? 190 1 ATOM 1476 O . THR A 190 ? -14.62769 -6.93066 -47.48372 1.000 27.95750 O ? A ? 190 1 ATOM 1477 CB . THR A 190 ? -16.92552 -6.78708 -49.85048 1.000 30.27052 C ? A ? 190 1 ATOM 1478 OG1 . THR A 190 ? -17.09649 -8.15501 -50.24333 1.000 33.96358 O ? A ? 190 1 ATOM 1479 CG2 . THR A 190 ? -15.64169 -6.23893 -50.46386 1.000 30.99571 C ? A ? 190 1 ATOM 1480 N . ALA A 191 ? -15.88349 -8.79884 -47.65507 1.000 34.73478 N ? A ? 191 1 ATOM 1481 CA . ALA A 191 ? -14.79985 -9.67578 -47.22605 1.000 33.63549 C ? A ? 191 1 ATOM 1482 C . ALA A 191 ? -13.74392 -9.76774 -48.32142 1.000 34.95146 C ? A ? 191 1 ATOM 1483 O . ALA A 191 ? -14.06013 -10.07243 -49.47498 1.000 35.61138 O ? A ? 191 1 ATOM 1484 CB . ALA A 191 ? -15.33756 -11.06608 -46.88536 1.000 27.08662 C ? A ? 191 1 ATOM 1485 N . GLN A 192 ? -12.48677 -9.50346 -47.96605 1.000 28.03723 N ? A ? 192 1 ATOM 1486 CA . GLN A 192 ? -11.41326 -9.41819 -48.94848 1.000 28.21870 C ? A ? 192 1 ATOM 1487 C . GLN A 192 ? -10.26302 -10.32863 -48.55172 1.000 21.51931 C ? A ? 192 1 ATOM 1488 O . GLN A 192 ? -9.80999 -10.30127 -47.40355 1.000 30.20034 O ? A ? 192 1 ATOM 1489 CB . GLN A 192 ? -10.92674 -7.97274 -49.09734 1.000 21.04109 C ? A ? 192 1 ATOM 1490 CG . GLN A 192 ? -12.01710 -7.02275 -49.56517 1.000 22.01636 C ? A ? 192 1 ATOM 1491 CD . GLN A 192 ? -11.58052 -5.57260 -49.55877 1.000 24.92039 C ? A ? 192 1 ATOM 1492 OE1 . GLN A 192 ? -10.46258 -5.24568 -49.95406 1.000 25.35031 O ? A ? 192 1 ATOM 1493 NE2 . GLN A 192 ? -12.46437 -4.69343 -49.10288 1.000 24.60059 N ? A ? 192 1 ATOM 1494 N . ALA A 193 ? -9.78675 -11.11598 -49.51190 1.000 27.77535 N ? A ? 193 1 ATOM 1495 CA . ALA A 193 ? -8.70245 -12.05683 -49.27259 1.000 29.75029 C ? A ? 193 1 ATOM 1496 C . ALA A 193 ? -7.37063 -11.32121 -49.21106 1.000 34.89289 C ? A ? 193 1 ATOM 1497 O . ALA A 193 ? -7.08960 -10.45430 -50.04508 1.000 36.37029 O ? A ? 193 1 ATOM 1498 CB . ALA A 193 ? -8.66645 -13.12138 -50.36891 1.000 26.18502 C ? A ? 193 1 ATOM 1499 N . ALA A 194 ? -6.55002 -11.67187 -48.22049 1.000 32.42333 N ? A ? 194 1 ATOM 1500 CA . ALA A 194 ? -5.24304 -11.05251 -48.04862 1.000 31.38800 C ? A ? 194 1 ATOM 1501 C . ALA A 194 ? -4.13131 -11.77693 -48.79342 1.000 29.32761 C ? A ? 194 1 ATOM 1502 O . ALA A 194 ? -3.07416 -11.18184 -49.03017 1.000 33.89323 O ? A ? 194 1 ATOM 1503 CB . ALA A 194 ? -4.88598 -10.98190 -46.56151 1.000 33.51117 C ? A ? 194 1 ATOM 1504 N . GLY A 195 ? -4.33629 -13.03517 -49.15969 1.000 34.07148 N ? A ? 195 1 ATOM 1505 CA . GLY A 195 ? -3.30576 -13.80955 -49.81392 1.000 30.41114 C ? A ? 195 1 ATOM 1506 C . GLY A 195 ? -2.36846 -14.47999 -48.82340 1.000 37.22287 C ? A ? 195 1 ATOM 1507 O . GLY A 195 ? -2.29450 -14.12689 -47.64587 1.000 32.42706 O ? A ? 195 1 ATOM 1508 N . THR A 196 ? -1.63987 -15.47382 -49.33141 1.000 28.45401 N ? A ? 196 1 ATOM 1509 CA . THR A 196 ? -0.71272 -16.24525 -48.51049 1.000 29.93435 C ? A ? 196 1 ATOM 1510 C . THR A 196 ? 0.36835 -15.35099 -47.91282 1.000 33.10414 C ? A ? 196 1 ATOM 1511 O . THR A 196 ? 1.01416 -14.57227 -48.62136 1.000 30.52798 O ? A ? 196 1 ATOM 1512 CB . THR A 196 ? -0.07469 -17.35544 -49.34835 1.000 30.02211 C ? A ? 196 1 ATOM 1513 OG1 . THR A 196 ? -1.05617 -18.35936 -49.63260 1.000 47.02438 O ? A ? 196 1 ATOM 1514 CG2 . THR A 196 ? 1.09620 -17.98939 -48.61152 1.000 36.68912 C ? A ? 196 1 ATOM 1515 N . ASP A 197 ? 0.55870 -15.46130 -46.60039 1.000 30.90291 N ? A ? 197 1 ATOM 1516 CA . ASP A 197 ? 1.56758 -14.69213 -45.88431 1.000 32.22072 C ? A ? 197 1 ATOM 1517 C . ASP A 197 ? 2.80292 -15.55760 -45.68217 1.000 33.07386 C ? A ? 197 1 ATOM 1518 O . ASP A 197 ? 2.71372 -16.64917 -45.11081 1.000 46.75766 O ? A ? 197 1 ATOM 1519 CB . ASP A 197 ? 1.03350 -14.20903 -44.53867 1.000 30.29654 C ? A ? 197 1 ATOM 1520 CG . ASP A 197 ? 1.94070 -13.17709 -43.88779 1.000 44.46208 C ? A ? 197 1 ATOM 1521 OD1 . ASP A 197 ? 2.80794 -12.60238 -44.59169 1.000 36.73458 O ? A ? 197 1 ATOM 1522 OD2 . ASP A 197 ? 1.78437 -12.94033 -42.66963 1.000 37.73089 O ? A ? 197 1 ATOM 1523 N . THR A 198 ? 3.94599 -15.07506 -46.15165 1.000 37.83041 N ? A ? 198 1 ATOM 1524 CA . THR A 198 ? 5.20733 -15.77690 -45.99031 1.000 42.21093 C ? A ? 198 1 ATOM 1525 C . THR A 198 ? 6.03654 -15.10833 -44.90193 1.000 32.29110 C ? A ? 198 1 ATOM 1526 O . THR A 198 ? 5.93720 -13.89982 -44.67207 1.000 40.49010 O ? A ? 198 1 ATOM 1527 CB . THR A 198 ? 5.99694 -15.81319 -47.30393 1.000 45.44944 C ? A ? 198 1 ATOM 1528 OG1 . THR A 198 ? 6.59393 -14.53336 -47.54500 1.000 46.92787 O ? A ? 198 1 ATOM 1529 CG2 . THR A 198 ? 5.07676 -16.15624 -48.46051 1.000 40.16179 C ? A ? 198 1 ATOM 1530 N . THR A 199 ? 6.85061 -15.91194 -44.22659 1.000 33.79087 N ? A ? 199 1 ATOM 1531 CA . THR A 199 ? 7.70963 -15.39088 -43.17413 1.000 31.95758 C ? A ? 199 1 ATOM 1532 C . THR A 199 ? 8.86389 -14.60392 -43.78473 1.000 28.77348 C ? A ? 199 1 ATOM 1533 O . THR A 199 ? 9.50575 -15.06152 -44.73642 1.000 25.66284 O ? A ? 199 1 ATOM 1534 CB . THR A 199 ? 8.23654 -16.53757 -42.31161 1.000 36.92188 C ? A ? 199 1 ATOM 1535 OG1 . THR A 199 ? 7.13520 -17.32323 -41.83951 1.000 36.92900 O ? A ? 199 1 ATOM 1536 CG2 . THR A 199 ? 9.00031 -16.00287 -41.11863 1.000 35.24942 C ? A ? 199 1 ATOM 1537 N . ILE A 200 ? 9.11352 -13.40745 -43.24883 1.000 27.90700 N ? A ? 200 1 ATOM 1538 CA . ILE A 200 ? 10.21971 -12.57028 -43.70318 1.000 22.72210 C ? A ? 200 1 ATOM 1539 C . ILE A 200 ? 11.52077 -13.17538 -43.20206 1.000 20.02454 C ? A ? 200 1 ATOM 1540 O . ILE A 200 ? 11.91273 -12.95831 -42.05133 1.000 27.48633 O ? A ? 200 1 ATOM 1541 CB . ILE A 200 ? 10.07384 -11.11648 -43.21907 1.000 27.11736 C ? A ? 200 1 ATOM 1542 CG1 . ILE A 200 ? 8.66645 -10.59514 -43.50838 1.000 25.03213 C ? A ? 200 1 ATOM 1543 CG2 . ILE A 200 ? 11.11761 -10.22817 -43.89077 1.000 17.04574 C ? A ? 200 1 ATOM 1544 CD1 . ILE A 200 ? 8.35741 -10.49129 -44.98373 1.000 33.06498 C ? A ? 200 1 ATOM 1545 N . THR A 201 ? 12.19813 -13.92932 -44.06783 1.000 21.39669 N ? A ? 201 1 ATOM 1546 CA . THR A 201 ? 13.38923 -14.66430 -43.65808 1.000 20.62351 C ? A ? 201 1 ATOM 1547 C . THR A 201 ? 14.47220 -13.73451 -43.12582 1.000 24.93318 C ? A ? 201 1 ATOM 1548 O . THR A 201 ? 15.07900 -14.01372 -42.08404 1.000 18.58585 O ? A ? 201 1 ATOM 1549 CB . THR A 201 ? 13.91515 -15.47882 -44.83359 1.000 25.55881 C ? A ? 201 1 ATOM 1550 OG1 . THR A 201 ? 12.83271 -16.21989 -45.40929 1.000 25.42575 O ? A ? 201 1 ATOM 1551 CG2 . THR A 201 ? 14.99761 -16.43848 -44.36571 1.000 29.40636 C ? A ? 201 1 ATOM 1552 N . VAL A 202 ? 14.72475 -12.61943 -43.81919 1.000 19.94424 N ? A ? 202 1 ATOM 1553 CA . VAL A 202 ? 15.78364 -11.71349 -43.38219 1.000 21.61859 C ? A ? 202 1 ATOM 1554 C . VAL A 202 ? 15.49324 -11.17396 -41.98206 1.000 22.79884 C ? A ? 202 1 ATOM 1555 O . VAL A 202 ? 16.42062 -10.93610 -41.19731 1.000 22.19170 O ? A ? 202 1 ATOM 1556 CB . VAL A 202 ? 15.98899 -10.58723 -44.42197 1.000 25.05917 C ? A ? 202 1 ATOM 1557 CG1 . VAL A 202 ? 14.81497 -9.60834 -44.43159 1.000 23.38159 C ? A ? 202 1 ATOM 1558 CG2 . VAL A 202 ? 17.31550 -9.86575 -44.17646 1.000 25.54602 C ? A ? 202 1 ATOM 1559 N . ASN A 203 ? 14.21198 -11.01203 -41.62980 1.000 16.95129 N ? A ? 203 1 ATOM 1560 CA . ASN A 203 ? 13.85726 -10.58453 -40.27815 1.000 19.77997 C ? A ? 203 1 ATOM 1561 C . ASN A 203 ? 14.12346 -11.67996 -39.25150 1.000 22.69491 C ? A ? 203 1 ATOM 1562 O . ASN A 203 ? 14.58324 -11.39154 -38.14146 1.000 23.05216 O ? A ? 203 1 ATOM 1563 CB . ASN A 203 ? 12.39295 -10.15663 -40.22607 1.000 17.28552 C ? A ? 203 1 ATOM 1564 CG . ASN A 203 ? 12.15172 -8.84253 -40.92106 1.000 21.19268 C ? A ? 203 1 ATOM 1565 OD1 . ASN A 203 ? 13.07780 -8.22731 -41.44128 1.000 22.91613 O ? A ? 203 1 ATOM 1566 ND2 . ASN A 203 ? 10.90162 -8.41011 -40.94918 1.000 16.69207 N ? A ? 203 1 ATOM 1567 N . VAL A 204 ? 13.82784 -12.93845 -39.58862 1.000 18.87695 N ? A ? 204 1 ATOM 1568 CA . VAL A 204 ? 14.10753 -14.02829 -38.65569 1.000 24.24239 C ? A ? 204 1 ATOM 1569 C . VAL A 204 ? 15.60166 -14.12070 -38.38724 1.000 19.87295 C ? A ? 204 1 ATOM 1570 O . VAL A 204 ? 16.02990 -14.31699 -37.24411 1.000 21.07750 O ? A ? 204 1 ATOM 1571 CB . VAL A 204 ? 13.54727 -15.36106 -39.18663 1.000 20.13740 C ? A ? 204 1 ATOM 1572 CG1 . VAL A 204 ? 13.92018 -16.50750 -38.24714 1.000 23.63440 C ? A ? 204 1 ATOM 1573 CG2 . VAL A 204 ? 12.04214 -15.27670 -39.33937 1.000 20.89476 C ? A ? 204 1 ATOM 1574 N . LEU A 205 ? 16.41837 -13.95894 -39.43226 1.000 20.54918 N ? A ? 205 1 ATOM 1575 CA . LEU A 205 ? 17.86712 -14.02309 -39.26133 1.000 21.25839 C ? A ? 205 1 ATOM 1576 C . LEU A 205 ? 18.37552 -12.89403 -38.37561 1.000 21.89074 C ? A ? 205 1 ATOM 1577 O . LEU A 205 ? 19.23178 -13.11622 -37.51165 1.000 22.19885 O ? A ? 205 1 ATOM 1578 CB . LEU A 205 ? 18.55543 -13.98288 -40.62318 1.000 22.91869 C ? A ? 205 1 ATOM 1579 CG . LEU A 205 ? 18.26103 -15.19230 -41.50538 1.000 21.16300 C ? A ? 205 1 ATOM 1580 CD1 . LEU A 205 ? 18.76930 -14.95667 -42.91680 1.000 27.66036 C ? A ? 205 1 ATOM 1581 CD2 . LEU A 205 ? 18.89332 -16.42426 -40.89005 1.000 22.28955 C ? A ? 205 1 ATOM 1582 N . ALA A 206 ? 17.86876 -11.67425 -38.58278 1.000 23.11570 N ? A ? 206 1 ATOM 1583 CA . ALA A 206 ? 18.26290 -10.55142 -37.73542 1.000 26.74714 C ? A ? 206 1 ATOM 1584 C . ALA A 206 ? 17.90049 -10.80991 -36.27941 1.000 23.54045 C ? A ? 206 1 ATOM 1585 O . ALA A 206 ? 18.66190 -10.46440 -35.36732 1.000 28.85174 O ? A ? 206 1 ATOM 1586 CB . ALA A 206 ? 17.60280 -9.26303 -38.22983 1.000 20.64724 C ? A ? 206 1 ATOM 1587 N . TRP A 207 ? 16.73670 -11.42007 -36.04901 1.000 21.92281 N ? A ? 207 1 ATOM 1588 CA . TRP A 207 ? 16.30972 -11.76448 -34.69854 1.000 19.26128 C ? A ? 207 1 ATOM 1589 C . TRP A 207 ? 17.21766 -12.82619 -34.08261 1.000 27.98334 C ? A ? 207 1 ATOM 1590 O . TRP A 207 ? 17.49246 -12.79557 -32.87636 1.000 24.19843 O ? A ? 207 1 ATOM 1591 CB . TRP A 207 ? 14.85341 -12.22681 -34.74424 1.000 20.81444 C ? A ? 207 1 ATOM 1592 CG . TRP A 207 ? 14.29830 -12.71127 -33.45031 1.000 29.14280 C ? A ? 207 1 ATOM 1593 CD1 . TRP A 207 ? 13.95278 -11.95706 -32.36414 1.000 27.47449 C ? A ? 207 1 ATOM 1594 CD2 . TRP A 207 ? 13.98681 -14.06581 -33.11584 1.000 26.20422 C ? A ? 207 1 ATOM 1595 NE1 . TRP A 207 ? 13.45813 -12.76601 -31.36738 1.000 27.20909 N ? A ? 207 1 ATOM 1596 CE2 . TRP A 207 ? 13.46918 -14.06490 -31.80549 1.000 26.09126 C ? A ? 207 1 ATOM 1597 CE3 . TRP A 207 ? 14.10116 -15.28092 -33.79658 1.000 23.22479 C ? A ? 207 1 ATOM 1598 CZ2 . TRP A 207 ? 13.06817 -15.23215 -31.16289 1.000 30.82618 C ? A ? 207 1 ATOM 1599 CZ3 . TRP A 207 ? 13.70307 -16.43831 -33.15742 1.000 29.79600 C ? A ? 207 1 ATOM 1600 CH2 . TRP A 207 ? 13.18982 -16.40618 -31.85496 1.000 29.32625 C ? A ? 207 1 ATOM 1601 N . LEU A 208 ? 17.70660 -13.76537 -34.89730 1.000 22.57689 N ? A ? 208 1 ATOM 1602 CA . LEU A 208 ? 18.64789 -14.75924 -34.39014 1.000 24.90317 C ? A ? 208 1 ATOM 1603 C . LEU A 208 ? 19.99023 -14.12608 -34.03952 1.000 27.76917 C ? A ? 208 1 ATOM 1604 O . LEU A 208 ? 20.64341 -14.54167 -33.07542 1.000 23.90895 O ? A ? 208 1 ATOM 1605 CB . LEU A 208 ? 18.82743 -15.88331 -35.40876 1.000 24.40956 C ? A ? 208 1 ATOM 1606 CG . LEU A 208 ? 17.64362 -16.84503 -35.53183 1.000 26.96567 C ? A ? 208 1 ATOM 1607 CD1 . LEU A 208 ? 17.88710 -17.85344 -36.64622 1.000 28.69645 C ? A ? 208 1 ATOM 1608 CD2 . LEU A 208 ? 17.38381 -17.55161 -34.20484 1.000 25.95332 C ? A ? 208 1 ATOM 1609 N . TYR A 209 ? 20.42466 -13.12535 -34.80982 1.000 21.86922 N ? A ? 209 1 ATOM 1610 CA . TYR A 209 ? 21.60573 -12.36781 -34.41064 1.000 20.69213 C ? A ? 209 1 ATOM 1611 C . TYR A 209 ? 21.35595 -11.62698 -33.10229 1.000 27.99262 C ? A ? 209 1 ATOM 1612 O . TYR A 209 ? 22.24000 -11.56078 -32.24041 1.000 28.75204 O ? A ? 209 1 ATOM 1613 CB . TYR A 209 ? 22.01653 -11.38983 -35.51289 1.000 26.51973 C ? A ? 209 1 ATOM 1614 CG . TYR A 209 ? 22.85455 -12.00418 -36.61721 1.000 27.79866 C ? A ? 209 1 ATOM 1615 CD1 . TYR A 209 ? 24.14407 -12.46323 -36.36844 1.000 30.60132 C ? A ? 209 1 ATOM 1616 CD2 . TYR A 209 ? 22.36325 -12.10711 -37.91321 1.000 26.60506 C ? A ? 209 1 ATOM 1617 CE1 . TYR A 209 ? 24.91619 -13.02096 -37.38136 1.000 33.47252 C ? A ? 209 1 ATOM 1618 CE2 . TYR A 209 ? 23.12805 -12.65961 -38.93047 1.000 31.18299 C ? A ? 209 1 ATOM 1619 CZ . TYR A 209 ? 24.40116 -13.11544 -38.66004 1.000 33.07385 C ? A ? 209 1 ATOM 1620 OH . TYR A 209 ? 25.15796 -13.66539 -39.67313 1.000 32.65896 O ? A ? 209 1 ATOM 1621 N . ALA A 210 ? 20.15035 -11.07230 -32.93236 1.000 26.66936 N ? A ? 210 1 ATOM 1622 CA . ALA A 210 ? 19.80232 -10.42704 -31.67014 1.000 29.57529 C ? A ? 210 1 ATOM 1623 C . ALA A 210 ? 19.89980 -11.40790 -30.50984 1.000 29.57593 C ? A ? 210 1 ATOM 1624 O . ALA A 210 ? 20.33947 -11.04284 -29.41327 1.000 23.74317 O ? A ? 210 1 ATOM 1625 CB . ALA A 210 ? 18.39701 -9.83089 -31.75345 1.000 21.07999 C ? A ? 210 1 ATOM 1626 N . ALA A 211 ? 19.49661 -12.66175 -30.73509 1.000 26.05163 N ? A ? 211 1 ATOM 1627 CA . ALA A 211 ? 19.62596 -13.67787 -29.69660 1.000 25.82769 C ? A ? 211 1 ATOM 1628 C . ALA A 211 ? 21.08636 -13.94127 -29.36002 1.000 27.79586 C ? A ? 211 1 ATOM 1629 O . ALA A 211 ? 21.43718 -14.09847 -28.18580 1.000 36.99255 O ? A ? 211 1 ATOM 1630 CB . ALA A 211 ? 18.94167 -14.97102 -30.13451 1.000 26.63489 C ? A ? 211 1 ATOM 1631 N . VAL A 212 ? 21.95152 -13.99290 -30.37579 1.000 25.92572 N ? A ? 212 1 ATOM 1632 CA . VAL A 212 ? 23.36375 -14.27925 -30.13754 1.000 28.12884 C ? A ? 212 1 ATOM 1633 C . VAL A 212 ? 24.01918 -13.13481 -29.37811 1.000 28.19919 C ? A ? 212 1 ATOM 1634 O . VAL A 212 ? 24.81909 -13.35646 -28.46115 1.000 29.88873 O ? A ? 212 1 ATOM 1635 CB . VAL A 212 ? 24.08091 -14.56378 -31.46978 1.000 27.64157 C ? A ? 212 1 ATOM 1636 CG1 . VAL A 212 ? 25.57579 -14.67668 -31.25107 1.000 29.74821 C ? A ? 212 1 ATOM 1637 CG2 . VAL A 212 ? 23.52925 -15.83494 -32.10338 1.000 30.19425 C ? A ? 212 1 ATOM 1638 N . ILE A 213 ? 23.68711 -11.89453 -29.74523 1.000 34.20413 N ? A ? 213 1 ATOM 1639 CA . ILE A 213 ? 24.21216 -10.72762 -29.04006 1.000 35.61595 C ? A ? 213 1 ATOM 1640 C . ILE A 213 ? 23.83368 -10.77408 -27.56336 1.000 34.53861 C ? A ? 213 1 ATOM 1641 O . ILE A 213 ? 24.61318 -10.36442 -26.69451 1.000 33.11953 O ? A ? 213 1 ATOM 1642 CB . ILE A 213 ? 23.71152 -9.43911 -29.71982 1.000 34.37411 C ? A ? 213 1 ATOM 1643 CG1 . ILE A 213 ? 24.25874 -9.34565 -31.14601 1.000 26.27426 C ? A ? 213 1 ATOM 1644 CG2 . ILE A 213 ? 24.08806 -8.20749 -28.91034 1.000 30.51764 C ? A ? 213 1 ATOM 1645 CD1 . ILE A 213 ? 23.75899 -8.14823 -31.91751 1.000 24.02893 C ? A ? 213 1 ATOM 1646 N . ASN A 214 ? 22.64096 -11.28383 -27.25353 1.000 29.97534 N ? A ? 214 1 ATOM 1647 CA . ASN A 214 ? 22.16323 -11.38705 -25.88211 1.000 31.31203 C ? A ? 214 1 ATOM 1648 C . ASN A 214 ? 22.51892 -12.71779 -25.22706 1.000 38.83083 C ? A ? 214 1 ATOM 1649 O . ASN A 214 ? 21.86328 -13.11400 -24.25650 1.000 45.68217 O ? A ? 214 1 ATOM 1650 CB . ASN A 214 ? 20.65065 -11.16589 -25.83171 1.000 30.64203 C ? A ? 214 1 ATOM 1651 CG . ASN A 214 ? 20.27475 -9.70903 -25.98142 1.000 41.03587 C ? A ? 214 1 ATOM 1652 OD1 . ASN A 214 ? 20.28076 -8.95284 -25.01052 1.000 49.00525 O ? A ? 214 1 ATOM 1653 ND2 . ASN A 214 ? 19.94806 -9.30383 -27.20406 1.000 42.18720 N ? A ? 214 1 ATOM 1654 N . GLY A 215 ? 23.53530 -13.41320 -25.73315 1.000 38.54288 N ? A ? 215 1 ATOM 1655 CA . GLY A 215 ? 24.00353 -14.62778 -25.09412 1.000 43.62797 C ? A ? 215 1 ATOM 1656 C . GLY A 215 ? 23.09653 -15.83013 -25.22445 1.000 42.66691 C ? A ? 215 1 ATOM 1657 O . GLY A 215 ? 23.19893 -16.75712 -24.41763 1.000 57.58995 O ? A ? 215 1 ATOM 1658 N . ASP A 216 ? 22.20969 -15.84849 -26.21356 1.000 32.91152 N ? A ? 216 1 ATOM 1659 CA . ASP A 216 ? 21.31498 -16.97883 -26.45496 1.000 34.02242 C ? A ? 216 1 ATOM 1660 C . ASP A 216 ? 21.75034 -17.63084 -27.76275 1.000 36.35939 C ? A ? 216 1 ATOM 1661 O . ASP A 216 ? 21.44146 -17.13133 -28.84789 1.000 41.62139 O ? A ? 216 1 ATOM 1662 CB . ASP A 216 ? 19.86204 -16.52000 -26.50780 1.000 37.17463 C ? A ? 216 1 ATOM 1663 CG . ASP A 216 ? 18.91758 -17.51625 -25.87890 1.000 39.53865 C ? A ? 216 1 ATOM 1664 OD1 . ASP A 216 ? 19.38226 -18.61222 -25.49826 1.000 46.97236 O ? A ? 216 1 ATOM 1665 OD2 . ASP A 216 ? 17.71515 -17.20060 -25.75662 1.000 43.94484 O ? A ? 216 1 ATOM 1666 N . ARG A 217 ? 22.46234 -18.75567 -27.65948 1.000 34.02477 N ? A ? 217 1 ATOM 1667 CA . ARG A 217 ? 23.15807 -19.29155 -28.82325 1.000 41.04080 C ? A ? 217 1 ATOM 1668 C . ARG A 217 ? 23.09258 -20.81374 -28.93696 1.000 44.92232 C ? A ? 217 1 ATOM 1669 O . ARG A 217 ? 23.94456 -21.40723 -29.61041 1.000 46.22233 O ? A ? 217 1 ATOM 1670 CB . ARG A 217 ? 24.61976 -18.86773 -28.78330 1.000 43.60713 C ? A ? 217 1 ATOM 1671 CG . ARG A 217 ? 25.31291 -19.32270 -27.51835 1.000 37.51659 C ? A ? 217 1 ATOM 1672 CD . ARG A 217 ? 26.80513 -19.17067 -27.62305 1.000 42.28547 C ? A ? 217 1 ATOM 1673 NE . ARG A 217 ? 27.18063 -17.89963 -28.22863 1.000 42.60597 N ? A ? 217 1 ATOM 1674 CZ . ARG A 217 ? 27.87293 -17.78525 -29.35288 1.000 36.93673 C ? A ? 217 1 ATOM 1675 NH1 . ARG A 217 ? 28.28798 -18.85048 -30.01921 1.000 38.18531 N ? A ? 217 1 ATOM 1676 NH2 . ARG A 217 ? 28.17298 -16.57257 -29.80875 1.000 37.79429 N ? A ? 217 1 ATOM 1677 N . TRP A 218 ? 22.10938 -21.46458 -28.31147 1.000 39.41685 N ? A ? 218 1 ATOM 1678 CA . TRP A 218 ? 22.05483 -22.92294 -28.35650 1.000 40.39411 C ? A ? 218 1 ATOM 1679 C . TRP A 218 ? 21.81104 -23.44323 -29.76780 1.000 43.63656 C ? A ? 218 1 ATOM 1680 O . TRP A 218 ? 22.22098 -24.56421 -30.09375 1.000 43.67932 O ? A ? 218 1 ATOM 1681 CB . TRP A 218 ? 20.97018 -23.43806 -27.41063 1.000 49.30433 C ? A ? 218 1 ATOM 1682 CG . TRP A 218 ? 19.59084 -22.93102 -27.72341 1.000 39.24429 C ? A ? 218 1 ATOM 1683 CD1 . TRP A 218 ? 18.96788 -21.85401 -27.16449 1.000 37.07977 C ? A ? 218 1 ATOM 1684 CD2 . TRP A 218 ? 18.65996 -23.49214 -28.65774 1.000 43.21442 C ? A ? 218 1 ATOM 1685 NE1 . TRP A 218 ? 17.70979 -21.70550 -27.69626 1.000 44.71649 N ? A ? 218 1 ATOM 1686 CE2 . TRP A 218 ? 17.49668 -22.69789 -28.61616 1.000 44.43693 C ? A ? 218 1 ATOM 1687 CE3 . TRP A 218 ? 18.69761 -24.58784 -29.52542 1.000 38.83096 C ? A ? 218 1 ATOM 1688 CZ2 . TRP A 218 ? 16.38389 -22.96280 -29.40980 1.000 42.91467 C ? A ? 218 1 ATOM 1689 CZ3 . TRP A 218 ? 17.59309 -24.84778 -30.31310 1.000 38.11430 C ? A ? 218 1 ATOM 1690 CH2 . TRP A 218 ? 16.45180 -24.03930 -30.25048 1.000 41.89608 C ? A ? 218 1 ATOM 1691 N . PHE A 219 ? 21.14944 -22.65060 -30.61131 1.000 40.21769 N ? A ? 219 1 ATOM 1692 CA . PHE A 219 ? 20.78067 -23.07480 -31.95594 1.000 39.80644 C ? A ? 219 1 ATOM 1693 C . PHE A 219 ? 21.94218 -23.02159 -32.93742 1.000 42.37025 C ? A ? 219 1 ATOM 1694 O . PHE A 219 ? 21.78614 -23.47239 -34.07795 1.000 39.64798 O ? A ? 219 1 ATOM 1695 CB . PHE A 219 ? 19.63482 -22.20327 -32.46973 1.000 39.28581 C ? A ? 219 1 ATOM 1696 CG . PHE A 219 ? 19.84155 -20.73549 -32.22918 1.000 32.34976 C ? A ? 219 1 ATOM 1697 CD1 . PHE A 219 ? 20.54101 -19.96252 -33.13968 1.000 38.94088 C ? A ? 219 1 ATOM 1698 CD2 . PHE A 219 ? 19.33978 -20.13008 -31.08871 1.000 31.90850 C ? A ? 219 1 ATOM 1699 CE1 . PHE A 219 ? 20.73332 -18.61212 -32.91911 1.000 32.12377 C ? A ? 219 1 ATOM 1700 CE2 . PHE A 219 ? 19.52644 -18.78666 -30.86455 1.000 31.34129 C ? A ? 219 1 ATOM 1701 CZ . PHE A 219 ? 20.22412 -18.02457 -31.78032 1.000 28.81414 C ? A ? 219 1 ATOM 1702 N . LEU A 220 ? 23.08954 -22.48686 -32.52730 1.000 44.04201 N ? A ? 220 1 ATOM 1703 CA . LEU A 220 ? 24.23298 -22.34168 -33.41711 1.000 45.74622 C ? A ? 220 1 ATOM 1704 C . LEU A 220 ? 24.92153 -23.68054 -33.63776 1.000 45.60841 C ? A ? 220 1 ATOM 1705 O . LEU A 220 ? 25.25462 -24.38490 -32.67984 1.000 56.16354 O ? A ? 220 1 ATOM 1706 CB . LEU A 220 ? 25.22991 -21.33907 -32.84056 1.000 39.52748 C ? A ? 220 1 ATOM 1707 CG . LEU A 220 ? 24.78755 -19.88176 -32.81724 1.000 35.30554 C ? A ? 220 1 ATOM 1708 CD1 . LEU A 220 ? 25.87985 -19.03320 -32.22125 1.000 33.31093 C ? A ? 220 1 ATOM 1709 CD2 . LEU A 220 ? 24.45788 -19.42001 -34.22454 1.000 34.08725 C ? A ? 220 1 ATOM 1710 N . ASN A 221 ? 25.14303 -24.02460 -34.89900 1.000 49.49927 N ? A ? 221 1 ATOM 1711 CA . ASN A 221 ? 25.94552 -25.18159 -35.26289 1.000 64.07060 C ? A ? 221 1 ATOM 1712 C . ASN A 221 ? 27.18158 -24.71792 -36.02463 1.000 61.67786 C ? A ? 221 1 ATOM 1713 O . ASN A 221 ? 27.32933 -23.53898 -36.36011 1.000 56.28611 O ? A ? 221 1 ATOM 1714 CB . ASN A 221 ? 25.12574 -26.18386 -36.09183 1.000 47.27335 C ? A ? 221 1 ATOM 1715 CG . ASN A 221 ? 24.46151 -25.54785 -37.30013 1.000 52.07650 C ? A ? 221 1 ATOM 1716 OD1 . ASN A 221 ? 25.09458 -24.82065 -38.06475 1.000 49.98570 O ? A ? 221 1 ATOM 1717 ND2 . ASN A 221 ? 23.17219 -25.81799 -37.47344 1.000 51.07840 N ? A ? 221 1 ATOM 1718 N . ARG A 222 ? 28.08089 -25.66414 -36.29442 1.000 55.07774 N ? A ? 222 1 ATOM 1719 CA . ARG A 222 ? 29.30389 -25.38715 -37.03547 1.000 59.18077 C ? A ? 222 1 ATOM 1720 C . ARG A 222 ? 29.15749 -25.68452 -38.52424 1.000 55.71458 C ? A ? 222 1 ATOM 1721 O . ARG A 222 ? 30.16373 -25.84842 -39.22229 1.000 59.81341 O ? A ? 222 1 ATOM 1722 CB . ARG A 222 ? 30.47099 -26.17459 -36.43800 1.000 55.90774 C ? A ? 222 1 ATOM 1723 CG . ARG A 222 ? 30.70293 -25.87438 -34.96461 1.000 63.73641 C ? A ? 222 1 ATOM 1724 CD . ARG A 222 ? 32.08902 -25.29345 -34.70232 1.000 73.77048 C ? A ? 222 1 ATOM 1725 NE . ARG A 222 ? 32.37379 -24.12732 -35.53145 1.000 77.90614 N ? A ? 222 1 ATOM 1726 CZ . ARG A 222 ? 33.32321 -24.07661 -36.45678 1.000 79.23902 C ? A ? 222 1 ATOM 1727 NH1 . ARG A 222 ? 34.12727 -25.10476 -36.67946 1.000 72.57854 N ? A ? 222 1 ATOM 1728 NH2 . ARG A 222 ? 33.47277 -22.96439 -37.17322 1.000 74.61533 N ? A ? 222 1 ATOM 1729 N . PHE A 223 ? 27.92738 -25.74008 -39.02331 1.000 58.83375 N ? A ? 223 1 ATOM 1730 CA . PHE A 223 ? 27.66715 -25.99052 -40.43077 1.000 51.61402 C ? A ? 223 1 ATOM 1731 C . PHE A 223 ? 27.54842 -24.67907 -41.19825 1.000 57.30713 C ? A ? 223 1 ATOM 1732 O . PHE A 223 ? 27.34923 -23.60248 -40.62636 1.000 51.17686 O ? A ? 223 1 ATOM 1733 CB . PHE A 223 ? 26.38520 -26.80471 -40.60857 1.000 48.37134 C ? A ? 223 1 ATOM 1734 CG . PHE A 223 ? 26.36685 -28.08227 -39.82877 1.000 55.41855 C ? A ? 223 1 ATOM 1735 CD1 . PHE A 223 ? 27.42175 -28.97608 -39.91207 1.000 58.65258 C ? A ? 223 1 ATOM 1736 CD2 . PHE A 223 ? 25.30004 -28.38451 -39.00016 1.000 53.61983 C ? A ? 223 1 ATOM 1737 CE1 . PHE A 223 ? 27.40905 -30.15233 -39.18890 1.000 56.23962 C ? A ? 223 1 ATOM 1738 CE2 . PHE A 223 ? 25.28005 -29.55836 -38.27453 1.000 55.85712 C ? A ? 223 1 ATOM 1739 CZ . PHE A 223 ? 26.33604 -30.44342 -38.36827 1.000 59.19145 C ? A ? 223 1 ATOM 1740 N . THR A 224 ? 27.67806 -24.78738 -42.51560 1.000 59.57249 N ? A ? 224 1 ATOM 1741 CA . THR A 224 ? 27.41662 -23.68801 -43.42709 1.000 50.20103 C ? A ? 224 1 ATOM 1742 C . THR A 224 ? 26.57822 -24.21972 -44.58032 1.000 51.33625 C ? A ? 224 1 ATOM 1743 O . THR A 224 ? 26.38993 -25.42999 -44.73521 1.000 57.93262 O ? A ? 224 1 ATOM 1744 CB . THR A 224 ? 28.71843 -23.05099 -43.93985 1.000 61.14494 C ? A ? 224 1 ATOM 1745 OG1 . THR A 224 ? 28.43856 -21.75666 -44.49051 1.000 49.96994 O ? A ? 224 1 ATOM 1746 CG2 . THR A 224 ? 29.36814 -23.93148 -45.00783 1.000 55.59588 C ? A ? 224 1 ATOM 1747 N . THR A 225 ? 26.06343 -23.30159 -45.39122 1.000 48.18166 N ? A ? 225 1 ATOM 1748 CA . THR A 225 ? 25.21999 -23.67972 -46.51177 1.000 39.33708 C ? A ? 225 1 ATOM 1749 C . THR A 225 ? 25.38051 -22.64504 -47.61188 1.000 52.07707 C ? A ? 225 1 ATOM 1750 O . THR A 225 ? 25.77810 -21.50243 -47.36381 1.000 44.91566 O ? A ? 225 1 ATOM 1751 CB . THR A 225 ? 23.74561 -23.79846 -46.09438 1.000 42.81829 C ? A ? 225 1 ATOM 1752 OG1 . THR A 225 ? 22.95773 -24.23479 -47.20844 1.000 39.03131 O ? A ? 225 1 ATOM 1753 CG2 . THR A 225 ? 23.21348 -22.45511 -45.59649 1.000 43.79499 C ? A ? 225 1 ATOM 1754 N . THR A 226 ? 25.08425 -23.06393 -48.83811 1.000 50.02669 N ? A ? 226 1 ATOM 1755 CA . THR A 226 ? 24.95313 -22.10968 -49.92444 1.000 42.03638 C ? A ? 226 1 ATOM 1756 C . THR A 226 ? 23.59821 -21.42106 -49.83008 1.000 39.21263 C ? A ? 226 1 ATOM 1757 O . THR A 226 ? 22.64151 -21.96119 -49.26669 1.000 35.28812 O ? A ? 226 1 ATOM 1758 CB . THR A 226 ? 25.10353 -22.79450 -51.28349 1.000 42.11621 C ? A ? 226 1 ATOM 1759 OG1 . THR A 226 ? 24.06881 -23.77126 -51.44568 1.000 52.09367 O ? A ? 226 1 ATOM 1760 CG2 . THR A 226 ? 26.45858 -23.47637 -51.39016 1.000 45.62832 C ? A ? 226 1 ATOM 1761 N . LEU A 227 ? 23.53401 -20.20007 -50.36313 1.000 41.29817 N ? A ? 227 1 ATOM 1762 CA . LEU A 227 ? 22.26840 -19.47763 -50.40019 1.000 32.69559 C ? A ? 227 1 ATOM 1763 C . LEU A 227 ? 21.21907 -20.26444 -51.17290 1.000 40.49881 C ? A ? 227 1 ATOM 1764 O . LEU A 227 ? 20.03130 -20.23131 -50.83404 1.000 42.38913 O ? A ? 227 1 ATOM 1765 CB . LEU A 227 ? 22.48461 -18.09664 -51.01917 1.000 36.61900 C ? A ? 227 1 ATOM 1766 CG . LEU A 227 ? 21.38763 -17.04183 -50.88639 1.000 43.15261 C ? A ? 227 1 ATOM 1767 CD1 . LEU A 227 ? 20.95222 -16.90903 -49.43636 1.000 41.29476 C ? A ? 227 1 ATOM 1768 CD2 . LEU A 227 ? 21.87936 -15.70222 -51.42800 1.000 33.24780 C ? A ? 227 1 ATOM 1769 N . ASN A 228 ? 21.64759 -20.99678 -52.20396 1.000 44.23267 N ? A ? 228 1 ATOM 1770 CA . ASN A 228 ? 20.72337 -21.80156 -52.99650 1.000 45.60082 C ? A ? 228 1 ATOM 1771 C . ASN A 228 ? 20.16613 -22.97007 -52.19006 1.000 37.31739 C ? A ? 228 1 ATOM 1772 O . ASN A 228 ? 18.96197 -23.24488 -52.23877 1.000 36.83793 O ? A ? 228 1 ATOM 1773 CB . ASN A 228 ? 21.43063 -22.29529 -54.25934 1.000 40.27729 C ? A ? 228 1 ATOM 1774 CG . ASN A 228 ? 20.55043 -23.16533 -55.11734 1.000 41.92577 C ? A ? 228 1 ATOM 1775 OD1 . ASN A 228 ? 20.77503 -24.37122 -55.23473 1.000 44.39758 O ? A ? 228 1 ATOM 1776 ND2 . ASN A 228 ? 19.53646 -22.56107 -55.72483 1.000 49.90087 N ? A ? 228 1 ATOM 1777 N . ASP A 229 ? 21.02509 -23.66420 -51.44023 1.000 42.00557 N ? A ? 229 1 ATOM 1778 CA . ASP A 229 ? 20.57623 -24.80230 -50.64194 1.000 49.29257 C ? A ? 229 1 ATOM 1779 C . ASP A 229 ? 19.58424 -24.36462 -49.56989 1.000 44.33453 C ? A ? 229 1 ATOM 1780 O . ASP A 229 ? 18.55477 -25.01586 -49.35835 1.000 41.64523 O ? A ? 229 1 ATOM 1781 CB . ASP A 229 ? 21.78508 -25.50086 -50.01192 1.000 58.47196 C ? A ? 229 1 ATOM 1782 CG . ASP A 229 ? 21.43019 -26.82887 -49.35768 1.000 71.70789 C ? A ? 229 1 ATOM 1783 OD1 . ASP A 229 ? 20.24118 -27.21968 -49.37666 1.000 71.35239 O ? A ? 229 1 ATOM 1784 OD2 . ASP A 229 ? 22.35278 -27.48719 -48.82535 1.000 75.41143 O ? A ? 229 1 ATOM 1785 N . PHE A 230 ? 19.88220 -23.26048 -48.87814 1.000 39.55259 N ? A ? 230 1 ATOM 1786 CA . PHE A 230 ? 18.98426 -22.77424 -47.83414 1.000 46.09884 C ? A ? 230 1 ATOM 1787 C . PHE A 230 ? 17.62568 -22.39026 -48.40503 1.000 41.34838 C ? A ? 230 1 ATOM 1788 O . PHE A 230 ? 16.58542 -22.69383 -47.80767 1.000 36.80634 O ? A ? 230 1 ATOM 1789 CB . PHE A 230 ? 19.60979 -21.58145 -47.10860 1.000 46.10300 C ? A ? 230 1 ATOM 1790 CG . PHE A 230 ? 18.65279 -20.85553 -46.20224 1.000 43.99984 C ? A ? 230 1 ATOM 1791 CD1 . PHE A 230 ? 18.38392 -21.33671 -44.92952 1.000 37.47311 C ? A ? 230 1 ATOM 1792 CD2 . PHE A 230 ? 18.01844 -19.69398 -46.62520 1.000 40.58136 C ? A ? 230 1 ATOM 1793 CE1 . PHE A 230 ? 17.50088 -20.67567 -44.09397 1.000 36.45219 C ? A ? 230 1 ATOM 1794 CE2 . PHE A 230 ? 17.13337 -19.02743 -45.79539 1.000 37.29926 C ? A ? 230 1 ATOM 1795 CZ . PHE A 230 ? 16.87550 -19.51914 -44.52694 1.000 42.81479 C ? A ? 230 1 ATOM 1796 N . ASN A 231 ? 17.61466 -21.71592 -49.55928 1.000 38.94653 N ? A ? 231 1 ATOM 1797 CA . ASN A 231 ? 16.35083 -21.30553 -50.16114 1.000 38.96113 C ? A ? 231 1 ATOM 1798 C . ASN A 231 ? 15.48496 -22.50568 -50.52130 1.000 37.96860 C ? A ? 231 1 ATOM 1799 O . ASN A 231 ? 14.25557 -22.41616 -50.46352 1.000 48.58166 O ? A ? 231 1 ATOM 1800 CB . ASN A 231 ? 16.60915 -20.43590 -51.39308 1.000 37.96180 C ? A ? 231 1 ATOM 1801 CG . ASN A 231 ? 17.06100 -19.02760 -51.03158 1.000 33.29900 C ? A ? 231 1 ATOM 1802 OD1 . ASN A 231 ? 16.70776 -18.50206 -49.97755 1.000 32.68430 O ? A ? 231 1 ATOM 1803 ND2 . ASN A 231 ? 17.84329 -18.41187 -51.90922 1.000 33.69450 N ? A ? 231 1 ATOM 1804 N . LEU A 232 ? 16.09948 -23.63471 -50.88471 1.000 37.11516 N ? A ? 232 1 ATOM 1805 CA . LEU A 232 ? 15.32709 -24.85316 -51.11153 1.000 39.42938 C ? A ? 232 1 ATOM 1806 C . LEU A 232 ? 14.56023 -25.25729 -49.85971 1.000 37.73950 C ? A ? 232 1 ATOM 1807 O . LEU A 232 ? 13.38769 -25.64200 -49.93591 1.000 44.04795 O ? A ? 232 1 ATOM 1808 CB . LEU A 232 ? 16.25154 -25.98411 -51.55508 1.000 46.96267 C ? A ? 232 1 ATOM 1809 CG . LEU A 232 ? 17.06241 -25.75245 -52.82933 1.000 58.71717 C ? A ? 232 1 ATOM 1810 CD1 . LEU A 232 ? 18.09280 -26.85893 -53.01538 1.000 59.77734 C ? A ? 232 1 ATOM 1811 CD2 . LEU A 232 ? 16.14529 -25.65445 -54.04242 1.000 63.20261 C ? A ? 232 1 ATOM 1812 N . VAL A 233 ? 15.20825 -25.17271 -48.69620 1.000 35.80331 N ? A ? 233 1 ATOM 1813 CA . VAL A 233 ? 14.53109 -25.47258 -47.44016 1.000 37.98709 C ? A ? 233 1 ATOM 1814 C . VAL A 233 ? 13.55015 -24.36577 -47.07952 1.000 47.20405 C ? A ? 233 1 ATOM 1815 O . VAL A 233 ? 12.52678 -24.62045 -46.43366 1.000 47.23496 O ? A ? 233 1 ATOM 1816 CB . VAL A 233 ? 15.56773 -25.69457 -46.32243 1.000 48.78059 C ? A ? 233 1 ATOM 1817 CG1 . VAL A 233 ? 14.89267 -26.17625 -45.04477 1.000 43.30456 C ? A ? 233 1 ATOM 1818 CG2 . VAL A 233 ? 16.63158 -26.67896 -46.77558 1.000 44.28178 C ? A ? 233 1 ATOM 1819 N . ALA A 234 ? 13.83556 -23.12798 -47.48916 1.000 40.02146 N ? A ? 234 1 ATOM 1820 CA . ALA A 234 ? 12.95665 -22.01126 -47.15580 1.000 42.61772 C ? A ? 234 1 ATOM 1821 C . ALA A 234 ? 11.58866 -22.16170 -47.81248 1.000 38.09909 C ? A ? 234 1 ATOM 1822 O . ALA A 234 ? 10.55506 -21.97878 -47.15844 1.000 42.86803 O ? A ? 234 1 ATOM 1823 CB . ALA A 234 ? 13.61112 -20.69014 -47.56440 1.000 40.07602 C ? A ? 234 1 ATOM 1824 N . MET A 235 ? 11.56397 -22.49113 -49.10993 1.000 37.32084 N ? A ? 235 1 ATOM 1825 CA . MET A 235 ? 10.29743 -22.59900 -49.83070 1.000 40.36287 C ? A ? 235 1 ATOM 1826 C . MET A 235 ? 9.35416 -23.58772 -49.16068 1.000 40.18725 C ? A ? 235 1 ATOM 1827 O . MET A 235 ? 8.13734 -23.37032 -49.13349 1.000 49.29545 O ? A ? 235 1 ATOM 1828 CB . MET A 235 ? 10.53337 -23.02710 -51.28048 1.000 51.88341 C ? A ? 235 1 ATOM 1829 CG . MET A 235 ? 11.59046 -22.24930 -52.03699 1.000 58.95702 C ? A ? 235 1 ATOM 1830 SD . MET A 235 ? 11.25378 -20.48479 -52.17261 1.000 79.53769 S ? A ? 235 1 ATOM 1831 CE . MET A 235 ? 12.81237 -19.83552 -51.57725 1.000 30.68627 C ? A ? 235 1 ATOM 1832 N . LYS A 236 ? 9.89537 -24.68460 -48.62263 1.000 39.74759 N ? A ? 236 1 ATOM 1833 CA . LYS A 236 ? 9.04364 -25.73930 -48.08216 1.000 39.79435 C ? A ? 236 1 ATOM 1834 C . LYS A 236 ? 8.28539 -25.26489 -46.84915 1.000 40.96358 C ? A ? 236 1 ATOM 1835 O . LYS A 236 ? 7.13201 -25.65448 -46.63465 1.000 40.92946 O ? A ? 236 1 ATOM 1836 CB . LYS A 236 ? 9.88049 -26.97462 -47.75097 1.000 37.96364 C ? A ? 236 1 ATOM 1837 CG . LYS A 236 ? 9.04517 -28.22473 -47.51041 1.000 58.74364 C ? A ? 236 1 ATOM 1838 CD . LYS A 236 ? 9.51345 -29.00466 -46.28940 1.000 60.88572 C ? A ? 236 1 ATOM 1839 CE . LYS A 236 ? 8.60545 -30.19976 -46.02170 1.000 57.81265 C ? A ? 236 1 ATOM 1840 NZ . LYS A 236 ? 7.17266 -29.79663 -45.89878 1.000 54.11638 N ? A ? 236 1 ATOM 1841 N . TYR A 237 ? 8.91605 -24.42413 -46.02665 1.000 44.17294 N ? A ? 237 1 ATOM 1842 CA . TYR A 237 ? 8.31937 -23.92587 -44.79430 1.000 40.82969 C ? A ? 237 1 ATOM 1843 C . TYR A 237 ? 7.72404 -22.53241 -44.95315 1.000 36.31567 C ? A ? 237 1 ATOM 1844 O . TYR A 237 ? 7.55117 -21.82603 -43.95418 1.000 38.05338 O ? A ? 237 1 ATOM 1845 CB . TYR A 237 ? 9.35110 -23.92973 -43.66522 1.000 38.85915 C ? A ? 237 1 ATOM 1846 CG . TYR A 237 ? 9.93542 -25.29220 -43.39083 1.000 39.96898 C ? A ? 237 1 ATOM 1847 CD1 . TYR A 237 ? 9.25717 -26.21506 -42.60886 1.000 35.38144 C ? A ? 237 1 ATOM 1848 CD2 . TYR A 237 ? 11.16204 -25.65914 -43.92292 1.000 49.34395 C ? A ? 237 1 ATOM 1849 CE1 . TYR A 237 ? 9.78567 -27.46244 -42.36404 1.000 39.08345 C ? A ? 237 1 ATOM 1850 CE2 . TYR A 237 ? 11.70041 -26.90419 -43.68370 1.000 48.72668 C ? A ? 237 1 ATOM 1851 CZ . TYR A 237 ? 11.00917 -27.80295 -42.90233 1.000 51.45244 C ? A ? 237 1 ATOM 1852 OH . TYR A 237 ? 11.54207 -29.04872 -42.66006 1.000 66.40050 O ? A ? 237 1 ATOM 1853 N . ASN A 238 ? 7.42018 -22.12508 -46.18772 1.000 30.42355 N ? A ? 238 1 ATOM 1854 CA . ASN A 238 ? 6.73368 -20.86233 -46.46807 1.000 38.31689 C ? A ? 238 1 ATOM 1855 C . ASN A 238 ? 7.56449 -19.65662 -46.02225 1.000 38.70136 C ? A ? 238 1 ATOM 1856 O . ASN A 238 ? 7.04232 -18.68719 -45.46917 1.000 35.02673 O ? A ? 238 1 ATOM 1857 CB . ASN A 238 ? 5.34196 -20.84277 -45.82743 1.000 32.77161 C ? A ? 238 1 ATOM 1858 CG . ASN A 238 ? 4.47624 -19.71120 -46.34264 1.000 50.46914 C ? A ? 238 1 ATOM 1859 OD1 . ASN A 238 ? 4.67696 -19.21548 -47.45278 1.000 53.30960 O ? A ? 238 1 ATOM 1860 ND2 . ASN A 238 ? 3.51001 -19.29041 -45.53281 1.000 55.66587 N ? A ? 238 1 ATOM 1861 N . TYR A 239 ? 8.87091 -19.71550 -46.26708 1.000 33.47745 N ? A ? 239 1 ATOM 1862 CA . TYR A 239 ? 9.77412 -18.59921 -46.01855 1.000 31.78722 C ? A ? 239 1 ATOM 1863 C . TYR A 239 ? 10.13189 -17.92197 -47.33627 1.000 33.54172 C ? A ? 239 1 ATOM 1864 O . TYR A 239 ? 10.31843 -18.59095 -48.35764 1.000 31.30475 O ? A ? 239 1 ATOM 1865 CB . TYR A 239 ? 11.04680 -19.07235 -45.31120 1.000 32.25243 C ? A ? 239 1 ATOM 1866 CG . TYR A 239 ? 10.93880 -19.10856 -43.80469 1.000 30.54916 C ? A ? 239 1 ATOM 1867 CD1 . TYR A 239 ? 9.97143 -19.88043 -43.17411 1.000 33.02544 C ? A ? 239 1 ATOM 1868 CD2 . TYR A 239 ? 11.81039 -18.37393 -43.01286 1.000 26.69969 C ? A ? 239 1 ATOM 1869 CE1 . TYR A 239 ? 9.87074 -19.91342 -41.79503 1.000 34.03732 C ? A ? 239 1 ATOM 1870 CE2 . TYR A 239 ? 11.72121 -18.39995 -41.63366 1.000 28.21978 C ? A ? 239 1 ATOM 1871 CZ . TYR A 239 ? 10.74994 -19.17155 -41.02992 1.000 36.63996 C ? A ? 239 1 ATOM 1872 OH . TYR A 239 ? 10.65441 -19.20238 -39.65849 1.000 34.61385 O ? A ? 239 1 ATOM 1873 N . GLU A 240 ? 10.21237 -16.59179 -47.31253 1.000 30.72072 N ? A ? 240 1 ATOM 1874 CA . GLU A 240 ? 10.59769 -15.85931 -48.50737 1.000 26.98583 C ? A ? 240 1 ATOM 1875 C . GLU A 240 ? 12.02425 -16.23782 -48.90226 1.000 28.99027 C ? A ? 240 1 ATOM 1876 O . GLU A 240 ? 12.84142 -16.59311 -48.04692 1.000 28.13170 O ? A ? 240 1 ATOM 1877 CB . GLU A 240 ? 10.49890 -14.34611 -48.28509 1.000 27.00706 C ? A ? 240 1 ATOM 1878 CG . GLU A 240 ? 11.36295 -13.83102 -47.12765 1.000 41.51962 C ? A ? 240 1 ATOM 1879 CD . GLU A 240 ? 12.02883 -12.48025 -47.39553 1.000 52.16147 C ? A ? 240 1 ATOM 1880 OE1 . GLU A 240 ? 11.42654 -11.65081 -48.11248 1.000 47.62236 O ? A ? 240 1 ATOM 1881 OE2 . GLU A 240 ? 13.15819 -12.25461 -46.88149 1.000 30.81210 O ? A ? 240 1 ATOM 1882 N . PRO A 241 ? 12.34327 -16.19468 -50.19361 1.000 33.05858 N ? A ? 241 1 ATOM 1883 CA . PRO A 241 ? 13.72636 -16.44298 -50.61612 1.000 35.29523 C ? A ? 241 1 ATOM 1884 C . PRO A 241 ? 14.66692 -15.38760 -50.05019 1.000 27.99194 C ? A ? 241 1 ATOM 1885 O . PRO A 241 ? 14.30593 -14.21711 -49.90953 1.000 30.62721 O ? A ? 241 1 ATOM 1886 CB . PRO A 241 ? 13.65189 -16.36672 -52.14668 1.000 31.75555 C ? A ? 241 1 ATOM 1887 CG . PRO A 241 ? 12.20135 -16.52859 -52.48264 1.000 38.76607 C ? A ? 241 1 ATOM 1888 CD . PRO A 241 ? 11.44377 -15.95620 -51.33318 1.000 35.10926 C ? A ? 241 1 ATOM 1889 N . LEU A 242 ? 15.88236 -15.81226 -49.71823 1.000 33.11933 N ? A ? 242 1 ATOM 1890 CA . LEU A 242 ? 16.90824 -14.91312 -49.20643 1.000 32.97564 C ? A ? 242 1 ATOM 1891 C . LEU A 242 ? 17.79404 -14.48050 -50.36689 1.000 33.21882 C ? A ? 242 1 ATOM 1892 O . LEU A 242 ? 18.43754 -15.31778 -51.00864 1.000 32.74970 O ? A ? 242 1 ATOM 1893 CB . LEU A 242 ? 17.73772 -15.58039 -48.10879 1.000 30.55129 C ? A ? 242 1 ATOM 1894 CG . LEU A 242 ? 18.54769 -14.62171 -47.23069 1.000 28.58950 C ? A ? 242 1 ATOM 1895 CD1 . LEU A 242 ? 17.63252 -13.86317 -46.28122 1.000 31.89155 C ? A ? 242 1 ATOM 1896 CD2 . LEU A 242 ? 19.62615 -15.35347 -46.45905 1.000 29.48942 C ? A ? 242 1 ATOM 1897 N . THR A 243 ? 17.81500 -13.18259 -50.64000 1.000 32.47982 N ? A ? 243 1 ATOM 1898 CA . THR A 243 ? 18.58627 -12.65711 -51.75320 1.000 31.35644 C ? A ? 243 1 ATOM 1899 C . THR A 243 ? 19.96228 -12.20508 -51.27763 1.000 30.48285 C ? A ? 243 1 ATOM 1900 O . THR A 243 ? 20.21170 -12.04413 -50.08001 1.000 31.43180 O ? A ? 243 1 ATOM 1901 CB . THR A 243 ? 17.84668 -11.49779 -52.42717 1.000 38.56229 C ? A ? 243 1 ATOM 1902 OG1 . THR A 243 ? 17.79861 -10.37093 -51.54389 1.000 28.15730 O ? A ? 243 1 ATOM 1903 CG2 . THR A 243 ? 16.42726 -11.91310 -52.77093 1.000 27.61270 C ? A ? 243 1 ATOM 1904 N . GLN A 244 ? 20.86915 -12.02372 -52.24215 1.000 31.60039 N ? A ? 244 1 ATOM 1905 CA . GLN A 244 ? 22.19321 -11.50460 -51.91875 1.000 34.55434 C ? A ? 244 1 ATOM 1906 C . GLN A 244 ? 22.09865 -10.13257 -51.27131 1.000 30.75011 C ? A ? 244 1 ATOM 1907 O . GLN A 244 ? 22.92206 -9.78842 -50.41549 1.000 32.98282 O ? A ? 244 1 ATOM 1908 CB . GLN A 244 ? 23.05631 -11.44215 -53.17897 1.000 39.91559 C ? A ? 244 1 ATOM 1909 CG . GLN A 244 ? 24.45864 -10.88985 -52.95103 1.000 34.10679 C ? A ? 244 1 ATOM 1910 CD . GLN A 244 ? 25.28709 -11.76283 -52.02750 1.000 38.37074 C ? A ? 244 1 ATOM 1911 OE1 . GLN A 244 ? 25.36361 -12.97945 -52.20654 1.000 35.22045 O ? A ? 244 1 ATOM 1912 NE2 . GLN A 244 ? 25.91125 -11.14411 -51.02887 1.000 33.43777 N ? A ? 244 1 ATOM 1913 N . ASP A 245 ? 21.09386 -9.34418 -51.65747 1.000 31.51318 N ? A ? 245 1 ATOM 1914 CA . ASP A 245 ? 20.87767 -8.05021 -51.02410 1.000 32.70797 C ? A ? 245 1 ATOM 1915 C . ASP A 245 ? 20.50287 -8.20438 -49.55758 1.000 34.59344 C ? A ? 245 1 ATOM 1916 O . ASP A 245 ? 20.88466 -7.36938 -48.73102 1.000 32.08194 O ? A ? 245 1 ATOM 1917 CB . ASP A 245 ? 19.79655 -7.28398 -51.77938 1.000 45.71833 C ? A ? 245 1 ATOM 1918 CG . ASP A 245 ? 19.95683 -7.39256 -53.28664 1.000 69.17287 C ? A ? 245 1 ATOM 1919 OD1 . ASP A 245 ? 19.72569 -8.49818 -53.83570 1.000 62.97900 O ? A ? 245 1 ATOM 1920 OD2 . ASP A 245 ? 20.31272 -6.37455 -53.92102 1.000 70.02669 O ? A ? 245 1 ATOM 1921 N . HIS A 246 ? 19.76677 -9.26608 -49.21522 1.000 33.02531 N ? A ? 246 1 ATOM 1922 CA . HIS A 246 ? 19.46840 -9.54280 -47.81322 1.000 29.88828 C ? A ? 246 1 ATOM 1923 C . HIS A 246 ? 20.73222 -9.89507 -47.04057 1.000 31.62808 C ? A ? 246 1 ATOM 1924 O . HIS A 246 ? 20.90229 -9.47124 -45.89061 1.000 29.04263 O ? A ? 246 1 ATOM 1925 CB . HIS A 246 ? 18.45071 -10.67801 -47.70133 1.000 30.17564 C ? A ? 246 1 ATOM 1926 CG . HIS A 246 ? 17.07316 -10.30708 -48.15157 1.000 27.67192 C ? A ? 246 1 ATOM 1927 ND1 . HIS A 246 ? 16.22163 -11.20567 -48.75760 1.000 30.50279 N ? A ? 246 1 ATOM 1928 CD2 . HIS A 246 ? 16.39537 -9.13808 -48.07722 1.000 28.32719 C ? A ? 246 1 ATOM 1929 CE1 . HIS A 246 ? 15.08085 -10.60459 -49.04366 1.000 29.84695 C ? A ? 246 1 ATOM 1930 NE2 . HIS A 246 ? 15.16050 -9.34904 -48.64109 1.000 29.76785 N ? A ? 246 1 ATOM 1931 N . VAL A 247 ? 21.62219 -10.67984 -47.65375 1.000 28.60673 N ? A ? 247 1 ATOM 1932 CA . VAL A 247 ? 22.87082 -11.05556 -46.99741 1.000 27.55273 C ? A ? 247 1 ATOM 1933 C . VAL A 247 ? 23.72454 -9.82273 -46.72989 1.000 30.16080 C ? A ? 247 1 ATOM 1934 O . VAL A 247 ? 24.31515 -9.67976 -45.65155 1.000 31.66633 O ? A ? 247 1 ATOM 1935 CB . VAL A 247 ? 23.62380 -12.09448 -47.84849 1.000 28.40009 C ? A ? 247 1 ATOM 1936 CG1 . VAL A 247 ? 24.96349 -12.43132 -47.21338 1.000 28.27831 C ? A ? 247 1 ATOM 1937 CG2 . VAL A 247 ? 22.77379 -13.34327 -48.02931 1.000 28.90189 C ? A ? 247 1 ATOM 1938 N . ASP A 248 ? 23.81026 -8.91657 -47.70974 1.000 29.31851 N ? A ? 248 1 ATOM 1939 CA . ASP A 248 ? 24.54879 -7.67221 -47.51242 1.000 34.22289 C ? A ? 248 1 ATOM 1940 C . ASP A 248 ? 23.88794 -6.78701 -46.46050 1.000 36.43153 C ? A ? 248 1 ATOM 1941 O . ASP A 248 ? 24.57715 -6.02492 -45.77140 1.000 32.20790 O ? A ? 248 1 ATOM 1942 CB . ASP A 248 ? 24.67126 -6.91384 -48.83622 1.000 30.53676 C ? A ? 248 1 ATOM 1943 CG . ASP A 248 ? 25.50737 -7.65442 -49.86587 1.000 42.39912 C ? A ? 248 1 ATOM 1944 OD1 . ASP A 248 ? 26.23066 -8.60377 -49.48485 1.000 40.26388 O ? A ? 248 1 ATOM 1945 OD2 . ASP A 248 ? 25.44024 -7.28079 -51.05872 1.000 39.73753 O ? A ? 248 1 ATOM 1946 N . ILE A 249 ? 22.56067 -6.86882 -46.32813 1.000 32.18507 N ? A ? 249 1 ATOM 1947 CA . ILE A 249 ? 21.86164 -6.12233 -45.28545 1.000 26.93867 C ? A ? 249 1 ATOM 1948 C . ILE A 249 ? 22.24678 -6.64200 -43.90427 1.000 29.15124 C ? A ? 249 1 ATOM 1949 O . ILE A 249 ? 22.47056 -5.86113 -42.97061 1.000 34.09034 O ? A ? 249 1 ATOM 1950 CB . ILE A 249 ? 20.34011 -6.19079 -45.51707 1.000 27.44549 C ? A ? 249 1 ATOM 1951 CG1 . ILE A 249 ? 19.93924 -5.32146 -46.70855 1.000 30.84015 C ? A ? 249 1 ATOM 1952 CG2 . ILE A 249 ? 19.58125 -5.75124 -44.27649 1.000 27.25966 C ? A ? 249 1 ATOM 1953 CD1 . ILE A 249 ? 18.53966 -5.59540 -47.21831 1.000 25.86862 C ? A ? 249 1 ATOM 1954 N . LEU A 250 ? 22.34100 -7.96244 -43.75357 1.000 28.44611 N ? A ? 250 1 ATOM 1955 CA . LEU A 250 ? 22.70419 -8.58133 -42.48401 1.000 30.95929 C ? A ? 250 1 ATOM 1956 C . LEU A 250 ? 24.19326 -8.49295 -42.17713 1.000 32.89402 C ? A ? 250 1 ATOM 1957 O . LEU A 250 ? 24.62746 -9.02540 -41.14898 1.000 37.37076 O ? A ? 250 1 ATOM 1958 CB . LEU A 250 ? 22.27100 -10.04930 -42.47554 1.000 23.27715 C ? A ? 250 1 ATOM 1959 CG . LEU A 250 ? 20.76626 -10.30905 -42.44823 1.000 23.76803 C ? A ? 250 1 ATOM 1960 CD1 . LEU A 250 ? 20.48247 -11.73740 -42.85813 1.000 25.51110 C ? A ? 250 1 ATOM 1961 CD2 . LEU A 250 ? 20.20599 -10.02688 -41.06500 1.000 21.83505 C ? A ? 250 1 ATOM 1962 N . GLY A 251 ? 24.97490 -7.83938 -43.03305 1.000 33.65098 N ? A ? 251 1 ATOM 1963 CA . GLY A 251 ? 26.41075 -7.76635 -42.88534 1.000 35.29819 C ? A ? 251 1 ATOM 1964 C . GLY A 251 ? 26.90208 -7.23458 -41.55132 1.000 30.76685 C ? A ? 251 1 ATOM 1965 O . GLY A 251 ? 27.69892 -7.88131 -40.86461 1.000 29.78302 O ? A ? 251 1 ATOM 1966 N . PRO A 252 ? 26.46551 -6.02628 -41.17456 1.000 35.66217 N ? A ? 252 1 ATOM 1967 CA . PRO A 252 ? 26.86091 -5.47981 -39.86294 1.000 32.52276 C ? A ? 252 1 ATOM 1968 C . PRO A 252 ? 26.57172 -6.40070 -38.68474 1.000 31.26479 C ? A ? 252 1 ATOM 1969 O . PRO A 252 ? 27.37838 -6.46537 -37.74842 1.000 36.61991 O ? A ? 252 1 ATOM 1970 CB . PRO A 252 ? 26.04760 -4.18205 -39.77981 1.000 31.06634 C ? A ? 252 1 ATOM 1971 CG . PRO A 252 ? 25.90595 -3.75319 -41.19048 1.000 35.54665 C ? A ? 252 1 ATOM 1972 CD . PRO A 252 ? 25.79065 -5.01465 -42.00758 1.000 36.19401 C ? A ? 252 1 ATOM 1973 N . LEU A 253 ? 25.44060 -7.10998 -38.69323 1.000 33.14521 N ? A ? 253 1 ATOM 1974 CA . LEU A 253 ? 25.17564 -8.06393 -37.61997 1.000 34.45116 C ? A ? 253 1 ATOM 1975 C . LEU A 253 ? 26.15743 -9.22724 -37.66354 1.000 30.18607 C ? A ? 253 1 ATOM 1976 O . LEU A 253 ? 26.55121 -9.75373 -36.61667 1.000 35.18491 O ? A ? 253 1 ATOM 1977 CB . LEU A 253 ? 23.73567 -8.56510 -37.70257 1.000 27.97034 C ? A ? 253 1 ATOM 1978 CG . LEU A 253 ? 22.67703 -7.51086 -37.37598 1.000 29.29197 C ? A ? 253 1 ATOM 1979 CD1 . LEU A 253 ? 21.28203 -8.08132 -37.54777 1.000 27.53637 C ? A ? 253 1 ATOM 1980 CD2 . LEU A 253 ? 22.87807 -6.97567 -35.96089 1.000 31.89765 C ? A ? 253 1 ATOM 1981 N . SER A 254 ? 26.56833 -9.63703 -38.86432 1.000 33.21974 N ? A ? 254 1 ATOM 1982 C . SER A 254 ? 28.90799 -10.28076 -38.44761 1.000 35.46043 C ? A ? 254 1 ATOM 1983 O . SER A 254 ? 29.62288 -11.08165 -37.83474 1.000 44.37491 O ? A ? 254 1 ATOM 1984 CA A SER A 254 ? 27.54722 -10.71140 -38.98214 0.487 34.52262 C ? A ? 254 1 ATOM 1985 CB A SER A 254 ? 27.65484 -11.15782 -40.43920 0.487 32.54262 C ? A ? 254 1 ATOM 1986 OG A SER A 254 ? 28.67095 -12.12980 -40.60078 0.487 34.29395 O ? A ? 254 1 ATOM 1987 CA B SER A 254 ? 27.54597 -10.71400 -38.97710 0.513 34.52183 C ? A ? 254 1 ATOM 1988 CB B SER A 254 ? 27.65670 -11.17802 -40.42996 0.513 32.54423 C ? A ? 254 1 ATOM 1989 OG B SER A 254 ? 28.30949 -10.20764 -41.23077 0.513 29.64711 O ? A ? 254 1 ATOM 1990 N . ALA A 255 ? 29.28161 -9.01693 -38.66853 1.000 41.41897 N ? A ? 255 1 ATOM 1991 CA . ALA A 255 ? 30.56656 -8.52328 -38.18149 1.000 35.96603 C ? A ? 255 1 ATOM 1992 C . ALA A 255 ? 30.56589 -8.37049 -36.66635 1.000 42.33525 C ? A ? 255 1 ATOM 1993 O . ALA A 255 ? 31.56648 -8.67410 -36.00567 1.000 48.14625 O ? A ? 255 1 ATOM 1994 CB . ALA A 255 ? 30.90352 -7.18990 -38.84689 1.000 41.40018 C ? A ? 255 1 ATOM 1995 N . GLN A 256 ? 29.45473 -7.89507 -36.09905 1.000 42.18842 N ? A ? 256 1 ATOM 1996 CA . GLN A 256 ? 29.39200 -7.68953 -34.65547 1.000 43.33392 C ? A ? 256 1 ATOM 1997 C . GLN A 256 ? 29.45702 -9.01305 -33.90310 1.000 41.37659 C ? A ? 256 1 ATOM 1998 O . GLN A 256 ? 30.08713 -9.10231 -32.84278 1.000 38.21806 O ? A ? 256 1 ATOM 1999 CB . GLN A 256 ? 28.12005 -6.92366 -34.28824 1.000 35.46796 C ? A ? 256 1 ATOM 2000 CG . GLN A 256 ? 28.01177 -6.58244 -32.80887 1.000 40.65290 C ? A ? 256 1 ATOM 2001 CD . GLN A 256 ? 26.76090 -5.78887 -32.48068 1.000 53.67384 C ? A ? 256 1 ATOM 2002 OE1 . GLN A 256 ? 26.13402 -5.20310 -33.36429 1.000 54.43513 O ? A ? 256 1 ATOM 2003 NE2 . GLN A 256 ? 26.38885 -5.76867 -31.20350 1.000 49.12468 N ? A ? 256 1 ATOM 2004 N . THR A 257 ? 28.81469 -10.05248 -34.43615 1.000 42.23436 N ? A ? 257 1 ATOM 2005 CA . THR A 257 ? 28.80208 -11.35722 -33.79020 1.000 39.24439 C ? A ? 257 1 ATOM 2006 C . THR A 257 ? 29.91762 -12.27407 -34.27238 1.000 42.20951 C ? A ? 257 1 ATOM 2007 O . THR A 257 ? 30.24483 -13.24267 -33.57648 1.000 40.21157 O ? A ? 257 1 ATOM 2008 CB . THR A 257 ? 27.45645 -12.05315 -34.02086 1.000 36.36842 C ? A ? 257 1 ATOM 2009 OG1 . THR A 257 ? 27.26889 -12.27496 -35.42241 1.000 35.43409 O ? A ? 257 1 ATOM 2010 CG2 . THR A 257 ? 26.31407 -11.19689 -33.50012 1.000 34.46324 C ? A ? 257 1 ATOM 2011 N . GLY A 258 ? 30.50720 -11.99620 -35.43604 1.000 36.70094 N ? A ? 258 1 ATOM 2012 CA . GLY A 258 ? 31.49365 -12.88523 -36.01878 1.000 46.72459 C ? A ? 258 1 ATOM 2013 C . GLY A 258 ? 30.92082 -14.12651 -36.66575 1.000 42.54792 C ? A ? 258 1 ATOM 2014 O . GLY A 258 ? 31.67350 -15.06236 -36.95728 1.000 46.97516 O ? A ? 258 1 ATOM 2015 N . ILE A 259 ? 29.61488 -14.16543 -36.90405 1.000 38.16110 N ? A ? 259 1 ATOM 2016 CA . ILE A 259 ? 28.94784 -15.31527 -37.50145 1.000 44.86273 C ? A ? 259 1 ATOM 2017 C . ILE A 259 ? 28.48679 -14.91138 -38.89396 1.000 39.27800 C ? A ? 259 1 ATOM 2018 O . ILE A 259 ? 27.60994 -14.05050 -39.04226 1.000 29.07526 O ? A ? 259 1 ATOM 2019 CB . ILE A 259 ? 27.77325 -15.79645 -36.64266 1.000 36.66835 C ? A ? 259 1 ATOM 2020 CG1 . ILE A 259 ? 28.27111 -16.14293 -35.23811 1.000 32.09428 C ? A ? 259 1 ATOM 2021 CG2 . ILE A 259 ? 27.09850 -16.98806 -37.29592 1.000 31.79781 C ? A ? 259 1 ATOM 2022 CD1 . ILE A 259 ? 27.17653 -16.31373 -34.22487 1.000 33.91275 C ? A ? 259 1 ATOM 2023 N . ALA A 260 ? 29.08489 -15.52771 -39.91251 1.000 38.11840 N ? A ? 260 1 ATOM 2024 CA . ALA A 260 ? 28.71496 -15.24504 -41.29108 1.000 31.94113 C ? A ? 260 1 ATOM 2025 C . ALA A 260 ? 27.24188 -15.55601 -41.52834 1.000 35.29660 C ? A ? 260 1 ATOM 2026 O . ALA A 260 ? 26.65293 -16.43299 -40.88735 1.000 32.48381 O ? A ? 260 1 ATOM 2027 CB . ALA A 260 ? 29.58345 -16.05344 -42.25491 1.000 36.02916 C ? A ? 260 1 ATOM 2028 N . VAL A 261 ? 26.64767 -14.81575 -42.46685 1.000 33.95531 N ? A ? 261 1 ATOM 2029 CA . VAL A 261 ? 25.22130 -14.95594 -42.74292 1.000 28.36441 C ? A ? 261 1 ATOM 2030 C . VAL A 261 ? 24.89791 -16.37842 -43.18192 1.000 27.64437 C ? A ? 261 1 ATOM 2031 O . VAL A 261 ? 23.93641 -16.98641 -42.69885 1.000 31.06187 O ? A ? 261 1 ATOM 2032 CB . VAL A 261 ? 24.77953 -13.91575 -43.79026 1.000 31.74841 C ? A ? 261 1 ATOM 2033 CG1 . VAL A 261 ? 23.34085 -14.15569 -44.21975 1.000 29.55920 C ? A ? 261 1 ATOM 2034 CG2 . VAL A 261 ? 24.93618 -12.50212 -43.23379 1.000 32.51999 C ? A ? 261 1 ATOM 2035 N . LEU A 262 ? 25.70372 -16.94193 -44.08594 1.000 35.72366 N ? A ? 262 1 ATOM 2036 CA . LEU A 262 ? 25.45439 -18.31106 -44.52471 1.000 33.02508 C ? A ? 262 1 ATOM 2037 C . LEU A 262 ? 25.61933 -19.31782 -43.39098 1.000 35.75122 C ? A ? 262 1 ATOM 2038 O . LEU A 262 ? 25.02963 -20.40251 -43.44964 1.000 38.17178 O ? A ? 262 1 ATOM 2039 CB . LEU A 262 ? 26.36911 -18.66501 -45.69905 1.000 33.23155 C ? A ? 262 1 ATOM 2040 CG . LEU A 262 ? 26.05037 -17.89828 -46.98879 1.000 35.12408 C ? A ? 262 1 ATOM 2041 CD1 . LEU A 262 ? 26.84048 -18.41914 -48.18295 1.000 35.69548 C ? A ? 262 1 ATOM 2042 CD2 . LEU A 262 ? 24.56001 -17.93885 -47.28054 1.000 31.00808 C ? A ? 262 1 ATOM 2043 N . ASP A 263 ? 26.39254 -18.98108 -42.35576 1.000 35.48412 N ? A ? 263 1 ATOM 2044 CA . ASP A 263 ? 26.46459 -19.84670 -41.18331 1.000 40.50337 C ? A ? 263 1 ATOM 2045 C . ASP A 263 ? 25.17813 -19.77538 -40.36981 1.000 39.31017 C ? A ? 263 1 ATOM 2046 O . ASP A 263 ? 24.66841 -20.80572 -39.91265 1.000 37.34871 O ? A ? 263 1 ATOM 2047 CB . ASP A 263 ? 27.67027 -19.46858 -40.32272 1.000 40.72341 C ? A ? 263 1 ATOM 2048 CG . ASP A 263 ? 28.98796 -19.69702 -41.03529 1.000 47.51639 C ? A ? 263 1 ATOM 2049 OD1 . ASP A 263 ? 28.96730 -19.89949 -42.26676 1.000 57.09309 O ? A ? 263 1 ATOM 2050 OD2 . ASP A 263 ? 30.04249 -19.68423 -40.36477 1.000 55.39834 O ? A ? 263 1 ATOM 2051 N . MET A 264 ? 24.63869 -18.56608 -40.18204 1.000 33.96834 N ? A ? 264 1 ATOM 2052 CA . MET A 264 ? 23.37004 -18.41470 -39.47769 1.000 33.28634 C ? A ? 264 1 ATOM 2053 C . MET A 264 ? 22.21648 -19.03993 -40.25723 1.000 34.15474 C ? A ? 264 1 ATOM 2054 O . MET A 264 ? 21.28662 -19.58418 -39.64984 1.000 31.14412 O ? A ? 264 1 ATOM 2055 CB . MET A 264 ? 23.10104 -16.93081 -39.20635 1.000 33.12312 C ? A ? 264 1 ATOM 2056 CG . MET A 264 ? 21.91332 -16.64904 -38.29139 1.000 36.04337 C ? A ? 264 1 ATOM 2057 SD . MET A 264 ? 22.18132 -17.16250 -36.58280 1.000 37.38617 S ? A ? 264 1 ATOM 2058 CE . MET A 264 ? 23.47002 -16.02886 -36.06265 1.000 36.12129 C ? A ? 264 1 ATOM 2059 N . CYS A 265 ? 22.25428 -18.97204 -41.59386 1.000 28.15320 N ? A ? 265 1 ATOM 2060 CA . CYS A 265 ? 21.24574 -19.65882 -42.39847 1.000 29.02932 C ? A ? 265 1 ATOM 2061 C . CYS A 265 ? 21.25340 -21.15719 -42.13041 1.000 29.15221 C ? A ? 265 1 ATOM 2062 O . CYS A 265 ? 20.19411 -21.79477 -42.09844 1.000 31.58871 O ? A ? 265 1 ATOM 2063 CB . CYS A 265 ? 21.47734 -19.39302 -43.88497 1.000 27.06777 C ? A ? 265 1 ATOM 2064 SG . CYS A 265 ? 21.21501 -17.69141 -44.41019 1.000 39.77624 S ? A ? 265 1 ATOM 2065 N . ALA A 266 ? 22.44332 -21.73768 -41.95028 1.000 30.58266 N ? A ? 266 1 ATOM 2066 CA . ALA A 266 ? 22.53906 -23.15302 -41.61190 1.000 32.91630 C ? A ? 266 1 ATOM 2067 C . ALA A 266 ? 21.87027 -23.44642 -40.27409 1.000 36.51383 C ? A ? 266 1 ATOM 2068 O . ALA A 266 ? 21.22460 -24.48845 -40.11244 1.000 33.97310 O ? A ? 266 1 ATOM 2069 CB . ALA A 266 ? 24.00542 -23.58451 -41.58953 1.000 35.36020 C ? A ? 266 1 ATOM 2070 N . SER A 267 ? 22.02033 -22.53941 -39.30091 1.000 37.66754 N ? A ? 267 1 ATOM 2071 CA . SER A 267 ? 21.34591 -22.69799 -38.01435 1.000 35.03887 C ? A ? 267 1 ATOM 2072 C . SER A 267 ? 19.83486 -22.60613 -38.17192 1.000 30.70703 C ? A ? 267 1 ATOM 2073 O . SER A 267 ? 19.08914 -23.39638 -37.58188 1.000 35.48845 O ? A ? 267 1 ATOM 2074 CB . SER A 267 ? 21.83919 -21.64290 -37.02331 1.000 31.15439 C ? A ? 267 1 ATOM 2075 OG . SER A 267 ? 23.20029 -21.84098 -36.69784 1.000 40.30081 O ? A ? 267 1 ATOM 2076 N . LEU A 268 ? 19.36220 -21.63212 -38.95569 1.000 29.54892 N ? A ? 268 1 ATOM 2077 CA . LEU A 268 ? 17.92800 -21.51728 -39.19808 1.000 36.76067 C ? A ? 268 1 ATOM 2078 C . LEU A 268 ? 17.40515 -22.69680 -40.00781 1.000 34.74332 C ? A ? 268 1 ATOM 2079 O . LEU A 268 ? 16.25631 -23.11455 -39.82340 1.000 36.76867 O ? A ? 268 1 ATOM 2080 CB . LEU A 268 ? 17.61454 -20.19601 -39.90615 1.000 31.52719 C ? A ? 268 1 ATOM 2081 CG . LEU A 268 ? 16.16461 -19.99070 -40.35814 1.000 28.19317 C ? A ? 268 1 ATOM 2082 CD1 . LEU A 268 ? 15.21509 -20.03244 -39.17291 1.000 31.40015 C ? A ? 268 1 ATOM 2083 CD2 . LEU A 268 ? 16.00460 -18.68701 -41.12555 1.000 32.99816 C ? A ? 268 1 ATOM 2084 N . LYS A 269 ? 18.23377 -23.25227 -40.89640 1.000 30.65898 N ? A ? 269 1 ATOM 2085 CA . LYS A 269 ? 17.81538 -24.41330 -41.67656 1.000 39.93131 C ? A ? 269 1 ATOM 2086 C . LYS A 269 ? 17.48410 -25.59456 -40.77224 1.000 39.72315 C ? A ? 269 1 ATOM 2087 O . LYS A 269 ? 16.54106 -26.34679 -41.04103 1.000 36.24600 O ? A ? 269 1 ATOM 2088 CB . LYS A 269 ? 18.90775 -24.79461 -42.67802 1.000 43.23876 C ? A ? 269 1 ATOM 2089 CG . LYS A 269 ? 18.47654 -25.82073 -43.72096 1.000 54.15926 C ? A ? 269 1 ATOM 2090 CD . LYS A 269 ? 19.64315 -26.25857 -44.59689 1.000 48.45411 C ? A ? 269 1 ATOM 2091 CE . LYS A 269 ? 20.22820 -27.58813 -44.12958 1.000 70.23063 C ? A ? 269 1 ATOM 2092 NZ . LYS A 269 ? 19.41366 -28.76660 -44.56264 1.000 70.26697 N ? A ? 269 1 ATOM 2093 N . GLU A 270 ? 18.24739 -25.77156 -39.69189 1.000 50.82962 N ? A ? 270 1 ATOM 2094 CA . GLU A 270 ? 17.99518 -26.87279 -38.76965 1.000 46.22790 C ? A ? 270 1 ATOM 2095 C . GLU A 270 ? 16.80639 -26.58938 -37.85668 1.000 47.34668 C ? A ? 270 1 ATOM 2096 O . GLU A 270 ? 16.05830 -27.51409 -37.51360 1.000 43.99637 O ? A ? 270 1 ATOM 2097 CB . GLU A 270 ? 19.25784 -27.15503 -37.95125 1.000 42.37894 C ? A ? 270 1 ATOM 2098 CG . GLU A 270 ? 19.03625 -27.96145 -36.69085 1.000 52.90045 C ? A ? 270 1 ATOM 2099 CD . GLU A 270 ? 20.31407 -28.59064 -36.17522 1.000 71.37482 C ? A ? 270 1 ATOM 2100 OE1 . GLU A 270 ? 21.04657 -29.19523 -36.98694 1.000 87.61614 O ? A ? 270 1 ATOM 2101 OE2 . GLU A 270 ? 20.59082 -28.47519 -34.96183 1.000 67.98058 O ? A ? 270 1 ATOM 2102 N . LEU A 271 ? 16.60980 -25.32452 -37.46791 1.000 48.18023 N ? A ? 271 1 ATOM 2103 CA . LEU A 271 ? 15.46935 -24.97108 -36.62676 1.000 43.24909 C ? A ? 271 1 ATOM 2104 C . LEU A 271 ? 14.14752 -25.23192 -37.34039 1.000 40.37391 C ? A ? 271 1 ATOM 2105 O . LEU A 271 ? 13.17195 -25.66436 -36.71635 1.000 42.79449 O ? A ? 271 1 ATOM 2106 CB . LEU A 271 ? 15.56271 -23.50489 -36.20385 1.000 35.93022 C ? A ? 271 1 ATOM 2107 CG . LEU A 271 ? 16.67266 -23.11025 -35.22866 1.000 40.38078 C ? A ? 271 1 ATOM 2108 CD1 . LEU A 271 ? 16.69112 -21.59869 -35.02057 1.000 40.80734 C ? A ? 271 1 ATOM 2109 CD2 . LEU A 271 ? 16.49769 -23.83474 -33.90313 1.000 45.04432 C ? A ? 271 1 ATOM 2110 N . LEU A 272 ? 14.08915 -24.96565 -38.64688 1.000 36.43307 N ? A ? 272 1 ATOM 2111 CA . LEU A 272 ? 12.84497 -25.18354 -39.37639 1.000 41.83386 C ? A ? 272 1 ATOM 2112 C . LEU A 272 ? 12.52731 -26.66665 -39.51042 1.000 44.86951 C ? A ? 272 1 ATOM 2113 O . LEU A 272 ? 11.35295 -27.05261 -39.47776 1.000 39.94184 O ? A ? 272 1 ATOM 2114 CB . LEU A 272 ? 12.92223 -24.52612 -40.75335 1.000 37.54143 C ? A ? 272 1 ATOM 2115 CG . LEU A 272 ? 13.05612 -23.00086 -40.77019 1.000 38.20414 C ? A ? 272 1 ATOM 2116 CD1 . LEU A 272 ? 13.26889 -22.50602 -42.19085 1.000 34.57051 C ? A ? 272 1 ATOM 2117 CD2 . LEU A 272 ? 11.83174 -22.34772 -40.14722 1.000 31.39696 C ? A ? 272 1 ATOM 2118 N . GLN A 273 ? 13.55403 -27.50767 -39.63692 1.000 45.22339 N ? A ? 273 1 ATOM 2119 CA . GLN A 273 ? 13.36543 -28.93668 -39.84595 1.000 41.24594 C ? A ? 273 1 ATOM 2120 C . GLN A 273 ? 13.19083 -29.71262 -38.55048 1.000 49.26228 C ? A ? 273 1 ATOM 2121 O . GLN A 273 ? 12.44817 -30.70227 -38.52660 1.000 53.91102 O ? A ? 273 1 ATOM 2122 CB . GLN A 273 ? 14.55573 -29.50742 -40.61655 1.000 49.08557 C ? A ? 273 1 ATOM 2123 CG . GLN A 273 ? 14.75474 -28.86254 -41.96439 1.000 47.39791 C ? A ? 273 1 ATOM 2124 CD . GLN A 273 ? 16.09541 -29.19908 -42.57590 1.000 54.69543 C ? A ? 273 1 ATOM 2125 OE1 . GLN A 273 ? 17.06164 -29.47294 -41.86601 1.000 54.91334 O ? A ? 273 1 ATOM 2126 NE2 . GLN A 273 ? 16.16129 -29.18576 -43.90333 1.000 54.91930 N ? A ? 273 1 ATOM 2127 N . ASN A 274 ? 13.87113 -29.30077 -37.48044 1.000 48.25453 N ? A ? 274 1 ATOM 2128 CA . ASN A 274 ? 13.80349 -30.00009 -36.20774 1.000 44.58417 C ? A ? 274 1 ATOM 2129 C . ASN A 274 ? 12.86879 -29.33855 -35.20278 1.000 48.19296 C ? A ? 274 1 ATOM 2130 O . ASN A 274 ? 12.59924 -29.92888 -34.15697 1.000 50.03125 O ? A ? 274 1 ATOM 2131 CB . ASN A 274 ? 15.20464 -30.11449 -35.58806 1.000 47.84361 C ? A ? 274 1 ATOM 2132 CG . ASN A 274 ? 16.22813 -30.71418 -36.54269 1.000 54.55696 C ? A ? 274 1 ATOM 2133 OD1 . ASN A 274 ? 15.89027 -31.16886 -37.63584 1.000 57.89803 O ? A ? 274 1 ATOM 2134 ND2 . ASN A 274 ? 17.48838 -30.72915 -36.12135 1.000 52.97032 N ? A ? 274 1 ATOM 2135 N . GLY A 275 ? 12.37375 -28.14183 -35.47634 1.000 45.03101 N ? A ? 275 1 ATOM 2136 CA . GLY A 275 ? 11.64416 -27.39666 -34.47134 1.000 44.86826 C ? A ? 275 1 ATOM 2137 C . GLY A 275 ? 12.59546 -26.90211 -33.39874 1.000 50.13257 C ? A ? 275 1 ATOM 2138 O . GLY A 275 ? 13.81780 -27.05079 -33.47919 1.000 45.88047 O ? A ? 275 1 ATOM 2139 N . MET A 276 ? 12.00883 -26.29758 -32.36975 1.000 51.48034 N ? A ? 276 1 ATOM 2140 CA . MET A 276 ? 12.77680 -25.78381 -31.24763 1.000 40.11388 C ? A ? 276 1 ATOM 2141 C . MET A 276 ? 12.78851 -26.72500 -30.04900 1.000 56.50215 C ? A ? 276 1 ATOM 2142 O . MET A 276 ? 13.43131 -26.40827 -29.04459 1.000 58.57889 O ? A ? 276 1 ATOM 2143 CB . MET A 276 ? 12.24463 -24.40865 -30.83539 1.000 42.38357 C ? A ? 276 1 ATOM 2144 CG . MET A 276 ? 12.50186 -23.32770 -31.87651 1.000 45.43391 C ? A ? 276 1 ATOM 2145 SD . MET A 276 ? 11.65392 -21.77070 -31.54001 1.000 54.57543 S ? A ? 276 1 ATOM 2146 CE . MET A 276 ? 12.32668 -21.36021 -29.93389 1.000 44.38493 C ? A ? 276 1 ATOM 2147 N . ASN A 277 ? 12.10087 -27.86845 -30.12680 1.000 52.93921 N ? A ? 277 1 ATOM 2148 CA . ASN A 277 ? 12.13531 -28.88596 -29.06851 1.000 57.30492 C ? A ? 277 1 ATOM 2149 C . ASN A 277 ? 11.70988 -28.32052 -27.71237 1.000 62.31532 C ? A ? 277 1 ATOM 2150 O . ASN A 277 ? 12.22399 -28.72024 -26.66433 1.000 63.47934 O ? A ? 277 1 ATOM 2151 CB . ASN A 277 ? 13.52151 -29.53246 -28.96606 1.000 68.05183 C ? A ? 277 1 ATOM 2152 CG . ASN A 277 ? 13.65765 -30.77285 -29.82986 1.000 74.35848 C ? A ? 277 1 ATOM 2153 OD1 . ASN A 277 ? 13.78117 -30.68147 -31.05140 1.000 69.24821 O ? A ? 277 1 ATOM 2154 ND2 . ASN A 277 ? 13.64869 -31.94171 -29.19497 1.000 59.06710 N ? A ? 277 1 ATOM 2155 N . GLY A 278 ? 10.76464 -27.38281 -27.72778 1.000 58.64687 N ? A ? 278 1 ATOM 2156 CA . GLY A 278 ? 10.28933 -26.79615 -26.49109 1.000 58.43666 C ? A ? 278 1 ATOM 2157 C . GLY A 278 ? 11.22897 -25.80764 -25.83996 1.000 62.13707 C ? A ? 278 1 ATOM 2158 O . GLY A 278 ? 10.97775 -25.39445 -24.70254 1.000 53.81808 O ? A ? 278 1 ATOM 2159 N . ARG A 279 ? 12.30843 -25.42318 -26.51543 1.000 56.97139 N ? A ? 279 1 ATOM 2160 CA . ARG A 279 ? 13.20895 -24.40102 -26.01033 1.000 50.96996 C ? A ? 279 1 ATOM 2161 C . ARG A 279 ? 12.69971 -23.01893 -26.40509 1.000 53.22865 C ? A ? 279 1 ATOM 2162 O . ARG A 279 ? 11.76501 -22.87169 -27.19489 1.000 48.26249 O ? A ? 279 1 ATOM 2163 CB . ARG A 279 ? 14.62724 -24.61448 -26.53943 1.000 53.25471 C ? A ? 279 1 ATOM 2164 CG . ARG A 279 ? 15.17156 -26.00902 -26.30858 1.000 47.53384 C ? A ? 279 1 ATOM 2165 CD . ARG A 279 ? 16.66079 -26.07184 -26.58516 1.000 50.88033 C ? A ? 279 1 ATOM 2166 NE . ARG A 279 ? 17.40542 -25.14271 -25.74352 1.000 48.78472 N ? A ? 279 1 ATOM 2167 CZ . ARG A 279 ? 18.70005 -25.24744 -25.47582 1.000 56.28303 C ? A ? 279 1 ATOM 2168 NH1 . ARG A 279 ? 19.42758 -26.24236 -25.96075 1.000 49.27068 N ? A ? 279 1 ATOM 2169 NH2 . ARG A 279 ? 19.27773 -24.33488 -24.69716 1.000 51.71197 N ? A ? 279 1 ATOM 2170 N . THR A 280 ? 13.32779 -21.99433 -25.84066 1.000 54.39424 N ? A ? 280 1 ATOM 2171 CA . THR A 280 ? 12.97145 -20.61596 -26.12865 1.000 47.68325 C ? A ? 280 1 ATOM 2172 C . THR A 280 ? 14.18178 -19.86203 -26.65583 1.000 44.22786 C ? A ? 280 1 ATOM 2173 O . THR A 280 ? 15.32729 -20.15664 -26.30282 1.000 49.78075 O ? A ? 280 1 ATOM 2174 CB . THR A 280 ? 12.42075 -19.89788 -24.88997 1.000 38.61546 C ? A ? 280 1 ATOM 2175 OG1 . THR A 280 ? 13.33834 -20.04529 -23.79988 1.000 61.52210 O ? A ? 280 1 ATOM 2176 CG2 . THR A 280 ? 11.07135 -20.47192 -24.49981 1.000 43.20723 C ? A ? 280 1 ATOM 2177 N . ILE A 281 ? 13.90754 -18.89001 -27.51618 1.000 42.77615 N ? A ? 281 1 ATOM 2178 CA . ILE A 281 ? 14.90802 -17.96822 -28.03119 1.000 36.14274 C ? A ? 281 1 ATOM 2179 C . ILE A 281 ? 14.42669 -16.56311 -27.69762 1.000 34.46032 C ? A ? 281 1 ATOM 2180 O . ILE A 281 ? 13.35415 -16.14743 -28.15433 1.000 34.36745 O ? A ? 281 1 ATOM 2181 CB . ILE A 281 ? 15.11859 -18.15059 -29.54165 1.000 29.84201 C ? A ? 281 1 ATOM 2182 CG1 . ILE A 281 ? 15.55513 -19.58656 -29.84337 1.000 35.84397 C ? A ? 281 1 ATOM 2183 CG2 . ILE A 281 ? 16.13686 -17.16140 -30.06660 1.000 33.18246 C ? A ? 281 1 ATOM 2184 CD1 . ILE A 281 ? 15.79811 -19.86491 -31.31072 1.000 28.91435 C ? A ? 281 1 ATOM 2185 N . LEU A 282 ? 15.19852 -15.84861 -26.87619 1.000 33.18704 N ? A ? 282 1 ATOM 2186 CA . LEU A 282 ? 14.82410 -14.51158 -26.40833 1.000 30.55184 C ? A ? 282 1 ATOM 2187 C . LEU A 282 ? 13.43466 -14.51118 -25.77498 1.000 32.06847 C ? A ? 282 1 ATOM 2188 O . LEU A 282 ? 12.61927 -13.61899 -26.01520 1.000 31.78468 O ? A ? 282 1 ATOM 2189 CB . LEU A 282 ? 14.89880 -13.48775 -27.54435 1.000 28.50615 C ? A ? 282 1 ATOM 2190 CG . LEU A 282 ? 16.28513 -13.13502 -28.08298 1.000 27.41370 C ? A ? 282 1 ATOM 2191 CD1 . LEU A 282 ? 16.16889 -12.19001 -29.27012 1.000 26.85356 C ? A ? 282 1 ATOM 2192 CD2 . LEU A 282 ? 17.13881 -12.51763 -26.98897 1.000 30.67131 C ? A ? 282 1 ATOM 2193 N . GLY A 283 ? 13.15654 -15.52871 -24.96397 1.000 34.06819 N ? A ? 283 1 ATOM 2194 CA . GLY A 283 ? 11.85887 -15.62165 -24.32487 1.000 36.01227 C ? A ? 283 1 ATOM 2195 C . GLY A 283 ? 10.70297 -15.90664 -25.25616 1.000 36.72901 C ? A ? 283 1 ATOM 2196 O . GLY A 283 ? 9.54917 -15.66507 -24.88816 1.000 39.44642 O ? A ? 283 1 ATOM 2197 N . SER A 284 ? 10.97526 -16.41549 -26.45522 1.000 36.25879 N ? A ? 284 1 ATOM 2198 CA . SER A 284 ? 9.94191 -16.74725 -27.42455 1.000 33.28441 C ? A ? 284 1 ATOM 2199 C . SER A 284 ? 10.04651 -18.21765 -27.79826 1.000 35.27197 C ? A ? 284 1 ATOM 2200 O . SER A 284 ? 11.14682 -18.73942 -28.00075 1.000 33.26604 O ? A ? 284 1 ATOM 2201 CB . SER A 284 ? 10.05605 -15.88053 -28.68291 1.000 32.11323 C ? A ? 284 1 ATOM 2202 OG . SER A 284 ? 9.12042 -16.28898 -29.66567 1.000 38.66218 O ? A ? 284 1 ATOM 2203 N . ALA A 285 ? 8.89709 -18.88130 -27.88525 1.000 40.36248 N ? A ? 285 1 ATOM 2204 CA . ALA A 285 ? 8.83238 -20.27397 -28.30356 1.000 37.10580 C ? A ? 285 1 ATOM 2205 C . ALA A 285 ? 8.59652 -20.42540 -29.79856 1.000 34.83485 C ? A ? 285 1 ATOM 2206 O . ALA A 285 ? 8.48914 -21.55616 -30.28324 1.000 37.01802 O ? A ? 285 1 ATOM 2207 CB . ALA A 285 ? 7.73680 -21.00833 -27.52559 1.000 39.64583 C ? A ? 285 1 ATOM 2208 N . LEU A 286 ? 8.51003 -19.31690 -30.52980 1.000 33.79706 N ? A ? 286 1 ATOM 2209 CA . LEU A 286 ? 8.37292 -19.30811 -31.97686 1.000 31.23419 C ? A ? 286 1 ATOM 2210 C . LEU A 286 ? 9.48121 -18.45549 -32.57476 1.000 37.40587 C ? A ? 286 1 ATOM 2211 O . LEU A 286 ? 10.16992 -17.71001 -31.87450 1.000 37.19040 O ? A ? 286 1 ATOM 2212 CB . LEU A 286 ? 7.01257 -18.75293 -32.41341 1.000 34.83149 C ? A ? 286 1 ATOM 2213 CG . LEU A 286 ? 5.76648 -19.33076 -31.75825 1.000 37.34757 C ? A ? 286 1 ATOM 2214 CD1 . LEU A 286 ? 4.57964 -18.42342 -32.02908 1.000 35.85955 C ? A ? 286 1 ATOM 2215 CD2 . LEU A 286 ? 5.51011 -20.73403 -32.27892 1.000 47.26304 C ? A ? 286 1 ATOM 2216 N . LEU A 287 ? 9.63306 -18.55312 -33.89079 1.000 35.21649 N ? A ? 287 1 ATOM 2217 CA . LEU A 287 ? 10.56923 -17.70105 -34.60899 1.000 32.41357 C ? A ? 287 1 ATOM 2218 C . LEU A 287 ? 9.91379 -16.35066 -34.88425 1.000 29.76971 C ? A ? 287 1 ATOM 2219 O . LEU A 287 ? 8.83194 -16.28593 -35.47777 1.000 28.57510 O ? A ? 287 1 ATOM 2220 CB . LEU A 287 ? 11.01592 -18.38060 -35.90083 1.000 31.72255 C ? A ? 287 1 ATOM 2221 CG . LEU A 287 ? 11.79925 -19.67904 -35.69110 1.000 32.33622 C ? A ? 287 1 ATOM 2222 CD1 . LEU A 287 ? 12.16013 -20.31762 -37.01665 1.000 33.82086 C ? A ? 287 1 ATOM 2223 CD2 . LEU A 287 ? 13.05041 -19.42765 -34.86871 1.000 29.93225 C ? A ? 287 1 ATOM 2224 N A GLU A 288 ? 10.56803 -15.27680 -34.44832 0.402 27.49207 N ? A ? 288 1 ATOM 2225 CA A GLU A 288 ? 10.04269 -13.92630 -34.59224 0.402 27.11247 C ? A ? 288 1 ATOM 2226 C A GLU A 288 ? 10.51163 -13.32316 -35.91064 0.402 23.47945 C ? A ? 288 1 ATOM 2227 O A GLU A 288 ? 11.70898 -13.33504 -36.21486 0.402 22.05353 O ? A ? 288 1 ATOM 2228 CB A GLU A 288 ? 10.49254 -13.05114 -33.42148 0.402 24.92697 C ? A ? 288 1 ATOM 2229 CG A GLU A 288 ? 9.95146 -11.63154 -33.45945 0.402 30.42620 C ? A ? 288 1 ATOM 2230 CD A GLU A 288 ? 8.49388 -11.55124 -33.05755 0.402 31.36061 C ? A ? 288 1 ATOM 2231 OE1 A GLU A 288 ? 8.12449 -12.16600 -32.03485 0.402 36.15409 O ? A ? 288 1 ATOM 2232 OE2 A GLU A 288 ? 7.71743 -10.87832 -33.76600 0.402 28.91638 O ? A ? 288 1 ATOM 2233 N B GLU A 288 ? 10.57088 -15.27547 -34.45599 0.598 27.50326 N ? A ? 288 1 ATOM 2234 CA B GLU A 288 ? 10.03876 -13.92598 -34.58918 0.598 26.76574 C ? A ? 288 1 ATOM 2235 C B GLU A 288 ? 10.51268 -13.30038 -35.89610 0.598 23.68079 C ? A ? 288 1 ATOM 2236 O B GLU A 288 ? 11.71524 -13.26936 -36.17597 0.598 23.08897 O ? A ? 288 1 ATOM 2237 CB B GLU A 288 ? 10.47469 -13.06403 -33.40383 0.598 25.87364 C ? A ? 288 1 ATOM 2238 CG B GLU A 288 ? 9.96460 -13.54752 -32.05641 0.598 29.51957 C ? A ? 288 1 ATOM 2239 CD B GLU A 288 ? 8.50617 -13.20713 -31.83024 0.598 32.17606 C ? A ? 288 1 ATOM 2240 OE1 B GLU A 288 ? 8.02080 -12.23576 -32.44863 0.598 36.59964 O ? A ? 288 1 ATOM 2241 OE2 B GLU A 288 ? 7.84526 -13.90936 -31.03702 0.598 29.37921 O ? A ? 288 1 ATOM 2242 N . ASP A 289 ? 9.56665 -12.78872 -36.68782 1.000 22.70650 N ? A ? 289 1 ATOM 2243 CA . ASP A 289 ? 9.87846 -12.17495 -37.97656 1.000 27.51428 C ? A ? 289 1 ATOM 2244 C . ASP A 289 ? 9.47866 -10.70241 -38.04258 1.000 24.86656 C ? A ? 289 1 ATOM 2245 O . ASP A 289 ? 9.38463 -10.14096 -39.13943 1.000 29.43391 O ? A ? 289 1 ATOM 2246 CB . ASP A 289 ? 9.21631 -12.94790 -39.12166 1.000 22.03445 C ? A ? 289 1 ATOM 2247 CG . ASP A 289 ? 7.71592 -12.72124 -39.19592 1.000 29.30048 C ? A ? 289 1 ATOM 2248 OD1 . ASP A 289 ? 7.08329 -12.51330 -38.13963 1.000 33.55844 O ? A ? 289 1 ATOM 2249 OD2 . ASP A 289 ? 7.16356 -12.75139 -40.31743 1.000 42.04988 O ? A ? 289 1 ATOM 2250 N . GLU A 290 ? 9.25059 -10.05462 -36.90021 1.000 24.23487 N ? A ? 290 1 ATOM 2251 CA . GLU A 290 ? 8.84268 -8.65423 -36.88386 1.000 30.60408 C ? A ? 290 1 ATOM 2252 C . GLU A 290 ? 9.96755 -7.72397 -36.43007 1.000 28.59931 C ? A ? 290 1 ATOM 2253 O . GLU A 290 ? 9.69639 -6.62907 -35.92526 1.000 26.98329 O ? A ? 290 1 ATOM 2254 CB . GLU A 290 ? 7.60225 -8.47241 -36.00570 1.000 26.98559 C ? A ? 290 1 ATOM 2255 CG . GLU A 290 ? 6.46108 -9.43245 -36.34300 1.000 37.72028 C ? A ? 290 1 ATOM 2256 CD . GLU A 290 ? 5.28251 -8.75976 -37.03639 1.000 49.37331 C ? A ? 290 1 ATOM 2257 OE1 . GLU A 290 ? 4.81582 -7.70543 -36.54969 1.000 37.21133 O ? A ? 290 1 ATOM 2258 OE2 . GLU A 290 ? 4.81696 -9.29344 -38.06773 1.000 44.69466 O ? A ? 290 1 ATOM 2259 N . PHE A 291 ? 11.22462 -8.13638 -36.60327 1.000 22.63825 N ? A ? 291 1 ATOM 2260 CA . PHE A 291 ? 12.38698 -7.29196 -36.34466 1.000 24.66257 C ? A ? 291 1 ATOM 2261 C . PHE A 291 ? 13.23110 -7.20678 -37.60833 1.000 25.66844 C ? A ? 291 1 ATOM 2262 O . PHE A 291 ? 13.75305 -8.22367 -38.07509 1.000 20.70832 O ? A ? 291 1 ATOM 2263 CB . PHE A 291 ? 13.23405 -7.83867 -35.19276 1.000 26.32785 C ? A ? 291 1 ATOM 2264 CG . PHE A 291 ? 12.58707 -7.71793 -33.84477 1.000 29.48527 C ? A ? 291 1 ATOM 2265 CD1 . PHE A 291 ? 12.58965 -6.51052 -33.16422 1.000 34.33489 C ? A ? 291 1 ATOM 2266 CD2 . PHE A 291 ? 11.99953 -8.81623 -33.24577 1.000 29.47427 C ? A ? 291 1 ATOM 2267 CE1 . PHE A 291 ? 12.00330 -6.40149 -31.91847 1.000 34.08673 C ? A ? 291 1 ATOM 2268 CE2 . PHE A 291 ? 11.41157 -8.71087 -32.00193 1.000 35.16821 C ? A ? 291 1 ATOM 2269 CZ . PHE A 291 ? 11.41503 -7.50292 -31.33825 1.000 28.21939 C ? A ? 291 1 ATOM 2270 N . THR A 292 ? 13.37704 -6.00015 -38.15173 1.000 24.62897 N ? A ? 292 1 ATOM 2271 CA . THR A 292 ? 14.29002 -5.80063 -39.26415 1.000 21.93598 C ? A ? 292 1 ATOM 2272 C . THR A 292 ? 15.73395 -5.82816 -38.77342 1.000 25.22451 C ? A ? 292 1 ATOM 2273 O . THR A 292 ? 15.99667 -5.68282 -37.57569 1.000 22.46383 O ? A ? 292 1 ATOM 2274 CB . THR A 292 ? 14.01214 -4.47002 -39.95615 1.000 23.19729 C ? A ? 292 1 ATOM 2275 OG1 . THR A 292 ? 14.33499 -3.39433 -39.06710 1.000 26.35317 O ? A ? 292 1 ATOM 2276 CG2 . THR A 292 ? 12.55254 -4.37096 -40.36126 1.000 26.14576 C ? A ? 292 1 ATOM 2277 N . PRO A 293 ? 16.69467 -6.03296 -39.67987 1.000 21.47957 N ? A ? 293 1 ATOM 2278 CA . PRO A 293 ? 18.10354 -5.88291 -39.28131 1.000 26.26263 C ? A ? 293 1 ATOM 2279 C . PRO A 293 ? 18.41338 -4.52890 -38.66323 1.000 23.12850 C ? A ? 293 1 ATOM 2280 O . PRO A 293 ? 19.20376 -4.45719 -37.71633 1.000 23.56111 O ? A ? 293 1 ATOM 2281 CB . PRO A 293 ? 18.85364 -6.10409 -40.59998 1.000 21.91231 C ? A ? 293 1 ATOM 2282 CG . PRO A 293 ? 17.97090 -7.04281 -41.35591 1.000 24.74451 C ? A ? 293 1 ATOM 2283 CD . PRO A 293 ? 16.56640 -6.59205 -41.03834 1.000 23.48099 C ? A ? 293 1 ATOM 2284 N . PHE A 294 ? 17.79718 -3.45185 -39.15586 1.000 24.09944 N ? A ? 294 1 ATOM 2285 CA . PHE A 294 ? 18.01602 -2.14258 -38.54637 1.000 28.40923 C ? A ? 294 1 ATOM 2286 C . PHE A 294 ? 17.43294 -2.07531 -37.13875 1.000 29.40143 C ? A ? 294 1 ATOM 2287 O . PHE A 294 ? 18.01650 -1.43674 -36.25381 1.000 30.64548 O ? A ? 294 1 ATOM 2288 CB . PHE A 294 ? 17.42492 -1.04319 -39.42659 1.000 31.50499 C ? A ? 294 1 ATOM 2289 CG . PHE A 294 ? 17.34102 0.29984 -38.74796 1.000 49.46077 C ? A ? 294 1 ATOM 2290 CD1 . PHE A 294 ? 18.48779 1.03409 -38.47783 1.000 43.26253 C ? A ? 294 1 ATOM 2291 CD2 . PHE A 294 ? 16.11158 0.83055 -38.38526 1.000 50.02687 C ? A ? 294 1 ATOM 2292 CE1 . PHE A 294 ? 18.40867 2.26905 -37.85440 1.000 48.54757 C ? A ? 294 1 ATOM 2293 CE2 . PHE A 294 ? 16.02701 2.06536 -37.76333 1.000 55.98460 C ? A ? 294 1 ATOM 2294 CZ . PHE A 294 ? 17.17647 2.78412 -37.49820 1.000 48.61554 C ? A ? 294 1 ATOM 2295 N . ASP A 295 ? 16.28276 -2.72304 -36.91494 1.000 27.29042 N ? A ? 295 1 ATOM 2296 CA . ASP A 295 ? 15.69001 -2.76169 -35.57900 1.000 28.26088 C ? A ? 295 1 ATOM 2297 C . ASP A 295 ? 16.63543 -3.39555 -34.57058 1.000 29.54540 C ? A ? 295 1 ATOM 2298 O . ASP A 295 ? 16.72167 -2.94728 -33.42180 1.000 32.43440 O ? A ? 295 1 ATOM 2299 CB . ASP A 295 ? 14.37368 -3.53788 -35.59791 1.000 26.78136 C ? A ? 295 1 ATOM 2300 CG . ASP A 295 ? 13.26705 -2.80023 -36.31034 1.000 30.11114 C ? A ? 295 1 ATOM 2301 OD1 . ASP A 295 ? 13.36451 -1.56203 -36.44521 1.000 33.91423 O ? A ? 295 1 ATOM 2302 OD2 . ASP A 295 ? 12.29440 -3.46430 -36.72796 1.000 29.07527 O ? A ? 295 1 ATOM 2303 N . VAL A 296 ? 17.33704 -4.45453 -34.97696 1.000 25.45613 N ? A ? 296 1 ATOM 2304 CA . VAL A 296 ? 18.27611 -5.11366 -34.07836 1.000 24.15040 C ? A ? 296 1 ATOM 2305 C . VAL A 296 ? 19.46093 -4.20404 -33.77927 1.000 28.67414 C ? A ? 296 1 ATOM 2306 O . VAL A 296 ? 19.88503 -4.08105 -32.62584 1.000 27.46498 O ? A ? 296 1 ATOM 2307 CB . VAL A 296 ? 18.72380 -6.45926 -34.67476 1.000 23.14742 C ? A ? 296 1 ATOM 2308 CG1 . VAL A 296 ? 19.73689 -7.12639 -33.76744 1.000 23.81679 C ? A ? 296 1 ATOM 2309 CG2 . VAL A 296 ? 17.52139 -7.36708 -34.89323 1.000 22.04688 C ? A ? 296 1 ATOM 2310 N . VAL A 297 ? 20.00726 -3.54303 -34.80250 1.000 26.86914 N ? A ? 297 1 ATOM 2311 CA . VAL A 297 ? 21.13257 -2.64420 -34.56695 1.000 31.78312 C ? A ? 297 1 ATOM 2312 C . VAL A 297 ? 20.69521 -1.45641 -33.71753 1.000 36.06357 C ? A ? 297 1 ATOM 2313 O . VAL A 297 ? 21.43960 -0.99863 -32.84310 1.000 36.97233 O ? A ? 297 1 ATOM 2314 CB . VAL A 297 ? 21.75860 -2.19394 -35.90062 1.000 31.38078 C ? A ? 297 1 ATOM 2315 CG1 . VAL A 297 ? 22.88846 -1.20924 -35.64284 1.000 29.74702 C ? A ? 297 1 ATOM 2316 CG2 . VAL A 297 ? 22.27752 -3.39264 -36.67796 1.000 27.13780 C ? A ? 297 1 ATOM 2317 N . ARG A 298 ? 19.47817 -0.95022 -33.94885 1.000 38.23830 N ? A ? 298 1 ATOM 2318 CA . ARG A 298 ? 18.96905 0.17786 -33.17115 1.000 37.10349 C ? A ? 298 1 ATOM 2319 C . ARG A 298 ? 18.87030 -0.17260 -31.69126 1.000 39.89500 C ? A ? 298 1 ATOM 2320 O . ARG A 298 ? 19.24643 0.62828 -30.82671 1.000 40.97852 O ? A ? 298 1 ATOM 2321 CB . ARG A 298 ? 17.60089 0.60522 -33.71368 1.000 37.42366 C ? A ? 298 1 ATOM 2322 CG . ARG A 298 ? 17.21670 2.05814 -33.45434 1.000 49.79898 C ? A ? 298 1 ATOM 2323 CD . ARG A 298 ? 15.96948 2.19298 -32.56644 1.000 56.39457 C ? A ? 298 1 ATOM 2324 NE . ARG A 298 ? 14.77254 1.57612 -33.13464 1.000 52.83413 N ? A ? 298 1 ATOM 2325 CZ . ARG A 298 ? 13.54427 1.72930 -32.65144 1.000 57.40634 C ? A ? 298 1 ATOM 2326 NH1 . ARG A 298 ? 13.30318 2.50840 -31.60544 1.000 39.59177 N ? A ? 298 1 ATOM 2327 NH2 . ARG A 298 ? 12.53171 1.08689 -33.23373 1.000 43.69073 N ? A ? 298 1 ATOM 2328 N . GLN A 299 ? 18.37474 -1.37164 -31.38151 1.000 35.21766 N ? A ? 299 1 ATOM 2329 CA . GLN A 299 ? 18.18400 -1.77501 -29.99619 1.000 36.53122 C ? A ? 299 1 ATOM 2330 C . GLN A 299 ? 19.45772 -2.30791 -29.35750 1.000 41.61953 C ? A ? 299 1 ATOM 2331 O . GLN A 299 ? 19.57704 -2.27815 -28.12818 1.000 43.58658 O ? A ? 299 1 ATOM 2332 CB . GLN A 299 ? 17.07969 -2.82988 -29.90461 1.000 31.23290 C ? A ? 299 1 ATOM 2333 CG . GLN A 299 ? 16.61219 -3.10998 -28.49194 1.000 31.05145 C ? A ? 299 1 ATOM 2334 CD . GLN A 299 ? 15.33648 -3.92189 -28.44954 1.000 36.30858 C ? A ? 299 1 ATOM 2335 OE1 . GLN A 299 ? 14.99132 -4.49903 -27.41996 1.000 39.00626 O ? A ? 299 1 ATOM 2336 NE2 . GLN A 299 ? 14.62295 -3.96534 -29.56865 1.000 34.22526 N ? A ? 299 1 ATOM 2337 N . CYS A 300 ? 20.41647 -2.77864 -30.15239 1.000 32.08808 N ? A ? 300 1 ATOM 2338 CA . CYS A 300 ? 21.65044 -3.33335 -29.61487 1.000 44.64874 C ? A ? 300 1 ATOM 2339 C . CYS A 300 ? 22.83330 -2.37583 -29.74586 1.000 50.45538 C ? A ? 300 1 ATOM 2340 O . CYS A 300 ? 23.98382 -2.79434 -29.57826 1.000 51.38664 O ? A ? 300 1 ATOM 2341 CB . CYS A 300 ? 21.95216 -4.67464 -30.28261 1.000 28.97739 C ? A ? 300 1 ATOM 2342 SG . CYS A 300 ? 20.66002 -5.91064 -29.97054 1.000 39.72881 S ? A ? 300 1 ATOM 2343 N . SER A 301 ? 22.57045 -1.09786 -30.03317 1.000 55.12350 N ? A ? 301 1 ATOM 2344 CA . SER A 301 ? 23.60277 -0.06643 -30.00190 1.000 45.12189 C ? A ? 301 1 ATOM 2345 C . SER A 301 ? 23.14368 1.24339 -29.37361 1.000 53.86972 C ? A ? 301 1 ATOM 2346 O . SER A 301 ? 23.98694 2.11945 -29.15772 1.000 60.87336 O ? A ? 301 1 ATOM 2347 CB . SER A 301 ? 24.12822 0.22187 -31.41702 1.000 58.08751 C ? A ? 301 1 ATOM 2348 OG . SER A 301 ? 23.15345 0.89116 -32.19951 1.000 61.50512 O ? A ? 301 1 ATOM 2349 N . GLY A 302 ? 21.85733 1.41815 -29.08122 1.000 54.90588 N ? A ? 302 1 ATOM 2350 CA . GLY A 302 ? 21.39186 2.61336 -28.39968 1.000 52.97437 C ? A ? 302 1 ATOM 2351 C . GLY A 302 ? 21.19961 3.82678 -29.28205 1.000 46.82391 C ? A ? 302 1 ATOM 2352 O . GLY A 302 ? 21.53348 4.94529 -28.87007 1.000 50.06699 O ? A ? 302 1 ATOM 2353 N . VAL A 303 ? 20.66209 3.64216 -30.48715 1.000 50.45560 N ? A ? 303 1 ATOM 2354 CA . VAL A 303 ? 20.45199 4.76211 -31.40014 1.000 65.18615 C ? A ? 303 1 ATOM 2355 C . VAL A 303 ? 19.27117 5.59181 -30.90859 1.000 61.02667 C ? A ? 303 1 ATOM 2356 O . VAL A 303 ? 18.14647 5.09000 -30.79421 1.000 57.73883 O ? A ? 303 1 ATOM 2357 CB . VAL A 303 ? 20.22456 4.26662 -32.83469 1.000 66.42902 C ? A ? 303 1 ATOM 2358 CG1 . VAL A 303 ? 20.06204 5.44785 -33.78750 1.000 60.43780 C ? A ? 303 1 ATOM 2359 CG2 . VAL A 303 ? 21.37198 3.36679 -33.27856 1.000 54.25772 C ? A ? 303 1 ATOM 2360 N . THR A 304 ? 19.52234 6.86886 -30.62088 1.000 56.07090 N ? A ? 304 1 ATOM 2361 CA . THR A 304 ? 18.50256 7.78810 -30.13922 1.000 56.48058 C ? A ? 304 1 ATOM 2362 C . THR A 304 ? 18.04479 8.71266 -31.26730 1.000 55.65827 C ? A ? 304 1 ATOM 2363 O . THR A 304 ? 18.52174 8.63922 -32.40268 1.000 64.50313 O ? A ? 304 1 ATOM 2364 CB . THR A 304 ? 19.02492 8.59937 -28.95192 1.000 53.11058 C ? A ? 304 1 ATOM 2365 OG1 . THR A 304 ? 20.15923 9.37529 -29.36036 1.000 63.38808 O ? A ? 304 1 ATOM 2366 CG2 . THR A 304 ? 19.42840 7.67795 -27.81938 1.000 51.82483 C ? A ? 304 1 ATOM 2367 N . PHE A 305 ? 17.10501 9.59941 -30.94474 1.000 55.38270 N ? A ? 305 1 ATOM 2368 CA . PHE A 305 ? 16.51635 10.48660 -31.94655 1.000 65.61169 C ? A ? 305 1 ATOM 2369 C . PHE A 305 ? 16.29157 11.89538 -31.40064 1.000 61.63089 C ? A ? 305 1 ATOM 2370 O . PHE A 305 ? 15.33068 12.14899 -30.67402 1.000 72.92287 O ? A ? 305 1 ATOM 2371 CB . PHE A 305 ? 15.19845 9.89681 -32.45877 1.000 54.80649 C ? A ? 305 1 ATOM 2372 CG . PHE A 305 ? 15.28714 8.43521 -32.78598 1.000 53.24319 C ? A ? 305 1 ATOM 2373 CD1 . PHE A 305 ? 15.88305 8.00860 -33.96220 1.000 55.74457 C ? A ? 305 1 ATOM 2374 CD2 . PHE A 305 ? 14.80269 7.48563 -31.90291 1.000 48.53465 C ? A ? 305 1 ATOM 2375 CE1 . PHE A 305 ? 15.98065 6.66157 -34.25725 1.000 53.89239 C ? A ? 305 1 ATOM 2376 CE2 . PHE A 305 ? 14.89593 6.13752 -32.19286 1.000 52.71997 C ? A ? 305 1 ATOM 2377 CZ . PHE A 305 ? 15.48825 5.72499 -33.36955 1.000 58.12375 C ? A ? 305 1 HETATM 2378 C01 . ZQ8 A 401 ? -12.03679 2.81728 -39.05318 1.000 21.74177 C ? B ? . 1 HETATM 2379 C03 . ZQ8 A 401 ? -12.53530 1.32030 -39.11361 1.000 23.32424 C ? B ? . 1 HETATM 2380 C04 . ZQ8 A 401 ? -11.57825 0.40282 -38.28668 1.000 20.60682 C ? B ? . 1 HETATM 2381 C05 . ZQ8 A 401 ? -11.91879 -1.11157 -38.28177 1.000 27.03854 C ? B ? . 1 HETATM 2382 C06 . ZQ8 A 401 ? -13.10181 -1.36645 -37.39377 1.000 25.98844 C ? B ? . 1 HETATM 2383 C07 . ZQ8 A 401 ? -12.74370 -2.56786 -36.48408 1.000 34.59701 C ? B ? . 1 HETATM 2384 C09 . ZQ8 A 401 ? -10.77631 -1.99453 -37.67287 1.000 27.02304 C ? B ? . 1 HETATM 2385 C12 . ZQ8 A 401 ? -13.80461 0.17280 -41.02128 1.000 21.13798 C ? B ? . 1 HETATM 2386 C13 . ZQ8 A 401 ? -13.91531 -0.25003 -42.58397 1.000 19.53924 C ? B ? . 1 HETATM 2387 C14 . ZQ8 A 401 ? -14.64421 0.81924 -43.43496 1.000 25.16046 C ? B ? . 1 HETATM 2388 C16 . ZQ8 A 401 ? -12.29215 1.21347 -45.55928 1.000 24.25583 C ? B ? . 1 HETATM 2389 C17 . ZQ8 A 401 ? -14.36671 -1.12396 -46.04598 1.000 28.64650 C ? B ? . 1 HETATM 2390 C18 . ZQ8 A 401 ? -15.29658 1.85122 -46.47414 1.000 26.85500 C ? B ? . 1 HETATM 2391 C20 . ZQ8 A 401 ? -13.94583 -2.79597 -42.37818 1.000 24.18086 C ? B ? . 1 HETATM 2392 C21 . ZQ8 A 401 ? -14.58325 -4.14434 -42.76401 1.000 25.24735 C ? B ? . 1 HETATM 2393 C22 . ZQ8 A 401 ? -15.69975 -4.39804 -43.61545 1.000 24.66784 C ? B ? . 1 HETATM 2394 C23 . ZQ8 A 401 ? -15.90065 -5.85754 -43.71554 1.000 27.21805 C ? B ? . 1 HETATM 2395 C24 . ZQ8 A 401 ? -16.81873 -6.73932 -44.37810 1.000 24.38591 C ? B ? . 1 HETATM 2396 C25 . ZQ8 A 401 ? -16.69752 -8.13557 -44.23692 1.000 27.37629 C ? B ? . 1 HETATM 2397 C26 . ZQ8 A 401 ? -15.65919 -8.68987 -43.42907 1.000 28.87036 C ? B ? . 1 HETATM 2398 C27 . ZQ8 A 401 ? -14.74958 -7.84242 -42.77551 1.000 29.63573 C ? B ? . 1 HETATM 2399 C29 . ZQ8 A 401 ? -14.85655 -6.42913 -42.90680 1.000 28.09052 C ? B ? . 1 HETATM 2400 N08 . ZQ8 A 401 ? -11.30444 -2.80956 -36.65221 1.000 28.49184 N ? B ? . 1 HETATM 2401 N11 . ZQ8 A 401 ? -12.71765 0.88288 -40.49279 1.000 18.95813 N ? B ? . 1 HETATM 2402 N19 . ZQ8 A 401 ? -14.45573 -1.56896 -42.81651 1.000 25.98090 N ? B ? . 1 HETATM 2403 N30 . ZQ8 A 401 ? -14.09677 -5.38217 -42.37180 1.000 24.54573 N ? B ? . 1 HETATM 2404 O02 . ZQ8 A 401 ? -12.33043 3.36287 -37.77536 1.000 30.42426 O ? B ? . 1 HETATM 2405 O10 . ZQ8 A 401 ? -9.58496 -2.00831 -38.01233 1.000 24.31862 O ? B ? . 1 HETATM 2406 O31 . ZQ8 A 401 ? -12.91965 -2.81105 -41.68528 1.000 20.41505 O ? B ? . 1 HETATM 2407 O32 . ZQ8 A 401 ? -14.74607 -0.16168 -40.28291 1.000 24.03888 O ? B ? . 1 HETATM 2408 CL28 . ZQ8 A 401 ? -13.49145 -8.46870 -41.80722 1.000 31.78167 Cl ? B ? . 1 HETATM 2409 SI15 . ZQ8 A 401 ? -14.15496 0.69661 -45.41332 1.000 33.81875 Si ? B ? . 1 ATOM 2410 N . SER B 1 ? -10.22402 -5.38765 -32.66411 1.000 52.30683 N ? C ? 1 1 ATOM 2411 CA . SER B 1 ? -9.56814 -6.43506 -33.44041 1.000 57.11064 C ? C ? 1 1 ATOM 2412 C . SER B 1 ? -8.05997 -6.44855 -33.16298 1.000 52.15756 C ? C ? 1 1 ATOM 2413 O . SER B 1 ? -7.39053 -5.41760 -33.27178 1.000 35.33171 O ? C ? 1 1 ATOM 2414 CB . SER B 1 ? -9.85132 -6.24928 -34.93923 1.000 42.23871 C ? C ? 1 1 ATOM 2415 OG . SER B 1 ? -9.54108 -4.93507 -35.37745 1.000 37.39808 O ? C ? 1 1 ATOM 2416 N . GLY B 2 ? -7.54248 -7.61728 -32.78647 1.000 51.19209 N ? C ? 2 1 ATOM 2417 CA . GLY B 2 ? -6.13805 -7.78879 -32.47391 1.000 39.42747 C ? C ? 2 1 ATOM 2418 C . GLY B 2 ? -5.79998 -7.39044 -31.04595 1.000 41.68888 C ? C ? 2 1 ATOM 2419 O . GLY B 2 ? -6.53875 -6.67257 -30.37236 1.000 41.18079 O ? C ? 2 1 ATOM 2420 N . PHE B 3 ? -4.64637 -7.87443 -30.58109 1.000 44.14316 N ? C ? 3 1 ATOM 2421 CA . PHE B 3 ? -4.17719 -7.57589 -29.22911 1.000 29.55436 C ? C ? 3 1 ATOM 2422 C . PHE B 3 ? -2.65720 -7.50662 -29.23495 1.000 31.57763 C ? C ? 3 1 ATOM 2423 O . PHE B 3 ? -1.99497 -8.48386 -29.59273 1.000 27.82562 O ? C ? 3 1 ATOM 2424 CB . PHE B 3 ? -4.66623 -8.62701 -28.22943 1.000 29.28705 C ? C ? 3 1 ATOM 2425 CG . PHE B 3 ? -4.65655 -8.15737 -26.80199 1.000 28.39030 C ? C ? 3 1 ATOM 2426 CD1 . PHE B 3 ? -5.64801 -7.31164 -26.33367 1.000 31.53327 C ? C ? 3 1 ATOM 2427 CD2 . PHE B 3 ? -3.66126 -8.56300 -25.92738 1.000 30.77047 C ? C ? 3 1 ATOM 2428 CE1 . PHE B 3 ? -5.64893 -6.87523 -25.02254 1.000 28.07060 C ? C ? 3 1 ATOM 2429 CE2 . PHE B 3 ? -3.65667 -8.13015 -24.61123 1.000 29.10172 C ? C ? 3 1 ATOM 2430 CZ . PHE B 3 ? -4.65305 -7.28416 -24.15945 1.000 28.62376 C ? C ? 3 1 ATOM 2431 N . ARG B 4 ? -2.11050 -6.35859 -28.82979 1.000 33.71515 N ? C ? 4 1 ATOM 2432 CA . ARG B 4 ? -0.67769 -6.09468 -28.86256 1.000 29.16805 C ? C ? 4 1 ATOM 2433 C . ARG B 4 ? -0.20224 -5.59018 -27.50651 1.000 30.03145 C ? C ? 4 1 ATOM 2434 O . ARG B 4 ? -0.97572 -5.02333 -26.73047 1.000 30.40791 O ? C ? 4 1 ATOM 2435 CB . ARG B 4 ? -0.32663 -5.05058 -29.92884 1.000 28.71418 C ? C ? 4 1 ATOM 2436 CG . ARG B 4 ? -0.83998 -5.37818 -31.31172 1.000 34.33549 C ? C ? 4 1 ATOM 2437 CD . ARG B 4 ? 0.10045 -6.32632 -32.01159 1.000 41.29409 C ? C ? 4 1 ATOM 2438 NE . ARG B 4 ? 1.46250 -5.81148 -31.97162 1.000 40.67522 N ? C ? 4 1 ATOM 2439 CZ . ARG B 4 ? 2.42554 -6.16976 -32.80800 1.000 48.42967 C ? C ? 4 1 ATOM 2440 NH1 . ARG B 4 ? 2.21024 -7.04982 -33.77448 1.000 49.21010 N ? C ? 4 1 ATOM 2441 NH2 . ARG B 4 ? 3.63232 -5.62485 -32.67670 1.000 53.81555 N ? C ? 4 1 ATOM 2442 N . LYS B 5 ? 1.08515 -5.79095 -27.23176 1.000 28.21696 N ? C ? 5 1 ATOM 2443 CA . LYS B 5 ? 1.71838 -5.21588 -26.04584 1.000 32.47018 C ? C ? 5 1 ATOM 2444 C . LYS B 5 ? 1.92955 -3.72824 -26.30598 1.000 33.96696 C ? C ? 5 1 ATOM 2445 O . LYS B 5 ? 2.86233 -3.32869 -27.00622 1.000 37.24462 O ? C ? 5 1 ATOM 2446 CB . LYS B 5 ? 3.02625 -5.93095 -25.73059 1.000 26.95474 C ? C ? 5 1 ATOM 2447 CG . LYS B 5 ? 3.58765 -5.60351 -24.35889 1.000 36.80776 C ? C ? 5 1 ATOM 2448 CD . LYS B 5 ? 4.53598 -6.68846 -23.88416 1.000 32.44905 C ? C ? 5 1 ATOM 2449 CE . LYS B 5 ? 3.81316 -8.01386 -23.73428 1.000 29.89515 C ? C ? 5 1 ATOM 2450 NZ . LYS B 5 ? 4.70753 -9.08095 -23.21434 1.000 38.38895 N ? C ? 5 1 ATOM 2451 N . MET B 6 ? 1.05379 -2.90506 -25.74170 1.000 28.24412 N ? C ? 6 1 ATOM 2452 CA . MET B 6 ? 0.91728 -1.50559 -26.11673 1.000 28.12157 C ? C ? 6 1 ATOM 2453 C . MET B 6 ? 1.44829 -0.60401 -25.01173 1.000 26.24037 C ? C ? 6 1 ATOM 2454 O . MET B 6 ? 1.12386 -0.79819 -23.83636 1.000 29.39973 O ? C ? 6 1 ATOM 2455 CB . MET B 6 ? -0.54895 -1.18756 -26.40156 1.000 29.06280 C ? C ? 6 1 ATOM 2456 CG . MET B 6 ? -0.80803 0.20894 -26.89617 1.000 35.14134 C ? C ? 6 1 ATOM 2457 SD . MET B 6 ? -2.54712 0.36635 -27.31837 1.000 46.68143 S ? C ? 6 1 ATOM 2458 CE . MET B 6 ? -2.75754 -1.08627 -28.34497 1.000 28.03738 C ? C ? 6 1 ATOM 2459 N . ALA B 7 ? 2.24693 0.38500 -25.39120 1.000 22.29151 N ? C ? 7 1 ATOM 2460 CA . ALA B 7 ? 2.77375 1.36350 -24.45284 1.000 21.71831 C ? C ? 7 1 ATOM 2461 C . ALA B 7 ? 1.95303 2.64503 -24.50082 1.000 23.20981 C ? C ? 7 1 ATOM 2462 O . ALA B 7 ? 1.22844 2.90957 -25.46005 1.000 26.76654 O ? C ? 7 1 ATOM 2463 CB . ALA B 7 ? 4.24108 1.67591 -24.75512 1.000 28.35058 C ? C ? 7 1 ATOM 2464 N . PHE B 8 ? 2.07484 3.44134 -23.44270 1.000 27.70501 N ? C ? 8 1 ATOM 2465 CA . PHE B 8 ? 1.42812 4.74110 -23.41804 1.000 28.32126 C ? C ? 8 1 ATOM 2466 C . PHE B 8 ? 2.11014 5.68608 -24.40515 1.000 24.97492 C ? C ? 8 1 ATOM 2467 O . PHE B 8 ? 3.28752 5.51077 -24.72909 1.000 20.36660 O ? C ? 8 1 ATOM 2468 CB . PHE B 8 ? 1.48545 5.34899 -22.01920 1.000 24.91359 C ? C ? 8 1 ATOM 2469 CG . PHE B 8 ? 0.64362 4.63564 -21.00858 1.000 23.45951 C ? C ? 8 1 ATOM 2470 CD1 . PHE B 8 ? -0.71469 4.88814 -20.91729 1.000 29.94321 C ? C ? 8 1 ATOM 2471 CD2 . PHE B 8 ? 1.21208 3.72479 -20.13658 1.000 24.47239 C ? C ? 8 1 ATOM 2472 CE1 . PHE B 8 ? -1.49254 4.23692 -19.97933 1.000 32.98833 C ? C ? 8 1 ATOM 2473 CE2 . PHE B 8 ? 0.44105 3.07013 -19.19812 1.000 25.82191 C ? C ? 8 1 ATOM 2474 CZ . PHE B 8 ? -0.91288 3.32643 -19.11769 1.000 26.22699 C ? C ? 8 1 ATOM 2475 N . PRO B 9 ? 1.38840 6.68781 -24.90761 1.000 27.76299 N ? C ? 9 1 ATOM 2476 CA . PRO B 9 ? 2.05560 7.77826 -25.63112 1.000 21.51021 C ? C ? 9 1 ATOM 2477 C . PRO B 9 ? 3.09859 8.43013 -24.73433 1.000 25.77963 C ? C ? 9 1 ATOM 2478 O . PRO B 9 ? 2.83914 8.71568 -23.56362 1.000 23.01890 O ? C ? 9 1 ATOM 2479 CB . PRO B 9 ? 0.90834 8.73763 -25.96614 1.000 27.02741 C ? C ? 9 1 ATOM 2480 CG . PRO B 9 ? -0.32390 7.88852 -25.92715 1.000 28.51688 C ? C ? 9 1 ATOM 2481 CD . PRO B 9 ? -0.07614 6.84887 -24.87804 1.000 27.61142 C ? C ? 9 1 ATOM 2482 N . SER B 10 ? 4.29162 8.65027 -25.28437 1.000 24.94335 N ? C ? 10 1 ATOM 2483 CA . SER B 10 ? 5.43840 9.06549 -24.48467 1.000 25.39499 C ? C ? 10 1 ATOM 2484 C . SER B 10 ? 5.71313 10.56262 -24.54023 1.000 24.24195 C ? C ? 10 1 ATOM 2485 O . SER B 10 ? 6.70539 11.01465 -23.95905 1.000 21.98662 O ? C ? 10 1 ATOM 2486 CB . SER B 10 ? 6.69192 8.30729 -24.92916 1.000 22.22632 C ? C ? 10 1 ATOM 2487 OG . SER B 10 ? 7.02361 8.61476 -26.27114 1.000 22.37574 O ? C ? 10 1 ATOM 2488 N . GLY B 11 ? 4.85235 11.34292 -25.19820 1.000 28.15830 N ? C ? 11 1 ATOM 2489 CA . GLY B 11 ? 5.17753 12.73963 -25.45793 1.000 24.90210 C ? C ? 11 1 ATOM 2490 C . GLY B 11 ? 5.35360 13.57212 -24.20017 1.000 26.11516 C ? C ? 11 1 ATOM 2491 O . GLY B 11 ? 6.20317 14.46656 -24.14993 1.000 29.85387 O ? C ? 11 1 ATOM 2492 N . LYS B 12 ? 4.55336 13.29766 -23.16856 1.000 22.41657 N ? C ? 12 1 ATOM 2493 CA . LYS B 12 ? 4.66943 14.07146 -21.93543 1.000 23.58760 C ? C ? 12 1 ATOM 2494 C . LYS B 12 ? 5.97394 13.78295 -21.19816 1.000 26.65315 C ? C ? 12 1 ATOM 2495 O . LYS B 12 ? 6.52335 14.67660 -20.54186 1.000 32.00712 O ? C ? 12 1 ATOM 2496 CB . LYS B 12 ? 3.47510 13.79987 -21.02373 1.000 26.45382 C ? C ? 12 1 ATOM 2497 CG . LYS B 12 ? 2.19823 14.49703 -21.45920 1.000 26.69582 C ? C ? 12 1 ATOM 2498 CD . LYS B 12 ? 1.28651 14.70968 -20.26313 1.000 41.88279 C ? C ? 12 1 ATOM 2499 CE . LYS B 12 ? -0.00182 13.91604 -20.37895 1.000 42.78745 C ? C ? 12 1 ATOM 2500 NZ . LYS B 12 ? -1.10630 14.76885 -20.89849 1.000 42.66162 N ? C ? 12 1 ATOM 2501 N . VAL B 13 ? 6.48695 12.55491 -21.29417 1.000 27.46502 N ? C ? 13 1 ATOM 2502 CA . VAL B 13 ? 7.73446 12.22187 -20.61216 1.000 25.64895 C ? C ? 13 1 ATOM 2503 C . VAL B 13 ? 8.94678 12.69528 -21.41033 1.000 22.78026 C ? C ? 13 1 ATOM 2504 O . VAL B 13 ? 9.97673 13.04833 -20.82477 1.000 27.08982 O ? C ? 13 1 ATOM 2505 CB . VAL B 13 ? 7.81097 10.70952 -20.33887 1.000 26.86433 C ? C ? 13 1 ATOM 2506 CG1 . VAL B 13 ? 9.07012 10.37469 -19.53601 1.000 24.99046 C ? C ? 13 1 ATOM 2507 CG2 . VAL B 13 ? 6.56461 10.23907 -19.61880 1.000 29.08383 C ? C ? 13 1 ATOM 2508 N . GLU B 14 ? 8.85731 12.69504 -22.74380 1.000 21.92136 N ? C ? 14 1 ATOM 2509 CA . GLU B 14 ? 9.99429 13.09862 -23.56865 1.000 26.90358 C ? C ? 14 1 ATOM 2510 C . GLU B 14 ? 10.46419 14.50837 -23.22668 1.000 26.91486 C ? C ? 14 1 ATOM 2511 O . GLU B 14 ? 11.66436 14.80144 -23.28413 1.000 31.77603 O ? C ? 14 1 ATOM 2512 CB . GLU B 14 ? 9.63347 13.00983 -25.05264 1.000 20.99106 C ? C ? 14 1 ATOM 2513 CG . GLU B 14 ? 9.30234 11.60793 -25.55055 1.000 26.35919 C ? C ? 14 1 ATOM 2514 CD . GLU B 14 ? 8.75075 11.60393 -26.96917 1.000 23.99595 C ? C ? 14 1 ATOM 2515 OE1 . GLU B 14 ? 9.23167 12.39930 -27.80237 1.000 30.77224 O ? C ? 14 1 ATOM 2516 OE2 . GLU B 14 ? 7.82750 10.81132 -27.25061 1.000 27.38342 O ? C ? 14 1 ATOM 2517 N . GLY B 15 ? 9.53898 15.39234 -22.86684 1.000 22.42905 N ? C ? 15 1 ATOM 2518 CA . GLY B 15 ? 9.90604 16.74778 -22.51114 1.000 31.86211 C ? C ? 15 1 ATOM 2519 C . GLY B 15 ? 10.55024 16.90269 -21.15281 1.000 35.61877 C ? C ? 15 1 ATOM 2520 O . GLY B 15 ? 10.86046 18.03129 -20.75749 1.000 34.46418 O ? C ? 15 1 ATOM 2521 N . CYS B 16 ? 10.75765 15.80298 -20.42904 1.000 26.36746 N ? C ? 16 1 ATOM 2522 CA . CYS B 16 ? 11.34284 15.83391 -19.09799 1.000 28.32997 C ? C ? 16 1 ATOM 2523 C . CYS B 16 ? 12.70983 15.17233 -19.03407 1.000 30.04882 C ? C ? 16 1 ATOM 2524 O . CYS B 16 ? 13.32161 15.14812 -17.96076 1.000 25.77036 O ? C ? 16 1 ATOM 2525 CB . CYS B 16 ? 10.40920 15.15369 -18.09007 1.000 26.67023 C ? C ? 16 1 ATOM 2526 SG . CYS B 16 ? 8.75171 15.84759 -17.99566 1.000 33.54922 S ? C ? 16 1 ATOM 2527 N . MET B 17 ? 13.20397 14.63208 -20.14031 1.000 22.11510 N ? C ? 17 1 ATOM 2528 CA . MET B 17 ? 14.46526 13.91165 -20.13306 1.000 19.95308 C ? C ? 17 1 ATOM 2529 C . MET B 17 ? 15.61807 14.87691 -20.36262 1.000 23.02478 C ? C ? 17 1 ATOM 2530 O . MET B 17 ? 15.57952 15.69737 -21.28408 1.000 22.51689 O ? C ? 17 1 ATOM 2531 CB . MET B 17 ? 14.46154 12.81149 -21.19214 1.000 20.33117 C ? C ? 17 1 ATOM 2532 CG . MET B 17 ? 13.34639 11.79799 -20.99568 1.000 23.83169 C ? C ? 17 1 ATOM 2533 SD . MET B 17 ? 13.28049 11.15428 -19.30962 1.000 29.70649 S ? C ? 17 1 ATOM 2534 CE . MET B 17 ? 14.90587 10.40548 -19.17617 1.000 22.57425 C ? C ? 17 1 ATOM 2535 N . VAL B 18 ? 16.63650 14.77956 -19.51028 1.000 22.68985 N ? C ? 18 1 ATOM 2536 CA . VAL B 18 ? 17.84056 15.58767 -19.61229 1.000 25.90393 C ? C ? 18 1 ATOM 2537 C . VAL B 18 ? 19.04819 14.66690 -19.51301 1.000 24.90111 C ? C ? 18 1 ATOM 2538 O . VAL B 18 ? 18.93979 13.48786 -19.17417 1.000 26.32954 O ? C ? 18 1 ATOM 2539 CB . VAL B 18 ? 17.91390 16.68275 -18.52761 1.000 24.23921 C ? C ? 18 1 ATOM 2540 CG1 . VAL B 18 ? 16.75959 17.65754 -18.67571 1.000 23.69379 C ? C ? 18 1 ATOM 2541 CG2 . VAL B 18 ? 17.92474 16.04816 -17.13939 1.000 22.20761 C ? C ? 18 1 ATOM 2542 N . GLN B 19 ? 20.21123 15.23333 -19.80452 1.000 24.31133 N ? C ? 19 1 ATOM 2543 CA . GLN B 19 ? 21.48062 14.52897 -19.72373 1.000 26.66069 C ? C ? 19 1 ATOM 2544 C . GLN B 19 ? 22.24166 15.02616 -18.50313 1.000 27.02754 C ? C ? 19 1 ATOM 2545 O . GLN B 19 ? 22.42452 16.23565 -18.33416 1.000 27.60948 O ? C ? 19 1 ATOM 2546 CB . GLN B 19 ? 22.29995 14.75392 -20.99500 1.000 35.48612 C ? C ? 19 1 ATOM 2547 CG . GLN B 19 ? 23.63159 14.04016 -21.01447 1.000 36.37552 C ? C ? 19 1 ATOM 2548 CD . GLN B 19 ? 24.53272 14.54521 -22.11956 1.000 38.24890 C ? C ? 19 1 ATOM 2549 OE1 . GLN B 19 ? 24.83918 13.82119 -23.06696 1.000 46.96031 O ? C ? 19 1 ATOM 2550 NE2 . GLN B 19 ? 24.96716 15.79329 -22.00290 1.000 46.20413 N ? C ? 19 1 ATOM 2551 N . VAL B 20 ? 22.67239 14.10252 -17.64962 1.000 23.28168 N ? C ? 20 1 ATOM 2552 CA . VAL B 20 ? 23.40105 14.44372 -16.43267 1.000 23.96300 C ? C ? 20 1 ATOM 2553 C . VAL B 20 ? 24.79959 13.85405 -16.53192 1.000 29.38192 C ? C ? 20 1 ATOM 2554 O . VAL B 20 ? 24.95966 12.63615 -16.68455 1.000 26.95606 O ? C ? 20 1 ATOM 2555 CB . VAL B 20 ? 22.68215 13.94532 -15.17051 1.000 30.67119 C ? C ? 20 1 ATOM 2556 CG1 . VAL B 20 ? 23.47915 14.32867 -13.92857 1.000 28.03562 C ? C ? 20 1 ATOM 2557 CG2 . VAL B 20 ? 21.27025 14.51634 -15.10773 1.000 30.99077 C ? C ? 20 1 ATOM 2558 N . THR B 21 ? 25.80769 14.71625 -16.45051 1.000 32.91103 N ? C ? 21 1 ATOM 2559 CA . THR B 21 ? 27.20141 14.30497 -16.50042 1.000 32.20696 C ? C ? 21 1 ATOM 2560 C . THR B 21 ? 27.88603 14.71139 -15.20468 1.000 35.73015 C ? C ? 21 1 ATOM 2561 O . THR B 21 ? 27.78511 15.86711 -14.77728 1.000 34.18947 O ? C ? 21 1 ATOM 2562 CB . THR B 21 ? 27.92927 14.92818 -17.69603 1.000 35.86394 C ? C ? 21 1 ATOM 2563 OG1 . THR B 21 ? 27.20716 14.65375 -18.90157 1.000 33.07210 O ? C ? 21 1 ATOM 2564 CG2 . THR B 21 ? 29.32639 14.34914 -17.82020 1.000 38.69532 C ? C ? 21 1 ATOM 2565 N . CYS B 22 ? 28.57415 13.75854 -14.58271 1.000 35.35179 N ? C ? 22 1 ATOM 2566 CA . CYS B 22 ? 29.39433 14.01357 -13.40409 1.000 31.95541 C ? C ? 22 1 ATOM 2567 C . CYS B 22 ? 30.75863 13.38956 -13.65292 1.000 36.38636 C ? C ? 22 1 ATOM 2568 O . CYS B 22 ? 30.89209 12.16160 -13.65719 1.000 37.13424 O ? C ? 22 1 ATOM 2569 CB . CYS B 22 ? 28.75185 13.44358 -12.14183 1.000 35.82503 C ? C ? 22 1 ATOM 2570 SG . CYS B 22 ? 29.67341 13.80013 -10.63926 1.000 42.41407 S ? C ? 22 1 ATOM 2571 N . GLY B 23 ? 31.76565 14.22981 -13.86343 1.000 37.80958 N ? C ? 23 1 ATOM 2572 CA . GLY B 23 ? 33.08079 13.73750 -14.21305 1.000 41.84282 C ? C ? 23 1 ATOM 2573 C . GLY B 23 ? 33.07626 13.01954 -15.54597 1.000 44.05054 C ? C ? 23 1 ATOM 2574 O . GLY B 23 ? 32.87740 13.64142 -16.59346 1.000 43.17554 O ? C ? 23 1 ATOM 2575 N . THR B 24 ? 33.27424 11.70314 -15.51724 1.000 49.14028 N ? C ? 24 1 ATOM 2576 CA . THR B 24 ? 33.33287 10.90078 -16.72948 1.000 51.27705 C ? C ? 24 1 ATOM 2577 C . THR B 24 ? 32.05962 10.09963 -16.98483 1.000 47.03957 C ? C ? 24 1 ATOM 2578 O . THR B 24 ? 31.91701 9.52229 -18.06857 1.000 51.85167 O ? C ? 24 1 ATOM 2579 CB . THR B 24 ? 34.53906 9.95105 -16.66782 1.000 54.34446 C ? C ? 24 1 ATOM 2580 OG1 . THR B 24 ? 34.57015 9.12748 -17.83919 1.000 52.28501 O ? C ? 24 1 ATOM 2581 CG2 . THR B 24 ? 34.46576 9.06971 -15.42568 1.000 57.40813 C ? C ? 24 1 ATOM 2582 N . THR B 25 ? 31.13153 10.06169 -16.03258 1.000 47.14014 N ? C ? 25 1 ATOM 2583 CA . THR B 25 ? 29.90714 9.27975 -16.15532 1.000 36.23048 C ? C ? 25 1 ATOM 2584 C . THR B 25 ? 28.77781 10.15397 -16.68914 1.000 36.79787 C ? C ? 25 1 ATOM 2585 O . THR B 25 ? 28.59805 11.29014 -16.23771 1.000 31.93768 O ? C ? 25 1 ATOM 2586 CB . THR B 25 ? 29.51553 8.67873 -14.80487 1.000 39.03274 C ? C ? 25 1 ATOM 2587 OG1 . THR B 25 ? 30.62618 7.95082 -14.27051 1.000 37.57379 O ? C ? 25 1 ATOM 2588 CG2 . THR B 25 ? 28.32472 7.73889 -14.95492 1.000 30.79614 C ? C ? 25 1 ATOM 2589 N . THR B 26 ? 28.01844 9.61915 -17.64471 1.000 34.01645 N ? C ? 26 1 ATOM 2590 CA . THR B 26 ? 26.88709 10.31964 -18.24213 1.000 31.66548 C ? C ? 26 1 ATOM 2591 C . THR B 26 ? 25.68093 9.39270 -18.25779 1.000 31.07548 C ? C ? 26 1 ATOM 2592 O . THR B 26 ? 25.75226 8.28832 -18.80722 1.000 30.32102 O ? C ? 26 1 ATOM 2593 CB . THR B 26 ? 27.21623 10.78868 -19.66140 1.000 30.25463 C ? C ? 26 1 ATOM 2594 OG1 . THR B 26 ? 28.20015 11.82704 -19.60451 1.000 48.86638 O ? C ? 26 1 ATOM 2595 CG2 . THR B 26 ? 25.97024 11.31490 -20.35145 1.000 29.72656 C ? C ? 26 1 ATOM 2596 N . LEU B 27 ? 24.57948 9.83707 -17.65686 1.000 26.45791 N ? C ? 27 1 ATOM 2597 CA . LEU B 27 ? 23.32893 9.08793 -17.68519 1.000 25.35938 C ? C ? 27 1 ATOM 2598 C . LEU B 27 ? 22.17801 10.07614 -17.85942 1.000 29.02026 C ? C ? 27 1 ATOM 2599 O . LEU B 27 ? 22.38568 11.27121 -18.09164 1.000 24.95967 O ? C ? 27 1 ATOM 2600 CB . LEU B 27 ? 23.18406 8.21182 -16.43109 1.000 29.54198 C ? C ? 27 1 ATOM 2601 CG . LEU B 27 ? 23.51819 8.75850 -15.03964 1.000 30.13148 C ? C ? 27 1 ATOM 2602 CD1 . LEU B 27 ? 22.49708 9.78542 -14.56149 1.000 23.89488 C ? C ? 27 1 ATOM 2603 CD2 . LEU B 27 ? 23.62686 7.60969 -14.04513 1.000 21.80802 C ? C ? 27 1 ATOM 2604 N . ASN B 28 ? 20.95458 9.57101 -17.74574 1.000 23.20290 N ? C ? 28 1 ATOM 2605 CA . ASN B 28 ? 19.74895 10.34910 -17.98729 1.000 29.72877 C ? C ? 28 1 ATOM 2606 C . ASN B 28 ? 19.18723 10.91286 -16.68753 1.000 25.48802 C ? C ? 28 1 ATOM 2607 O . ASN B 28 ? 19.43399 10.39261 -15.59677 1.000 24.65525 O ? C ? 28 1 ATOM 2608 CB . ASN B 28 ? 18.68600 9.49142 -18.68007 1.000 22.82478 C ? C ? 28 1 ATOM 2609 CG . ASN B 28 ? 19.21895 8.78672 -19.91039 1.000 24.22476 C ? C ? 28 1 ATOM 2610 OD1 . ASN B 28 ? 19.42354 9.40838 -20.95371 1.000 22.32938 O ? C ? 28 1 ATOM 2611 ND2 . ASN B 28 ? 19.44827 7.48143 -19.79509 1.000 23.86151 N ? C ? 28 1 ATOM 2612 N . GLY B 29 ? 18.41155 11.99022 -16.82212 1.000 21.74921 N ? C ? 29 1 ATOM 2613 CA . GLY B 29 ? 17.76755 12.60552 -15.68158 1.000 21.71529 C ? C ? 29 1 ATOM 2614 C . GLY B 29 ? 16.35010 13.02763 -16.01619 1.000 21.17989 C ? C ? 29 1 ATOM 2615 O . GLY B 29 ? 16.01254 13.28315 -17.17293 1.000 25.28806 O ? C ? 29 1 ATOM 2616 N . LEU B 30 ? 15.52052 13.10208 -14.97320 1.000 22.98247 N ? C ? 30 1 ATOM 2617 CA . LEU B 30 ? 14.10809 13.46338 -15.09692 1.000 26.40047 C ? C ? 30 1 ATOM 2618 C . LEU B 30 ? 13.91304 14.87564 -14.55346 1.000 24.07077 C ? C ? 30 1 ATOM 2619 O . LEU B 30 ? 14.06252 15.11133 -13.34903 1.000 25.62587 O ? C ? 30 1 ATOM 2620 CB . LEU B 30 ? 13.21969 12.46283 -14.35763 1.000 23.85511 C ? C ? 30 1 ATOM 2621 CG . LEU B 30 ? 11.70098 12.63469 -14.47546 1.000 26.05935 C ? C ? 30 1 ATOM 2622 CD1 . LEU B 30 ? 11.23327 12.34902 -15.89461 1.000 23.89665 C ? C ? 30 1 ATOM 2623 CD2 . LEU B 30 ? 10.96349 11.74905 -13.47621 1.000 21.10131 C ? C ? 30 1 ATOM 2624 N . TRP B 31 ? 13.55918 15.80388 -15.43961 1.000 27.26687 N ? C ? 31 1 ATOM 2625 CA . TRP B 31 ? 13.47358 17.22987 -15.12130 1.000 25.41394 C ? C ? 31 1 ATOM 2626 C . TRP B 31 ? 12.00906 17.61276 -14.91520 1.000 30.01538 C ? C ? 31 1 ATOM 2627 O . TRP B 31 ? 11.24672 17.74634 -15.87700 1.000 27.79871 O ? C ? 31 1 ATOM 2628 CB . TRP B 31 ? 14.11216 18.05241 -16.23471 1.000 23.55529 C ? C ? 31 1 ATOM 2629 CG . TRP B 31 ? 14.22613 19.51629 -15.95813 1.000 28.04505 C ? C ? 31 1 ATOM 2630 CD1 . TRP B 31 ? 14.23905 20.13005 -14.73784 1.000 27.33675 C ? C ? 31 1 ATOM 2631 CD2 . TRP B 31 ? 14.34545 20.55852 -16.93325 1.000 27.28986 C ? C ? 31 1 ATOM 2632 NE1 . TRP B 31 ? 14.36180 21.49369 -14.89534 1.000 23.48079 N ? C ? 31 1 ATOM 2633 CE2 . TRP B 31 ? 14.42566 21.77997 -16.23395 1.000 23.85462 C ? C ? 31 1 ATOM 2634 CE3 . TRP B 31 ? 14.38835 20.57751 -18.33160 1.000 28.74043 C ? C ? 31 1 ATOM 2635 CZ2 . TRP B 31 ? 14.54706 23.00429 -16.88505 1.000 29.55650 C ? C ? 31 1 ATOM 2636 CZ3 . TRP B 31 ? 14.51031 21.79822 -18.97580 1.000 27.87717 C ? C ? 31 1 ATOM 2637 CH2 . TRP B 31 ? 14.58838 22.99162 -18.25279 1.000 28.49696 C ? C ? 31 1 ATOM 2638 N . LEU B 32 ? 11.62375 17.79862 -13.65286 1.000 26.41766 N ? C ? 32 1 ATOM 2639 CA . LEU B 32 ? 10.28021 18.21626 -13.27238 1.000 26.95328 C ? C ? 32 1 ATOM 2640 C . LEU B 32 ? 10.39139 19.43490 -12.37041 1.000 29.93692 C ? C ? 32 1 ATOM 2641 O . LEU B 32 ? 11.11806 19.40099 -11.37193 1.000 27.78082 O ? C ? 32 1 ATOM 2642 CB . LEU B 32 ? 9.53435 17.09031 -12.54997 1.000 28.62888 C ? C ? 32 1 ATOM 2643 CG . LEU B 32 ? 9.39239 15.77095 -13.31218 1.000 27.32419 C ? C ? 32 1 ATOM 2644 CD1 . LEU B 32 ? 9.01253 14.64028 -12.36528 1.000 20.75906 C ? C ? 32 1 ATOM 2645 CD2 . LEU B 32 ? 8.36440 15.91365 -14.41912 1.000 22.64901 C ? C ? 32 1 ATOM 2646 N . ASP B 33 ? 9.66614 20.50009 -12.71395 1.000 30.35138 N ? C ? 33 1 ATOM 2647 CA . ASP B 33 ? 9.78180 21.79832 -12.03419 1.000 35.98979 C ? C ? 33 1 ATOM 2648 C . ASP B 33 ? 11.26012 22.19014 -12.09052 1.000 33.02931 C ? C ? 33 1 ATOM 2649 O . ASP B 33 ? 11.86050 22.12517 -13.17162 1.000 26.72066 O ? C ? 33 1 ATOM 2650 CB . ASP B 33 ? 9.16924 21.71869 -10.63906 1.000 41.60074 C ? C ? 33 1 ATOM 2651 CG . ASP B 33 ? 7.67913 21.41145 -10.66888 1.000 50.58592 C ? C ? 33 1 ATOM 2652 OD1 . ASP B 33 ? 6.98315 21.90444 -11.58492 1.000 49.39324 O ? C ? 33 1 ATOM 2653 OD2 . ASP B 33 ? 7.20315 20.67875 -9.77396 1.000 47.73069 O ? C ? 33 1 ATOM 2654 N . ASP B 34 ? 11.88955 22.56274 -10.97529 1.000 24.12053 N ? C ? 34 1 ATOM 2655 CA . ASP B 34 ? 13.29650 22.94960 -10.97994 1.000 34.25243 C ? C ? 34 1 ATOM 2656 C . ASP B 34 ? 14.19355 21.89385 -10.33417 1.000 27.83272 C ? C ? 34 1 ATOM 2657 O . ASP B 34 ? 15.21578 22.22648 -9.73219 1.000 28.92170 O ? C ? 34 1 ATOM 2658 CB . ASP B 34 ? 13.48857 24.30763 -10.29972 1.000 27.54538 C ? C ? 34 1 ATOM 2659 CG . ASP B 34 ? 13.05006 24.31242 -8.84338 1.000 34.57641 C ? C ? 34 1 ATOM 2660 OD1 . ASP B 34 ? 12.51760 23.28765 -8.36408 1.000 33.36164 O ? C ? 34 1 ATOM 2661 OD2 . ASP B 34 ? 13.24129 25.35364 -8.17617 1.000 36.34060 O ? C ? 34 1 ATOM 2662 N . VAL B 35 ? 13.83221 20.61830 -10.45971 1.000 32.18178 N ? C ? 35 1 ATOM 2663 CA . VAL B 35 ? 14.58777 19.52021 -9.86763 1.000 28.08209 C ? C ? 35 1 ATOM 2664 C . VAL B 35 ? 14.85504 18.47221 -10.93769 1.000 28.63725 C ? C ? 35 1 ATOM 2665 O . VAL B 35 ? 13.95170 18.10295 -11.69667 1.000 24.94792 O ? C ? 35 1 ATOM 2666 CB . VAL B 35 ? 13.84106 18.88869 -8.67407 1.000 25.78864 C ? C ? 35 1 ATOM 2667 CG1 . VAL B 35 ? 14.63498 17.71875 -8.10751 1.000 24.09631 C ? C ? 35 1 ATOM 2668 CG2 . VAL B 35 ? 13.58463 19.92730 -7.60025 1.000 26.04266 C ? C ? 35 1 ATOM 2669 N . VAL B 36 ? 16.09660 17.99482 -10.99776 1.000 21.71932 N ? C ? 36 1 ATOM 2670 CA . VAL B 36 ? 16.48763 16.89617 -11.87362 1.000 24.35186 C ? C ? 36 1 ATOM 2671 C . VAL B 36 ? 16.76051 15.67426 -11.00798 1.000 24.94084 C ? C ? 36 1 ATOM 2672 O . VAL B 36 ? 17.50170 15.75952 -10.02054 1.000 22.99054 O ? C ? 36 1 ATOM 2673 CB . VAL B 36 ? 17.71842 17.25869 -12.72099 1.000 29.34169 C ? C ? 36 1 ATOM 2674 CG1 . VAL B 36 ? 18.20078 16.04169 -13.49833 1.000 24.95447 C ? C ? 36 1 ATOM 2675 CG2 . VAL B 36 ? 17.39361 18.40911 -13.66687 1.000 20.40398 C ? C ? 36 1 ATOM 2676 N . TYR B 37 ? 16.14996 14.54770 -11.36912 1.000 23.84726 N ? C ? 37 1 ATOM 2677 CA . TYR B 37 ? 16.31324 13.27966 -10.67062 1.000 21.47807 C ? C ? 37 1 ATOM 2678 C . TYR B 37 ? 17.15442 12.34142 -11.52296 1.000 23.87971 C ? C ? 37 1 ATOM 2679 O . TYR B 37 ? 16.94268 12.24335 -12.73418 1.000 22.44489 O ? C ? 37 1 ATOM 2680 CB . TYR B 37 ? 14.95501 12.62633 -10.38170 1.000 20.61674 C ? C ? 37 1 ATOM 2681 CG . TYR B 37 ? 13.96944 13.51855 -9.65655 1.000 26.25573 C ? C ? 37 1 ATOM 2682 CD1 . TYR B 37 ? 13.21484 14.45976 -10.34751 1.000 25.27929 C ? C ? 37 1 ATOM 2683 CD2 . TYR B 37 ? 13.78278 13.41092 -8.28389 1.000 28.14104 C ? C ? 37 1 ATOM 2684 CE1 . TYR B 37 ? 12.31050 15.27884 -9.69138 1.000 21.76534 C ? C ? 37 1 ATOM 2685 CE2 . TYR B 37 ? 12.87652 14.22227 -7.61960 1.000 30.67439 C ? C ? 37 1 ATOM 2686 CZ . TYR B 37 ? 12.14542 15.15609 -8.32885 1.000 28.75630 C ? C ? 37 1 ATOM 2687 OH . TYR B 37 ? 11.24277 15.96804 -7.67453 1.000 31.54291 O ? C ? 37 1 ATOM 2688 N . CYS B 38 ? 18.09945 11.64542 -10.89466 1.000 22.87377 N ? C ? 38 1 ATOM 2689 CA . CYS B 38 ? 18.96906 10.72771 -11.61949 1.000 20.45650 C ? C ? 38 1 ATOM 2690 C . CYS B 38 ? 19.54546 9.72083 -10.63419 1.000 22.59534 C ? C ? 38 1 ATOM 2691 O . CYS B 38 ? 19.57538 9.97764 -9.42594 1.000 20.63888 O ? C ? 38 1 ATOM 2692 CB . CYS B 38 ? 20.09586 11.48114 -12.34517 1.000 18.39420 C ? C ? 38 1 ATOM 2693 SG . CYS B 38 ? 21.40805 12.08057 -11.27179 1.000 30.38227 S ? C ? 38 1 ATOM 2694 N . PRO B 39 ? 20.00429 8.56500 -11.11637 1.000 20.73626 N ? C ? 39 1 ATOM 2695 CA . PRO B 39 ? 20.63246 7.59279 -10.21374 1.000 22.97915 C ? C ? 39 1 ATOM 2696 C . PRO B 39 ? 21.87963 8.17631 -9.56577 1.000 26.21839 C ? C ? 39 1 ATOM 2697 O . PRO B 39 ? 22.67172 8.87258 -10.20639 1.000 22.73500 O ? C ? 39 1 ATOM 2698 CB . PRO B 39 ? 20.97316 6.41763 -11.13719 1.000 17.28994 C ? C ? 39 1 ATOM 2699 CG . PRO B 39 ? 20.05161 6.57122 -12.30426 1.000 17.61614 C ? C ? 39 1 ATOM 2700 CD . PRO B 39 ? 19.89506 8.04828 -12.49133 1.000 21.54819 C ? C ? 39 1 ATOM 2701 N . ARG B 40 ? 22.04818 7.88324 -8.27605 1.000 22.39515 N ? C ? 40 1 ATOM 2702 CA . ARG B 40 ? 23.13571 8.48654 -7.51872 1.000 22.89036 C ? C ? 40 1 ATOM 2703 C . ARG B 40 ? 24.50376 7.96016 -7.93362 1.000 29.72513 C ? C ? 40 1 ATOM 2704 O . ARG B 40 ? 25.51297 8.61649 -7.65527 1.000 20.01506 O ? C ? 40 1 ATOM 2705 CB . ARG B 40 ? 22.92375 8.26281 -6.02057 1.000 23.46498 C ? C ? 40 1 ATOM 2706 CG . ARG B 40 ? 23.10900 6.82999 -5.55167 1.000 21.80027 C ? C ? 40 1 ATOM 2707 CD . ARG B 40 ? 23.04216 6.76228 -4.03503 1.000 21.59983 C ? C ? 40 1 ATOM 2708 NE . ARG B 40 ? 23.11802 5.39594 -3.53482 1.000 18.39927 N ? C ? 40 1 ATOM 2709 CZ . ARG B 40 ? 23.05431 5.06788 -2.25134 1.000 30.01480 C ? C ? 40 1 ATOM 2710 NH1 . ARG B 40 ? 22.91177 5.98809 -1.30908 1.000 25.32176 N ? C ? 40 1 ATOM 2711 NH2 . ARG B 40 ? 23.14058 3.78575 -1.90368 1.000 19.64523 N ? C ? 40 1 ATOM 2712 N . HIS B 41 ? 24.56980 6.80461 -8.59740 1.000 22.66240 N ? C ? 41 1 ATOM 2713 CA . HIS B 41 ? 25.85970 6.26714 -9.01387 1.000 24.08716 C ? C ? 41 1 ATOM 2714 C . HIS B 41 ? 26.45601 7.01496 -10.20003 1.000 29.12869 C ? C ? 41 1 ATOM 2715 O . HIS B 41 ? 27.51628 6.61504 -10.69320 1.000 24.24176 O ? C ? 41 1 ATOM 2716 CB . HIS B 41 ? 25.75713 4.76418 -9.32031 1.000 28.60153 C ? C ? 41 1 ATOM 2717 CG . HIS B 41 ? 24.89537 4.42096 -10.49720 1.000 27.94142 C ? C ? 41 1 ATOM 2718 ND1 . HIS B 41 ? 25.36792 4.42105 -11.79193 1.000 31.69794 N ? C ? 41 1 ATOM 2719 CD2 . HIS B 41 ? 23.60284 4.02339 -10.56993 1.000 28.33181 C ? C ? 41 1 ATOM 2720 CE1 . HIS B 41 ? 24.39866 4.05756 -12.61343 1.000 28.13045 C ? C ? 41 1 ATOM 2721 NE2 . HIS B 41 ? 23.31772 3.80809 -11.89688 1.000 28.56099 N ? C ? 41 1 ATOM 2722 N . VAL B 42 ? 25.81352 8.09507 -10.65472 1.000 22.34153 N ? C ? 42 1 ATOM 2723 CA . VAL B 42 ? 26.44799 8.98956 -11.61354 1.000 26.33419 C ? C ? 42 1 ATOM 2724 C . VAL B 42 ? 27.73140 9.59116 -11.04282 1.000 29.82236 C ? C ? 42 1 ATOM 2725 O . VAL B 42 ? 28.62214 9.98431 -11.80367 1.000 31.81493 O ? C ? 42 1 ATOM 2726 CB . VAL B 42 ? 25.45067 10.08842 -12.05321 1.000 21.60378 C ? C ? 42 1 ATOM 2727 CG1 . VAL B 42 ? 25.11068 11.01047 -10.89318 1.000 26.16108 C ? C ? 42 1 ATOM 2728 CG2 . VAL B 42 ? 25.99401 10.88388 -13.23609 1.000 29.79879 C ? C ? 42 1 ATOM 2729 N . ILE B 43 ? 27.86165 9.65376 -9.71091 1.000 25.67073 N ? C ? 43 1 ATOM 2730 CA . ILE B 43 ? 29.05666 10.21629 -9.08520 1.000 33.42845 C ? C ? 43 1 ATOM 2731 C . ILE B 43 ? 30.16771 9.19063 -8.89918 1.000 30.94939 C ? C ? 43 1 ATOM 2732 O . ILE B 43 ? 31.22756 9.53263 -8.35688 1.000 33.47824 O ? C ? 43 1 ATOM 2733 CB . ILE B 43 ? 28.73428 10.84770 -7.71298 1.000 31.53184 C ? C ? 43 1 ATOM 2734 CG1 . ILE B 43 ? 28.36870 9.75858 -6.69779 1.000 29.66511 C ? C ? 43 1 ATOM 2735 CG2 . ILE B 43 ? 27.62249 11.88116 -7.84356 1.000 20.82459 C ? C ? 43 1 ATOM 2736 CD1 . ILE B 43 ? 27.98766 10.28969 -5.32925 1.000 26.94138 C ? C ? 43 1 ATOM 2737 N . CYS B 44 ? 29.96562 7.94853 -9.32873 1.000 29.95381 N ? C ? 44 1 ATOM 2738 CA . CYS B 44 ? 30.95291 6.89440 -9.13494 1.000 30.55879 C ? C ? 44 1 ATOM 2739 C . CYS B 44 ? 31.89482 6.79626 -10.32483 1.000 30.68236 C ? C ? 44 1 ATOM 2740 O . CYS B 44 ? 31.48485 6.97752 -11.47412 1.000 41.84031 O ? C ? 44 1 ATOM 2741 CB . CYS B 44 ? 30.27086 5.54031 -8.93071 1.000 38.55864 C ? C ? 44 1 ATOM 2742 SG . CYS B 44 ? 29.45632 5.31745 -7.35249 1.000 39.08838 S ? C ? 44 1 ATOM 2743 N . THR B 45 ? 33.15885 6.49491 -10.03835 1.000 43.03764 N ? C ? 45 1 ATOM 2744 CA . THR B 45 ? 34.09808 6.05958 -11.05601 1.000 43.35790 C ? C ? 45 1 ATOM 2745 C . THR B 45 ? 33.99785 4.54248 -11.19820 1.000 45.50620 C ? C ? 45 1 ATOM 2746 O . THR B 45 ? 33.16816 3.88965 -10.56176 1.000 48.38067 O ? C ? 45 1 ATOM 2747 CB . THR B 45 ? 35.52108 6.48691 -10.70117 1.000 42.08318 C ? C ? 45 1 ATOM 2748 OG1 . THR B 45 ? 36.03641 5.62257 -9.68329 1.000 51.69601 O ? C ? 45 1 ATOM 2749 CG2 . THR B 45 ? 35.53321 7.91617 -10.17839 1.000 47.43877 C ? C ? 45 1 ATOM 2750 N . SER B 46 ? 34.85656 3.96529 -12.03987 1.000 53.95127 N ? C ? 46 1 ATOM 2751 CA . SER B 46 ? 34.83673 2.51548 -12.21231 1.000 58.44374 C ? C ? 46 1 ATOM 2752 C . SER B 46 ? 35.28251 1.80195 -10.93972 1.000 58.58685 C ? C ? 46 1 ATOM 2753 O . SER B 46 ? 34.71237 0.76918 -10.56702 1.000 46.25085 O ? C ? 46 1 ATOM 2754 CB . SER B 46 ? 35.71606 2.11372 -13.39681 1.000 63.74512 C ? C ? 46 1 ATOM 2755 OG . SER B 46 ? 35.17444 2.60076 -14.61416 1.000 68.08657 O ? C ? 46 1 ATOM 2756 N . GLU B 47 ? 36.29307 2.34504 -10.25404 1.000 55.33059 N ? C ? 47 1 ATOM 2757 CA . GLU B 47 ? 36.76099 1.74626 -9.00742 1.000 56.44119 C ? C ? 47 1 ATOM 2758 C . GLU B 47 ? 35.74351 1.90463 -7.88249 1.000 57.08905 C ? C ? 47 1 ATOM 2759 O . GLU B 47 ? 35.69766 1.07334 -6.96820 1.000 59.68960 O ? C ? 47 1 ATOM 2760 CB . GLU B 47 ? 38.09290 2.37364 -8.59794 1.000 49.11082 C ? C ? 47 1 ATOM 2761 CG . GLU B 47 ? 38.91487 1.53777 -7.62274 1.000 69.82010 C ? C ? 47 1 ATOM 2762 CD . GLU B 47 ? 39.80472 0.52392 -8.32068 1.000 80.49519 C ? C ? 47 1 ATOM 2763 OE1 . GLU B 47 ? 39.27259 -0.42037 -8.94352 1.000 70.35275 O ? C ? 47 1 ATOM 2764 OE2 . GLU B 47 ? 41.04221 0.67677 -8.24990 1.000 67.14230 O ? C ? 47 1 ATOM 2765 N . ASP B 48 ? 34.92712 2.96032 -7.92582 1.000 48.29755 N ? C ? 48 1 ATOM 2766 CA . ASP B 48 ? 34.00115 3.22379 -6.82869 1.000 48.82960 C ? C ? 48 1 ATOM 2767 C . ASP B 48 ? 32.86611 2.21055 -6.78269 1.000 44.91109 C ? C ? 48 1 ATOM 2768 O . ASP B 48 ? 32.37741 1.87827 -5.69687 1.000 36.57153 O ? C ? 48 1 ATOM 2769 CB . ASP B 48 ? 33.43685 4.63902 -6.94973 1.000 36.95018 C ? C ? 48 1 ATOM 2770 CG . ASP B 48 ? 34.50241 5.70008 -6.79466 1.000 49.45385 C ? C ? 48 1 ATOM 2771 OD1 . ASP B 48 ? 35.53808 5.39851 -6.16454 1.000 50.31824 O ? C ? 48 1 ATOM 2772 OD2 . ASP B 48 ? 34.30806 6.82866 -7.29768 1.000 44.11685 O ? C ? 48 1 ATOM 2773 N . MET B 49 ? 32.44850 1.69917 -7.94097 1.000 48.13487 N ? C ? 49 1 ATOM 2774 CA . MET B 49 ? 31.24353 0.88372 -8.01721 1.000 48.50311 C ? C ? 49 1 ATOM 2775 C . MET B 49 ? 31.36933 -0.43527 -7.26452 1.000 40.82381 C ? C ? 49 1 ATOM 2776 O . MET B 49 ? 30.34289 -1.04457 -6.94422 1.000 32.24010 O ? C ? 49 1 ATOM 2777 CB . MET B 49 ? 30.89270 0.62768 -9.48317 1.000 48.97124 C ? C ? 49 1 ATOM 2778 CG . MET B 49 ? 30.83329 1.89858 -10.31521 1.000 48.26109 C ? C ? 49 1 ATOM 2779 SD . MET B 49 ? 29.39399 1.96692 -11.39855 1.000 68.86166 S ? C ? 49 1 ATOM 2780 CE . MET B 49 ? 29.58372 3.59462 -12.13150 1.000 48.95147 C ? C ? 49 1 ATOM 2781 N . LEU B 50 ? 32.59259 -0.88199 -6.96340 1.000 38.91286 N ? C ? 50 1 ATOM 2782 CA . LEU B 50 ? 32.76580 -2.16135 -6.28055 1.000 39.56001 C ? C ? 50 1 ATOM 2783 C . LEU B 50 ? 32.28370 -2.08567 -4.83520 1.000 45.80776 C ? C ? 50 1 ATOM 2784 O . LEU B 50 ? 31.55158 -2.96574 -4.36929 1.000 40.37430 O ? C ? 50 1 ATOM 2785 CB . LEU B 50 ? 34.23037 -2.59702 -6.34931 1.000 44.52220 C ? C ? 50 1 ATOM 2786 CG . LEU B 50 ? 34.54455 -4.08613 -6.15582 1.000 57.59548 C ? C ? 50 1 ATOM 2787 CD1 . LEU B 50 ? 34.66523 -4.46170 -4.67853 1.000 57.33901 C ? C ? 50 1 ATOM 2788 CD2 . LEU B 50 ? 33.49659 -4.95192 -6.85581 1.000 44.76509 C ? C ? 50 1 ATOM 2789 N . ASN B 51 ? 32.68361 -1.04344 -4.10941 1.000 42.67935 N ? C ? 51 1 ATOM 2790 CA . ASN B 51 ? 32.25690 -0.84855 -2.72237 1.000 36.18127 C ? C ? 51 1 ATOM 2791 C . ASN B 51 ? 32.12940 0.64424 -2.45125 1.000 39.00463 C ? C ? 51 1 ATOM 2792 O . ASN B 51 ? 32.98595 1.25579 -1.80336 1.000 36.97338 O ? C ? 51 1 ATOM 2793 CB . ASN B 51 ? 33.23788 -1.50275 -1.74813 1.000 45.01346 C ? C ? 51 1 ATOM 2794 CG . ASN B 51 ? 32.80936 -1.35615 -0.29932 1.000 49.46221 C ? C ? 51 1 ATOM 2795 OD1 . ASN B 51 ? 31.63164 -1.14448 -0.00580 1.000 49.84853 O ? C ? 51 1 ATOM 2796 ND2 . ASN B 51 ? 33.76738 -1.46540 0.61516 1.000 48.17601 N ? C ? 51 1 ATOM 2797 N . PRO B 52 ? 31.05273 1.26560 -2.93020 1.000 41.47559 N ? C ? 52 1 ATOM 2798 CA . PRO B 52 ? 30.94453 2.72703 -2.84154 1.000 37.52941 C ? C ? 52 1 ATOM 2799 C . PRO B 52 ? 30.41886 3.19239 -1.49224 1.000 31.34874 C ? C ? 52 1 ATOM 2800 O . PRO B 52 ? 29.47948 2.62150 -0.93294 1.000 32.19979 O ? C ? 52 1 ATOM 2801 CB . PRO B 52 ? 29.95487 3.06760 -3.96288 1.000 33.86237 C ? C ? 52 1 ATOM 2802 CG . PRO B 52 ? 29.06758 1.86046 -4.03631 1.000 32.75717 C ? C ? 52 1 ATOM 2803 CD . PRO B 52 ? 29.92085 0.66706 -3.65972 1.000 35.64212 C ? C ? 52 1 ATOM 2804 N . ASN B 53 ? 31.04549 4.24409 -0.97014 1.000 26.68426 N ? C ? 53 1 ATOM 2805 CA . ASN B 53 ? 30.53119 4.98886 0.17829 1.000 27.26580 C ? C ? 53 1 ATOM 2806 C . ASN B 53 ? 29.90185 6.25628 -0.39256 1.000 26.17299 C ? C ? 53 1 ATOM 2807 O . ASN B 53 ? 30.56519 7.28148 -0.54766 1.000 25.32485 O ? C ? 53 1 ATOM 2808 CB . ASN B 53 ? 31.64392 5.29422 1.17537 1.000 27.93470 C ? C ? 53 1 ATOM 2809 CG . ASN B 53 ? 31.12249 5.87000 2.48488 1.000 27.95450 C ? C ? 53 1 ATOM 2810 OD1 . ASN B 53 ? 30.21346 6.70074 2.49974 1.000 32.25991 O ? C ? 53 1 ATOM 2811 ND2 . ASN B 53 ? 31.70104 5.42528 3.59468 1.000 31.40537 N ? C ? 53 1 ATOM 2812 N . TYR B 54 ? 28.60530 6.17672 -0.71506 1.000 24.20935 N ? C ? 54 1 ATOM 2813 CA . TYR B 54 ? 27.94978 7.26261 -1.44144 1.000 23.91668 C ? C ? 54 1 ATOM 2814 C . TYR B 54 ? 27.91479 8.55634 -0.64178 1.000 24.76441 C ? C ? 54 1 ATOM 2815 O . TYR B 54 ? 27.95071 9.64341 -1.22969 1.000 26.26459 O ? C ? 54 1 ATOM 2816 CB . TYR B 54 ? 26.53278 6.85934 -1.83815 1.000 21.19840 C ? C ? 54 1 ATOM 2817 CG . TYR B 54 ? 26.48733 5.93372 -3.02633 1.000 24.74432 C ? C ? 54 1 ATOM 2818 CD1 . TYR B 54 ? 26.67751 6.41580 -4.31122 1.000 23.44784 C ? C ? 54 1 ATOM 2819 CD2 . TYR B 54 ? 26.25620 4.57850 -2.86371 1.000 28.75617 C ? C ? 54 1 ATOM 2820 CE1 . TYR B 54 ? 26.63276 5.57335 -5.40167 1.000 28.17146 C ? C ? 54 1 ATOM 2821 CE2 . TYR B 54 ? 26.20660 3.72873 -3.94681 1.000 28.41427 C ? C ? 54 1 ATOM 2822 CZ . TYR B 54 ? 26.39882 4.22915 -5.21420 1.000 29.61832 C ? C ? 54 1 ATOM 2823 OH . TYR B 54 ? 26.35270 3.38081 -6.29853 1.000 28.24069 O ? C ? 54 1 ATOM 2824 N . GLU B 55 ? 27.82692 8.46993 0.68679 1.000 23.24532 N ? C ? 55 1 ATOM 2825 CA . GLU B 55 ? 27.92046 9.67835 1.49995 1.000 29.37202 C ? C ? 55 1 ATOM 2826 C . GLU B 55 ? 29.26386 10.36484 1.29022 1.000 26.39060 C ? C ? 55 1 ATOM 2827 O . GLU B 55 ? 29.32002 11.56886 1.01925 1.000 32.16927 O ? C ? 55 1 ATOM 2828 CB . GLU B 55 ? 27.70185 9.35102 2.97847 1.000 24.53679 C ? C ? 55 1 ATOM 2829 CG . GLU B 55 ? 26.26763 8.96818 3.33050 1.000 30.40048 C ? C ? 55 1 ATOM 2830 CD . GLU B 55 ? 25.89823 7.56384 2.87085 1.000 54.84697 C ? C ? 55 1 ATOM 2831 OE1 . GLU B 55 ? 26.82073 6.76552 2.58672 1.000 40.98479 O ? C ? 55 1 ATOM 2832 OE2 . GLU B 55 ? 24.68598 7.25947 2.79510 1.000 59.25094 O ? C ? 55 1 ATOM 2833 N . ASP B 56 ? 30.35871 9.60248 1.37984 1.000 25.79547 N ? C ? 56 1 ATOM 2834 CA . ASP B 56 ? 31.68953 10.17904 1.19980 1.000 30.18326 C ? C ? 56 1 ATOM 2835 C . ASP B 56 ? 31.88163 10.69843 -0.22051 1.000 29.16316 C ? C ? 56 1 ATOM 2836 O . ASP B 56 ? 32.39334 11.80564 -0.42475 1.000 35.07013 O ? C ? 56 1 ATOM 2837 CB . ASP B 56 ? 32.76575 9.14418 1.53915 1.000 35.91408 C ? C ? 56 1 ATOM 2838 CG . ASP B 56 ? 32.96161 8.96633 3.03360 1.000 34.40939 C ? C ? 56 1 ATOM 2839 OD1 . ASP B 56 ? 32.36591 9.73899 3.81495 1.000 32.26981 O ? C ? 56 1 ATOM 2840 OD2 . ASP B 56 ? 33.71796 8.05053 3.42452 1.000 41.24312 O ? C ? 56 1 ATOM 2841 N . LEU B 57 ? 31.47910 9.90673 -1.21745 1.000 26.58743 N ? C ? 57 1 ATOM 2842 CA . LEU B 57 ? 31.67836 10.30085 -2.60927 1.000 27.51421 C ? C ? 57 1 ATOM 2843 C . LEU B 57 ? 30.93575 11.58881 -2.94066 1.000 27.67377 C ? C ? 57 1 ATOM 2844 O . LEU B 57 ? 31.46974 12.45857 -3.63870 1.000 31.91424 O ? C ? 57 1 ATOM 2845 CB . LEU B 57 ? 31.22740 9.17878 -3.54216 1.000 27.56585 C ? C ? 57 1 ATOM 2846 CG . LEU B 57 ? 31.98716 7.85698 -3.44984 1.000 34.44661 C ? C ? 57 1 ATOM 2847 CD1 . LEU B 57 ? 31.43570 6.85735 -4.46120 1.000 25.60301 C ? C ? 57 1 ATOM 2848 CD2 . LEU B 57 ? 33.48009 8.08430 -3.65247 1.000 27.97061 C ? C ? 57 1 ATOM 2849 N . LEU B 58 ? 29.70022 11.72812 -2.45644 1.000 23.60181 N ? C ? 58 1 ATOM 2850 CA . LEU B 58 ? 28.92516 12.92560 -2.76181 1.000 27.05721 C ? C ? 58 1 ATOM 2851 C . LEU B 58 ? 29.49267 14.15720 -2.06908 1.000 25.46930 C ? C ? 58 1 ATOM 2852 O . LEU B 58 ? 29.34878 15.27325 -2.57782 1.000 28.63256 O ? C ? 58 1 ATOM 2853 CB . LEU B 58 ? 27.46296 12.71499 -2.37398 1.000 24.16770 C ? C ? 58 1 ATOM 2854 CG . LEU B 58 ? 26.51031 13.88052 -2.64012 1.000 28.88209 C ? C ? 58 1 ATOM 2855 CD1 . LEU B 58 ? 26.49381 14.24260 -4.11763 1.000 21.70708 C ? C ? 58 1 ATOM 2856 CD2 . LEU B 58 ? 25.11138 13.56116 -2.14564 1.000 23.28365 C ? C ? 58 1 ATOM 2857 N . ILE B 59 ? 30.15038 13.97193 -0.92443 1.000 25.89660 N ? C ? 59 1 ATOM 2858 CA . ILE B 59 ? 30.75021 15.08859 -0.20083 1.000 34.03751 C ? C ? 59 1 ATOM 2859 C . ILE B 59 ? 31.89937 15.70292 -0.99409 1.000 33.15254 C ? C ? 59 1 ATOM 2860 O . ILE B 59 ? 32.14628 16.91346 -0.91120 1.000 36.72566 O ? C ? 59 1 ATOM 2861 CB . ILE B 59 ? 31.19265 14.60676 1.19567 1.000 36.65667 C ? C ? 59 1 ATOM 2862 CG1 . ILE B 59 ? 29.96776 14.47547 2.10678 1.000 29.89765 C ? C ? 59 1 ATOM 2863 CG2 . ILE B 59 ? 32.24646 15.52411 1.80875 1.000 28.75408 C ? C ? 59 1 ATOM 2864 CD1 . ILE B 59 ? 30.26929 13.86826 3.44529 1.000 33.75924 C ? C ? 59 1 ATOM 2865 N . ARG B 60 ? 32.60941 14.89972 -1.78257 1.000 33.22937 N ? C ? 60 1 ATOM 2866 CA . ARG B 60 ? 33.67026 15.42755 -2.63107 1.000 38.07755 C ? C ? 60 1 ATOM 2867 C . ARG B 60 ? 33.14133 16.17288 -3.85165 1.000 35.79498 C ? C ? 60 1 ATOM 2868 O . ARG B 60 ? 33.94173 16.74752 -4.59906 1.000 30.49500 O ? C ? 60 1 ATOM 2869 CB . ARG B 60 ? 34.59536 14.29389 -3.08414 1.000 37.49288 C ? C ? 60 1 ATOM 2870 CG . ARG B 60 ? 35.14358 13.44882 -1.94920 1.000 51.28652 C ? C ? 60 1 ATOM 2871 CD . ARG B 60 ? 36.26737 12.54013 -2.42396 1.000 55.41500 C ? C ? 60 1 ATOM 2872 NE . ARG B 60 ? 35.92670 11.12453 -2.32935 1.000 68.86799 N ? C ? 60 1 ATOM 2873 CZ . ARG B 60 ? 36.00788 10.40403 -1.21781 1.000 58.26539 C ? C ? 60 1 ATOM 2874 NH1 . ARG B 60 ? 36.38148 10.94621 -0.06817 1.000 40.59432 N ? C ? 60 1 ATOM 2875 NH2 . ARG B 60 ? 35.70435 9.10751 -1.26070 1.000 46.09701 N ? C ? 60 1 ATOM 2876 N . LYS B 61 ? 31.82872 16.17737 -4.07125 1.000 31.30876 N ? C ? 61 1 ATOM 2877 CA . LYS B 61 ? 31.22660 16.81279 -5.23370 1.000 31.20209 C ? C ? 61 1 ATOM 2878 C . LYS B 61 ? 30.58193 18.13780 -4.84799 1.000 37.94071 C ? C ? 61 1 ATOM 2879 O . LYS B 61 ? 29.93318 18.24712 -3.80270 1.000 34.03334 O ? C ? 61 1 ATOM 2880 CB . LYS B 61 ? 30.18246 15.89870 -5.87501 1.000 25.45720 C ? C ? 61 1 ATOM 2881 CG . LYS B 61 ? 30.74346 14.58136 -6.36828 1.000 31.19571 C ? C ? 61 1 ATOM 2882 CD . LYS B 61 ? 31.72692 14.80380 -7.49880 1.000 30.77516 C ? C ? 61 1 ATOM 2883 CE . LYS B 61 ? 32.26448 13.48787 -8.01696 1.000 26.19998 C ? C ? 61 1 ATOM 2884 NZ . LYS B 61 ? 33.15556 13.69918 -9.18432 1.000 43.36216 N ? C ? 61 1 ATOM 2885 N . SER B 62 ? 30.77466 19.14007 -5.70100 1.000 35.34559 N ? C ? 62 1 ATOM 2886 CA . SER B 62 ? 30.15236 20.45034 -5.59243 1.000 34.02049 C ? C ? 62 1 ATOM 2887 C . SER B 62 ? 29.10871 20.60500 -6.69276 1.000 30.99909 C ? C ? 62 1 ATOM 2888 O . SER B 62 ? 28.98808 19.76040 -7.58460 1.000 28.57609 O ? C ? 62 1 ATOM 2889 CB . SER B 62 ? 31.20708 21.56153 -5.68360 1.000 31.96151 C ? C ? 62 1 ATOM 2890 OG . SER B 62 ? 32.13431 21.48258 -4.61451 1.000 35.79933 O ? C ? 62 1 ATOM 2891 N . ASN B 63 ? 28.34764 21.70349 -6.62131 1.000 31.81479 N ? C ? 63 1 ATOM 2892 CA . ASN B 63 ? 27.29406 21.93822 -7.60706 1.000 30.74422 C ? C ? 63 1 ATOM 2893 C . ASN B 63 ? 27.85681 21.98617 -9.02272 1.000 31.59684 C ? C ? 63 1 ATOM 2894 O . ASN B 63 ? 27.26398 21.42727 -9.95179 1.000 37.84009 O ? C ? 63 1 ATOM 2895 CB . ASN B 63 ? 26.54520 23.23483 -7.29142 1.000 30.25943 C ? C ? 63 1 ATOM 2896 CG . ASN B 63 ? 25.61456 23.10208 -6.10006 1.000 32.88333 C ? C ? 63 1 ATOM 2897 OD1 . ASN B 63 ? 25.06523 22.03161 -5.83964 1.000 29.33872 O ? C ? 63 1 ATOM 2898 ND2 . ASN B 63 ? 25.42990 24.19647 -5.37176 1.000 27.60142 N ? C ? 63 1 ATOM 2899 N . HIS B 64 ? 29.00607 22.63481 -9.20570 1.000 29.26140 N ? C ? 64 1 ATOM 2900 CA . HIS B 64 ? 29.59391 22.79452 -10.53065 1.000 29.80209 C ? C ? 64 1 ATOM 2901 C . HIS B 64 ? 30.23176 21.51881 -11.06572 1.000 33.45933 C ? C ? 64 1 ATOM 2902 O . HIS B 64 ? 30.70132 21.52061 -12.20894 1.000 34.78564 O ? C ? 64 1 ATOM 2903 CB . HIS B 64 ? 30.63401 23.92089 -10.51967 1.000 32.00658 C ? C ? 64 1 ATOM 2904 CG . HIS B 64 ? 31.84286 23.62421 -9.68836 1.000 34.34285 C ? C ? 64 1 ATOM 2905 ND1 . HIS B 64 ? 31.95445 24.01691 -8.37220 1.000 43.08375 N ? C ? 64 1 ATOM 2906 CD2 . HIS B 64 ? 32.99521 22.97827 -9.98708 1.000 34.88183 C ? C ? 64 1 ATOM 2907 CE1 . HIS B 64 ? 33.12159 23.62270 -7.89473 1.000 42.98848 C ? C ? 64 1 ATOM 2908 NE2 . HIS B 64 ? 33.77240 22.99002 -8.85428 1.000 35.55967 N ? C ? 64 1 ATOM 2909 N . ASN B 65 ? 30.27590 20.44181 -10.27659 1.000 35.08747 N ? C ? 65 1 ATOM 2910 CA . ASN B 65 ? 30.73706 19.15258 -10.77990 1.000 31.31325 C ? C ? 65 1 ATOM 2911 C . ASN B 65 ? 29.66407 18.39963 -11.55577 1.000 34.34171 C ? C ? 65 1 ATOM 2912 O . ASN B 65 ? 29.94886 17.31803 -12.08206 1.000 37.51176 O ? C ? 65 1 ATOM 2913 CB . ASN B 65 ? 31.22667 18.26554 -9.63186 1.000 29.40977 C ? C ? 65 1 ATOM 2914 CG . ASN B 65 ? 32.47509 18.80052 -8.97249 1.000 36.14693 C ? C ? 65 1 ATOM 2915 OD1 . ASN B 65 ? 32.52362 18.96642 -7.75378 1.000 32.49621 O ? C ? 65 1 ATOM 2916 ND2 . ASN B 65 ? 33.49533 19.07953 -9.77560 1.000 40.47125 N ? C ? 65 1 ATOM 2917 N . PHE B 66 ? 28.44661 18.92960 -11.63123 1.000 35.63675 N ? C ? 66 1 ATOM 2918 CA . PHE B 66 ? 27.34353 18.28554 -12.33348 1.000 37.19927 C ? C ? 66 1 ATOM 2919 C . PHE B 66 ? 27.00653 19.09942 -13.57560 1.000 37.27258 C ? C ? 66 1 ATOM 2920 O . PHE B 66 ? 26.72195 20.29807 -13.47851 1.000 36.84773 O ? C ? 66 1 ATOM 2921 CB . PHE B 66 ? 26.11904 18.15202 -11.42791 1.000 31.46306 C ? C ? 66 1 ATOM 2922 CG . PHE B 66 ? 26.35013 17.29525 -10.21441 1.000 32.26571 C ? C ? 66 1 ATOM 2923 CD1 . PHE B 66 ? 26.33624 15.91324 -10.31457 1.000 37.50729 C ? C ? 66 1 ATOM 2924 CD2 . PHE B 66 ? 26.56886 17.86947 -8.97286 1.000 30.23513 C ? C ? 66 1 ATOM 2925 CE1 . PHE B 66 ? 26.54304 15.11737 -9.19941 1.000 34.40783 C ? C ? 66 1 ATOM 2926 CE2 . PHE B 66 ? 26.77540 17.08163 -7.85402 1.000 36.08669 C ? C ? 66 1 ATOM 2927 CZ . PHE B 66 ? 26.76252 15.70176 -7.96767 1.000 38.33197 C ? C ? 66 1 ATOM 2928 N . LEU B 67 ? 27.04715 18.44973 -14.73553 1.000 36.57240 N ? C ? 67 1 ATOM 2929 CA . LEU B 67 ? 26.72276 19.07204 -16.01415 1.000 36.15142 C ? C ? 67 1 ATOM 2930 C . LEU B 67 ? 25.37908 18.52420 -16.47854 1.000 39.58410 C ? C ? 67 1 ATOM 2931 O . LEU B 67 ? 25.28660 17.36246 -16.89062 1.000 37.96594 O ? C ? 67 1 ATOM 2932 CB . LEU B 67 ? 27.81602 18.79916 -17.04452 1.000 40.64845 C ? C ? 67 1 ATOM 2933 CG . LEU B 67 ? 28.81137 19.92513 -17.32894 1.000 56.39109 C ? C ? 67 1 ATOM 2934 CD1 . LEU B 67 ? 28.12917 21.05752 -18.08699 1.000 60.71269 C ? C ? 67 1 ATOM 2935 CD2 . LEU B 67 ? 29.44261 20.43639 -16.03845 1.000 54.23591 C ? C ? 67 1 ATOM 2936 N . VAL B 68 ? 24.33991 19.35246 -16.39933 1.000 29.97602 N ? C ? 68 1 ATOM 2937 CA . VAL B 68 ? 22.99727 18.98539 -16.83341 1.000 29.08566 C ? C ? 68 1 ATOM 2938 C . VAL B 68 ? 22.70771 19.68895 -18.15082 1.000 35.26581 C ? C ? 68 1 ATOM 2939 O . VAL B 68 ? 23.03838 20.86819 -18.32157 1.000 33.92841 O ? C ? 68 1 ATOM 2940 CB . VAL B 68 ? 21.93543 19.34341 -15.77605 1.000 32.44983 C ? C ? 68 1 ATOM 2941 CG1 . VAL B 68 ? 20.58693 18.74632 -16.15584 1.000 25.58944 C ? C ? 68 1 ATOM 2942 CG2 . VAL B 68 ? 22.37202 18.86413 -14.40552 1.000 27.26898 C ? C ? 68 1 ATOM 2943 N . GLN B 69 ? 22.08438 18.96603 -19.07998 1.000 30.37088 N ? C ? 69 1 ATOM 2944 CA . GLN B 69 ? 21.81752 19.48530 -20.41633 1.000 38.10557 C ? C ? 69 1 ATOM 2945 C . GLN B 69 ? 20.45188 19.00508 -20.88134 1.000 32.49863 C ? C ? 69 1 ATOM 2946 O . GLN B 69 ? 20.23775 17.79912 -21.04133 1.000 29.73337 O ? C ? 69 1 ATOM 2947 CB . GLN B 69 ? 22.90341 19.03778 -21.39475 1.000 39.66461 C ? C ? 69 1 ATOM 2948 CG . GLN B 69 ? 23.35016 20.10301 -22.36357 1.000 42.67706 C ? C ? 69 1 ATOM 2949 CD . GLN B 69 ? 24.67914 19.75640 -22.98915 1.000 53.38562 C ? C ? 69 1 ATOM 2950 OE1 . GLN B 69 ? 25.23586 18.69066 -22.72723 1.000 52.01824 O ? C ? 69 1 ATOM 2951 NE2 . GLN B 69 ? 25.20200 20.65443 -23.81414 1.000 62.87430 N ? C ? 69 1 ATOM 2952 N . ALA B 70 ? 19.53491 19.94643 -21.10157 1.000 34.22346 N ? C ? 70 1 ATOM 2953 CA . ALA B 70 ? 18.20853 19.65156 -21.64481 1.000 38.03195 C ? C ? 70 1 ATOM 2954 C . ALA B 70 ? 18.25771 19.95409 -23.13757 1.000 37.14004 C ? C ? 70 1 ATOM 2955 O . ALA B 70 ? 18.03119 21.08344 -23.57073 1.000 40.88861 O ? C ? 70 1 ATOM 2956 CB . ALA B 70 ? 17.13128 20.46206 -20.93694 1.000 33.03352 C ? C ? 70 1 ATOM 2957 N . GLY B 71 ? 18.55141 18.92789 -23.92956 1.000 44.49248 N ? C ? 71 1 ATOM 2958 CA . GLY B 71 ? 18.83996 19.13057 -25.33370 1.000 38.76743 C ? C ? 71 1 ATOM 2959 C . GLY B 71 ? 20.13654 19.89229 -25.50210 1.000 46.38203 C ? C ? 71 1 ATOM 2960 O . GLY B 71 ? 21.21773 19.35755 -25.24195 1.000 51.63552 O ? C ? 71 1 ATOM 2961 N . ASN B 72 ? 20.04192 21.14951 -25.92516 1.000 46.10014 N ? C ? 72 1 ATOM 2962 CA . ASN B 72 ? 21.19906 22.02834 -25.98866 1.000 49.21070 C ? C ? 72 1 ATOM 2963 C . ASN B 72 ? 21.21742 23.06701 -24.87841 1.000 56.76673 C ? C ? 72 1 ATOM 2964 O . ASN B 72 ? 22.25729 23.69856 -24.65965 1.000 48.86147 O ? C ? 72 1 ATOM 2965 CB . ASN B 72 ? 21.25588 22.72937 -27.34807 1.000 52.28666 C ? C ? 72 1 ATOM 2966 CG . ASN B 72 ? 22.07313 21.95748 -28.35801 1.000 65.08184 C ? C ? 72 1 ATOM 2967 OD1 . ASN B 72 ? 21.57853 21.02896 -28.99934 1.000 64.42282 O ? C ? 72 1 ATOM 2968 ND2 . ASN B 72 ? 23.34040 22.32988 -28.49671 1.000 67.13593 N ? C ? 72 1 ATOM 2969 N . VAL B 73 ? 20.10083 23.25022 -24.17474 1.000 50.44450 N ? C ? 73 1 ATOM 2970 CA . VAL B 73 ? 20.04668 24.19996 -23.07200 1.000 50.38860 C ? C ? 73 1 ATOM 2971 C . VAL B 73 ? 20.87587 23.67268 -21.90842 1.000 50.55293 C ? C ? 73 1 ATOM 2972 O . VAL B 73 ? 20.74987 22.50706 -21.50775 1.000 43.28921 O ? C ? 73 1 ATOM 2973 CB . VAL B 73 ? 18.58856 24.45548 -22.65822 1.000 52.40441 C ? C ? 73 1 ATOM 2974 CG1 . VAL B 73 ? 18.52200 25.15949 -21.30998 1.000 54.61348 C ? C ? 73 1 ATOM 2975 CG2 . VAL B 73 ? 17.86940 25.27106 -23.72159 1.000 47.72200 C ? C ? 73 1 ATOM 2976 N . GLN B 74 ? 21.73691 24.52901 -21.36658 1.000 40.83308 N ? C ? 74 1 ATOM 2977 CA . GLN B 74 ? 22.56670 24.19682 -20.21736 1.000 41.22499 C ? C ? 74 1 ATOM 2978 C . GLN B 74 ? 21.87246 24.66213 -18.94549 1.000 45.10899 C ? C ? 74 1 ATOM 2979 O . GLN B 74 ? 21.53315 25.84312 -18.81459 1.000 54.93879 O ? C ? 74 1 ATOM 2980 CB . GLN B 74 ? 23.94362 24.85166 -20.32992 1.000 49.64430 C ? C ? 74 1 ATOM 2981 CG . GLN B 74 ? 25.09516 23.94096 -19.94705 1.000 57.34406 C ? C ? 74 1 ATOM 2982 CD . GLN B 74 ? 25.36217 22.87970 -20.99818 1.000 65.67727 C ? C ? 74 1 ATOM 2983 OE1 . GLN B 74 ? 25.20409 23.12263 -22.19719 1.000 67.25902 O ? C ? 74 1 ATOM 2984 NE2 . GLN B 74 ? 25.76620 21.69367 -20.55391 1.000 62.24415 N ? C ? 74 1 ATOM 2985 N . LEU B 75 ? 21.66390 23.73913 -18.01473 1.000 35.84093 N ? C ? 75 1 ATOM 2986 CA . LEU B 75 ? 21.04236 24.05420 -16.73822 1.000 37.49156 C ? C ? 75 1 ATOM 2987 C . LEU B 75 ? 22.11730 24.27593 -15.68286 1.000 45.37257 C ? C ? 75 1 ATOM 2988 O . LEU B 75 ? 23.08104 23.50970 -15.58833 1.000 47.64461 O ? C ? 75 1 ATOM 2989 CB . LEU B 75 ? 20.09461 22.93791 -16.29705 1.000 33.12708 C ? C ? 75 1 ATOM 2990 CG . LEU B 75 ? 18.98619 22.56222 -17.28425 1.000 32.84236 C ? C ? 75 1 ATOM 2991 CD1 . LEU B 75 ? 18.08529 21.47961 -16.70678 1.000 29.83812 C ? C ? 75 1 ATOM 2992 CD2 . LEU B 75 ? 18.17809 23.78919 -17.66689 1.000 32.09089 C ? C ? 75 1 ATOM 2993 N . ARG B 76 ? 21.95352 25.33448 -14.89796 1.000 37.93655 N ? C ? 76 1 ATOM 2994 CA . ARG B 76 ? 22.89357 25.65408 -13.83411 1.000 35.59855 C ? C ? 76 1 ATOM 2995 C . ARG B 76 ? 22.44604 24.95231 -12.55839 1.000 35.89648 C ? C ? 76 1 ATOM 2996 O . ARG B 76 ? 21.30994 25.13338 -12.10910 1.000 36.71760 O ? C ? 76 1 ATOM 2997 CB . ARG B 76 ? 22.98406 27.16483 -13.62768 1.000 31.45400 C ? C ? 76 1 ATOM 2998 CG . ARG B 76 ? 24.13352 27.59516 -12.73173 1.000 42.16210 C ? C ? 76 1 ATOM 2999 CD . ARG B 76 ? 24.26870 29.10654 -12.72437 1.000 41.54511 C ? C ? 76 1 ATOM 3000 NE . ARG B 76 ? 24.50015 29.63925 -14.06251 1.000 48.26262 N ? C ? 76 1 ATOM 3001 CZ . ARG B 76 ? 25.66653 30.09825 -14.49631 1.000 55.98820 C ? C ? 76 1 ATOM 3002 NH1 . ARG B 76 ? 26.73705 30.10897 -13.71783 1.000 47.91619 N ? C ? 76 1 ATOM 3003 NH2 . ARG B 76 ? 25.75909 30.56537 -15.73963 1.000 46.20338 N ? C ? 76 1 ATOM 3004 N . VAL B 77 ? 23.32716 24.14304 -11.98417 1.000 33.21004 N ? C ? 77 1 ATOM 3005 CA . VAL B 77 ? 23.00332 23.43582 -10.75166 1.000 28.36180 C ? C ? 77 1 ATOM 3006 C . VAL B 77 ? 23.29532 24.35119 -9.57118 1.000 27.86437 C ? C ? 77 1 ATOM 3007 O . VAL B 77 ? 24.43384 24.79406 -9.38247 1.000 28.09666 O ? C ? 77 1 ATOM 3008 CB . VAL B 77 ? 23.79023 22.12484 -10.63887 1.000 32.49116 C ? C ? 77 1 ATOM 3009 CG1 . VAL B 77 ? 23.35947 21.35641 -9.39093 1.000 25.12795 C ? C ? 77 1 ATOM 3010 CG2 . VAL B 77 ? 23.60883 21.27877 -11.89523 1.000 31.83170 C ? C ? 77 1 ATOM 3011 N . ILE B 78 ? 22.26576 24.63190 -8.77382 1.000 32.38015 N ? C ? 78 1 ATOM 3012 CA . ILE B 78 ? 22.38029 25.50523 -7.61218 1.000 28.37624 C ? C ? 78 1 ATOM 3013 C . ILE B 78 ? 22.21964 24.75212 -6.30243 1.000 29.38579 C ? C ? 78 1 ATOM 3014 O . ILE B 78 ? 22.32028 25.36686 -5.22841 1.000 31.93024 O ? C ? 78 1 ATOM 3015 CB . ILE B 78 ? 21.37199 26.66672 -7.68901 1.000 30.23933 C ? C ? 78 1 ATOM 3016 CG1 . ILE B 78 ? 19.94335 26.13125 -7.60736 1.000 31.76110 C ? C ? 78 1 ATOM 3017 CG2 . ILE B 78 ? 21.55977 27.45638 -8.97873 1.000 30.14710 C ? C ? 78 1 ATOM 3018 CD1 . ILE B 78 ? 18.87589 27.19155 -7.76777 1.000 31.20747 C ? C ? 78 1 ATOM 3019 N . GLY B 79 ? 21.97715 23.44357 -6.35058 1.000 30.44248 N ? C ? 79 1 ATOM 3020 CA . GLY B 79 ? 21.84781 22.64181 -5.14776 1.000 30.33779 C ? C ? 79 1 ATOM 3021 C . GLY B 79 ? 21.81008 21.15596 -5.44926 1.000 30.41639 C ? C ? 79 1 ATOM 3022 O . GLY B 79 ? 21.38362 20.75755 -6.53739 1.000 33.57967 O ? C ? 79 1 ATOM 3023 N . HIS B 80 ? 22.25033 20.32055 -4.50812 1.000 27.05820 N ? C ? 80 1 ATOM 3024 CA . HIS B 80 ? 22.26232 18.87953 -4.72945 1.000 28.90247 C ? C ? 80 1 ATOM 3025 C . HIS B 80 ? 22.02524 18.15487 -3.41595 1.000 30.07944 C ? C ? 80 1 ATOM 3026 O . HIS B 80 ? 22.54409 18.55814 -2.37251 1.000 28.72681 O ? C ? 80 1 ATOM 3027 CB . HIS B 80 ? 23.58136 18.40179 -5.34642 1.000 23.58244 C ? C ? 80 1 ATOM 3028 CG . HIS B 80 ? 24.77290 18.59322 -4.46108 1.000 32.64012 C ? C ? 80 1 ATOM 3029 ND1 . HIS B 80 ? 25.54263 19.73687 -4.48211 1.000 33.03393 N ? C ? 80 1 ATOM 3030 CD2 . HIS B 80 ? 25.33051 17.78134 -3.53183 1.000 33.10008 C ? C ? 80 1 ATOM 3031 CE1 . HIS B 80 ? 26.52221 19.62121 -3.60281 1.000 36.37902 C ? C ? 80 1 ATOM 3032 NE2 . HIS B 80 ? 26.41561 18.44427 -3.01239 1.000 36.90259 N ? C ? 80 1 ATOM 3033 N . SER B 81 ? 21.22926 17.09137 -3.47570 1.000 27.54655 N ? C ? 81 1 ATOM 3034 CA . SER B 81 ? 20.93326 16.29928 -2.29456 1.000 24.60623 C ? C ? 81 1 ATOM 3035 C . SER B 81 ? 20.72949 14.85304 -2.71362 1.000 30.81260 C ? C ? 81 1 ATOM 3036 O . SER B 81 ? 20.38944 14.55672 -3.86161 1.000 27.82654 O ? C ? 81 1 ATOM 3037 CB . SER B 81 ? 19.69630 16.82434 -1.55992 1.000 20.38995 C ? C ? 81 1 ATOM 3038 OG . SER B 81 ? 18.51473 16.47687 -2.25816 1.000 35.91684 O ? C ? 81 1 ATOM 3039 N . MET B 82 ? 20.93732 13.95491 -1.76317 1.000 23.47548 N ? C ? 82 1 ATOM 3040 CA . MET B 82 ? 20.79862 12.52785 -1.99089 1.000 20.47602 C ? C ? 82 1 ATOM 3041 C . MET B 82 ? 19.61451 12.01803 -1.18668 1.000 24.81903 C ? C ? 82 1 ATOM 3042 O . MET B 82 ? 19.59497 12.13398 0.04490 1.000 26.00941 O ? C ? 82 1 ATOM 3043 CB . MET B 82 ? 22.07734 11.79448 -1.60230 1.000 24.43256 C ? C ? 82 1 ATOM 3044 CG . MET B 82 ? 22.00213 10.30101 -1.78572 1.000 22.35883 C ? C ? 82 1 ATOM 3045 SD . MET B 82 ? 23.64259 9.57308 -1.75650 1.000 29.45900 S ? C ? 82 1 ATOM 3046 CE . MET B 82 ? 23.95519 9.53434 0.00397 1.000 30.55115 C ? C ? 82 1 ATOM 3047 N . GLN B 83 ? 18.62946 11.46614 -1.88425 1.000 23.44947 N ? C ? 83 1 ATOM 3048 CA . GLN B 83 ? 17.49610 10.80313 -1.25468 1.000 26.29246 C ? C ? 83 1 ATOM 3049 C . GLN B 83 ? 17.54258 9.33847 -1.66745 1.000 23.66142 C ? C ? 83 1 ATOM 3050 O . GLN B 83 ? 17.29846 9.01083 -2.83285 1.000 22.57333 O ? C ? 83 1 ATOM 3051 CB . GLN B 83 ? 16.17495 11.45371 -1.65454 1.000 23.16964 C ? C ? 83 1 ATOM 3052 CG . GLN B 83 ? 14.98937 10.91258 -0.87978 1.000 31.67960 C ? C ? 83 1 ATOM 3053 CD . GLN B 83 ? 13.68073 11.56377 -1.27520 1.000 43.03922 C ? C ? 83 1 ATOM 3054 OE1 . GLN B 83 ? 13.62013 12.34235 -2.22738 1.000 45.31629 O ? C ? 83 1 ATOM 3055 NE2 . GLN B 83 ? 12.62028 11.24572 -0.54185 1.000 45.83097 N ? C ? 83 1 ATOM 3056 N . ASN B 84 ? 17.86514 8.46428 -0.71335 1.000 24.97099 N ? C ? 84 1 ATOM 3057 CA . ASN B 84 ? 18.04178 7.04160 -0.97948 1.000 23.80890 C ? C ? 84 1 ATOM 3058 C . ASN B 84 ? 19.02982 6.83464 -2.12416 1.000 26.99117 C ? C ? 84 1 ATOM 3059 O . ASN B 84 ? 20.17891 7.28285 -2.04055 1.000 27.38741 O ? C ? 84 1 ATOM 3060 CB . ASN B 84 ? 16.69112 6.38888 -1.26958 1.000 22.25521 C ? C ? 84 1 ATOM 3061 CG . ASN B 84 ? 15.70580 6.59293 -0.14472 1.000 26.97926 C ? C ? 84 1 ATOM 3062 OD1 . ASN B 84 ? 16.01334 6.32756 1.01985 1.000 29.00263 O ? C ? 84 1 ATOM 3063 ND2 . ASN B 84 ? 14.52036 7.08860 -0.47858 1.000 31.02416 N ? C ? 84 1 ATOM 3064 N . CYS B 85 ? 18.60217 6.17847 -3.20229 1.000 16.66169 N ? C ? 85 1 ATOM 3065 CA . CYS B 85 ? 19.49352 5.87283 -4.31293 1.000 25.46620 C ? C ? 85 1 ATOM 3066 C . CYS B 85 ? 19.31420 6.81631 -5.50025 1.000 24.98271 C ? C ? 85 1 ATOM 3067 O . CYS B 85 ? 19.76308 6.49623 -6.60704 1.000 24.10837 O ? C ? 85 1 ATOM 3068 CB . CYS B 85 ? 19.30444 4.42245 -4.75294 1.000 22.96545 C ? C ? 85 1 ATOM 3069 SG . CYS B 85 ? 19.75732 3.21779 -3.48213 1.000 27.69400 S ? C ? 85 1 ATOM 3070 N . VAL B 86 ? 18.68293 7.97301 -5.29574 1.000 20.83689 N ? C ? 86 1 ATOM 3071 CA . VAL B 86 ? 18.51648 8.97322 -6.34469 1.000 25.02868 C ? C ? 86 1 ATOM 3072 C . VAL B 86 ? 19.13630 10.28547 -5.88010 1.000 28.56288 C ? C ? 86 1 ATOM 3073 O . VAL B 86 ? 19.01843 10.66819 -4.71093 1.000 22.45945 O ? C ? 86 1 ATOM 3074 CB . VAL B 86 ? 17.03174 9.17155 -6.74205 1.000 26.64131 C ? C ? 86 1 ATOM 3075 CG1 . VAL B 86 ? 16.20460 9.67899 -5.58187 1.000 24.82314 C ? C ? 86 1 ATOM 3076 CG2 . VAL B 86 ? 16.90339 10.13353 -7.91175 1.000 33.85592 C ? C ? 86 1 ATOM 3077 N . LEU B 87 ? 19.82136 10.95387 -6.80075 1.000 26.54275 N ? C ? 87 1 ATOM 3078 CA . LEU B 87 ? 20.30184 12.30933 -6.59718 1.000 24.51947 C ? C ? 87 1 ATOM 3079 C . LEU B 87 ? 19.23559 13.29573 -7.03701 1.000 28.59981 C ? C ? 87 1 ATOM 3080 O . LEU B 87 ? 18.59445 13.10786 -8.07342 1.000 26.62189 O ? C ? 87 1 ATOM 3081 CB . LEU B 87 ? 21.57432 12.55383 -7.40152 1.000 25.34974 C ? C ? 87 1 ATOM 3082 CG . LEU B 87 ? 22.77304 13.04223 -6.61186 1.000 37.77126 C ? C ? 87 1 ATOM 3083 CD1 . LEU B 87 ? 23.27087 11.91168 -5.72546 1.000 37.81359 C ? C ? 87 1 ATOM 3084 CD2 . LEU B 87 ? 23.84427 13.51177 -7.57373 1.000 33.70639 C ? C ? 87 1 ATOM 3085 N . LYS B 88 ? 19.05386 14.35178 -6.25178 1.000 31.96643 N ? C ? 88 1 ATOM 3086 CA . LYS B 88 ? 18.14710 15.43791 -6.60539 1.000 25.70385 C ? C ? 88 1 ATOM 3087 C . LYS B 88 ? 18.97690 16.70041 -6.80270 1.000 28.04560 C ? C ? 88 1 ATOM 3088 O . LYS B 88 ? 19.49454 17.26941 -5.83491 1.000 30.55298 O ? C ? 88 1 ATOM 3089 CB . LYS B 88 ? 17.07036 15.62852 -5.53798 1.000 30.90701 C ? C ? 88 1 ATOM 3090 CG . LYS B 88 ? 16.22820 14.37993 -5.29487 1.000 29.90069 C ? C ? 88 1 ATOM 3091 CD . LYS B 88 ? 14.81264 14.72956 -4.87472 1.000 30.92292 C ? C ? 88 1 ATOM 3092 CE . LYS B 88 ? 14.78263 15.48751 -3.56416 1.000 34.91006 C ? C ? 88 1 ATOM 3093 NZ . LYS B 88 ? 15.36108 14.68645 -2.45301 1.000 32.54567 N ? C ? 88 1 ATOM 3094 N . LEU B 89 ? 19.11820 17.12132 -8.05698 1.000 27.23536 N ? C ? 89 1 ATOM 3095 CA . LEU B 89 ? 19.86385 18.32182 -8.41252 1.000 30.21543 C ? C ? 89 1 ATOM 3096 C . LEU B 89 ? 18.88750 19.47340 -8.60225 1.000 29.97805 C ? C ? 89 1 ATOM 3097 O . LEU B 89 ? 18.04233 19.42862 -9.50163 1.000 24.93373 O ? C ? 89 1 ATOM 3098 CB . LEU B 89 ? 20.67289 18.10682 -9.69139 1.000 25.17226 C ? C ? 89 1 ATOM 3099 CG . LEU B 89 ? 21.63443 16.92098 -9.69174 1.000 30.95892 C ? C ? 89 1 ATOM 3100 CD1 . LEU B 89 ? 22.30930 16.79820 -11.04670 1.000 35.02973 C ? C ? 89 1 ATOM 3101 CD2 . LEU B 89 ? 22.65844 17.08808 -8.58857 1.000 26.75327 C ? C ? 89 1 ATOM 3102 N . LYS B 90 ? 19.00660 20.50126 -7.76640 1.000 30.21850 N ? C ? 90 1 ATOM 3103 CA . LYS B 90 ? 18.21068 21.70421 -7.95089 1.000 28.36144 C ? C ? 90 1 ATOM 3104 C . LYS B 90 ? 18.83033 22.55600 -9.05056 1.000 31.13758 C ? C ? 90 1 ATOM 3105 O . LYS B 90 ? 20.04141 22.80374 -9.05059 1.000 29.28652 O ? C ? 90 1 ATOM 3106 CB . LYS B 90 ? 18.11532 22.50424 -6.65434 1.000 23.44159 C ? C ? 90 1 ATOM 3107 CG . LYS B 90 ? 16.81074 23.26926 -6.53171 1.000 29.88302 C ? C ? 90 1 ATOM 3108 CD . LYS B 90 ? 17.02040 24.66453 -5.98439 1.000 46.26715 C ? C ? 90 1 ATOM 3109 CE . LYS B 90 ? 15.71511 25.44909 -5.98583 1.000 49.37058 C ? C ? 90 1 ATOM 3110 NZ . LYS B 90 ? 15.92235 26.90677 -5.73284 1.000 57.60247 N ? C ? 90 1 ATOM 3111 N . VAL B 91 ? 18.00068 22.98832 -9.99731 1.000 27.70214 N ? C ? 91 1 ATOM 3112 CA . VAL B 91 ? 18.44473 23.82667 -11.10108 1.000 33.39019 C ? C ? 91 1 ATOM 3113 C . VAL B 91 ? 17.69288 25.15010 -11.04145 1.000 33.62120 C ? C ? 91 1 ATOM 3114 O . VAL B 91 ? 16.60081 25.25063 -10.47664 1.000 32.68683 O ? C ? 91 1 ATOM 3115 CB . VAL B 91 ? 18.24577 23.14430 -12.46935 1.000 31.13674 C ? C ? 91 1 ATOM 3116 CG1 . VAL B 91 ? 19.11193 21.89505 -12.56816 1.000 29.56592 C ? C ? 91 1 ATOM 3117 CG2 . VAL B 91 ? 16.78086 22.79836 -12.67511 1.000 30.07676 C ? C ? 91 1 ATOM 3118 N . ASP B 92 ? 18.29513 26.17483 -11.64247 1.000 32.74300 N ? C ? 92 1 ATOM 3119 CA . ASP B 92 ? 17.75494 27.52718 -11.58535 1.000 41.06888 C ? C ? 92 1 ATOM 3120 C . ASP B 92 ? 16.63009 27.76508 -12.58274 1.000 37.20788 C ? C ? 92 1 ATOM 3121 O . ASP B 92 ? 16.10769 28.88193 -12.64391 1.000 49.50972 O ? C ? 92 1 ATOM 3122 CB . ASP B 92 ? 18.87818 28.54473 -11.81523 1.000 39.21859 C ? C ? 92 1 ATOM 3123 CG . ASP B 92 ? 19.44770 28.48568 -13.22649 1.000 40.30215 C ? C ? 92 1 ATOM 3124 OD1 . ASP B 92 ? 19.23845 27.47098 -13.92947 1.000 55.00638 O ? C ? 92 1 ATOM 3125 OD2 . ASP B 92 ? 20.10677 29.46236 -13.63508 1.000 49.16802 O ? C ? 92 1 ATOM 3126 N . THR B 93 ? 16.24956 26.75860 -13.36462 1.000 38.12543 N ? C ? 93 1 ATOM 3127 CA . THR B 93 ? 15.19751 26.89864 -14.36285 1.000 32.63650 C ? C ? 93 1 ATOM 3128 C . THR B 93 ? 14.17246 25.79873 -14.14584 1.000 34.65503 C ? C ? 93 1 ATOM 3129 O . THR B 93 ? 14.52634 24.61637 -14.11861 1.000 26.56280 O ? C ? 93 1 ATOM 3130 CB . THR B 93 ? 15.76847 26.83124 -15.78312 1.000 37.97413 C ? C ? 93 1 ATOM 3131 OG1 . THR B 93 ? 16.64158 27.94772 -16.00276 1.000 44.54433 O ? C ? 93 1 ATOM 3132 CG2 . THR B 93 ? 14.64593 26.85667 -16.81523 1.000 35.29534 C ? C ? 93 1 ATOM 3133 N . ALA B 94 ? 12.91369 26.18824 -13.97088 1.000 34.93390 N ? C ? 94 1 ATOM 3134 CA . ALA B 94 ? 11.83536 25.21560 -13.91973 1.000 32.78067 C ? C ? 94 1 ATOM 3135 C . ALA B 94 ? 11.51379 24.73671 -15.32678 1.000 30.94748 C ? C ? 94 1 ATOM 3136 O . ALA B 94 ? 11.44357 25.53162 -16.26785 1.000 29.28217 O ? C ? 94 1 ATOM 3137 CB . ALA B 94 ? 10.59331 25.82308 -13.26890 1.000 32.20841 C ? C ? 94 1 ATOM 3138 N . ASN B 95 ? 11.33348 23.42874 -15.46961 1.000 26.36549 N ? C ? 95 1 ATOM 3139 CA . ASN B 95 ? 11.00599 22.84553 -16.76390 1.000 28.39722 C ? C ? 95 1 ATOM 3140 C . ASN B 95 ? 9.63992 23.34367 -17.21802 1.000 33.20134 C ? C ? 95 1 ATOM 3141 O . ASN B 95 ? 8.61860 23.01964 -16.59648 1.000 28.98666 O ? C ? 95 1 ATOM 3142 CB . ASN B 95 ? 11.02737 21.31887 -16.69061 1.000 28.96759 C ? C ? 95 1 ATOM 3143 CG . ASN B 95 ? 10.84127 20.66140 -18.04729 1.000 36.07135 C ? C ? 95 1 ATOM 3144 OD1 . ASN B 95 ? 10.79116 21.33095 -19.07987 1.000 33.46092 O ? C ? 95 1 ATOM 3145 ND2 . ASN B 95 ? 10.74621 19.33637 -18.04863 1.000 29.01186 N ? C ? 95 1 ATOM 3146 N . PRO B 96 ? 9.58194 24.13677 -18.29172 1.000 28.62187 N ? C ? 96 1 ATOM 3147 CA . PRO B 96 ? 8.28287 24.62874 -18.76912 1.000 31.12522 C ? C ? 96 1 ATOM 3148 C . PRO B 96 ? 7.40024 23.53520 -19.33644 1.000 39.43105 C ? C ? 96 1 ATOM 3149 O . PRO B 96 ? 6.19016 23.75258 -19.48037 1.000 38.23293 O ? C ? 96 1 ATOM 3150 CB . PRO B 96 ? 8.67164 25.64616 -19.84778 1.000 31.99662 C ? C ? 96 1 ATOM 3151 CG . PRO B 96 ? 9.98962 25.14909 -20.35299 1.000 32.91789 C ? C ? 96 1 ATOM 3152 CD . PRO B 96 ? 10.69241 24.56359 -19.16050 1.000 29.23995 C ? C ? 96 1 ATOM 3153 N . LYS B 97 ? 7.96286 22.37247 -19.66734 1.000 33.87162 N ? C ? 97 1 ATOM 3154 CA . LYS B 97 ? 7.19576 21.25268 -20.19015 1.000 37.91010 C ? C ? 97 1 ATOM 3155 C . LYS B 97 ? 6.78352 20.26940 -19.10218 1.000 37.59151 C ? C ? 97 1 ATOM 3156 O . LYS B 97 ? 6.44258 19.12158 -19.41305 1.000 34.71191 O ? C ? 97 1 ATOM 3157 CB . LYS B 97 ? 7.99480 20.53134 -21.27675 1.000 30.73158 C ? C ? 97 1 ATOM 3158 CG . LYS B 97 ? 8.30813 21.38882 -22.48887 1.000 33.22562 C ? C ? 97 1 ATOM 3159 CD . LYS B 97 ? 9.46675 20.79972 -23.26956 1.000 44.12644 C ? C ? 97 1 ATOM 3160 CE . LYS B 97 ? 9.63395 21.48213 -24.61487 1.000 51.06940 C ? C ? 97 1 ATOM 3161 NZ . LYS B 97 ? 9.44042 20.51783 -25.73117 1.000 50.18600 N ? C ? 97 1 ATOM 3162 N . THR B 98 ? 6.81560 20.68653 -17.84196 1.000 36.23800 N ? C ? 98 1 ATOM 3163 CA . THR B 98 ? 6.42642 19.80536 -16.75053 1.000 36.04776 C ? C ? 98 1 ATOM 3164 C . THR B 98 ? 4.94473 19.46507 -16.86529 1.000 31.17974 C ? C ? 98 1 ATOM 3165 O . THR B 98 ? 4.10443 20.37842 -16.88812 1.000 29.99095 O ? C ? 98 1 ATOM 3166 CB . THR B 98 ? 6.71739 20.45481 -15.39946 1.000 31.53818 C ? C ? 98 1 ATOM 3167 OG1 . THR B 98 ? 8.08377 20.88159 -15.36158 1.000 28.38163 O ? C ? 98 1 ATOM 3168 CG2 . THR B 98 ? 6.47223 19.46618 -14.26348 1.000 24.84700 C ? C ? 98 1 ATOM 3169 N . PRO B 99 ? 4.58491 18.19336 -16.96671 1.000 29.33330 N ? C ? 99 1 ATOM 3170 CA . PRO B 99 ? 3.17566 17.80509 -16.97856 1.000 28.39015 C ? C ? 99 1 ATOM 3171 C . PRO B 99 ? 2.65878 17.64714 -15.55388 1.000 26.82994 C ? C ? 99 1 ATOM 3172 O . PRO B 99 ? 3.42264 17.63577 -14.58671 1.000 33.60106 O ? C ? 99 1 ATOM 3173 CB . PRO B 99 ? 3.20614 16.45286 -17.70169 1.000 26.12139 C ? C ? 99 1 ATOM 3174 CG . PRO B 99 ? 4.52497 15.86560 -17.28769 1.000 27.14344 C ? C ? 99 1 ATOM 3175 CD . PRO B 99 ? 5.48075 17.03132 -17.10934 1.000 32.81164 C ? C ? 99 1 ATOM 3176 N . LYS B 100 ? 1.33709 17.53462 -15.44117 1.000 26.53695 N ? C ? 100 1 ATOM 3177 CA . LYS B 100 ? 0.74924 17.09288 -14.18343 1.000 28.65300 C ? C ? 100 1 ATOM 3178 C . LYS B 100 ? 1.28184 15.70162 -13.86070 1.000 32.53600 C ? C ? 100 1 ATOM 3179 O . LYS B 100 ? 1.15722 14.78129 -14.67459 1.000 31.15498 O ? C ? 100 1 ATOM 3180 CB . LYS B 100 ? -0.77837 17.08177 -14.27976 1.000 38.32398 C ? C ? 100 1 ATOM 3181 CG . LYS B 100 ? -1.48687 16.91303 -12.93661 1.000 51.76058 C ? C ? 100 1 ATOM 3182 CD . LYS B 100 ? -2.94780 16.48906 -13.09611 1.000 62.84300 C ? C ? 100 1 ATOM 3183 CE . LYS B 100 ? -3.81827 17.60302 -13.67174 1.000 67.39590 C ? C ? 100 1 ATOM 3184 NZ . LYS B 100 ? -5.25587 17.19927 -13.76891 1.000 49.40110 N ? C ? 100 1 ATOM 3185 N . TYR B 101 ? 1.91096 15.54828 -12.69565 1.000 30.40200 N ? C ? 101 1 ATOM 3186 CA . TYR B 101 ? 2.58788 14.29836 -12.38063 1.000 32.47893 C ? C ? 101 1 ATOM 3187 C . TYR B 101 ? 2.43187 13.95382 -10.90637 1.000 28.45272 C ? C ? 101 1 ATOM 3188 O . TYR B 101 ? 1.94409 14.74793 -10.09901 1.000 32.36112 O ? C ? 101 1 ATOM 3189 CB . TYR B 101 ? 4.07642 14.35311 -12.74552 1.000 29.71060 C ? C ? 101 1 ATOM 3190 CG . TYR B 101 ? 4.91414 15.19995 -11.81212 1.000 35.10242 C ? C ? 101 1 ATOM 3191 CD1 . TYR B 101 ? 5.06864 16.56450 -12.03114 1.000 29.18393 C ? C ? 101 1 ATOM 3192 CD2 . TYR B 101 ? 5.56120 14.63271 -10.71778 1.000 26.49607 C ? C ? 101 1 ATOM 3193 CE1 . TYR B 101 ? 5.83458 17.34132 -11.18209 1.000 29.42493 C ? C ? 101 1 ATOM 3194 CE2 . TYR B 101 ? 6.32242 15.40203 -9.86560 1.000 27.12070 C ? C ? 101 1 ATOM 3195 CZ . TYR B 101 ? 6.45772 16.75473 -10.10227 1.000 29.18396 C ? C ? 101 1 ATOM 3196 OH . TYR B 101 ? 7.22113 17.52365 -9.25268 1.000 39.56836 O ? C ? 101 1 ATOM 3197 N . LYS B 102 ? 2.86565 12.73920 -10.57409 1.000 33.97029 N ? C ? 102 1 ATOM 3198 CA . LYS B 102 ? 2.89790 12.22428 -9.21208 1.000 28.24046 C ? C ? 102 1 ATOM 3199 C . LYS B 102 ? 3.88448 11.06429 -9.17977 1.000 24.53957 C ? C ? 102 1 ATOM 3200 O . LYS B 102 ? 4.23427 10.49892 -10.21914 1.000 27.49375 O ? C ? 102 1 ATOM 3201 CB . LYS B 102 ? 1.50834 11.77536 -8.74086 1.000 33.79884 C ? C ? 102 1 ATOM 3202 CG . LYS B 102 ? 0.82946 10.79667 -9.69021 1.000 40.38735 C ? C ? 102 1 ATOM 3203 CD . LYS B 102 ? -0.19041 9.90597 -8.97935 1.000 52.46356 C ? C ? 102 1 ATOM 3204 CE . LYS B 102 ? -1.56405 10.55147 -8.88315 1.000 51.21955 C ? C ? 102 1 ATOM 3205 NZ . LYS B 102 ? -2.59431 9.58384 -8.39337 1.000 58.60258 N ? C ? 102 1 ATOM 3206 N . PHE B 103 ? 4.34025 10.72377 -7.97662 1.000 22.42582 N ? C ? 103 1 ATOM 3207 CA . PHE B 103 ? 5.26562 9.61526 -7.76269 1.000 25.05798 C ? C ? 103 1 ATOM 3208 C . PHE B 103 ? 4.52104 8.49705 -7.04893 1.000 28.65517 C ? C ? 103 1 ATOM 3209 O . PHE B 103 ? 3.95634 8.71685 -5.97122 1.000 23.35046 O ? C ? 103 1 ATOM 3210 CB . PHE B 103 ? 6.48029 10.04471 -6.93602 1.000 21.56360 C ? C ? 103 1 ATOM 3211 CG . PHE B 103 ? 7.40505 10.99085 -7.64608 1.000 22.12446 C ? C ? 103 1 ATOM 3212 CD1 . PHE B 103 ? 7.39739 11.09141 -9.02658 1.000 21.99656 C ? C ? 103 1 ATOM 3213 CD2 . PHE B 103 ? 8.28993 11.77704 -6.92670 1.000 23.34276 C ? C ? 103 1 ATOM 3214 CE1 . PHE B 103 ? 8.25185 11.96193 -9.67648 1.000 22.11207 C ? C ? 103 1 ATOM 3215 CE2 . PHE B 103 ? 9.14474 12.64570 -7.56857 1.000 23.30551 C ? C ? 103 1 ATOM 3216 CZ . PHE B 103 ? 9.12586 12.73943 -8.94565 1.000 21.15647 C ? C ? 103 1 ATOM 3217 N . VAL B 104 ? 4.51943 7.30425 -7.64384 1.000 23.19712 N ? C ? 104 1 ATOM 3218 CA . VAL B 104 ? 3.86658 6.14886 -7.04352 1.000 25.99371 C ? C ? 104 1 ATOM 3219 C . VAL B 104 ? 4.85923 5.00003 -6.96811 1.000 25.80442 C ? C ? 104 1 ATOM 3220 O . VAL B 104 ? 5.81266 4.91752 -7.74884 1.000 25.59040 O ? C ? 104 1 ATOM 3221 CB . VAL B 104 ? 2.59773 5.71543 -7.81592 1.000 27.03147 C ? C ? 104 1 ATOM 3222 CG1 . VAL B 104 ? 1.69477 6.91266 -8.07323 1.000 22.45689 C ? C ? 104 1 ATOM 3223 CG2 . VAL B 104 ? 2.96637 5.01967 -9.11216 1.000 25.53930 C ? C ? 104 1 ATOM 3224 N . ARG B 105 ? 4.63834 4.11853 -6.00365 1.000 23.84125 N ? C ? 105 1 ATOM 3225 CA . ARG B 105 ? 5.39253 2.87869 -5.88517 1.000 27.47251 C ? C ? 105 1 ATOM 3226 C . ARG B 105 ? 4.44280 1.74539 -6.24368 1.000 21.70032 C ? C ? 105 1 ATOM 3227 O . ARG B 105 ? 3.51882 1.44358 -5.48330 1.000 30.10942 O ? C ? 105 1 ATOM 3228 CB . ARG B 105 ? 5.96746 2.70795 -4.48118 1.000 21.21128 C ? C ? 105 1 ATOM 3229 CG . ARG B 105 ? 6.84839 1.48462 -4.34022 1.000 21.73124 C ? C ? 105 1 ATOM 3230 CD . ARG B 105 ? 7.50295 1.43200 -2.98206 1.000 33.32508 C ? C ? 105 1 ATOM 3231 NE . ARG B 105 ? 8.31769 0.23324 -2.82938 1.000 32.56465 N ? C ? 105 1 ATOM 3232 CZ . ARG B 105 ? 9.59981 0.15148 -3.15772 1.000 30.07645 C ? C ? 105 1 ATOM 3233 NH1 . ARG B 105 ? 10.25407 1.18987 -3.65424 1.000 24.69324 N ? C ? 105 1 ATOM 3234 NH2 . ARG B 105 ? 10.24246 -1.00056 -2.98053 1.000 32.83673 N ? C ? 105 1 ATOM 3235 N . ILE B 106 ? 4.65727 1.13184 -7.40516 1.000 22.24305 N ? C ? 106 1 ATOM 3236 CA . ILE B 106 ? 3.73796 0.10441 -7.87279 1.000 22.62516 C ? C ? 106 1 ATOM 3237 C . ILE B 106 ? 3.98987 -1.19932 -7.12363 1.000 25.11521 C ? C ? 106 1 ATOM 3238 O . ILE B 106 ? 5.02474 -1.39754 -6.48188 1.000 28.83819 O ? C ? 106 1 ATOM 3239 CB . ILE B 106 ? 3.84408 -0.10282 -9.39440 1.000 27.40520 C ? C ? 106 1 ATOM 3240 CG1 . ILE B 106 ? 5.25173 -0.56089 -9.77776 1.000 24.18956 C ? C ? 106 1 ATOM 3241 CG2 . ILE B 106 ? 3.44646 1.16177 -10.14192 1.000 20.40822 C ? C ? 106 1 ATOM 3242 CD1 . ILE B 106 ? 5.35925 -1.00803 -11.21040 1.000 29.67513 C ? C ? 106 1 ATOM 3243 N . GLN B 107 ? 3.01907 -2.09179 -7.20926 1.000 27.46537 N ? C ? 107 1 ATOM 3244 CA . GLN B 107 ? 2.94842 -3.45394 -6.71125 1.000 34.06099 C ? C ? 107 1 ATOM 3245 C . GLN B 107 ? 3.39959 -4.43392 -7.78993 1.000 34.62629 C ? C ? 107 1 ATOM 3246 O . GLN B 107 ? 3.30925 -4.13636 -8.98676 1.000 31.53141 O ? C ? 107 1 ATOM 3247 CB . GLN B 107 ? 1.52046 -3.79124 -6.28908 1.000 33.06300 C ? C ? 107 1 ATOM 3248 CG . GLN B 107 ? 0.90374 -2.81283 -5.30110 1.000 43.06695 C ? C ? 107 1 ATOM 3249 CD . GLN B 107 ? 0.95607 -3.31407 -3.87030 1.000 52.53717 C ? C ? 107 1 ATOM 3250 OE1 . GLN B 107 ? 1.79886 -4.13992 -3.51683 1.000 52.31362 O ? C ? 107 1 ATOM 3251 NE2 . GLN B 107 ? 0.04604 -2.81945 -3.03918 1.000 62.92352 N ? C ? 107 1 ATOM 3252 N . PRO B 108 ? 3.89917 -5.60274 -7.39430 1.000 28.08020 N ? C ? 108 1 ATOM 3253 CA . PRO B 108 ? 4.19025 -6.64522 -8.38461 1.000 29.33098 C ? C ? 108 1 ATOM 3254 C . PRO B 108 ? 2.93705 -7.02665 -9.16022 1.000 26.36409 C ? C ? 108 1 ATOM 3255 O . PRO B 108 ? 1.83495 -7.09090 -8.61130 1.000 30.14510 O ? C ? 108 1 ATOM 3256 CB . PRO B 108 ? 4.71556 -7.81122 -7.53593 1.000 32.25055 C ? C ? 108 1 ATOM 3257 CG . PRO B 108 ? 4.35544 -7.47131 -6.11730 1.000 34.71175 C ? C ? 108 1 ATOM 3258 CD . PRO B 108 ? 4.33281 -5.98447 -6.04202 1.000 30.49451 C ? C ? 108 1 ATOM 3259 N . GLY B 109 ? 3.11554 -7.26507 -10.45690 1.000 24.26224 N ? C ? 109 1 ATOM 3260 CA . GLY B 109 ? 2.01570 -7.52257 -11.35417 1.000 31.82326 C ? C ? 109 1 ATOM 3261 C . GLY B 109 ? 1.50311 -6.30431 -12.09366 1.000 34.28310 C ? C ? 109 1 ATOM 3262 O . GLY B 109 ? 0.79297 -6.45870 -13.09305 1.000 32.73996 O ? C ? 109 1 ATOM 3263 N . GLN B 110 ? 1.83804 -5.10077 -11.63385 1.000 29.24450 N ? C ? 110 1 ATOM 3264 CA . GLN B 110 ? 1.40962 -3.88704 -12.31199 1.000 30.22184 C ? C ? 110 1 ATOM 3265 C . GLN B 110 ? 2.35604 -3.55629 -13.45962 1.000 25.70787 C ? C ? 110 1 ATOM 3266 O . GLN B 110 ? 3.56569 -3.78873 -13.38624 1.000 24.98519 O ? C ? 110 1 ATOM 3267 CB . GLN B 110 ? 1.34157 -2.71068 -11.33436 1.000 31.69913 C ? C ? 110 1 ATOM 3268 CG . GLN B 110 ? 0.41143 -2.93784 -10.14408 1.000 36.71736 C ? C ? 110 1 ATOM 3269 CD . GLN B 110 ? -0.04689 -1.64107 -9.49175 1.000 43.06430 C ? C ? 110 1 ATOM 3270 OE1 . GLN B 110 ? 0.49242 -1.21685 -8.46629 1.000 37.08248 O ? C ? 110 1 ATOM 3271 NE2 . GLN B 110 ? -1.05475 -1.01099 -10.08132 1.000 52.53602 N ? C ? 110 1 ATOM 3272 N . THR B 111 ? 1.79209 -2.99929 -14.52438 1.000 26.18423 N ? C ? 111 1 ATOM 3273 CA . THR B 111 ? 2.53166 -2.71224 -15.74160 1.000 22.33563 C ? C ? 111 1 ATOM 3274 C . THR B 111 ? 2.76531 -1.21340 -15.89573 1.000 25.39103 C ? C ? 111 1 ATOM 3275 O . THR B 111 ? 2.12112 -0.38622 -15.24419 1.000 27.39295 O ? C ? 111 1 ATOM 3276 CB . THR B 111 ? 1.79222 -3.25941 -16.96678 1.000 23.48611 C ? C ? 111 1 ATOM 3277 OG1 . THR B 111 ? 0.47783 -2.69269 -17.02957 1.000 24.67898 O ? C ? 111 1 ATOM 3278 CG2 . THR B 111 ? 1.68160 -4.77715 -16.88058 1.000 24.94530 C ? C ? 111 1 ATOM 3279 N . PHE B 112 ? 3.70620 -0.87354 -16.77403 1.000 20.86834 N ? C ? 112 1 ATOM 3280 CA . PHE B 112 ? 4.06485 0.51662 -17.01132 1.000 21.91933 C ? C ? 112 1 ATOM 3281 C . PHE B 112 ? 4.91025 0.59596 -18.27207 1.000 24.12817 C ? C ? 112 1 ATOM 3282 O . PHE B 112 ? 5.54632 -0.37911 -18.68242 1.000 23.87266 O ? C ? 112 1 ATOM 3283 CB . PHE B 112 ? 4.80957 1.12794 -15.81382 1.000 16.13981 C ? C ? 112 1 ATOM 3284 CG . PHE B 112 ? 6.07642 0.40092 -15.43601 1.000 25.19122 C ? C ? 112 1 ATOM 3285 CD1 . PHE B 112 ? 6.03362 -0.74375 -14.65108 1.000 23.92682 C ? C ? 112 1 ATOM 3286 CD2 . PHE B 112 ? 7.31375 0.87569 -15.84508 1.000 23.62740 C ? C ? 112 1 ATOM 3287 CE1 . PHE B 112 ? 7.20267 -1.40885 -14.29351 1.000 23.54507 C ? C ? 112 1 ATOM 3288 CE2 . PHE B 112 ? 8.48672 0.21519 -15.48805 1.000 25.60712 C ? C ? 112 1 ATOM 3289 CZ . PHE B 112 ? 8.42974 -0.92658 -14.71155 1.000 21.47853 C ? C ? 112 1 ATOM 3290 N . SER B 113 ? 4.89249 1.77071 -18.88866 1.000 17.53549 N ? C ? 113 1 ATOM 3291 CA . SER B 113 ? 5.69459 2.03359 -20.07051 1.000 20.52376 C ? C ? 113 1 ATOM 3292 C . SER B 113 ? 7.05935 2.56848 -19.65921 1.000 22.73207 C ? C ? 113 1 ATOM 3293 O . SER B 113 ? 7.16683 3.38573 -18.74231 1.000 26.56723 O ? C ? 113 1 ATOM 3294 CB . SER B 113 ? 4.98837 3.03705 -20.98331 1.000 21.86603 C ? C ? 113 1 ATOM 3295 OG . SER B 113 ? 3.77087 2.50539 -21.47229 1.000 24.97924 O ? C ? 113 1 ATOM 3296 N . VAL B 114 ? 8.10207 2.09612 -20.33484 1.000 23.08823 N ? C ? 114 1 ATOM 3297 CA . VAL B 114 ? 9.46351 2.57452 -20.12758 1.000 22.06499 C ? C ? 114 1 ATOM 3298 C . VAL B 114 ? 9.87086 3.37400 -21.35590 1.000 23.59672 C ? C ? 114 1 ATOM 3299 O . VAL B 114 ? 9.68274 2.92032 -22.49082 1.000 19.23060 O ? C ? 114 1 ATOM 3300 CB . VAL B 114 ? 10.44587 1.41608 -19.87169 1.000 25.99487 C ? C ? 114 1 ATOM 3301 CG1 . VAL B 114 ? 11.88506 1.93173 -19.83600 1.000 20.83080 C ? C ? 114 1 ATOM 3302 CG2 . VAL B 114 ? 10.10804 0.70079 -18.57600 1.000 16.24928 C ? C ? 114 1 ATOM 3303 N . LEU B 115 ? 10.40345 4.56937 -21.13262 1.000 19.72659 N ? C ? 115 1 ATOM 3304 CA . LEU B 115 ? 10.97980 5.37995 -22.19952 1.000 18.95424 C ? C ? 115 1 ATOM 3305 C . LEU B 115 ? 12.49446 5.24112 -22.09403 1.000 23.97451 C ? C ? 115 1 ATOM 3306 O . LEU B 115 ? 13.13710 5.90789 -21.27792 1.000 23.52897 O ? C ? 115 1 ATOM 3307 CB . LEU B 115 ? 10.53097 6.83277 -22.09143 1.000 23.51345 C ? C ? 115 1 ATOM 3308 CG . LEU B 115 ? 11.09015 7.76872 -23.16882 1.000 24.58977 C ? C ? 115 1 ATOM 3309 CD1 . LEU B 115 ? 10.69255 7.29760 -24.56106 1.000 25.54148 C ? C ? 115 1 ATOM 3310 CD2 . LEU B 115 ? 10.64855 9.20783 -22.93438 1.000 22.60466 C ? C ? 115 1 ATOM 3311 N . ALA B 116 ? 13.05986 4.35490 -22.90792 1.000 20.28434 N ? C ? 116 1 ATOM 3312 CA . ALA B 116 ? 14.49974 4.13568 -22.89542 1.000 29.82401 C ? C ? 116 1 ATOM 3313 C . ALA B 116 ? 15.21652 5.35966 -23.44812 1.000 27.00560 C ? C ? 116 1 ATOM 3314 O . ALA B 116 ? 14.82566 5.90183 -24.48662 1.000 30.81621 O ? C ? 116 1 ATOM 3315 CB . ALA B 116 ? 14.85596 2.89547 -23.71378 1.000 27.80936 C ? C ? 116 1 ATOM 3316 N . CYS B 117 ? 16.26617 5.79570 -22.75224 1.000 25.85754 N ? C ? 117 1 ATOM 3317 CA . CYS B 117 ? 16.96793 7.01897 -23.10717 1.000 24.82103 C ? C ? 117 1 ATOM 3318 C . CYS B 117 ? 18.46905 6.81213 -22.99896 1.000 28.42745 C ? C ? 117 1 ATOM 3319 O . CYS B 117 ? 18.94663 5.97659 -22.22739 1.000 26.10053 O ? C ? 117 1 ATOM 3320 CB . CYS B 117 ? 16.54682 8.19734 -22.21958 1.000 23.56218 C ? C ? 117 1 ATOM 3321 SG . CYS B 117 ? 14.81771 8.68047 -22.41672 1.000 30.62862 S ? C ? 117 1 ATOM 3322 N . TYR B 118 ? 19.20202 7.59264 -23.79209 1.000 30.99204 N ? C ? 118 1 ATOM 3323 CA . TYR B 118 ? 20.65762 7.58551 -23.82480 1.000 32.61726 C ? C ? 118 1 ATOM 3324 C . TYR B 118 ? 21.12869 9.00737 -24.08287 1.000 38.73578 C ? C ? 118 1 ATOM 3325 O . TYR B 118 ? 20.67720 9.64556 -25.03918 1.000 35.63692 O ? C ? 118 1 ATOM 3326 CB . TYR B 118 ? 21.19075 6.63537 -24.90813 1.000 27.54083 C ? C ? 118 1 ATOM 3327 CG . TYR B 118 ? 20.77551 5.19810 -24.69045 1.000 33.12772 C ? C ? 118 1 ATOM 3328 CD1 . TYR B 118 ? 21.55681 4.34050 -23.93057 1.000 22.40853 C ? C ? 118 1 ATOM 3329 CD2 . TYR B 118 ? 19.59028 4.70455 -25.22686 1.000 37.51785 C ? C ? 118 1 ATOM 3330 CE1 . TYR B 118 ? 21.17817 3.03012 -23.71818 1.000 27.98727 C ? C ? 118 1 ATOM 3331 CE2 . TYR B 118 ? 19.20234 3.39621 -25.01633 1.000 32.67710 C ? C ? 118 1 ATOM 3332 CZ . TYR B 118 ? 20.00216 2.56422 -24.26047 1.000 26.65900 C ? C ? 118 1 ATOM 3333 OH . TYR B 118 ? 19.62804 1.25938 -24.04549 1.000 34.44468 O ? C ? 118 1 ATOM 3334 N . ASN B 119 ? 22.02451 9.49967 -23.22478 1.000 31.99839 N ? C ? 119 1 ATOM 3335 CA . ASN B 119 ? 22.54935 10.86172 -23.32200 1.000 36.49048 C ? C ? 119 1 ATOM 3336 C . ASN B 119 ? 21.43319 11.89976 -23.28220 1.000 31.73618 C ? C ? 119 1 ATOM 3337 O . ASN B 119 ? 21.53109 12.95404 -23.91449 1.000 32.17632 O ? C ? 119 1 ATOM 3338 CB . ASN B 119 ? 23.40244 11.04256 -24.58190 1.000 33.41860 C ? C ? 119 1 ATOM 3339 CG . ASN B 119 ? 24.70097 10.26192 -24.52253 1.000 45.92791 C ? C ? 119 1 ATOM 3340 OD1 . ASN B 119 ? 25.45700 10.36717 -23.55552 1.000 49.19307 O ? C ? 119 1 ATOM 3341 ND2 . ASN B 119 ? 24.96248 9.46428 -25.55452 1.000 41.41009 N ? C ? 119 1 ATOM 3342 N . GLY B 120 ? 20.36261 11.60434 -22.54598 1.000 29.47388 N ? C ? 120 1 ATOM 3343 CA . GLY B 120 ? 19.24755 12.51684 -22.41013 1.000 31.90404 C ? C ? 120 1 ATOM 3344 C . GLY B 120 ? 18.23996 12.48502 -23.53768 1.000 35.39541 C ? C ? 120 1 ATOM 3345 O . GLY B 120 ? 17.20875 13.16295 -23.44035 1.000 33.09609 O ? C ? 120 1 ATOM 3346 N . SER B 121 ? 18.49793 11.72634 -24.60107 1.000 31.15357 N ? C ? 121 1 ATOM 3347 CA . SER B 121 ? 17.56155 11.65850 -25.71209 1.000 34.12978 C ? C ? 121 1 ATOM 3348 C . SER B 121 ? 16.79528 10.34009 -25.69617 1.000 37.45058 C ? C ? 121 1 ATOM 3349 O . SER B 121 ? 17.37751 9.28430 -25.41571 1.000 32.85575 O ? C ? 121 1 ATOM 3350 CB . SER B 121 ? 18.29119 11.79832 -27.04822 1.000 35.39380 C ? C ? 121 1 ATOM 3351 OG . SER B 121 ? 18.93545 13.05347 -27.14383 1.000 42.24199 O ? C ? 121 1 ATOM 3352 N . PRO B 122 ? 15.50086 10.37737 -26.00738 1.000 34.67711 N ? C ? 122 1 ATOM 3353 CA . PRO B 122 ? 14.70487 9.14313 -26.03662 1.000 33.47642 C ? C ? 122 1 ATOM 3354 C . PRO B 122 ? 15.00443 8.32315 -27.27726 1.000 36.84732 C ? C ? 122 1 ATOM 3355 O . PRO B 122 ? 15.10058 8.85859 -28.38315 1.000 48.98366 O ? C ? 122 1 ATOM 3356 CB . PRO B 122 ? 13.25454 9.64985 -26.05465 1.000 37.06746 C ? C ? 122 1 ATOM 3357 CG . PRO B 122 ? 13.33964 11.16767 -25.92543 1.000 47.66740 C ? C ? 122 1 ATOM 3358 CD . PRO B 122 ? 14.70504 11.56031 -26.36579 1.000 32.47327 C ? C ? 122 1 ATOM 3359 N . SER B 123 ? 15.13302 7.00689 -27.09490 1.000 30.64422 N ? C ? 123 1 ATOM 3360 CA . SER B 123 ? 15.38287 6.10138 -28.20931 1.000 34.18613 C ? C ? 123 1 ATOM 3361 C . SER B 123 ? 14.24734 5.12856 -28.49438 1.000 30.47141 C ? C ? 123 1 ATOM 3362 O . SER B 123 ? 14.23145 4.52965 -29.57669 1.000 41.01481 O ? C ? 123 1 ATOM 3363 CB . SER B 123 ? 16.66887 5.29115 -27.97500 1.000 31.30971 C ? C ? 123 1 ATOM 3364 OG . SER B 123 ? 16.60071 4.54688 -26.77403 1.000 44.50137 O ? C ? 123 1 ATOM 3365 N . GLY B 124 ? 13.30715 4.95415 -27.57702 1.000 28.41044 N ? C ? 124 1 ATOM 3366 CA . GLY B 124 ? 12.23729 4.00003 -27.79329 1.000 24.40062 C ? C ? 124 1 ATOM 3367 C . GLY B 124 ? 11.40060 3.85251 -26.54694 1.000 27.89564 C ? C ? 124 1 ATOM 3368 O . GLY B 124 ? 11.80511 4.23486 -25.44734 1.000 28.55172 O ? C ? 124 1 ATOM 3369 N . VAL B 125 ? 10.20998 3.28693 -26.73688 1.000 21.53193 N ? C ? 125 1 ATOM 3370 CA . VAL B 125 ? 9.26639 3.08024 -25.64540 1.000 21.74437 C ? C ? 125 1 ATOM 3371 C . VAL B 125 ? 8.68422 1.67797 -25.76053 1.000 21.38168 C ? C ? 125 1 ATOM 3372 O . VAL B 125 ? 8.45182 1.17748 -26.86538 1.000 20.84759 O ? C ? 125 1 ATOM 3373 CB . VAL B 125 ? 8.16015 4.15928 -25.64795 1.000 25.23187 C ? C ? 125 1 ATOM 3374 CG1 . VAL B 125 ? 7.41131 4.17087 -26.97032 1.000 20.15878 C ? C ? 125 1 ATOM 3375 CG2 . VAL B 125 ? 7.20169 3.96252 -24.47928 1.000 24.26452 C ? C ? 125 1 ATOM 3376 N . TYR B 126 ? 8.47498 1.03458 -24.61269 1.000 24.47830 N ? C ? 126 1 ATOM 3377 CA . TYR B 126 ? 7.86406 -0.28582 -24.57457 1.000 23.14258 C ? C ? 126 1 ATOM 3378 C . TYR B 126 ? 7.17106 -0.47515 -23.23363 1.000 20.89395 C ? C ? 126 1 ATOM 3379 O . TYR B 126 ? 7.41774 0.25968 -22.27474 1.000 23.15882 O ? C ? 126 1 ATOM 3380 CB . TYR B 126 ? 8.89579 -1.39619 -24.81449 1.000 21.47335 C ? C ? 126 1 ATOM 3381 CG . TYR B 126 ? 10.14989 -1.25614 -23.98437 1.000 27.22382 C ? C ? 126 1 ATOM 3382 CD1 . TYR B 126 ? 10.20922 -1.75124 -22.69041 1.000 25.54621 C ? C ? 126 1 ATOM 3383 CD2 . TYR B 126 ? 11.27454 -0.62550 -24.49498 1.000 27.20811 C ? C ? 126 1 ATOM 3384 CE1 . TYR B 126 ? 11.35233 -1.61919 -21.93171 1.000 26.54180 C ? C ? 126 1 ATOM 3385 CE2 . TYR B 126 ? 12.42153 -0.48948 -23.73951 1.000 30.76061 C ? C ? 126 1 ATOM 3386 CZ . TYR B 126 ? 12.45376 -0.98821 -22.45861 1.000 25.27574 C ? C ? 126 1 ATOM 3387 OH . TYR B 126 ? 13.59510 -0.85962 -21.69966 1.000 28.00625 O ? C ? 126 1 ATOM 3388 N . GLN B 127 ? 6.29537 -1.47588 -23.18079 1.000 23.60854 N ? C ? 127 1 ATOM 3389 CA . GLN B 127 ? 5.51644 -1.77464 -21.98564 1.000 25.05466 C ? C ? 127 1 ATOM 3390 C . GLN B 127 ? 6.20368 -2.86983 -21.17472 1.000 25.12560 C ? C ? 127 1 ATOM 3391 O . GLN B 127 ? 6.62816 -3.88780 -21.73000 1.000 26.60626 O ? C ? 127 1 ATOM 3392 CB . GLN B 127 ? 4.10069 -2.20299 -22.37656 1.000 28.47194 C ? C ? 127 1 ATOM 3393 CG . GLN B 127 ? 3.14454 -2.41262 -21.21804 1.000 28.23903 C ? C ? 127 1 ATOM 3394 CD . GLN B 127 ? 2.45440 -1.13100 -20.77729 1.000 30.76470 C ? C ? 127 1 ATOM 3395 OE1 . GLN B 127 ? 2.95387 -0.02662 -21.00208 1.000 25.59902 O ? C ? 127 1 ATOM 3396 NE2 . GLN B 127 ? 1.29524 -1.27586 -20.14520 1.000 36.09858 N ? C ? 127 1 ATOM 3397 N . CYS B 128 ? 6.31747 -2.65534 -19.86452 1.000 31.69132 N ? C ? 128 1 ATOM 3398 CA . CYS B 128 ? 6.95894 -3.59956 -18.95835 1.000 29.20750 C ? C ? 128 1 ATOM 3399 C . CYS B 128 ? 6.00504 -3.96539 -17.83527 1.000 27.99840 C ? C ? 128 1 ATOM 3400 O . CYS B 128 ? 4.97715 -3.32153 -17.62304 1.000 31.59496 O ? C ? 128 1 ATOM 3401 CB . CYS B 128 ? 8.24819 -3.03277 -18.34958 1.000 25.33371 C ? C ? 128 1 ATOM 3402 SG . CYS B 128 ? 9.66649 -3.06800 -19.43617 1.000 40.00731 S ? C ? 128 1 ATOM 3403 N . ALA B 129 ? 6.38062 -4.99892 -17.09349 1.000 26.64511 N ? C ? 129 1 ATOM 3404 CA . ALA B 129 ? 5.61581 -5.46781 -15.95144 1.000 31.30172 C ? C ? 129 1 ATOM 3405 C . ALA B 129 ? 6.55453 -5.71287 -14.78144 1.000 27.32217 C ? C ? 129 1 ATOM 3406 O . ALA B 129 ? 7.63782 -6.28171 -14.94841 1.000 26.76110 O ? C ? 129 1 ATOM 3407 CB . ALA B 129 ? 4.84431 -6.74988 -16.28315 1.000 28.64881 C ? C ? 129 1 ATOM 3408 N . MET B 130 ? 6.13915 -5.26335 -13.60244 1.000 22.20654 N ? C ? 130 1 ATOM 3409 CA . MET B 130 ? 6.87215 -5.53514 -12.37479 1.000 21.23846 C ? C ? 130 1 ATOM 3410 C . MET B 130 ? 6.60588 -6.97446 -11.95235 1.000 24.94344 C ? C ? 130 1 ATOM 3411 O . MET B 130 ? 5.45478 -7.34347 -11.69209 1.000 24.31048 O ? C ? 130 1 ATOM 3412 CB . MET B 130 ? 6.44552 -4.56014 -11.28189 1.000 21.86344 C ? C ? 130 1 ATOM 3413 CG . MET B 130 ? 7.23969 -4.68941 -10.00091 1.000 26.57446 C ? C ? 130 1 ATOM 3414 SD . MET B 130 ? 8.98101 -4.30700 -10.25965 1.000 26.33987 S ? C ? 130 1 ATOM 3415 CE . MET B 130 ? 8.91321 -2.52258 -10.39919 1.000 26.94007 C ? C ? 130 1 ATOM 3416 N . ARG B 131 ? 7.65966 -7.78763 -11.89282 1.000 24.92111 N ? C ? 131 1 ATOM 3417 CA . ARG B 131 ? 7.49714 -9.20556 -11.61207 1.000 26.42819 C ? C ? 131 1 ATOM 3418 C . ARG B 131 ? 7.26118 -9.43602 -10.12061 1.000 29.86431 C ? C ? 131 1 ATOM 3419 O . ARG B 131 ? 7.39251 -8.53205 -9.29122 1.000 22.34725 O ? C ? 131 1 ATOM 3420 CB . ARG B 131 ? 8.72165 -9.99363 -12.07592 1.000 24.54467 C ? C ? 131 1 ATOM 3421 CG . ARG B 131 ? 9.22683 -9.60718 -13.45088 1.000 30.08909 C ? C ? 131 1 ATOM 3422 CD . ARG B 131 ? 8.44873 -10.26634 -14.54345 1.000 28.76640 C ? C ? 131 1 ATOM 3423 NE . ARG B 131 ? 8.79060 -11.67691 -14.65251 1.000 30.95901 N ? C ? 131 1 ATOM 3424 CZ . ARG B 131 ? 8.05916 -12.56666 -15.30536 1.000 34.78243 C ? C ? 131 1 ATOM 3425 NH1 . ARG B 131 ? 6.93686 -12.22112 -15.91450 1.000 39.77094 N ? C ? 131 1 ATOM 3426 NH2 . ARG B 131 ? 8.45922 -13.83504 -15.34164 1.000 46.14627 N ? C ? 131 1 ATOM 3427 N . HIS B 132 ? 6.90681 -10.67996 -9.78538 1.000 31.00727 N ? C ? 132 1 ATOM 3428 CA . HIS B 132 ? 6.72609 -11.04897 -8.38569 1.000 27.34860 C ? C ? 132 1 ATOM 3429 C . HIS B 132 ? 7.99934 -10.82695 -7.57750 1.000 31.25478 C ? C ? 132 1 ATOM 3430 O . HIS B 132 ? 7.92885 -10.48541 -6.39069 1.000 25.61004 O ? C ? 132 1 ATOM 3431 CB . HIS B 132 ? 6.27850 -12.50647 -8.28452 1.000 27.36244 C ? C ? 132 1 ATOM 3432 CG . HIS B 132 ? 6.04509 -12.97069 -6.88107 1.000 36.23315 C ? C ? 132 1 ATOM 3433 ND1 . HIS B 132 ? 4.81580 -12.88438 -6.26342 1.000 37.91672 N ? C ? 132 1 ATOM 3434 CD2 . HIS B 132 ? 6.88265 -13.52826 -5.97505 1.000 37.49355 C ? C ? 132 1 ATOM 3435 CE1 . HIS B 132 ? 4.90510 -13.36985 -5.03812 1.000 40.39527 C ? C ? 132 1 ATOM 3436 NE2 . HIS B 132 ? 6.14875 -13.76767 -4.83800 1.000 48.15079 N ? C ? 132 1 ATOM 3437 N . ASN B 133 ? 9.16763 -11.00607 -8.19744 1.000 29.61574 N ? C ? 133 1 ATOM 3438 CA . ASN B 133 ? 10.44694 -10.80810 -7.52760 1.000 30.57887 C ? C ? 133 1 ATOM 3439 C . ASN B 133 ? 11.01925 -9.40282 -7.73994 1.000 27.31729 C ? C ? 133 1 ATOM 3440 O . ASN B 133 ? 12.22617 -9.20008 -7.56116 1.000 28.33102 O ? C ? 133 1 ATOM 3441 CB . ASN B 133 ? 11.44768 -11.87654 -7.98220 1.000 25.71851 C ? C ? 133 1 ATOM 3442 CG . ASN B 133 ? 11.81312 -11.76281 -9.45517 1.000 30.13233 C ? C ? 133 1 ATOM 3443 OD1 . ASN B 133 ? 11.22775 -10.97805 -10.20069 1.000 26.52470 O ? C ? 133 1 ATOM 3444 ND2 . ASN B 133 ? 12.78197 -12.56460 -9.88222 1.000 31.33733 N ? C ? 133 1 ATOM 3445 N . PHE B 134 ? 10.17755 -8.44151 -8.12826 1.000 27.15467 N ? C ? 134 1 ATOM 3446 CA . PHE B 134 ? 10.54954 -7.02486 -8.22589 1.000 28.71701 C ? C ? 134 1 ATOM 3447 C . PHE B 134 ? 11.65953 -6.78669 -9.24793 1.000 30.75662 C ? C ? 134 1 ATOM 3448 O . PHE B 134 ? 12.50786 -5.90905 -9.07551 1.000 26.03946 O ? C ? 134 1 ATOM 3449 CB . PHE B 134 ? 10.93899 -6.45154 -6.86079 1.000 23.20505 C ? C ? 134 1 ATOM 3450 CG . PHE B 134 ? 9.78030 -6.29126 -5.92110 1.000 26.40782 C ? C ? 134 1 ATOM 3451 CD1 . PHE B 134 ? 8.86184 -5.26733 -6.10290 1.000 26.88324 C ? C ? 134 1 ATOM 3452 CD2 . PHE B 134 ? 9.60486 -7.16459 -4.85830 1.000 28.54403 C ? C ? 134 1 ATOM 3453 CE1 . PHE B 134 ? 7.78684 -5.11933 -5.24557 1.000 27.30942 C ? C ? 134 1 ATOM 3454 CE2 . PHE B 134 ? 8.53163 -7.02105 -3.99362 1.000 38.20453 C ? C ? 134 1 ATOM 3455 CZ . PHE B 134 ? 7.62143 -5.99597 -4.18801 1.000 31.69438 C ? C ? 134 1 ATOM 3456 N . THR B 135 ? 11.65303 -7.56632 -10.32248 1.000 24.78410 N ? C ? 135 1 ATOM 3457 CA . THR B 135 ? 12.47534 -7.29357 -11.49106 1.000 20.01650 C ? C ? 135 1 ATOM 3458 C . THR B 135 ? 11.56943 -6.93056 -12.65839 1.000 26.08189 C ? C ? 135 1 ATOM 3459 O . THR B 135 ? 10.34298 -7.01928 -12.57141 1.000 28.08252 O ? C ? 135 1 ATOM 3460 CB . THR B 135 ? 13.35886 -8.49657 -11.85183 1.000 23.81300 C ? C ? 135 1 ATOM 3461 OG1 . THR B 135 ? 12.54267 -9.65777 -12.05282 1.000 25.61681 O ? C ? 135 1 ATOM 3462 CG2 . THR B 135 ? 14.35987 -8.77985 -10.74725 1.000 24.43832 C ? C ? 135 1 ATOM 3463 N . ILE B 136 ? 12.18434 -6.49229 -13.75783 1.000 24.34906 N ? C ? 136 1 ATOM 3464 CA . ILE B 136 ? 11.46967 -6.27573 -15.00936 1.000 19.00698 C ? C ? 136 1 ATOM 3465 C . ILE B 136 ? 12.30438 -6.84349 -16.14740 1.000 20.83149 C ? C ? 136 1 ATOM 3466 O . ILE B 136 ? 13.52631 -6.97674 -16.05076 1.000 24.24026 O ? C ? 136 1 ATOM 3467 CB . ILE B 136 ? 11.14129 -4.78767 -15.29420 1.000 21.38439 C ? C ? 136 1 ATOM 3468 CG1 . ILE B 136 ? 12.41791 -3.97242 -15.50565 1.000 20.50124 C ? C ? 136 1 ATOM 3469 CG2 . ILE B 136 ? 10.29005 -4.19149 -14.18580 1.000 22.89595 C ? C ? 136 1 ATOM 3470 CD1 . ILE B 136 ? 12.15662 -2.57096 -15.99923 1.000 17.61168 C ? C ? 136 1 ATOM 3471 N . LYS B 137 ? 11.61733 -7.18689 -17.23397 1.000 22.56820 N ? C ? 137 1 ATOM 3472 CA . LYS B 137 ? 12.24759 -7.67571 -18.45941 1.000 24.57285 C ? C ? 137 1 ATOM 3473 C . LYS B 137 ? 12.23832 -6.52238 -19.45415 1.000 26.41844 C ? C ? 137 1 ATOM 3474 O . LYS B 137 ? 11.31968 -6.38158 -20.26535 1.000 31.93869 O ? C ? 137 1 ATOM 3475 CB . LYS B 137 ? 11.51577 -8.89759 -19.00393 1.000 21.20879 C ? C ? 137 1 ATOM 3476 CG . LYS B 137 ? 11.47831 -10.08428 -18.06445 1.000 24.58595 C ? C ? 137 1 ATOM 3477 CD . LYS B 137 ? 10.57274 -11.17603 -18.62100 1.000 32.75087 C ? C ? 137 1 ATOM 3478 CE . LYS B 137 ? 10.72868 -12.48394 -17.85901 1.000 31.18775 C ? C ? 137 1 ATOM 3479 NZ . LYS B 137 ? 9.85809 -13.54758 -18.43411 1.000 38.20727 N ? C ? 137 1 ATOM 3480 N . GLY B 138 ? 13.27066 -5.68172 -19.38453 1.000 29.30533 N ? C ? 138 1 ATOM 3481 CA . GLY B 138 ? 13.37780 -4.52566 -20.23656 1.000 25.92306 C ? C ? 138 1 ATOM 3482 C . GLY B 138 ? 14.45247 -4.67882 -21.29872 1.000 29.03786 C ? C ? 138 1 ATOM 3483 O . GLY B 138 ? 15.03029 -5.74482 -21.49464 1.000 31.92635 O ? C ? 138 1 ATOM 3484 N . SER B 139 ? 14.69579 -3.57572 -22.00141 1.000 28.94828 N ? C ? 139 1 ATOM 3485 CA . SER B 139 ? 15.78892 -3.47576 -22.96387 1.000 29.29436 C ? C ? 139 1 ATOM 3486 C . SER B 139 ? 16.60704 -2.24590 -22.59506 1.000 28.13932 C ? C ? 139 1 ATOM 3487 O . SER B 139 ? 16.16447 -1.11164 -22.81213 1.000 23.46290 O ? C ? 139 1 ATOM 3488 CB . SER B 139 ? 15.26726 -3.38547 -24.39628 1.000 30.03428 C ? C ? 139 1 ATOM 3489 OG . SER B 139 ? 16.33752 -3.27497 -25.31408 1.000 35.64766 O ? C ? 139 1 ATOM 3490 N . PHE B 140 ? 17.78816 -2.47548 -22.02335 1.000 24.90229 N ? C ? 140 1 ATOM 3491 CA . PHE B 140 ? 18.64608 -1.41415 -21.51596 1.000 27.79255 C ? C ? 140 1 ATOM 3492 C . PHE B 140 ? 20.09026 -1.72040 -21.87977 1.000 36.72405 C ? C ? 140 1 ATOM 3493 O . PHE B 140 ? 20.55675 -2.84408 -21.67112 1.000 33.29131 O ? C ? 140 1 ATOM 3494 CB . PHE B 140 ? 18.51884 -1.27416 -19.99354 1.000 27.64895 C ? C ? 140 1 ATOM 3495 CG . PHE B 140 ? 17.14741 -0.87724 -19.52406 1.000 25.50380 C ? C ? 140 1 ATOM 3496 CD1 . PHE B 140 ? 16.67085 0.40178 -19.74067 1.000 28.96369 C ? C ? 140 1 ATOM 3497 CD2 . PHE B 140 ? 16.34634 -1.77739 -18.84064 1.000 28.48528 C ? C ? 140 1 ATOM 3498 CE1 . PHE B 140 ? 15.41286 0.77393 -19.29793 1.000 30.90521 C ? C ? 140 1 ATOM 3499 CE2 . PHE B 140 ? 15.08912 -1.41290 -18.39619 1.000 27.86795 C ? C ? 140 1 ATOM 3500 CZ . PHE B 140 ? 14.62237 -0.13538 -18.62498 1.000 24.33910 C ? C ? 140 1 ATOM 3501 N . LEU B 141 ? 20.79362 -0.72375 -22.41045 1.000 28.77271 N ? C ? 141 1 ATOM 3502 CA . LEU B 141 ? 22.21335 -0.82221 -22.71287 1.000 30.36906 C ? C ? 141 1 ATOM 3503 C . LEU B 141 ? 22.99860 0.05463 -21.74345 1.000 27.32475 C ? C ? 141 1 ATOM 3504 O . LEU B 141 ? 22.43555 0.69235 -20.84917 1.000 26.05220 O ? C ? 141 1 ATOM 3505 CB . LEU B 141 ? 22.48450 -0.42336 -24.16495 1.000 36.79544 C ? C ? 141 1 ATOM 3506 CG . LEU B 141 ? 22.04672 -1.40477 -25.25432 1.000 42.48897 C ? C ? 141 1 ATOM 3507 CD1 . LEU B 141 ? 22.14588 -0.75337 -26.61909 1.000 36.81084 C ? C ? 141 1 ATOM 3508 CD2 . LEU B 141 ? 22.89088 -2.67044 -25.20364 1.000 34.95211 C ? C ? 141 1 ATOM 3509 N . ASN B 142 ? 24.31682 0.07806 -21.92088 1.000 30.18809 N ? C ? 142 1 ATOM 3510 CA . ASN B 142 ? 25.13973 0.98776 -21.13739 1.000 34.78667 C ? C ? 142 1 ATOM 3511 C . ASN B 142 ? 24.71116 2.42532 -21.40543 1.000 31.05657 C ? C ? 142 1 ATOM 3512 O . ASN B 142 ? 24.44780 2.80929 -22.54823 1.000 28.91493 O ? C ? 142 1 ATOM 3513 CB . ASN B 142 ? 26.62158 0.79598 -21.47085 1.000 41.24156 C ? C ? 142 1 ATOM 3514 CG . ASN B 142 ? 27.11097 -0.61848 -21.18162 1.000 52.50610 C ? C ? 142 1 ATOM 3515 OD1 . ASN B 142 ? 26.60215 -1.29499 -20.28743 1.000 50.11673 O ? C ? 142 1 ATOM 3516 ND2 . ASN B 142 ? 28.10507 -1.06855 -21.94008 1.000 54.95316 N ? C ? 142 1 ATOM 3517 N . GLY B 143 ? 24.61132 3.21234 -20.33895 1.000 25.20514 N ? C ? 143 1 ATOM 3518 CA . GLY B 143 ? 24.14991 4.58024 -20.44424 1.000 34.38956 C ? C ? 143 1 ATOM 3519 C . GLY B 143 ? 22.64880 4.76495 -20.42836 1.000 24.97697 C ? C ? 143 1 ATOM 3520 O . GLY B 143 ? 22.17814 5.88640 -20.65132 1.000 28.84092 O ? C ? 143 1 ATOM 3521 N . SER B 144 ? 21.88142 3.71049 -20.17035 1.000 22.87109 N ? C ? 144 1 ATOM 3522 CA . SER B 144 ? 20.43140 3.81419 -20.11854 1.000 22.10494 C ? C ? 144 1 ATOM 3523 C . SER B 144 ? 19.90757 4.17328 -18.73671 1.000 23.43384 C ? C ? 144 1 ATOM 3524 O . SER B 144 ? 18.70830 4.43556 -18.59699 1.000 21.02272 O ? C ? 144 1 ATOM 3525 CB . SER B 144 ? 19.78988 2.49736 -20.56018 1.000 25.31242 C ? C ? 144 1 ATOM 3526 OG . SER B 144 ? 20.04625 1.47015 -19.61907 1.000 21.32728 O ? C ? 144 1 ATOM 3527 N . CYS B 145 ? 20.75905 4.16338 -17.71514 1.000 23.24392 N ? C ? 145 1 ATOM 3528 CA . CYS B 145 ? 20.30429 4.49227 -16.37336 1.000 20.59220 C ? C ? 145 1 ATOM 3529 C . CYS B 145 ? 19.75795 5.91391 -16.33654 1.000 21.16241 C ? C ? 145 1 ATOM 3530 O . CYS B 145 ? 20.22932 6.80615 -17.04725 1.000 21.37767 O ? C ? 145 1 ATOM 3531 CB . CYS B 145 ? 21.44240 4.31755 -15.37105 1.000 20.72562 C ? C ? 145 1 ATOM 3532 SG . CYS B 145 ? 21.85394 2.57989 -15.07471 1.000 24.22911 S ? C ? 145 1 ATOM 3533 N . GLY B 146 ? 18.73314 6.11249 -15.51246 1.000 21.98985 N ? C ? 146 1 ATOM 3534 CA . GLY B 146 ? 17.97575 7.34136 -15.49370 1.000 25.12823 C ? C ? 146 1 ATOM 3535 C . GLY B 146 ? 16.68910 7.29039 -16.29185 1.000 23.89272 C ? C ? 146 1 ATOM 3536 O . GLY B 146 ? 15.80094 8.12004 -16.06146 1.000 22.44409 O ? C ? 146 1 ATOM 3537 N . SER B 147 ? 16.57859 6.34875 -17.23047 1.000 24.41896 N ? C ? 147 1 ATOM 3538 CA . SER B 147 ? 15.32607 6.11156 -17.93434 1.000 20.28056 C ? C ? 147 1 ATOM 3539 C . SER B 147 ? 14.22496 5.74814 -16.94698 1.000 19.73866 C ? C ? 147 1 ATOM 3540 O . SER B 147 ? 14.45098 5.01482 -15.98056 1.000 19.26726 O ? C ? 147 1 ATOM 3541 CB . SER B 147 ? 15.50186 4.98841 -18.95734 1.000 20.44214 C ? C ? 147 1 ATOM 3542 OG . SER B 147 ? 16.36058 5.37952 -20.01307 1.000 22.67827 O ? C ? 147 1 ATOM 3543 N . VAL B 148 ? 13.01997 6.24547 -17.20638 1.000 19.97809 N ? C ? 148 1 ATOM 3544 CA . VAL B 148 ? 11.93083 6.15724 -16.24439 1.000 19.77077 C ? C ? 148 1 ATOM 3545 C . VAL B 148 ? 10.79314 5.31609 -16.81090 1.000 20.17531 C ? C ? 148 1 ATOM 3546 O . VAL B 148 ? 10.63313 5.17899 -18.02704 1.000 19.85790 O ? C ? 148 1 ATOM 3547 CB . VAL B 148 ? 11.42284 7.55913 -15.84889 1.000 20.41097 C ? C ? 148 1 ATOM 3548 CG1 . VAL B 148 ? 12.54950 8.36957 -15.23456 1.000 20.56438 C ? C ? 148 1 ATOM 3549 CG2 . VAL B 148 ? 10.84331 8.27226 -17.06362 1.000 21.14436 C ? C ? 148 1 ATOM 3550 N . GLY B 149 ? 10.00503 4.74746 -15.89885 1.000 19.36755 N ? C ? 149 1 ATOM 3551 CA . GLY B 149 ? 8.78372 4.04312 -16.23875 1.000 19.35149 C ? C ? 149 1 ATOM 3552 C . GLY B 149 ? 7.58935 4.82242 -15.71012 1.000 22.36206 C ? C ? 149 1 ATOM 3553 O . GLY B 149 ? 7.68937 5.50290 -14.68755 1.000 21.05183 O ? C ? 149 1 ATOM 3554 N . PHE B 150 ? 6.46586 4.72785 -16.41373 1.000 20.70167 N ? C ? 150 1 ATOM 3555 CA . PHE B 150 ? 5.34654 5.60758 -16.09915 1.000 23.12939 C ? C ? 150 1 ATOM 3556 C . PHE B 150 ? 4.03734 5.00501 -16.58495 1.000 23.72979 C ? C ? 150 1 ATOM 3557 O . PHE B 150 ? 4.01033 4.14047 -17.46613 1.000 21.04780 O ? C ? 150 1 ATOM 3558 CB . PHE B 150 ? 5.53989 6.99243 -16.72499 1.000 21.91221 C ? C ? 150 1 ATOM 3559 CG . PHE B 150 ? 5.53177 6.98027 -18.22698 1.000 22.76001 C ? C ? 150 1 ATOM 3560 CD1 . PHE B 150 ? 6.66059 6.60089 -18.93455 1.000 21.65196 C ? C ? 150 1 ATOM 3561 CD2 . PHE B 150 ? 4.39380 7.34171 -18.93226 1.000 25.92360 C ? C ? 150 1 ATOM 3562 CE1 . PHE B 150 ? 6.65594 6.58272 -20.31495 1.000 28.86611 C ? C ? 150 1 ATOM 3563 CE2 . PHE B 150 ? 4.38327 7.32486 -20.31818 1.000 30.16335 C ? C ? 150 1 ATOM 3564 CZ . PHE B 150 ? 5.51636 6.94649 -21.00893 1.000 25.77629 C ? C ? 150 1 ATOM 3565 N . ASN B 151 ? 2.95034 5.48585 -15.98603 1.000 22.23769 N ? C ? 151 1 ATOM 3566 CA . ASN B 151 ? 1.59507 5.31224 -16.48282 1.000 26.01011 C ? C ? 151 1 ATOM 3567 C . ASN B 151 ? 0.98018 6.68685 -16.71525 1.000 29.86007 C ? C ? 151 1 ATOM 3568 O . ASN B 151 ? 1.49244 7.70720 -16.24751 1.000 27.88076 O ? C ? 151 1 ATOM 3569 CB . ASN B 151 ? 0.73833 4.50074 -15.50464 1.000 23.01714 C ? C ? 151 1 ATOM 3570 CG . ASN B 151 ? 1.14130 3.04299 -15.45196 1.000 28.50589 C ? C ? 151 1 ATOM 3571 OD1 . ASN B 151 ? 0.68276 2.23637 -16.25665 1.000 29.47705 O ? C ? 151 1 ATOM 3572 ND2 . ASN B 151 ? 2.00410 2.69628 -14.50229 1.000 28.28184 N ? C ? 151 1 ATOM 3573 N . ILE B 152 ? -0.12686 6.71556 -17.45436 1.000 29.27617 N ? C ? 152 1 ATOM 3574 CA . ILE B 152 ? -0.83881 7.95579 -17.74240 1.000 38.65782 C ? C ? 152 1 ATOM 3575 C . ILE B 152 ? -2.31810 7.75161 -17.45239 1.000 34.53849 C ? C ? 152 1 ATOM 3576 O . ILE B 152 ? -2.91275 6.76380 -17.89790 1.000 39.72924 O ? C ? 152 1 ATOM 3577 CB . ILE B 152 ? -0.63183 8.41966 -19.19752 1.000 38.25013 C ? C ? 152 1 ATOM 3578 CG1 . ILE B 152 ? 0.85432 8.63508 -19.48176 1.000 27.19345 C ? C ? 152 1 ATOM 3579 CG2 . ILE B 152 ? -1.40283 9.70341 -19.46563 1.000 31.16418 C ? C ? 152 1 ATOM 3580 CD1 . ILE B 152 ? 1.13445 9.18094 -20.85753 1.000 37.92470 C ? C ? 152 1 ATOM 3581 N . ASP B 153 ? -2.90373 8.68421 -16.70330 1.000 47.27742 N ? C ? 153 1 ATOM 3582 CA . ASP B 153 ? -4.33302 8.71900 -16.39848 1.000 49.43367 C ? C ? 153 1 ATOM 3583 C . ASP B 153 ? -4.86245 10.04050 -16.94720 1.000 52.90597 C ? C ? 153 1 ATOM 3584 O . ASP B 153 ? -4.83008 11.06507 -16.26091 1.000 54.97287 O ? C ? 153 1 ATOM 3585 CB . ASP B 153 ? -4.58011 8.58505 -14.90149 1.000 56.88961 C ? C ? 153 1 ATOM 3586 CG . ASP B 153 ? -3.77095 7.46303 -14.27788 1.000 75.36268 C ? C ? 153 1 ATOM 3587 OD1 . ASP B 153 ? -2.53105 7.60365 -14.18136 1.000 64.96128 O ? C ? 153 1 ATOM 3588 OD2 . ASP B 153 ? -4.37392 6.43953 -13.88770 1.000 83.38304 O ? C ? 153 1 ATOM 3589 N . TYR B 154 ? -5.34840 10.00201 -18.18895 1.000 55.67224 N ? C ? 154 1 ATOM 3590 CA . TYR B 154 ? -5.71704 11.18762 -18.95850 1.000 54.73846 C ? C ? 154 1 ATOM 3591 C . TYR B 154 ? -4.52145 12.11475 -19.14606 1.000 55.28868 C ? C ? 154 1 ATOM 3592 O . TYR B 154 ? -3.74714 11.95121 -20.09564 1.000 55.31430 O ? C ? 154 1 ATOM 3593 CB . TYR B 154 ? -6.87421 11.94962 -18.30522 1.000 52.28749 C ? C ? 154 1 ATOM 3594 CG . TYR B 154 ? -7.51388 12.96191 -19.23227 1.000 58.47779 C ? C ? 154 1 ATOM 3595 CD1 . TYR B 154 ? -7.43014 12.81428 -20.61306 1.000 68.37583 C ? C ? 154 1 ATOM 3596 CD2 . TYR B 154 ? -8.18835 14.07078 -18.73174 1.000 68.71587 C ? C ? 154 1 ATOM 3597 CE1 . TYR B 154 ? -8.00779 13.73513 -21.46939 1.000 67.70544 C ? C ? 154 1 ATOM 3598 CE2 . TYR B 154 ? -8.77019 14.99952 -19.58252 1.000 58.44340 C ? C ? 154 1 ATOM 3599 CZ . TYR B 154 ? -8.67585 14.82580 -20.94972 1.000 63.60633 C ? C ? 154 1 ATOM 3600 OH . TYR B 154 ? -9.25016 15.74275 -21.80094 1.000 66.05062 O ? C ? 154 1 ATOM 3601 N . ASP B 155 ? -4.36194 13.09225 -18.25279 1.000 45.53363 N ? C ? 155 1 ATOM 3602 CA . ASP B 155 ? -3.30187 14.08476 -18.38412 1.000 54.16635 C ? C ? 155 1 ATOM 3603 C . ASP B 155 ? -2.29005 14.03674 -17.24453 1.000 40.29974 C ? C ? 155 1 ATOM 3604 O . ASP B 155 ? -1.41090 14.90412 -17.17830 1.000 44.07857 O ? C ? 155 1 ATOM 3605 CB . ASP B 155 ? -3.90090 15.49408 -18.49593 1.000 50.94146 C ? C ? 155 1 ATOM 3606 CG . ASP B 155 ? -4.74346 15.87858 -17.28771 1.000 50.22208 C ? C ? 155 1 ATOM 3607 OD1 . ASP B 155 ? -4.96004 15.02949 -16.39477 1.000 54.46763 O ? C ? 155 1 ATOM 3608 OD2 . ASP B 155 ? -5.19213 17.04288 -17.23370 1.000 49.68113 O ? C ? 155 1 ATOM 3609 N . CYS B 156 ? -2.37814 13.05225 -16.35437 1.000 41.48254 N ? C ? 156 1 ATOM 3610 CA . CYS B 156 ? -1.49440 12.95851 -15.19834 1.000 45.95258 C ? C ? 156 1 ATOM 3611 C . CYS B 156 ? -0.53370 11.78916 -15.38625 1.000 36.52715 C ? C ? 156 1 ATOM 3612 O . CYS B 156 ? -0.96688 10.64325 -15.56441 1.000 37.14431 O ? C ? 156 1 ATOM 3613 CB . CYS B 156 ? -2.29791 12.79777 -13.90739 1.000 44.51637 C ? C ? 156 1 ATOM 3614 SG . CYS B 156 ? -1.29774 12.76843 -12.39639 1.000 44.11089 S ? C ? 156 1 ATOM 3615 N . VAL B 157 ? 0.76389 12.08148 -15.33393 1.000 31.41865 N ? C ? 157 1 ATOM 3616 CA . VAL B 157 ? 1.80935 11.07725 -15.50754 1.000 32.26754 C ? C ? 157 1 ATOM 3617 C . VAL B 157 ? 2.21903 10.55469 -14.13629 1.000 35.62209 C ? C ? 157 1 ATOM 3618 O . VAL B 157 ? 2.67877 11.32167 -13.28299 1.000 27.35038 O ? C ? 157 1 ATOM 3619 CB . VAL B 157 ? 3.01999 11.66079 -16.25184 1.000 27.58138 C ? C ? 157 1 ATOM 3620 CG1 . VAL B 157 ? 4.08873 10.58880 -16.46083 1.000 25.15755 C ? C ? 157 1 ATOM 3621 CG2 . VAL B 157 ? 2.58814 12.28237 -17.57535 1.000 27.74299 C ? C ? 157 1 ATOM 3622 N . SER B 158 ? 2.06435 9.24982 -13.92257 1.000 25.35003 N ? C ? 158 1 ATOM 3623 CA . SER B 158 ? 2.48006 8.61024 -12.67590 1.000 24.72302 C ? C ? 158 1 ATOM 3624 C . SER B 158 ? 3.84006 7.96751 -12.91183 1.000 23.47487 C ? C ? 158 1 ATOM 3625 O . SER B 158 ? 3.94114 6.91498 -13.54583 1.000 25.41599 O ? C ? 158 1 ATOM 3626 CB . SER B 158 ? 1.45284 7.58537 -12.20724 1.000 26.77908 C ? C ? 158 1 ATOM 3627 OG . SER B 158 ? 0.28501 8.21911 -11.71760 1.000 36.21926 O ? C ? 158 1 ATOM 3628 N . PHE B 159 ? 4.88947 8.60858 -12.40909 1.000 27.46390 N ? C ? 159 1 ATOM 3629 CA . PHE B 159 ? 6.22495 8.03621 -12.48158 1.000 22.15665 C ? C ? 159 1 ATOM 3630 C . PHE B 159 ? 6.37436 6.96585 -11.41119 1.000 22.83111 C ? C ? 159 1 ATOM 3631 O . PHE B 159 ? 6.02303 7.18341 -10.24593 1.000 25.79800 O ? C ? 159 1 ATOM 3632 CB . PHE B 159 ? 7.28357 9.12275 -12.31038 1.000 22.31571 C ? C ? 159 1 ATOM 3633 CG . PHE B 159 ? 7.32305 10.09701 -13.44347 1.000 23.36661 C ? C ? 159 1 ATOM 3634 CD1 . PHE B 159 ? 7.87878 9.73640 -14.65885 1.000 22.48506 C ? C ? 159 1 ATOM 3635 CD2 . PHE B 159 ? 6.78728 11.36576 -13.30404 1.000 24.05868 C ? C ? 159 1 ATOM 3636 CE1 . PHE B 159 ? 7.90755 10.62452 -15.71355 1.000 23.21490 C ? C ? 159 1 ATOM 3637 CE2 . PHE B 159 ? 6.81403 12.25968 -14.35620 1.000 24.79048 C ? C ? 159 1 ATOM 3638 CZ . PHE B 159 ? 7.37634 11.88866 -15.56257 1.000 24.37052 C ? C ? 159 1 ATOM 3639 N . CYS B 160 ? 6.88590 5.80429 -11.80528 1.000 21.08092 N ? C ? 160 1 ATOM 3640 CA . CYS B 160 ? 6.98742 4.68763 -10.87926 1.000 20.41738 C ? C ? 160 1 ATOM 3641 C . CYS B 160 ? 8.32730 3.97093 -10.89526 1.000 20.98635 C ? C ? 160 1 ATOM 3642 O . CYS B 160 ? 8.60151 3.21133 -9.95856 1.000 23.04497 O ? C ? 160 1 ATOM 3643 CB . CYS B 160 ? 5.87938 3.66113 -11.15749 1.000 20.44901 C ? C ? 160 1 ATOM 3644 SG . CYS B 160 ? 5.87219 3.00598 -12.83788 1.000 28.53399 S ? C ? 160 1 ATOM 3645 N . TYR B 161 ? 9.17287 4.18570 -11.89881 1.000 19.33288 N ? C ? 161 1 ATOM 3646 CA . TYR B 161 ? 10.39292 3.40879 -12.04446 1.000 18.80640 C ? C ? 161 1 ATOM 3647 C . TYR B 161 ? 11.50618 4.29942 -12.57189 1.000 18.84788 C ? C ? 161 1 ATOM 3648 O . TYR B 161 ? 11.26389 5.20495 -13.37335 1.000 19.17305 O ? C ? 161 1 ATOM 3649 CB . TYR B 161 ? 10.17654 2.22110 -12.99371 1.000 19.63492 C ? C ? 161 1 ATOM 3650 CG . TYR B 161 ? 11.39663 1.35193 -13.20250 1.000 21.29192 C ? C ? 161 1 ATOM 3651 CD1 . TYR B 161 ? 11.68488 0.30962 -12.32872 1.000 25.72677 C ? C ? 161 1 ATOM 3652 CD2 . TYR B 161 ? 12.25536 1.56409 -14.27848 1.000 18.13644 C ? C ? 161 1 ATOM 3653 CE1 . TYR B 161 ? 12.79520 -0.49279 -12.51326 1.000 17.96179 C ? C ? 161 1 ATOM 3654 CE2 . TYR B 161 ? 13.36810 0.76855 -14.47110 1.000 18.05910 C ? C ? 161 1 ATOM 3655 CZ . TYR B 161 ? 13.63418 -0.25950 -13.58363 1.000 17.97321 C ? C ? 161 1 ATOM 3656 OH . TYR B 161 ? 14.74085 -1.05686 -13.76372 1.000 18.09483 O ? C ? 161 1 ATOM 3657 N . MET B 162 ? 12.72324 4.04607 -12.10645 1.000 18.66778 N ? C ? 162 1 ATOM 3658 CA . MET B 162 ? 13.91897 4.60359 -12.71917 1.000 22.62867 C ? C ? 162 1 ATOM 3659 C . MET B 162 ? 14.95872 3.49754 -12.78619 1.000 19.42718 C ? C ? 162 1 ATOM 3660 O . MET B 162 ? 15.13368 2.74542 -11.82368 1.000 18.41879 O ? C ? 162 1 ATOM 3661 CB . MET B 162 ? 14.45403 5.81243 -11.94344 1.000 19.08170 C ? C ? 162 1 ATOM 3662 CG . MET B 162 ? 15.78409 6.33665 -12.45619 1.000 19.27768 C ? C ? 162 1 ATOM 3663 SD . MET B 162 ? 16.29936 7.85502 -11.61936 1.000 25.82978 S ? C ? 162 1 ATOM 3664 CE . MET B 162 ? 15.30642 9.08624 -12.46964 1.000 20.32016 C ? C ? 162 1 ATOM 3665 N . HIS B 163 ? 15.63530 3.39214 -13.92603 1.000 21.15251 N ? C ? 163 1 ATOM 3666 CA . HIS B 163 ? 16.49741 2.24858 -14.17723 1.000 22.73363 C ? C ? 163 1 ATOM 3667 C . HIS B 163 ? 17.87740 2.44415 -13.55992 1.000 22.82329 C ? C ? 163 1 ATOM 3668 O . HIS B 163 ? 18.44127 3.54230 -13.59546 1.000 19.18142 O ? C ? 163 1 ATOM 3669 CB . HIS B 163 ? 16.62909 1.99620 -15.67572 1.000 18.85676 C ? C ? 163 1 ATOM 3670 CG . HIS B 163 ? 17.47345 0.80676 -15.99809 1.000 20.22163 C ? C ? 163 1 ATOM 3671 ND1 . HIS B 163 ? 17.22136 -0.44359 -15.47454 1.000 19.80777 N ? C ? 163 1 ATOM 3672 CD2 . HIS B 163 ? 18.58326 0.67986 -16.76272 1.000 21.08290 C ? C ? 163 1 ATOM 3673 CE1 . HIS B 163 ? 18.13102 -1.29343 -15.91653 1.000 20.33795 C ? C ? 163 1 ATOM 3674 NE2 . HIS B 163 ? 18.96922 -0.63742 -16.69950 1.000 23.05571 N ? C ? 163 1 ATOM 3675 N . HIS B 164 ? 18.42390 1.35414 -12.99810 1.000 20.49821 N ? C ? 164 1 ATOM 3676 CA . HIS B 164 ? 19.69863 1.35141 -12.28333 1.000 19.30383 C ? C ? 164 1 ATOM 3677 C . HIS B 164 ? 20.64009 0.22830 -12.69692 1.000 20.72789 C ? C ? 164 1 ATOM 3678 O . HIS B 164 ? 21.84673 0.46350 -12.78685 1.000 25.07763 O ? C ? 164 1 ATOM 3679 CB . HIS B 164 ? 19.47363 1.26349 -10.76242 1.000 19.20892 C ? C ? 164 1 ATOM 3680 CG . HIS B 164 ? 19.13181 2.57044 -10.11893 1.000 19.77344 C ? C ? 164 1 ATOM 3681 ND1 . HIS B 164 ? 17.90469 3.17709 -10.27857 1.000 23.87583 N ? C ? 164 1 ATOM 3682 CD2 . HIS B 164 ? 19.84490 3.37580 -9.29630 1.000 19.39483 C ? C ? 164 1 ATOM 3683 CE1 . HIS B 164 ? 17.87864 4.30457 -9.59164 1.000 19.04960 C ? C ? 164 1 ATOM 3684 NE2 . HIS B 164 ? 19.04347 4.44848 -8.98553 1.000 23.84998 N ? C ? 164 1 ATOM 3685 N . MET B 165 ? 20.14038 -0.98944 -12.92017 1.000 19.67417 N ? C ? 165 1 ATOM 3686 CA . MET B 165 ? 21.07157 -2.10001 -13.09009 1.000 20.30012 C ? C ? 165 1 ATOM 3687 C . MET B 165 ? 20.44407 -3.25939 -13.85349 1.000 23.40567 C ? C ? 165 1 ATOM 3688 O . MET B 165 ? 19.22090 -3.37921 -13.97105 1.000 22.33325 O ? C ? 165 1 ATOM 3689 CB . MET B 165 ? 21.57302 -2.60806 -11.73793 1.000 23.16897 C ? C ? 165 1 ATOM 3690 CG . MET B 165 ? 20.53394 -3.42105 -10.99993 1.000 26.36676 C ? C ? 165 1 ATOM 3691 SD . MET B 165 ? 21.10211 -3.98861 -9.39500 1.000 49.86239 S ? C ? 165 1 ATOM 3692 CE . MET B 165 ? 21.39037 -2.41639 -8.60624 1.000 30.53298 C ? C ? 165 1 ATOM 3693 N . VAL B 166 ? 21.31967 -4.12532 -14.35381 1.000 24.45585 N ? C ? 166 1 ATOM 3694 CA . VAL B 166 ? 20.94425 -5.41842 -14.90782 1.000 28.63835 C ? C ? 166 1 ATOM 3695 C . VAL B 166 ? 21.49080 -6.50085 -13.98315 1.000 27.81853 C ? C ? 166 1 ATOM 3696 O . VAL B 166 ? 22.54215 -6.33803 -13.35307 1.000 25.69920 O ? C ? 166 1 ATOM 3697 CB . VAL B 166 ? 21.46551 -5.58842 -16.35216 1.000 24.05648 C ? C ? 166 1 ATOM 3698 CG1 . VAL B 166 ? 22.98327 -5.49271 -16.38581 1.000 25.63728 C ? C ? 166 1 ATOM 3699 CG2 . VAL B 166 ? 20.98448 -6.89999 -16.95558 1.000 25.07979 C ? C ? 166 1 ATOM 3700 N . LEU B 167 ? 20.75919 -7.59634 -13.88334 1.000 29.48499 N ? C ? 167 1 ATOM 3701 CA . LEU B 167 ? 21.09004 -8.72177 -13.02516 1.000 26.83408 C ? C ? 167 1 ATOM 3702 C . LEU B 167 ? 21.73197 -9.83730 -13.83493 1.000 32.38968 C ? C ? 167 1 ATOM 3703 O . LEU B 167 ? 21.68046 -9.83872 -15.06894 1.000 33.85710 O ? C ? 167 1 ATOM 3704 CB . LEU B 167 ? 19.82722 -9.22570 -12.32560 1.000 35.46609 C ? C ? 167 1 ATOM 3705 CG . LEU B 167 ? 19.08310 -8.20489 -11.46327 1.000 29.87765 C ? C ? 167 1 ATOM 3706 CD1 . LEU B 167 ? 18.03225 -8.91851 -10.64639 1.000 37.11877 C ? C ? 167 1 ATOM 3707 CD2 . LEU B 167 ? 20.03798 -7.42735 -10.57004 1.000 27.58379 C ? C ? 167 1 ATOM 3708 N . PRO B 168 ? 22.38147 -10.80093 -13.16832 1.000 28.52122 N ? C ? 168 1 ATOM 3709 CA . PRO B 168 ? 23.00434 -11.90929 -13.91457 1.000 34.65407 C ? C ? 168 1 ATOM 3710 C . PRO B 168 ? 22.03372 -12.67572 -14.79690 1.000 34.45569 C ? C ? 168 1 ATOM 3711 O . PRO B 168 ? 22.43347 -13.15729 -15.86431 1.000 35.02558 O ? C ? 168 1 ATOM 3712 CB . PRO B 168 ? 23.58031 -12.79181 -12.79961 1.000 31.90119 C ? C ? 168 1 ATOM 3713 CG . PRO B 168 ? 23.87005 -11.82676 -11.69133 1.000 28.26832 C ? C ? 168 1 ATOM 3714 CD . PRO B 168 ? 22.74623 -10.83076 -11.73861 1.000 30.08315 C ? C ? 168 1 ATOM 3715 N . THR B 169 ? 20.76655 -12.79312 -14.39456 1.000 32.34351 N ? C ? 169 1 ATOM 3716 CA . THR B 169 ? 19.76089 -13.45879 -15.21728 1.000 35.81950 C ? C ? 169 1 ATOM 3717 C . THR B 169 ? 19.36881 -12.65282 -16.44882 1.000 36.13424 C ? C ? 169 1 ATOM 3718 O . THR B 169 ? 18.57425 -13.14465 -17.25775 1.000 32.73986 O ? C ? 169 1 ATOM 3719 CB . THR B 169 ? 18.50642 -13.75637 -14.38799 1.000 29.02101 C ? C ? 169 1 ATOM 3720 OG1 . THR B 169 ? 18.20741 -12.63259 -13.54919 1.000 38.74989 O ? C ? 169 1 ATOM 3721 CG2 . THR B 169 ? 18.70799 -14.99284 -13.52385 1.000 25.04428 C ? C ? 169 1 ATOM 3722 N . GLY B 170 ? 19.88935 -11.43963 -16.61444 1.000 36.33213 N ? C ? 170 1 ATOM 3723 CA . GLY B 170 ? 19.51737 -10.59865 -17.73010 1.000 29.77625 C ? C ? 170 1 ATOM 3724 C . GLY B 170 ? 18.29873 -9.73385 -17.50067 1.000 33.82162 C ? C ? 170 1 ATOM 3725 O . GLY B 170 ? 17.95668 -8.93075 -18.37930 1.000 40.28297 O ? C ? 170 1 ATOM 3726 N . VAL B 171 ? 17.62785 -9.87622 -16.35799 1.000 29.72777 N ? C ? 171 1 ATOM 3727 CA . VAL B 171 ? 16.49445 -9.02740 -16.00930 1.000 26.60922 C ? C ? 171 1 ATOM 3728 C . VAL B 171 ? 17.02835 -7.72293 -15.43479 1.000 25.96506 C ? C ? 171 1 ATOM 3729 O . VAL B 171 ? 18.24144 -7.55807 -15.26851 1.000 28.30693 O ? C ? 171 1 ATOM 3730 CB . VAL B 171 ? 15.54584 -9.73185 -15.02303 1.000 28.55520 C ? C ? 171 1 ATOM 3731 CG1 . VAL B 171 ? 14.96577 -10.98782 -15.65781 1.000 24.59893 C ? C ? 171 1 ATOM 3732 CG2 . VAL B 171 ? 16.27899 -10.07370 -13.73665 1.000 32.92762 C ? C ? 171 1 ATOM 3733 N . HIS B 172 ? 16.13323 -6.78932 -15.12499 1.000 29.13724 N ? C ? 172 1 ATOM 3734 CA . HIS B 172 ? 16.52700 -5.43885 -14.75724 1.000 27.17047 C ? C ? 172 1 ATOM 3735 C . HIS B 172 ? 15.90703 -5.04434 -13.42424 1.000 25.06427 C ? C ? 172 1 ATOM 3736 O . HIS B 172 ? 14.86634 -5.56669 -13.01471 1.000 21.70067 O ? C ? 172 1 ATOM 3737 CB . HIS B 172 ? 16.12843 -4.44547 -15.84684 1.000 21.03895 C ? C ? 172 1 ATOM 3738 CG . HIS B 172 ? 16.78208 -4.71911 -17.16173 1.000 26.24196 C ? C ? 172 1 ATOM 3739 ND1 . HIS B 172 ? 16.16916 -5.44269 -18.16126 1.000 24.26303 N ? C ? 172 1 ATOM 3740 CD2 . HIS B 172 ? 18.00912 -4.39259 -17.63107 1.000 25.89403 C ? C ? 172 1 ATOM 3741 CE1 . HIS B 172 ? 16.98345 -5.53581 -19.19689 1.000 24.00711 C ? C ? 172 1 ATOM 3742 NE2 . HIS B 172 ? 18.10580 -4.90554 -18.90184 1.000 35.23206 N ? C ? 172 1 ATOM 3743 N . ALA B 173 ? 16.56833 -4.10572 -12.74965 1.000 18.86393 N ? C ? 173 1 ATOM 3744 CA . ALA B 173 ? 16.15344 -3.65797 -11.43014 1.000 18.77690 C ? C ? 173 1 ATOM 3745 C . ALA B 173 ? 16.35997 -2.15523 -11.31411 1.000 21.68547 C ? C ? 173 1 ATOM 3746 O . ALA B 173 ? 17.29517 -1.59844 -11.89760 1.000 18.72652 O ? C ? 173 1 ATOM 3747 CB . ALA B 173 ? 16.93147 -4.38334 -10.32618 1.000 21.68861 C ? C ? 173 1 ATOM 3748 N . GLY B 174 ? 15.48621 -1.50523 -10.55644 1.000 18.62647 N ? C ? 174 1 ATOM 3749 CA . GLY B 174 ? 15.57526 -0.07544 -10.38503 1.000 20.54003 C ? C ? 174 1 ATOM 3750 C . GLY B 174 ? 14.81675 0.37404 -9.15950 1.000 20.41580 C ? C ? 174 1 ATOM 3751 O . GLY B 174 ? 14.43917 -0.43220 -8.30860 1.000 23.02272 O ? C ? 174 1 ATOM 3752 N . THR B 175 ? 14.58328 1.68058 -9.09114 1.000 18.60045 N ? C ? 175 1 ATOM 3753 CA . THR B 175 ? 13.97896 2.31152 -7.93065 1.000 21.61633 C ? C ? 175 1 ATOM 3754 C . THR B 175 ? 12.70293 3.04376 -8.32461 1.000 19.02447 C ? C ? 175 1 ATOM 3755 O . THR B 175 ? 12.43316 3.27981 -9.50577 1.000 18.83241 O ? C ? 175 1 ATOM 3756 CB . THR B 175 ? 14.94945 3.30460 -7.26977 1.000 19.15985 C ? C ? 175 1 ATOM 3757 OG1 . THR B 175 ? 15.14486 4.43020 -8.13317 1.000 19.10782 O ? C ? 175 1 ATOM 3758 CG2 . THR B 175 ? 16.28606 2.64620 -7.02470 1.000 19.18711 C ? C ? 175 1 ATOM 3759 N . ASP B 176 ? 11.91128 3.39690 -7.31364 1.000 21.30417 N ? C ? 176 1 ATOM 3760 CA . ASP B 176 ? 10.87206 4.39012 -7.52005 1.000 22.60507 C ? C ? 176 1 ATOM 3761 C . ASP B 176 ? 11.50320 5.78201 -7.54844 1.000 24.75063 C ? C ? 176 1 ATOM 3762 O . ASP B 176 ? 12.69962 5.95611 -7.29697 1.000 22.37322 O ? C ? 176 1 ATOM 3763 CB . ASP B 176 ? 9.78874 4.29075 -6.43956 1.000 23.85296 C ? C ? 176 1 ATOM 3764 CG . ASP B 176 ? 10.34003 4.40229 -5.01848 1.000 28.96186 C ? C ? 176 1 ATOM 3765 OD1 . ASP B 176 ? 11.21862 5.25285 -4.75985 1.000 27.83932 O ? C ? 176 1 ATOM 3766 OD2 . ASP B 176 ? 9.85630 3.65083 -4.14206 1.000 30.97472 O ? C ? 176 1 ATOM 3767 N . LEU B 177 ? 10.68731 6.79030 -7.84381 1.000 20.57209 N ? C ? 177 1 ATOM 3768 CA . LEU B 177 ? 11.27697 8.11641 -7.97902 1.000 22.25985 C ? C ? 177 1 ATOM 3769 C . LEU B 177 ? 11.66178 8.73685 -6.64241 1.000 25.59053 C ? C ? 177 1 ATOM 3770 O . LEU B 177 ? 12.15076 9.87196 -6.62825 1.000 26.45863 O ? C ? 177 1 ATOM 3771 CB . LEU B 177 ? 10.33542 9.04632 -8.74577 1.000 22.91167 C ? C ? 177 1 ATOM 3772 CG . LEU B 177 ? 10.60989 9.11251 -10.25281 1.000 23.43435 C ? C ? 177 1 ATOM 3773 CD1 . LEU B 177 ? 12.00080 9.66498 -10.52129 1.000 21.03942 C ? C ? 177 1 ATOM 3774 CD2 . LEU B 177 ? 10.44075 7.74085 -10.91138 1.000 23.07624 C ? C ? 177 1 ATOM 3775 N . GLU B 178 ? 11.47029 8.03490 -5.52974 1.000 25.04652 N ? C ? 178 1 ATOM 3776 CA . GLU B 178 ? 12.01914 8.47179 -4.25499 1.000 28.04922 C ? C ? 178 1 ATOM 3777 C . GLU B 178 ? 13.35048 7.80761 -3.93753 1.000 22.80308 C ? C ? 178 1 ATOM 3778 O . GLU B 178 ? 13.92640 8.07986 -2.87992 1.000 29.46265 O ? C ? 178 1 ATOM 3779 CB . GLU B 178 ? 11.02296 8.20434 -3.12695 1.000 26.66963 C ? C ? 178 1 ATOM 3780 CG . GLU B 178 ? 9.68535 8.87878 -3.33513 1.000 35.58422 C ? C ? 178 1 ATOM 3781 CD . GLU B 178 ? 8.85738 8.92520 -2.07290 1.000 49.50681 C ? C ? 178 1 ATOM 3782 OE1 . GLU B 178 ? 8.58329 7.85215 -1.49430 1.000 54.91936 O ? C ? 178 1 ATOM 3783 OE2 . GLU B 178 ? 8.49227 10.04229 -1.65253 1.000 61.40027 O ? C ? 178 1 ATOM 3784 N . GLY B 179 ? 13.84680 6.94600 -4.82200 1.000 23.75420 N ? C ? 179 1 ATOM 3785 CA . GLY B 179 ? 15.14996 6.34085 -4.66479 1.000 23.03929 C ? C ? 179 1 ATOM 3786 C . GLY B 179 ? 15.16584 4.98564 -3.99493 1.000 22.46323 C ? C ? 179 1 ATOM 3787 O . GLY B 179 ? 16.24902 4.41296 -3.82338 1.000 21.46039 O ? C ? 179 1 ATOM 3788 N . ASN B 180 ? 14.01346 4.45318 -3.60388 1.000 23.04093 N ? C ? 180 1 ATOM 3789 CA . ASN B 180 ? 13.95291 3.14698 -2.96211 1.000 22.87908 C ? C ? 180 1 ATOM 3790 C . ASN B 180 ? 13.86527 2.06816 -4.03280 1.000 22.24278 C ? C ? 180 1 ATOM 3791 O . ASN B 180 ? 12.95497 2.08875 -4.86681 1.000 20.10326 O ? C ? 180 1 ATOM 3792 CB . ASN B 180 ? 12.76106 3.05889 -2.01091 1.000 26.80479 C ? C ? 180 1 ATOM 3793 CG . ASN B 180 ? 12.83043 4.08017 -0.89960 1.000 28.76321 C ? C ? 180 1 ATOM 3794 OD1 . ASN B 180 ? 11.94183 4.91846 -0.76193 1.000 32.82830 O ? C ? 180 1 ATOM 3795 ND2 . ASN B 180 ? 13.89188 4.02218 -0.10366 1.000 22.65466 N ? C ? 180 1 ATOM 3796 N . PHE B 181 ? 14.80728 1.13014 -4.00511 1.000 20.29931 N ? C ? 181 1 ATOM 3797 CA . PHE B 181 ? 14.77828 0.01608 -4.94048 1.000 22.97148 C ? C ? 181 1 ATOM 3798 C . PHE B 181 ? 13.51094 -0.81205 -4.76729 1.000 21.91524 C ? C ? 181 1 ATOM 3799 O . PHE B 181 ? 12.98640 -0.97324 -3.66151 1.000 22.80736 O ? C ? 181 1 ATOM 3800 CB . PHE B 181 ? 16.00358 -0.88164 -4.74511 1.000 20.16077 C ? C ? 181 1 ATOM 3801 CG . PHE B 181 ? 17.15186 -0.54713 -5.65268 1.000 24.05668 C ? C ? 181 1 ATOM 3802 CD1 . PHE B 181 ? 17.25419 -1.13925 -6.90251 1.000 19.54389 C ? C ? 181 1 ATOM 3803 CD2 . PHE B 181 ? 18.12977 0.35947 -5.25894 1.000 21.87573 C ? C ? 181 1 ATOM 3804 CE1 . PHE B 181 ? 18.30748 -0.83047 -7.74981 1.000 26.25690 C ? C ? 181 1 ATOM 3805 CE2 . PHE B 181 ? 19.18395 0.67521 -6.09921 1.000 22.36843 C ? C ? 181 1 ATOM 3806 CZ . PHE B 181 ? 19.27411 0.07918 -7.34624 1.000 22.98367 C ? C ? 181 1 ATOM 3807 N . TYR B 182 ? 13.01065 -1.32708 -5.88491 1.000 25.07738 N ? C ? 182 1 ATOM 3808 CA . TYR B 182 ? 12.08773 -2.44851 -5.84265 1.000 22.34452 C ? C ? 182 1 ATOM 3809 C . TYR B 182 ? 12.89964 -3.72026 -5.63733 1.000 26.52308 C ? C ? 182 1 ATOM 3810 O . TYR B 182 ? 13.84143 -3.98719 -6.38999 1.000 29.61734 O ? C ? 182 1 ATOM 3811 CB . TYR B 182 ? 11.27958 -2.53956 -7.13583 1.000 25.51944 C ? C ? 182 1 ATOM 3812 CG . TYR B 182 ? 10.33221 -1.38732 -7.37582 1.000 21.55578 C ? C ? 182 1 ATOM 3813 CD1 . TYR B 182 ? 9.02039 -1.43789 -6.92541 1.000 23.12312 C ? C ? 182 1 ATOM 3814 CD2 . TYR B 182 ? 10.74428 -0.26044 -8.07104 1.000 22.11368 C ? C ? 182 1 ATOM 3815 CE1 . TYR B 182 ? 8.14773 -0.39429 -7.14913 1.000 25.82030 C ? C ? 182 1 ATOM 3816 CE2 . TYR B 182 ? 9.88226 0.79026 -8.30178 1.000 19.52148 C ? C ? 182 1 ATOM 3817 CZ . TYR B 182 ? 8.58532 0.71879 -7.83789 1.000 26.68903 C ? C ? 182 1 ATOM 3818 OH . TYR B 182 ? 7.72274 1.76326 -8.06623 1.000 24.26243 O ? C ? 182 1 ATOM 3819 N . GLY B 183 ? 12.55371 -4.49290 -4.61177 1.000 27.31276 N ? C ? 183 1 ATOM 3820 CA . GLY B 183 ? 13.26398 -5.71563 -4.31656 1.000 27.90797 C ? C ? 183 1 ATOM 3821 C . GLY B 183 ? 14.45366 -5.49912 -3.40506 1.000 26.84681 C ? C ? 183 1 ATOM 3822 O . GLY B 183 ? 14.64257 -4.42031 -2.83731 1.000 27.53041 O ? C ? 183 1 ATOM 3823 N . PRO B 184 ? 15.29006 -6.52799 -3.25723 1.000 31.34961 N ? C ? 184 1 ATOM 3824 CA . PRO B 184 ? 16.37404 -6.46667 -2.26844 1.000 27.93879 C ? C ? 184 1 ATOM 3825 C . PRO B 184 ? 17.68157 -5.92653 -2.82397 1.000 27.09121 C ? C ? 184 1 ATOM 3826 O . PRO B 184 ? 18.74546 -6.17780 -2.25049 1.000 34.40466 O ? C ? 184 1 ATOM 3827 CB . PRO B 184 ? 16.52834 -7.93330 -1.85832 1.000 26.06842 C ? C ? 184 1 ATOM 3828 CG . PRO B 184 ? 16.26005 -8.66714 -3.13370 1.000 29.55330 C ? C ? 184 1 ATOM 3829 CD . PRO B 184 ? 15.18933 -7.86542 -3.86763 1.000 25.39361 C ? C ? 184 1 ATOM 3830 N . PHE B 185 ? 17.62483 -5.18590 -3.92433 1.000 25.35838 N ? C ? 185 1 ATOM 3831 CA . PHE B 185 ? 18.82626 -4.82979 -4.66187 1.000 28.14431 C ? C ? 185 1 ATOM 3832 C . PHE B 185 ? 19.46655 -3.56699 -4.10339 1.000 24.35102 C ? C ? 185 1 ATOM 3833 O . PHE B 185 ? 18.78672 -2.68286 -3.57708 1.000 21.51287 O ? C ? 185 1 ATOM 3834 CB . PHE B 185 ? 18.49691 -4.64885 -6.14144 1.000 21.82824 C ? C ? 185 1 ATOM 3835 CG . PHE B 185 ? 17.70709 -5.77949 -6.70617 1.000 25.85368 C ? C ? 185 1 ATOM 3836 CD1 . PHE B 185 ? 18.28974 -7.02052 -6.87426 1.000 24.78683 C ? C ? 185 1 ATOM 3837 CD2 . PHE B 185 ? 16.37519 -5.61672 -7.03453 1.000 24.30358 C ? C ? 185 1 ATOM 3838 CE1 . PHE B 185 ? 17.56627 -8.07508 -7.37230 1.000 28.93732 C ? C ? 185 1 ATOM 3839 CE2 . PHE B 185 ? 15.64487 -6.66910 -7.54209 1.000 28.90603 C ? C ? 185 1 ATOM 3840 CZ . PHE B 185 ? 16.24194 -7.90052 -7.71230 1.000 27.87408 C ? C ? 185 1 ATOM 3841 N . VAL B 186 ? 20.79464 -3.50103 -4.21894 1.000 22.09573 N ? C ? 186 1 ATOM 3842 CA . VAL B 186 ? 21.58428 -2.34983 -3.80197 1.000 22.13654 C ? C ? 186 1 ATOM 3843 C . VAL B 186 ? 22.44712 -1.90690 -4.97511 1.000 27.30790 C ? C ? 186 1 ATOM 3844 O . VAL B 186 ? 22.81305 -2.71259 -5.83749 1.000 23.83550 O ? C ? 186 1 ATOM 3845 CB . VAL B 186 ? 22.46072 -2.66593 -2.56774 1.000 26.03053 C ? C ? 186 1 ATOM 3846 CG1 . VAL B 186 ? 21.59057 -3.06452 -1.38630 1.000 26.79136 C ? C ? 186 1 ATOM 3847 CG2 . VAL B 186 ? 23.46672 -3.76585 -2.88704 1.000 23.90327 C ? C ? 186 1 ATOM 3848 N . ASP B 187 ? 22.77819 -0.61293 -5.00544 1.000 22.88663 N ? C ? 187 1 ATOM 3849 CA . ASP B 187 ? 23.57528 -0.05767 -6.10181 1.000 22.64727 C ? C ? 187 1 ATOM 3850 C . ASP B 187 ? 25.05809 -0.24941 -5.78626 1.000 28.52770 C ? C ? 187 1 ATOM 3851 O . ASP B 187 ? 25.78621 0.67661 -5.41997 1.000 27.51189 O ? C ? 187 1 ATOM 3852 CB . ASP B 187 ? 23.22199 1.40538 -6.36141 1.000 26.83386 C ? C ? 187 1 ATOM 3853 CG . ASP B 187 ? 23.08441 2.22588 -5.08916 1.000 30.57662 C ? C ? 187 1 ATOM 3854 OD1 . ASP B 187 ? 23.12900 1.64958 -3.98132 1.000 33.58259 O ? C ? 187 1 ATOM 3855 OD2 . ASP B 187 ? 22.92321 3.45927 -5.20778 1.000 28.16068 O ? C ? 187 1 ATOM 3856 N . ARG B 188 ? 25.50439 -1.49382 -5.95081 1.000 28.90478 N ? C ? 188 1 ATOM 3857 CA . ARG B 188 ? 26.88690 -1.90366 -5.74849 1.000 25.43844 C ? C ? 188 1 ATOM 3858 C . ARG B 188 ? 27.19049 -3.00114 -6.75890 1.000 38.45877 C ? C ? 188 1 ATOM 3859 O . ARG B 188 ? 26.32516 -3.82974 -7.05251 1.000 35.63652 O ? C ? 188 1 ATOM 3860 CB . ARG B 188 ? 27.11844 -2.40522 -4.31681 1.000 32.00086 C ? C ? 188 1 ATOM 3861 CG . ARG B 188 ? 28.46078 -3.07899 -4.10023 1.000 45.28408 C ? C ? 188 1 ATOM 3862 CD . ARG B 188 ? 28.71830 -3.42435 -2.63869 1.000 41.55732 C ? C ? 188 1 ATOM 3863 NE . ARG B 188 ? 28.34127 -4.79745 -2.32476 1.000 48.46768 N ? C ? 188 1 ATOM 3864 CZ . ARG B 188 ? 27.35627 -5.13978 -1.50513 1.000 57.12231 C ? C ? 188 1 ATOM 3865 NH1 . ARG B 188 ? 26.64705 -4.22791 -0.85758 1.000 48.25524 N ? C ? 188 1 ATOM 3866 NH2 . ARG B 188 ? 27.07936 -6.43031 -1.32669 1.000 58.02546 N ? C ? 188 1 ATOM 3867 N . GLN B 189 ? 28.40926 -3.00015 -7.29845 1.000 33.21578 N ? C ? 189 1 ATOM 3868 CA . GLN B 189 ? 28.75325 -3.95769 -8.34344 1.000 34.40059 C ? C ? 189 1 ATOM 3869 C . GLN B 189 ? 28.99471 -5.35118 -7.77356 1.000 37.74279 C ? C ? 189 1 ATOM 3870 O . GLN B 189 ? 30.13675 -5.72592 -7.48520 1.000 47.78776 O ? C ? 189 1 ATOM 3871 CB . GLN B 189 ? 29.98264 -3.48665 -9.11942 1.000 33.71816 C ? C ? 189 1 ATOM 3872 CG . GLN B 189 ? 30.37720 -4.40614 -10.26400 1.000 44.07909 C ? C ? 189 1 ATOM 3873 CD . GLN B 189 ? 31.59208 -3.90758 -11.01298 1.000 53.76123 C ? C ? 189 1 ATOM 3874 OE1 . GLN B 189 ? 31.73703 -2.70782 -11.24915 1.000 54.00695 O ? C ? 189 1 ATOM 3875 NE2 . GLN B 189 ? 32.48061 -4.82562 -11.38325 1.000 44.30735 N ? C ? 189 1 ATOM 3876 N . THR B 190 ? 27.92068 -6.11570 -7.58745 1.000 38.64380 N ? C ? 190 1 ATOM 3877 CA . THR B 190 ? 28.00347 -7.53159 -7.25545 1.000 40.64649 C ? C ? 190 1 ATOM 3878 C . THR B 190 ? 26.91026 -8.26447 -8.01818 1.000 39.53229 C ? C ? 190 1 ATOM 3879 O . THR B 190 ? 25.95442 -7.65761 -8.50986 1.000 39.84845 O ? C ? 190 1 ATOM 3880 CB . THR B 190 ? 27.84202 -7.81099 -5.74911 1.000 39.65552 C ? C ? 190 1 ATOM 3881 OG1 . THR B 190 ? 26.55469 -7.35891 -5.31189 1.000 42.89416 O ? C ? 190 1 ATOM 3882 CG2 . THR B 190 ? 28.92619 -7.12142 -4.93079 1.000 45.43112 C ? C ? 190 1 ATOM 3883 N . ALA B 191 ? 27.06295 -9.58285 -8.11358 1.000 40.83455 N ? C ? 191 1 ATOM 3884 CA . ALA B 191 ? 26.03283 -10.43955 -8.69218 1.000 39.46829 C ? C ? 191 1 ATOM 3885 C . ALA B 191 ? 24.94731 -10.65275 -7.64631 1.000 38.17688 C ? C ? 191 1 ATOM 3886 O . ALA B 191 ? 25.17283 -11.32477 -6.63496 1.000 42.51860 O ? C ? 191 1 ATOM 3887 CB . ALA B 191 ? 26.62912 -11.76785 -9.14816 1.000 36.30336 C ? C ? 191 1 ATOM 3888 N . GLN B 192 ? 23.77209 -10.08090 -7.88035 1.000 31.41994 N ? C ? 192 1 ATOM 3889 CA . GLN B 192 ? 22.69825 -10.07160 -6.89826 1.000 27.11259 C ? C ? 192 1 ATOM 3890 C . GLN B 192 ? 21.56423 -10.96943 -7.36903 1.000 27.29120 C ? C ? 192 1 ATOM 3891 O . GLN B 192 ? 21.15562 -10.90341 -8.53249 1.000 26.45338 O ? C ? 192 1 ATOM 3892 CB . GLN B 192 ? 22.19907 -8.64498 -6.66066 1.000 25.71462 C ? C ? 192 1 ATOM 3893 CG . GLN B 192 ? 23.31031 -7.69074 -6.24087 1.000 34.29557 C ? C ? 192 1 ATOM 3894 CD . GLN B 192 ? 22.84984 -6.25360 -6.11677 1.000 29.85509 C ? C ? 192 1 ATOM 3895 OE1 . GLN B 192 ? 21.83534 -5.96597 -5.48241 1.000 31.91777 O ? C ? 192 1 ATOM 3896 NE2 . GLN B 192 ? 23.59683 -5.34137 -6.72421 1.000 28.61078 N ? C ? 192 1 ATOM 3897 N . ALA B 193 ? 21.06754 -11.80783 -6.46484 1.000 27.85960 N ? C ? 193 1 ATOM 3898 CA . ALA B 193 ? 19.98776 -12.72761 -6.78455 1.000 29.53116 C ? C ? 193 1 ATOM 3899 C . ALA B 193 ? 18.63744 -12.02949 -6.67815 1.000 34.95050 C ? C ? 193 1 ATOM 3900 O . ALA B 193 ? 18.44102 -11.12895 -5.85615 1.000 30.01945 O ? C ? 193 1 ATOM 3901 CB . ALA B 193 ? 20.02325 -13.93861 -5.85266 1.000 27.38059 C ? C ? 193 1 ATOM 3902 N . ALA B 194 ? 17.69918 -12.45582 -7.52428 1.000 27.57996 N ? C ? 194 1 ATOM 3903 CA . ALA B 194 ? 16.35765 -11.89706 -7.52159 1.000 27.15124 C ? C ? 194 1 ATOM 3904 C . ALA B 194 ? 15.31927 -12.81438 -6.89288 1.000 32.67942 C ? C ? 194 1 ATOM 3905 O . ALA B 194 ? 14.20093 -12.36272 -6.62716 1.000 33.61374 O ? C ? 194 1 ATOM 3906 CB . ALA B 194 ? 15.92525 -11.54660 -8.95148 1.000 32.95973 C ? C ? 194 1 ATOM 3907 N . GLY B 195 ? 15.65241 -14.07441 -6.63857 1.000 26.91940 N ? C ? 195 1 ATOM 3908 CA . GLY B 195 ? 14.71369 -15.00100 -6.04577 1.000 32.36007 C ? C ? 195 1 ATOM 3909 C . GLY B 195 ? 13.77757 -15.61574 -7.06928 1.000 32.00640 C ? C ? 195 1 ATOM 3910 O . GLY B 195 ? 13.76395 -15.26374 -8.25051 1.000 29.60395 O ? C ? 195 1 ATOM 3911 N . THR B 196 ? 12.97270 -16.56353 -6.58868 1.000 37.81337 N ? C ? 196 1 ATOM 3912 CA . THR B 196 ? 12.04248 -17.28114 -7.45330 1.000 35.03854 C ? C ? 196 1 ATOM 3913 C . THR B 196 ? 11.08864 -16.31190 -8.14181 1.000 32.97370 C ? C ? 196 1 ATOM 3914 O . THR B 196 ? 10.50815 -15.43062 -7.50155 1.000 27.54493 O ? C ? 196 1 ATOM 3915 CB . THR B 196 ? 11.25389 -18.30913 -6.64057 1.000 34.18355 C ? C ? 196 1 ATOM 3916 OG1 . THR B 196 ? 12.16349 -19.11790 -5.88492 1.000 36.64495 O ? C ? 196 1 ATOM 3917 CG2 . THR B 196 ? 10.43261 -19.20426 -7.55995 1.000 31.48274 C ? C ? 196 1 ATOM 3918 N . ASP B 197 ? 10.93757 -16.47047 -9.45817 1.000 36.48906 N ? C ? 197 1 ATOM 3919 CA . ASP B 197 ? 10.07131 -15.59940 -10.24970 1.000 36.54233 C ? C ? 197 1 ATOM 3920 C . ASP B 197 ? 8.76133 -16.33278 -10.51378 1.000 33.66909 C ? C ? 197 1 ATOM 3921 O . ASP B 197 ? 8.57384 -16.98902 -11.53755 1.000 40.78003 O ? C ? 197 1 ATOM 3922 CB . ASP B 197 ? 10.75143 -15.18041 -11.54854 1.000 38.89374 C ? C ? 197 1 ATOM 3923 CG . ASP B 197 ? 10.10226 -13.95814 -12.16765 1.000 45.81825 C ? C ? 197 1 ATOM 3924 OD1 . ASP B 197 ? 9.19902 -13.37912 -11.51697 1.000 34.50002 O ? C ? 197 1 ATOM 3925 OD2 . ASP B 197 ? 10.49548 -13.57585 -13.29190 1.000 51.14949 O ? C ? 197 1 ATOM 3926 N . THR B 198 ? 7.83891 -16.20344 -9.56739 1.000 37.64180 N ? C ? 198 1 ATOM 3927 CA . THR B 198 ? 6.53396 -16.82705 -9.70579 1.000 34.77756 C ? C ? 198 1 ATOM 3928 C . THR B 198 ? 5.65537 -15.99588 -10.63386 1.000 34.58518 C ? C ? 198 1 ATOM 3929 O . THR B 198 ? 5.73518 -14.76366 -10.65447 1.000 35.44338 O ? C ? 198 1 ATOM 3930 CB . THR B 198 ? 5.87585 -16.99099 -8.33548 1.000 40.08657 C ? C ? 198 1 ATOM 3931 OG1 . THR B 198 ? 5.38011 -15.72728 -7.87636 1.000 51.82886 O ? C ? 198 1 ATOM 3932 CG2 . THR B 198 ? 6.89613 -17.51072 -7.33057 1.000 37.55262 C ? C ? 198 1 ATOM 3933 N . THR B 199 ? 4.82873 -16.67823 -11.41962 1.000 33.91104 N ? C ? 199 1 ATOM 3934 CA . THR B 199 ? 4.00555 -16.00151 -12.40993 1.000 35.39340 C ? C ? 199 1 ATOM 3935 C . THR B 199 ? 2.82901 -15.30139 -11.73924 1.000 30.63747 C ? C ? 199 1 ATOM 3936 O . THR B 199 ? 2.26399 -15.79984 -10.75944 1.000 28.29248 O ? C ? 199 1 ATOM 3937 CB . THR B 199 ? 3.50623 -16.99932 -13.45850 1.000 37.52350 C ? C ? 199 1 ATOM 3938 OG1 . THR B 199 ? 4.60929 -17.78484 -13.92663 1.000 32.98852 O ? C ? 199 1 ATOM 3939 CG2 . THR B 199 ? 2.89322 -16.27391 -14.63996 1.000 27.83295 C ? C ? 199 1 ATOM 3940 N . ILE B 200 ? 2.48280 -14.12552 -12.25776 1.000 24.36890 N ? C ? 200 1 ATOM 3941 CA . ILE B 200 ? 1.30166 -13.38699 -11.81609 1.000 26.27533 C ? C ? 200 1 ATOM 3942 C . ILE B 200 ? 0.08733 -14.08065 -12.42954 1.000 22.24370 C ? C ? 200 1 ATOM 3943 O . ILE B 200 ? -0.26003 -13.84365 -13.58812 1.000 23.66876 O ? C ? 200 1 ATOM 3944 CB . ILE B 200 ? 1.36903 -11.91132 -12.21211 1.000 27.95654 C ? C ? 200 1 ATOM 3945 CG1 . ILE B 200 ? 2.72956 -11.32489 -11.83755 1.000 27.98581 C ? C ? 200 1 ATOM 3946 CG2 . ILE B 200 ? 0.25922 -11.12359 -11.53480 1.000 26.26021 C ? C ? 200 1 ATOM 3947 CD1 . ILE B 200 ? 3.01978 -11.37757 -10.35843 1.000 32.15887 C ? C ? 200 1 ATOM 3948 N . THR B 201 ? -0.55570 -14.94873 -11.64796 1.000 23.25659 N ? C ? 201 1 ATOM 3949 CA . THR B 201 ? -1.65579 -15.75439 -12.16910 1.000 23.71270 C ? C ? 201 1 ATOM 3950 C . THR B 201 ? -2.79117 -14.88624 -12.69761 1.000 24.77745 C ? C ? 201 1 ATOM 3951 O . THR B 201 ? -3.36927 -15.18481 -13.75098 1.000 23.43493 O ? C ? 201 1 ATOM 3952 CB . THR B 201 ? -2.16786 -16.69356 -11.08080 1.000 25.07914 C ? C ? 201 1 ATOM 3953 OG1 . THR B 201 ? -1.05688 -17.38266 -10.49545 1.000 26.66145 O ? C ? 201 1 ATOM 3954 CG2 . THR B 201 ? -3.14462 -17.70125 -11.66687 1.000 25.55190 C ? C ? 201 1 ATOM 3955 N . VAL B 202 ? -3.12561 -13.80602 -11.98411 1.000 23.87812 N ? C ? 202 1 ATOM 3956 CA . VAL B 202 ? -4.25195 -12.97317 -12.39830 1.000 24.09681 C ? C ? 202 1 ATOM 3957 C . VAL B 202 ? -3.97816 -12.32114 -13.75030 1.000 24.66472 C ? C ? 202 1 ATOM 3958 O . VAL B 202 ? -4.90476 -12.09757 -14.54079 1.000 26.30924 O ? C ? 202 1 ATOM 3959 CB . VAL B 202 ? -4.58000 -11.93165 -11.30651 1.000 24.76068 C ? C ? 202 1 ATOM 3960 CG1 . VAL B 202 ? -3.43494 -10.94088 -11.13200 1.000 23.95447 C ? C ? 202 1 ATOM 3961 CG2 . VAL B 202 ? -5.88569 -11.21641 -11.62819 1.000 27.80113 C ? C ? 202 1 ATOM 3962 N . ASN B 203 ? -2.70805 -12.03891 -14.05314 1.000 22.17422 N ? C ? 203 1 ATOM 3963 CA . ASN B 203 ? -2.35699 -11.46832 -15.34913 1.000 21.37745 C ? C ? 203 1 ATOM 3964 C . ASN B 203 ? -2.53823 -12.48131 -16.47291 1.000 24.00398 C ? C ? 203 1 ATOM 3965 O . ASN B 203 ? -2.98165 -12.12495 -17.57123 1.000 22.23653 O ? C ? 203 1 ATOM 3966 CB . ASN B 203 ? -0.91590 -10.95605 -15.32420 1.000 20.64726 C ? C ? 203 1 ATOM 3967 CG . ASN B 203 ? -0.78370 -9.61207 -14.63692 1.000 27.94300 C ? C ? 203 1 ATOM 3968 OD1 . ASN B 203 ? -1.74010 -9.10234 -14.05387 1.000 22.01663 O ? C ? 203 1 ATOM 3969 ND2 . ASN B 203 ? 0.40996 -9.02839 -14.70347 1.000 23.14977 N ? C ? 203 1 ATOM 3970 N . VAL B 204 ? -2.18180 -13.74318 -16.22875 1.000 21.40614 N ? C ? 204 1 ATOM 3971 CA . VAL B 204 ? -2.35200 -14.76217 -17.25918 1.000 23.13214 C ? C ? 204 1 ATOM 3972 C . VAL B 204 ? -3.82970 -14.97911 -17.55007 1.000 22.49931 C ? C ? 204 1 ATOM 3973 O . VAL B 204 ? -4.22967 -15.12757 -18.71000 1.000 24.95251 O ? C ? 204 1 ATOM 3974 CB . VAL B 204 ? -1.65722 -16.07248 -16.84637 1.000 22.23318 C ? C ? 204 1 ATOM 3975 CG1 . VAL B 204 ? -1.91616 -17.16545 -17.87874 1.000 21.93157 C ? C ? 204 1 ATOM 3976 CG2 . VAL B 204 ? -0.16368 -15.84657 -16.67156 1.000 22.87753 C ? C ? 204 1 ATOM 3977 N . LEU B 205 ? -4.66583 -14.98032 -16.50740 1.000 22.77779 N ? C ? 205 1 ATOM 3978 CA . LEU B 205 ? -6.09801 -15.17605 -16.71092 1.000 23.54121 C ? C ? 205 1 ATOM 3979 C . LEU B 205 ? -6.70464 -14.02712 -17.50741 1.000 28.06045 C ? C ? 205 1 ATOM 3980 O . LEU B 205 ? -7.54461 -14.25094 -18.38737 1.000 26.69457 O ? C ? 205 1 ATOM 3981 CB . LEU B 205 ? -6.80637 -15.33685 -15.36562 1.000 24.63546 C ? C ? 205 1 ATOM 3982 CG . LEU B 205 ? -6.50710 -16.63080 -14.60017 1.000 26.56217 C ? C ? 205 1 ATOM 3983 CD1 . LEU B 205 ? -7.03000 -16.55061 -13.17779 1.000 26.36425 C ? C ? 205 1 ATOM 3984 CD2 . LEU B 205 ? -7.09343 -17.84525 -15.31406 1.000 25.56983 C ? C ? 205 1 ATOM 3985 N . ALA B 206 ? -6.28546 -12.78960 -17.22199 1.000 24.22858 N ? C ? 206 1 ATOM 3986 CA . ALA B 206 ? -6.79313 -11.64897 -17.97992 1.000 23.10418 C ? C ? 206 1 ATOM 3987 C . ALA B 206 ? -6.38831 -11.74585 -19.44216 1.000 24.61362 C ? C ? 206 1 ATOM 3988 O . ALA B 206 ? -7.16964 -11.40413 -20.33809 1.000 27.11979 O ? C ? 206 1 ATOM 3989 CB . ALA B 206 ? -6.28815 -10.34115 -17.37164 1.000 22.95487 C ? C ? 206 1 ATOM 3990 N . TRP B 207 ? -5.16736 -12.21494 -19.70138 1.000 24.21605 N ? C ? 207 1 ATOM 3991 CA . TRP B 207 ? -4.72464 -12.40741 -21.07362 1.000 27.39252 C ? C ? 207 1 ATOM 3992 C . TRP B 207 ? -5.51411 -13.52115 -21.75597 1.000 21.63531 C ? C ? 207 1 ATOM 3993 O . TRP B 207 ? -5.82465 -13.41756 -22.94851 1.000 22.50928 O ? C ? 207 1 ATOM 3994 CB . TRP B 207 ? -3.21982 -12.68135 -21.07758 1.000 24.34861 C ? C ? 207 1 ATOM 3995 CG . TRP B 207 ? -2.65276 -13.09908 -22.39030 1.000 24.84347 C ? C ? 207 1 ATOM 3996 CD1 . TRP B 207 ? -2.33397 -12.29723 -23.44986 1.000 24.53219 C ? C ? 207 1 ATOM 3997 CD2 . TRP B 207 ? -2.30676 -14.42949 -22.77343 1.000 24.25865 C ? C ? 207 1 ATOM 3998 NE1 . TRP B 207 ? -1.82032 -13.05555 -24.47637 1.000 26.26513 N ? C ? 207 1 ATOM 3999 CE2 . TRP B 207 ? -1.79503 -14.36892 -24.08392 1.000 26.62972 C ? C ? 207 1 ATOM 4000 CE3 . TRP B 207 ? -2.38529 -15.67031 -22.13467 1.000 22.31803 C ? C ? 207 1 ATOM 4001 CZ2 . TRP B 207 ? -1.36457 -15.50180 -24.76626 1.000 30.45398 C ? C ? 207 1 ATOM 4002 CZ3 . TRP B 207 ? -1.95979 -16.79189 -22.81238 1.000 22.14742 C ? C ? 207 1 ATOM 4003 CH2 . TRP B 207 ? -1.45301 -16.70124 -24.11408 1.000 25.75184 C ? C ? 207 1 ATOM 4004 N . LEU B 208 ? -5.87906 -14.57286 -21.01486 1.000 27.40922 N ? C ? 208 1 ATOM 4005 CA . LEU B 208 ? -6.75581 -15.59846 -21.57697 1.000 25.28010 C ? C ? 208 1 ATOM 4006 C . LEU B 208 ? -8.14327 -15.04731 -21.88822 1.000 25.97944 C ? C ? 208 1 ATOM 4007 O . LEU B 208 ? -8.78510 -15.49321 -22.84659 1.000 23.49493 O ? C ? 208 1 ATOM 4008 CB . LEU B 208 ? -6.86051 -16.79072 -20.62530 1.000 23.03343 C ? C ? 208 1 ATOM 4009 CG . LEU B 208 ? -5.57869 -17.61087 -20.46020 1.000 25.28452 C ? C ? 208 1 ATOM 4010 CD1 . LEU B 208 ? -5.75463 -18.67684 -19.39401 1.000 31.63831 C ? C ? 208 1 ATOM 4011 CD2 . LEU B 208 ? -5.16174 -18.23948 -21.78482 1.000 25.32132 C ? C ? 208 1 ATOM 4012 N . TYR B 209 ? -8.62714 -14.09087 -21.09351 1.000 25.68894 N ? C ? 209 1 ATOM 4013 CA . TYR B 209 ? -9.88257 -13.43181 -21.43424 1.000 24.40439 C ? C ? 209 1 ATOM 4014 C . TYR B 209 ? -9.71996 -12.55950 -22.67031 1.000 24.10606 C ? C ? 209 1 ATOM 4015 O . TYR B 209 ? -10.63828 -12.46271 -23.49090 1.000 25.78597 O ? C ? 209 1 ATOM 4016 CB . TYR B 209 ? -10.38646 -12.60397 -20.25392 1.000 25.09877 C ? C ? 209 1 ATOM 4017 CG . TYR B 209 ? -11.15176 -13.40577 -19.22826 1.000 29.57463 C ? C ? 209 1 ATOM 4018 CD1 . TYR B 209 ? -12.40414 -13.93171 -19.52553 1.000 30.70282 C ? C ? 209 1 ATOM 4019 CD2 . TYR B 209 ? -10.63028 -13.62885 -17.95941 1.000 26.07765 C ? C ? 209 1 ATOM 4020 CE1 . TYR B 209 ? -13.11116 -14.66572 -18.59261 1.000 31.24228 C ? C ? 209 1 ATOM 4021 CE2 . TYR B 209 ? -11.33314 -14.36182 -17.01808 1.000 35.75658 C ? C ? 209 1 ATOM 4022 CZ . TYR B 209 ? -12.57310 -14.87773 -17.33959 1.000 33.23098 C ? C ? 209 1 ATOM 4023 OH . TYR B 209 ? -13.27574 -15.60864 -16.40471 1.000 38.57056 O ? C ? 209 1 ATOM 4024 N . ALA B 210 ? -8.55442 -11.92210 -22.81863 1.000 23.31639 N ? C ? 210 1 ATOM 4025 CA . ALA B 210 ? -8.27229 -11.14494 -24.02036 1.000 23.74512 C ? C ? 210 1 ATOM 4026 C . ALA B 210 ? -8.31533 -12.01933 -25.26495 1.000 26.96080 C ? C ? 210 1 ATOM 4027 O . ALA B 210 ? -8.77672 -11.57961 -26.32365 1.000 27.54500 O ? C ? 210 1 ATOM 4028 CB . ALA B 210 ? -6.91070 -10.46036 -23.89757 1.000 22.37011 C ? C ? 210 1 ATOM 4029 N . ALA B 211 ? -7.83024 -13.25817 -25.16001 1.000 23.19906 N ? C ? 211 1 ATOM 4030 CA . ALA B 211 ? -7.89299 -14.17445 -26.29274 1.000 26.63832 C ? C ? 211 1 ATOM 4031 C . ALA B 211 ? -9.33249 -14.51588 -26.64828 1.000 29.33531 C ? C ? 211 1 ATOM 4032 O . ALA B 211 ? -9.68566 -14.57791 -27.83194 1.000 27.08327 O ? C ? 211 1 ATOM 4033 CB . ALA B 211 ? -7.10557 -15.44424 -25.98385 1.000 27.98662 C ? C ? 211 1 ATOM 4034 N . VAL B 212 ? -10.17947 -14.73276 -25.63813 1.000 27.61847 N ? C ? 212 1 ATOM 4035 CA . VAL B 212 ? -11.58053 -15.05577 -25.90165 1.000 31.22887 C ? C ? 212 1 ATOM 4036 C . VAL B 212 ? -12.27629 -13.89127 -26.59429 1.000 28.76039 C ? C ? 212 1 ATOM 4037 O . VAL B 212 ? -13.07272 -14.08696 -27.52109 1.000 32.09649 O ? C ? 212 1 ATOM 4038 CB . VAL B 212 ? -12.29598 -15.45155 -24.59586 1.000 27.24474 C ? C ? 212 1 ATOM 4039 CG1 . VAL B 212 ? -13.79065 -15.59017 -24.82516 1.000 27.61012 C ? C ? 212 1 ATOM 4040 CG2 . VAL B 212 ? -11.71618 -16.75319 -24.05018 1.000 27.71282 C ? C ? 212 1 ATOM 4041 N . ILE B 213 ? -11.97479 -12.66144 -26.17109 1.000 27.77917 N ? C ? 213 1 ATOM 4042 CA . ILE B 213 ? -12.59107 -11.48626 -26.78494 1.000 30.58638 C ? C ? 213 1 ATOM 4043 C . ILE B 213 ? -12.21537 -11.37872 -28.25840 1.000 34.01457 C ? C ? 213 1 ATOM 4044 O . ILE B 213 ? -13.01939 -10.92266 -29.08230 1.000 37.87176 O ? C ? 213 1 ATOM 4045 CB . ILE B 213 ? -12.19690 -10.21837 -25.99944 1.000 35.65648 C ? C ? 213 1 ATOM 4046 CG1 . ILE B 213 ? -12.70427 -10.31175 -24.55882 1.000 26.72067 C ? C ? 213 1 ATOM 4047 CG2 . ILE B 213 ? -12.72619 -8.96441 -26.68277 1.000 36.21873 C ? C ? 213 1 ATOM 4048 CD1 . ILE B 213 ? -12.32171 -9.12806 -23.69674 1.000 26.75771 C ? C ? 213 1 ATOM 4049 N . ASN B 214 ? -11.00925 -11.81381 -28.61958 1.000 28.10562 N ? C ? 214 1 ATOM 4050 CA . ASN B 214 ? -10.52660 -11.76239 -29.99229 1.000 25.92454 C ? C ? 214 1 ATOM 4051 C . ASN B 214 ? -10.75783 -13.05889 -30.76118 1.000 30.27777 C ? C ? 214 1 ATOM 4052 O . ASN B 214 ? -10.15269 -13.25096 -31.82137 1.000 38.00346 O ? C ? 214 1 ATOM 4053 CB . ASN B 214 ? -9.04062 -11.40518 -30.00822 1.000 28.83670 C ? C ? 214 1 ATOM 4054 CG . ASN B 214 ? -8.79506 -9.95175 -29.66615 1.000 34.78182 C ? C ? 214 1 ATOM 4055 OD1 . ASN B 214 ? -8.69947 -9.10404 -30.55198 1.000 42.75483 O ? C ? 214 1 ATOM 4056 ND2 . ASN B 214 ? -8.70579 -9.65234 -28.37470 1.000 37.98064 N ? C ? 214 1 ATOM 4057 N . GLY B 215 ? -11.60674 -13.94953 -30.25520 1.000 30.71562 N ? C ? 215 1 ATOM 4058 CA . GLY B 215 ? -11.99652 -15.13317 -30.99860 1.000 35.41373 C ? C ? 215 1 ATOM 4059 C . GLY B 215 ? -11.08361 -16.33439 -30.88065 1.000 33.01689 C ? C ? 215 1 ATOM 4060 O . GLY B 215 ? -11.15940 -17.23146 -31.72710 1.000 47.70655 O ? C ? 215 1 ATOM 4061 N . ASP B 216 ? -10.22572 -16.38963 -29.86647 1.000 32.95988 N ? C ? 216 1 ATOM 4062 CA . ASP B 216 ? -9.35991 -17.54214 -29.61966 1.000 34.64491 C ? C ? 216 1 ATOM 4063 C . ASP B 216 ? -9.95905 -18.31788 -28.44955 1.000 36.21974 C ? C ? 216 1 ATOM 4064 O . ASP B 216 ? -9.80326 -17.92380 -27.29028 1.000 39.20394 O ? C ? 216 1 ATOM 4065 CB . ASP B 216 ? -7.92931 -17.09969 -29.32662 1.000 39.51325 C ? C ? 216 1 ATOM 4066 CG . ASP B 216 ? -6.89944 -17.91410 -30.08498 1.000 44.33505 C ? C ? 216 1 ATOM 4067 OD1 . ASP B 216 ? -7.20657 -19.06524 -30.46355 1.000 48.16658 O ? C ? 216 1 ATOM 4068 OD2 . ASP B 216 ? -5.77985 -17.40197 -30.29866 1.000 42.19452 O ? C ? 216 1 ATOM 4069 N . ARG B 217 ? -10.64252 -19.42313 -28.75461 1.000 28.84100 N ? C ? 217 1 ATOM 4070 CA . ARG B 217 ? -11.37547 -20.18171 -27.75078 1.000 38.64749 C ? C ? 217 1 ATOM 4071 C . ARG B 217 ? -10.92997 -21.63011 -27.60245 1.000 34.85054 C ? C ? 217 1 ATOM 4072 O . ARG B 217 ? -11.50701 -22.34683 -26.77469 1.000 29.27617 O ? C ? 217 1 ATOM 4073 CB . ARG B 217 ? -12.87625 -20.16707 -28.07003 1.000 34.32558 C ? C ? 217 1 ATOM 4074 CG . ARG B 217 ? -13.58147 -18.88630 -27.72399 1.000 35.30818 C ? C ? 217 1 ATOM 4075 CD . ARG B 217 ? -15.06220 -19.01249 -27.99228 1.000 31.95659 C ? C ? 217 1 ATOM 4076 NE . ARG B 217 ? -15.81402 -18.01485 -27.24436 1.000 36.78448 N ? C ? 217 1 ATOM 4077 CZ . ARG B 217 ? -16.53304 -18.28060 -26.16376 1.000 41.46087 C ? C ? 217 1 ATOM 4078 NH1 . ARG B 217 ? -16.65173 -19.51470 -25.69940 1.000 41.43240 N ? C ? 217 1 ATOM 4079 NH2 . ARG B 217 ? -17.16413 -17.28669 -25.54427 1.000 45.47263 N ? C ? 217 1 ATOM 4080 N . TRP B 218 ? -9.92667 -22.08167 -28.36574 1.000 30.23253 N ? C ? 218 1 ATOM 4081 CA . TRP B 218 ? -9.60569 -23.50726 -28.42462 1.000 33.62064 C ? C ? 218 1 ATOM 4082 C . TRP B 218 ? -9.22723 -24.08994 -27.06818 1.000 32.04055 C ? C ? 218 1 ATOM 4083 O . TRP B 218 ? -9.37462 -25.30071 -26.86344 1.000 38.62109 O ? C ? 218 1 ATOM 4084 CB . TRP B 218 ? -8.46748 -23.76516 -29.42160 1.000 35.16290 C ? C ? 218 1 ATOM 4085 CG . TRP B 218 ? -7.11247 -23.26224 -28.98342 1.000 27.19460 C ? C ? 218 1 ATOM 4086 CD1 . TRP B 218 ? -6.54230 -22.06926 -29.30981 1.000 31.78571 C ? C ? 218 1 ATOM 4087 CD2 . TRP B 218 ? -6.15547 -23.95088 -28.16166 1.000 29.38425 C ? C ? 218 1 ATOM 4088 NE1 . TRP B 218 ? -5.29736 -21.96509 -28.73976 1.000 33.84725 N ? C ? 218 1 ATOM 4089 CE2 . TRP B 218 ? -5.03591 -23.10546 -28.02842 1.000 34.02135 C ? C ? 218 1 ATOM 4090 CE3 . TRP B 218 ? -6.13979 -25.19591 -27.52220 1.000 33.84326 C ? C ? 218 1 ATOM 4091 CZ2 . TRP B 218 ? -3.91229 -23.46262 -27.28272 1.000 33.23354 C ? C ? 218 1 ATOM 4092 CZ3 . TRP B 218 ? -5.02283 -25.55056 -26.78212 1.000 30.38723 C ? C ? 218 1 ATOM 4093 CH2 . TRP B 218 ? -3.92506 -24.68643 -26.66889 1.000 38.34203 C ? C ? 218 1 ATOM 4094 N . PHE B 219 ? -8.73580 -23.26988 -26.14601 1.000 31.98893 N ? C ? 219 1 ATOM 4095 CA . PHE B 219 ? -8.30309 -23.74715 -24.83956 1.000 34.86180 C ? C ? 219 1 ATOM 4096 C . PHE B 219 ? -9.43790 -23.85962 -23.83157 1.000 31.82813 C ? C ? 219 1 ATOM 4097 O . PHE B 219 ? -9.20190 -24.31887 -22.70804 1.000 32.00169 O ? C ? 219 1 ATOM 4098 CB . PHE B 219 ? -7.21980 -22.82372 -24.27794 1.000 27.91576 C ? C ? 219 1 ATOM 4099 CG . PHE B 219 ? -7.58098 -21.36696 -24.33536 1.000 29.35398 C ? C ? 219 1 ATOM 4100 CD1 . PHE B 219 ? -7.27168 -20.61201 -25.45494 1.000 27.21861 C ? C ? 219 1 ATOM 4101 CD2 . PHE B 219 ? -8.23015 -20.75270 -23.27555 1.000 28.47651 C ? C ? 219 1 ATOM 4102 CE1 . PHE B 219 ? -7.59747 -19.27470 -25.51876 1.000 26.81253 C ? C ? 219 1 ATOM 4103 CE2 . PHE B 219 ? -8.55858 -19.41201 -23.33399 1.000 26.89382 C ? C ? 219 1 ATOM 4104 CZ . PHE B 219 ? -8.24149 -18.67269 -24.45739 1.000 22.23809 C ? C ? 219 1 ATOM 4105 N . LEU B 220 ? -10.64849 -23.43906 -24.18805 1.000 25.42516 N ? C ? 220 1 ATOM 4106 CA . LEU B 220 ? -11.76641 -23.49593 -23.25664 1.000 27.70495 C ? C ? 220 1 ATOM 4107 C . LEU B 220 ? -12.26452 -24.93313 -23.16923 1.000 38.48309 C ? C ? 220 1 ATOM 4108 O . LEU B 220 ? -12.70111 -25.51070 -24.17154 1.000 39.68945 O ? C ? 220 1 ATOM 4109 CB . LEU B 220 ? -12.88192 -22.55306 -23.69733 1.000 31.62557 C ? C ? 220 1 ATOM 4110 CG . LEU B 220 ? -12.49722 -21.07426 -23.80121 1.000 32.09760 C ? C ? 220 1 ATOM 4111 CD1 . LEU B 220 ? -13.64835 -20.27539 -24.36959 1.000 29.02038 C ? C ? 220 1 ATOM 4112 CD2 . LEU B 220 ? -12.06924 -20.51491 -22.44817 1.000 27.16687 C ? C ? 220 1 ATOM 4113 N . ASN B 221 ? -12.18892 -25.51700 -21.98211 1.000 34.44168 N ? C ? 221 1 ATOM 4114 CA . ASN B 221 ? -12.51695 -26.92109 -21.82595 1.000 45.07877 C ? C ? 221 1 ATOM 4115 C . ASN B 221 ? -13.91962 -27.08176 -21.24943 1.000 43.03963 C ? C ? 221 1 ATOM 4116 O . ASN B 221 ? -14.67733 -26.11933 -21.09716 1.000 43.35914 O ? C ? 221 1 ATOM 4117 CB . ASN B 221 ? -11.46155 -27.62701 -20.96651 1.000 45.73086 C ? C ? 221 1 ATOM 4118 CG . ASN B 221 ? -11.39170 -27.08990 -19.54282 1.000 55.69638 C ? C ? 221 1 ATOM 4119 OD1 . ASN B 221 ? -12.26579 -26.34612 -19.08647 1.000 55.45323 O ? C ? 221 1 ATOM 4120 ND2 . ASN B 221 ? -10.34254 -27.47449 -18.83029 1.000 56.15728 N ? C ? 221 1 ATOM 4121 N . ARG B 222 ? -14.25517 -28.31753 -20.90299 1.000 52.70541 N ? C ? 222 1 ATOM 4122 CA . ARG B 222 ? -15.57790 -28.69470 -20.43576 1.000 56.95396 C ? C ? 222 1 ATOM 4123 C . ARG B 222 ? -15.70349 -28.66371 -18.91744 1.000 51.88706 C ? C ? 222 1 ATOM 4124 O . ARG B 222 ? -16.82349 -28.74478 -18.40006 1.000 54.98322 O ? C ? 222 1 ATOM 4125 CB . ARG B 222 ? -15.90538 -30.09865 -20.96026 1.000 55.21752 C ? C ? 222 1 ATOM 4126 CG . ARG B 222 ? -17.37107 -30.43850 -21.05946 1.000 52.71475 C ? C ? 222 1 ATOM 4127 CD . ARG B 222 ? -17.57869 -31.51520 -22.11801 1.000 69.50872 C ? C ? 222 1 ATOM 4128 NE . ARG B 222 ? -17.79143 -30.93776 -23.44072 1.000 76.22605 N ? C ? 222 1 ATOM 4129 CZ . ARG B 222 ? -17.69247 -31.60836 -24.58081 1.000 81.61136 C ? C ? 222 1 ATOM 4130 NH1 . ARG B 222 ? -17.33448 -32.88260 -24.60458 1.000 85.51619 N ? C ? 222 1 ATOM 4131 NH2 . ARG B 222 ? -17.95663 -30.98354 -25.72610 1.000 86.33066 N ? C ? 222 1 ATOM 4132 N . PHE B 223 ? -14.59515 -28.53732 -18.19619 1.000 46.04010 N ? C ? 223 1 ATOM 4133 CA . PHE B 223 ? -14.58833 -28.69877 -16.75170 1.000 47.75151 C ? C ? 223 1 ATOM 4134 C . PHE B 223 ? -14.61855 -27.35032 -16.04170 1.000 40.08063 C ? C ? 223 1 ATOM 4135 O . PHE B 223 ? -14.44288 -26.28781 -16.64101 1.000 42.92193 O ? C ? 223 1 ATOM 4136 CB . PHE B 223 ? -13.35563 -29.49170 -16.30383 1.000 54.64649 C ? C ? 223 1 ATOM 4137 CG . PHE B 223 ? -12.89328 -30.51752 -17.29897 1.000 52.73401 C ? C ? 223 1 ATOM 4138 CD1 . PHE B 223 ? -13.68735 -31.60870 -17.61545 1.000 59.86729 C ? C ? 223 1 ATOM 4139 CD2 . PHE B 223 ? -11.65130 -30.39829 -17.90360 1.000 55.90503 C ? C ? 223 1 ATOM 4140 CE1 . PHE B 223 ? -13.25776 -32.55548 -18.52878 1.000 62.15160 C ? C ? 223 1 ATOM 4141 CE2 . PHE B 223 ? -11.21385 -31.34097 -18.81565 1.000 57.13168 C ? C ? 223 1 ATOM 4142 CZ . PHE B 223 ? -12.01901 -32.42178 -19.12921 1.000 66.56261 C ? C ? 223 1 ATOM 4143 N . THR B 224 ? -14.85337 -27.41494 -14.73536 1.000 35.66425 N ? C ? 224 1 ATOM 4144 CA . THR B 224 ? -14.68047 -26.29187 -13.82953 1.000 36.43191 C ? C ? 224 1 ATOM 4145 C . THR B 224 ? -13.81257 -26.75772 -12.66229 1.000 37.73381 C ? C ? 224 1 ATOM 4146 O . THR B 224 ? -13.37109 -27.91121 -12.60878 1.000 36.80973 O ? C ? 224 1 ATOM 4147 CB . THR B 224 ? -16.03227 -25.73592 -13.35612 1.000 32.69583 C ? C ? 224 1 ATOM 4148 OG1 . THR B 224 ? -15.82873 -24.48763 -12.68122 1.000 33.85387 O ? C ? 224 1 ATOM 4149 CG2 . THR B 224 ? -16.72298 -26.70598 -12.41700 1.000 35.41234 C ? C ? 224 1 ATOM 4150 N . THR B 225 ? -13.54890 -25.85211 -11.72740 1.000 40.78783 N ? C ? 225 1 ATOM 4151 CA . THR B 225 ? -12.66936 -26.15105 -10.60464 1.000 35.59462 C ? C ? 225 1 ATOM 4152 C . THR B 225 ? -13.05097 -25.24316 -9.44417 1.000 35.48822 C ? C ? 225 1 ATOM 4153 O . THR B 225 ? -13.95640 -24.41212 -9.55173 1.000 35.82804 O ? C ? 225 1 ATOM 4154 CB . THR B 225 ? -11.19514 -25.97423 -10.98866 1.000 35.30098 C ? C ? 225 1 ATOM 4155 OG1 . THR B 225 ? -10.35842 -26.48982 -9.94588 1.000 47.54363 O ? C ? 225 1 ATOM 4156 CG2 . THR B 225 ? -10.86823 -24.50106 -11.20804 1.000 29.06927 C ? C ? 225 1 ATOM 4157 N . THR B 226 ? -12.36371 -25.42788 -8.32273 1.000 40.99698 N ? C ? 226 1 ATOM 4158 CA . THR B 226 ? -12.45069 -24.54598 -7.17041 1.000 38.26653 C ? C ? 226 1 ATOM 4159 C . THR B 226 ? -11.14257 -23.78263 -7.02191 1.000 35.00665 C ? C ? 226 1 ATOM 4160 O . THR B 226 ? -10.11842 -24.13245 -7.61494 1.000 38.79199 O ? C ? 226 1 ATOM 4161 CB . THR B 226 ? -12.74354 -25.33344 -5.88967 1.000 37.00877 C ? C ? 226 1 ATOM 4162 OG1 . THR B 226 ? -11.61834 -26.16348 -5.57576 1.000 41.81205 O ? C ? 226 1 ATOM 4163 CG2 . THR B 226 ? -13.97856 -26.20797 -6.06528 1.000 38.78774 C ? C ? 226 1 ATOM 4164 N . LEU B 227 ? -11.18863 -22.72433 -6.21271 1.000 32.42667 N ? C ? 227 1 ATOM 4165 CA . LEU B 227 ? -9.99046 -21.92449 -5.98525 1.000 40.69583 C ? C ? 227 1 ATOM 4166 C . LEU B 227 ? -8.89928 -22.74631 -5.30767 1.000 40.14894 C ? C ? 227 1 ATOM 4167 O . LEU B 227 ? -7.72588 -22.67474 -5.69423 1.000 35.62151 O ? C ? 227 1 ATOM 4168 CB . LEU B 227 ? -10.33879 -20.69187 -5.15085 1.000 38.94577 C ? C ? 227 1 ATOM 4169 CG . LEU B 227 ? -9.52334 -19.42697 -5.42082 1.000 44.95366 C ? C ? 227 1 ATOM 4170 CD1 . LEU B 227 ? -9.45569 -19.14682 -6.91099 1.000 35.58769 C ? C ? 227 1 ATOM 4171 CD2 . LEU B 227 ? -10.14492 -18.25328 -4.68805 1.000 45.57660 C ? C ? 227 1 ATOM 4172 N . ASN B 228 ? -9.26831 -23.54125 -4.29994 1.000 37.89265 N ? C ? 228 1 ATOM 4173 CA . ASN B 228 ? -8.27555 -24.34928 -3.59897 1.000 41.74098 C ? C ? 228 1 ATOM 4174 C . ASN B 228 ? -7.68283 -25.41898 -4.51082 1.000 41.82272 C ? C ? 228 1 ATOM 4175 O . ASN B 228 ? -6.46417 -25.62693 -4.51843 1.000 45.36154 O ? C ? 228 1 ATOM 4176 CB . ASN B 228 ? -8.89464 -24.97930 -2.34940 1.000 41.10128 C ? C ? 228 1 ATOM 4177 CG . ASN B 228 ? -9.13179 -23.96758 -1.24089 1.000 47.93999 C ? C ? 228 1 ATOM 4178 OD1 . ASN B 228 ? -8.60198 -22.85603 -1.27422 1.000 52.55249 O ? C ? 228 1 ATOM 4179 ND2 . ASN B 228 ? -9.92308 -24.35237 -0.24828 1.000 43.37554 N ? C ? 228 1 ATOM 4180 N . ASP B 229 ? -8.52187 -26.10190 -5.29245 1.000 37.47772 N ? C ? 229 1 ATOM 4181 CA . ASP B 229 ? -8.00746 -27.11833 -6.20509 1.000 44.43410 C ? C ? 229 1 ATOM 4182 C . ASP B 229 ? -7.11040 -26.50439 -7.27190 1.000 42.31959 C ? C ? 229 1 ATOM 4183 O . ASP B 229 ? -6.07023 -27.07536 -7.62093 1.000 36.00329 O ? C ? 229 1 ATOM 4184 CB . ASP B 229 ? -9.16302 -27.88394 -6.84790 1.000 50.16793 C ? C ? 229 1 ATOM 4185 CG . ASP B 229 ? -9.66984 -29.00598 -5.96933 1.000 62.43602 C ? C ? 229 1 ATOM 4186 OD1 . ASP B 229 ? -8.83205 -29.66915 -5.32238 1.000 64.82448 O ? C ? 229 1 ATOM 4187 OD2 . ASP B 229 ? -10.89898 -29.22029 -5.91707 1.000 69.13444 O ? C ? 229 1 ATOM 4188 N . PHE B 230 ? -7.49208 -25.34064 -7.80196 1.000 32.07324 N ? C ? 230 1 ATOM 4189 CA . PHE B 230 ? -6.65137 -24.69039 -8.80057 1.000 33.94469 C ? C ? 230 1 ATOM 4190 C . PHE B 230 ? -5.31263 -24.26494 -8.20533 1.000 34.25854 C ? C ? 230 1 ATOM 4191 O . PHE B 230 ? -4.26975 -24.38560 -8.85792 1.000 33.36678 O ? C ? 230 1 ATOM 4192 CB . PHE B 230 ? -7.37745 -23.48810 -9.40403 1.000 29.49222 C ? C ? 230 1 ATOM 4193 CG . PHE B 230 ? -6.49951 -22.62600 -10.26403 1.000 34.17463 C ? C ? 230 1 ATOM 4194 CD1 . PHE B 230 ? -6.30941 -22.92400 -11.60345 1.000 34.11896 C ? C ? 230 1 ATOM 4195 CD2 . PHE B 230 ? -5.85533 -21.52172 -9.72935 1.000 38.77175 C ? C ? 230 1 ATOM 4196 CE1 . PHE B 230 ? -5.49690 -22.13744 -12.39006 1.000 30.82425 C ? C ? 230 1 ATOM 4197 CE2 . PHE B 230 ? -5.04052 -20.73442 -10.51076 1.000 34.84475 C ? C ? 230 1 ATOM 4198 CZ . PHE B 230 ? -4.86189 -21.04148 -11.84246 1.000 30.44944 C ? C ? 230 1 ATOM 4199 N . ASN B 231 ? -5.31773 -23.76584 -6.96650 1.000 34.38654 N ? C ? 231 1 ATOM 4200 CA . ASN B 231 ? -4.07270 -23.29541 -6.36774 1.000 36.25887 C ? C ? 231 1 ATOM 4201 C . ASN B 231 ? -3.10722 -24.43823 -6.09205 1.000 40.56902 C ? C ? 231 1 ATOM 4202 O . ASN B 231 ? -1.89209 -24.22066 -6.05664 1.000 38.05842 O ? C ? 231 1 ATOM 4203 CB . ASN B 231 ? -4.36254 -22.51967 -5.08586 1.000 33.70447 C ? C ? 231 1 ATOM 4204 CG . ASN B 231 ? -4.96405 -21.15977 -5.36138 1.000 38.63673 C ? C ? 231 1 ATOM 4205 OD1 . ASN B 231 ? -4.85471 -20.63546 -6.46935 1.000 29.50818 O ? C ? 231 1 ATOM 4206 ND2 . ASN B 231 ? -5.59921 -20.57713 -4.35348 1.000 41.06910 N ? C ? 231 1 ATOM 4207 N . LEU B 232 ? -3.61820 -25.65493 -5.89861 1.000 32.88067 N ? C ? 232 1 ATOM 4208 CA . LEU B 232 ? -2.73025 -26.79801 -5.72018 1.000 35.39825 C ? C ? 232 1 ATOM 4209 C . LEU B 232 ? -1.88921 -27.03889 -6.96912 1.000 43.42251 C ? C ? 232 1 ATOM 4210 O . LEU B 232 ? -0.70942 -27.39944 -6.87296 1.000 50.96993 O ? C ? 232 1 ATOM 4211 CB . LEU B 232 ? -3.54413 -28.04146 -5.37177 1.000 40.68602 C ? C ? 232 1 ATOM 4212 CG . LEU B 232 ? -2.93329 -28.95670 -4.31404 1.000 47.78897 C ? C ? 232 1 ATOM 4213 CD1 . LEU B 232 ? -2.93978 -28.27279 -2.95380 1.000 47.52805 C ? C ? 232 1 ATOM 4214 CD2 . LEU B 232 ? -3.68286 -30.27641 -4.26564 1.000 45.11618 C ? C ? 232 1 ATOM 4215 N . VAL B 233 ? -2.47800 -26.83135 -8.15016 1.000 36.68312 N ? C ? 233 1 ATOM 4216 CA . VAL B 233 ? -1.74865 -27.00063 -9.40401 1.000 43.46562 C ? C ? 233 1 ATOM 4217 C . VAL B 233 ? -0.93948 -25.75164 -9.74224 1.000 44.17787 C ? C ? 233 1 ATOM 4218 O . VAL B 233 ? 0.13566 -25.84904 -10.34702 1.000 49.68049 O ? C ? 233 1 ATOM 4219 CB . VAL B 233 ? -2.72494 -27.36034 -10.53870 1.000 42.93158 C ? C ? 233 1 ATOM 4220 CG1 . VAL B 233 ? -1.98246 -27.55116 -11.85901 1.000 42.77287 C ? C ? 233 1 ATOM 4221 CG2 . VAL B 233 ? -3.50835 -28.61055 -10.18372 1.000 42.26796 C ? C ? 233 1 ATOM 4222 N . ALA B 234 ? -1.42930 -24.56958 -9.36239 1.000 38.31206 N ? C ? 234 1 ATOM 4223 CA . ALA B 234 ? -0.68680 -23.34084 -9.62165 1.000 40.11190 C ? C ? 234 1 ATOM 4224 C . ALA B 234 ? 0.63775 -23.32735 -8.86617 1.000 36.34739 C ? C ? 234 1 ATOM 4225 O . ALA B 234 ? 1.68254 -22.98592 -9.43283 1.000 32.95903 O ? C ? 234 1 ATOM 4226 CB . ALA B 234 ? -1.53870 -22.12769 -9.24831 1.000 36.03658 C ? C ? 234 1 ATOM 4227 N . MET B 235 ? 0.61267 -23.69854 -7.58045 1.000 34.41042 N ? C ? 235 1 ATOM 4228 CA . MET B 235 ? 1.83700 -23.71354 -6.78437 1.000 36.05579 C ? C ? 235 1 ATOM 4229 C . MET B 235 ? 2.86129 -24.69066 -7.34353 1.000 37.25522 C ? C ? 235 1 ATOM 4230 O . MET B 235 ? 4.06903 -24.44769 -7.24290 1.000 37.05006 O ? C ? 235 1 ATOM 4231 CB . MET B 235 ? 1.51508 -24.06295 -5.33099 1.000 53.05127 C ? C ? 235 1 ATOM 4232 CG . MET B 235 ? 0.63477 -23.04571 -4.62573 1.000 63.95273 C ? C ? 235 1 ATOM 4233 SD . MET B 235 ? 0.07882 -23.63597 -3.01106 1.000 91.86589 S ? C ? 235 1 ATOM 4234 CE . MET B 235 ? -1.16727 -22.40494 -2.61419 1.000 67.57575 C ? C ? 235 1 ATOM 4235 N . LYS B 236 ? 2.40186 -25.79821 -7.93007 1.000 33.53923 N ? C ? 236 1 ATOM 4236 CA . LYS B 236 ? 3.31998 -26.76518 -8.52247 1.000 37.79127 C ? C ? 236 1 ATOM 4237 C . LYS B 236 ? 4.04873 -26.18401 -9.72952 1.000 36.61947 C ? C ? 236 1 ATOM 4238 O . LYS B 236 ? 5.18243 -26.58342 -10.02289 1.000 34.82070 O ? C ? 236 1 ATOM 4239 CB . LYS B 236 ? 2.55098 -28.03206 -8.90923 1.000 40.01424 C ? C ? 236 1 ATOM 4240 CG . LYS B 236 ? 3.41778 -29.22308 -9.30300 1.000 51.49645 C ? C ? 236 1 ATOM 4241 CD . LYS B 236 ? 2.84370 -30.52788 -8.74883 1.000 64.04931 C ? C ? 236 1 ATOM 4242 CE . LYS B 236 ? 1.35724 -30.67130 -9.06078 1.000 65.35903 C ? C ? 236 1 ATOM 4243 NZ . LYS B 236 ? 0.73746 -31.83754 -8.36730 1.000 64.58439 N ? C ? 236 1 ATOM 4244 N . TYR B 237 ? 3.42497 -25.23955 -10.43214 1.000 30.54708 N ? C ? 237 1 ATOM 4245 CA . TYR B 237 ? 4.00682 -24.63034 -11.61858 1.000 29.10243 C ? C ? 237 1 ATOM 4246 C . TYR B 237 ? 4.54289 -23.22643 -11.35118 1.000 31.41503 C ? C ? 237 1 ATOM 4247 O . TYR B 237 ? 4.69333 -22.43833 -12.29029 1.000 35.27590 O ? C ? 237 1 ATOM 4248 CB . TYR B 237 ? 2.97824 -24.61544 -12.75052 1.000 31.72697 C ? C ? 237 1 ATOM 4249 CG . TYR B 237 ? 2.74172 -25.98296 -13.36356 1.000 32.92537 C ? C ? 237 1 ATOM 4250 CD1 . TYR B 237 ? 1.79112 -26.84981 -12.84028 1.000 32.34186 C ? C ? 237 1 ATOM 4251 CD2 . TYR B 237 ? 3.48179 -26.40880 -14.46189 1.000 35.17205 C ? C ? 237 1 ATOM 4252 CE1 . TYR B 237 ? 1.58004 -28.10284 -13.40008 1.000 38.37522 C ? C ? 237 1 ATOM 4253 CE2 . TYR B 237 ? 3.28097 -27.65415 -15.02649 1.000 32.05844 C ? C ? 237 1 ATOM 4254 CZ . TYR B 237 ? 2.32966 -28.49866 -14.49331 1.000 37.34564 C ? C ? 237 1 ATOM 4255 OH . TYR B 237 ? 2.13022 -29.74021 -15.05752 1.000 39.82907 O ? C ? 237 1 ATOM 4256 N . ASN B 238 ? 4.84236 -22.90988 -10.08830 1.000 35.17968 N ? C ? 238 1 ATOM 4257 CA . ASN B 238 ? 5.38547 -21.60902 -9.68688 1.000 35.48034 C ? C ? 238 1 ATOM 4258 C . ASN B 238 ? 4.49221 -20.45548 -10.13764 1.000 30.67846 C ? C ? 238 1 ATOM 4259 O . ASN B 238 ? 4.96942 -19.43252 -10.62674 1.000 28.81117 O ? C ? 238 1 ATOM 4260 CB . ASN B 238 ? 6.81674 -21.42075 -10.19652 1.000 36.71996 C ? C ? 238 1 ATOM 4261 CG . ASN B 238 ? 7.85720 -21.94276 -9.21792 1.000 53.74012 C ? C ? 238 1 ATOM 4262 OD1 . ASN B 238 ? 7.67307 -21.87518 -8.00094 1.000 54.04255 O ? C ? 238 1 ATOM 4263 ND2 . ASN B 238 ? 8.95840 -22.46402 -9.74647 1.000 61.89406 N ? C ? 238 1 ATOM 4264 N . TYR B 239 ? 3.18614 -20.62311 -9.97659 1.000 29.27884 N ? C ? 239 1 ATOM 4265 CA . TYR B 239 ? 2.22720 -19.55192 -10.19327 1.000 30.90479 C ? C ? 239 1 ATOM 4266 C . TYR B 239 ? 1.78971 -18.98185 -8.85102 1.000 37.32944 C ? C ? 239 1 ATOM 4267 O . TYR B 239 ? 1.79004 -19.67837 -7.83174 1.000 30.55657 O ? C ? 239 1 ATOM 4268 CB . TYR B 239 ? 1.00494 -20.04672 -10.97214 1.000 25.45851 C ? C ? 239 1 ATOM 4269 CG . TYR B 239 ? 1.13846 -19.93507 -12.47459 1.000 26.74218 C ? C ? 239 1 ATOM 4270 CD1 . TYR B 239 ? 2.15638 -20.59353 -13.15366 1.000 29.05204 C ? C ? 239 1 ATOM 4271 CD2 . TYR B 239 ? 0.24064 -19.17969 -13.21475 1.000 29.09283 C ? C ? 239 1 ATOM 4272 CE1 . TYR B 239 ? 2.28241 -20.49509 -14.52912 1.000 27.22734 C ? C ? 239 1 ATOM 4273 CE2 . TYR B 239 ? 0.35613 -19.07557 -14.59264 1.000 30.09508 C ? C ? 239 1 ATOM 4274 CZ . TYR B 239 ? 1.37868 -19.73436 -15.24338 1.000 27.08643 C ? C ? 239 1 ATOM 4275 OH . TYR B 239 ? 1.49594 -19.63330 -16.60991 1.000 27.24711 O ? C ? 239 1 ATOM 4276 N . GLU B 240 ? 1.42952 -17.70150 -8.85667 1.000 33.11929 N ? C ? 240 1 ATOM 4277 CA . GLU B 240 ? 0.91143 -17.08510 -7.64655 1.000 28.65360 C ? C ? 240 1 ATOM 4278 C . GLU B 240 ? -0.41630 -17.73169 -7.26408 1.000 30.76005 C ? C ? 240 1 ATOM 4279 O . GLU B 240 ? -1.23647 -18.02956 -8.13747 1.000 34.38884 O ? C ? 240 1 ATOM 4280 CB . GLU B 240 ? 0.70482 -15.58776 -7.84084 1.000 33.23091 C ? C ? 240 1 ATOM 4281 CG . GLU B 240 ? 1.90900 -14.73156 -7.53795 1.000 31.44916 C ? C ? 240 1 ATOM 4282 CD . GLU B 240 ? 1.56592 -13.25699 -7.58337 1.000 47.23696 C ? C ? 240 1 ATOM 4283 OE1 . GLU B 240 ? 0.37437 -12.93769 -7.80049 1.000 41.53472 O ? C ? 240 1 ATOM 4284 OE2 . GLU B 240 ? 2.47821 -12.42122 -7.40385 1.000 48.13241 O ? C ? 240 1 ATOM 4285 N . PRO B 241 ? -0.65543 -17.97017 -5.97800 1.000 32.98372 N ? C ? 241 1 ATOM 4286 CA . PRO B 241 ? -1.97370 -18.45923 -5.56431 1.000 37.48085 C ? C ? 241 1 ATOM 4287 C . PRO B 241 ? -3.03623 -17.41422 -5.86264 1.000 36.11209 C ? C ? 241 1 ATOM 4288 O . PRO B 241 ? -2.87500 -16.23204 -5.55025 1.000 36.79386 O ? C ? 241 1 ATOM 4289 CB . PRO B 241 ? -1.80839 -18.69793 -4.05829 1.000 38.22443 C ? C ? 241 1 ATOM 4290 CG . PRO B 241 ? -0.32513 -18.84067 -3.85689 1.000 36.52056 C ? C ? 241 1 ATOM 4291 CD . PRO B 241 ? 0.28026 -17.89095 -4.84526 1.000 37.30647 C ? C ? 241 1 ATOM 4292 N . LEU B 242 ? -4.11688 -17.85357 -6.49844 1.000 32.89571 N ? C ? 242 1 ATOM 4293 CA . LEU B 242 ? -5.20215 -16.94733 -6.84123 1.000 37.68940 C ? C ? 242 1 ATOM 4294 C . LEU B 242 ? -6.06096 -16.68991 -5.60892 1.000 37.73947 C ? C ? 242 1 ATOM 4295 O . LEU B 242 ? -6.43663 -17.62448 -4.89306 1.000 39.28145 O ? C ? 242 1 ATOM 4296 CB . LEU B 242 ? -6.04520 -17.52371 -7.97831 1.000 29.04018 C ? C ? 242 1 ATOM 4297 CG . LEU B 242 ? -6.87985 -16.52699 -8.78905 1.000 31.96649 C ? C ? 242 1 ATOM 4298 CD1 . LEU B 242 ? -5.98901 -15.60017 -9.61437 1.000 27.54553 C ? C ? 242 1 ATOM 4299 CD2 . LEU B 242 ? -7.85664 -17.26809 -9.68336 1.000 33.21175 C ? C ? 242 1 ATOM 4300 N . THR B 243 ? -6.35849 -15.42137 -5.35979 1.000 35.13818 N ? C ? 243 1 ATOM 4301 CA . THR B 243 ? -7.11314 -14.98614 -4.19623 1.000 34.09210 C ? C ? 243 1 ATOM 4302 C . THR B 243 ? -8.51912 -14.57030 -4.61385 1.000 38.52215 C ? C ? 243 1 ATOM 4303 O . THR B 243 ? -8.85807 -14.51990 -5.80038 1.000 33.10017 O ? C ? 243 1 ATOM 4304 CB . THR B 243 ? -6.39928 -13.83019 -3.49463 1.000 36.04176 C ? C ? 243 1 ATOM 4305 OG1 . THR B 243 ? -6.57674 -12.62890 -4.25577 1.000 38.36788 O ? C ? 243 1 ATOM 4306 CG2 . THR B 243 ? -4.91339 -14.12277 -3.37355 1.000 42.06752 C ? C ? 243 1 ATOM 4307 N . GLN B 244 ? -9.34153 -14.25981 -3.60968 1.000 40.85711 N ? C ? 244 1 ATOM 4308 CA . GLN B 244 ? -10.69961 -13.79898 -3.87523 1.000 39.61006 C ? C ? 244 1 ATOM 4309 C . GLN B 244 ? -10.71009 -12.39439 -4.46648 1.000 44.44192 C ? C ? 244 1 ATOM 4310 O . GLN B 244 ? -11.59495 -12.06458 -5.26675 1.000 38.20147 O ? C ? 244 1 ATOM 4311 CB . GLN B 244 ? -11.52615 -13.85121 -2.58927 1.000 40.67399 C ? C ? 244 1 ATOM 4312 CG . GLN B 244 ? -12.94310 -13.32203 -2.72995 1.000 46.96467 C ? C ? 244 1 ATOM 4313 CD . GLN B 244 ? -13.74659 -14.07447 -3.77085 1.000 51.00038 C ? C ? 244 1 ATOM 4314 OE1 . GLN B 244 ? -13.51115 -15.25751 -4.01970 1.000 56.08830 O ? C ? 244 1 ATOM 4315 NE2 . GLN B 244 ? -14.69920 -13.38730 -4.39189 1.000 47.65210 N ? C ? 244 1 ATOM 4316 N . ASP B 245 ? -9.74037 -11.55799 -4.08877 1.000 39.90559 N ? C ? 245 1 ATOM 4317 CA . ASP B 245 ? -9.62947 -10.23575 -4.69473 1.000 38.15434 C ? C ? 245 1 ATOM 4318 C . ASP B 245 ? -9.35243 -10.34215 -6.18638 1.000 33.53438 C ? C ? 245 1 ATOM 4319 O . ASP B 245 ? -9.89697 -9.57022 -6.98321 1.000 34.67128 O ? C ? 245 1 ATOM 4320 CB . ASP B 245 ? -8.53277 -9.43132 -3.99929 1.000 36.98029 C ? C ? 245 1 ATOM 4321 CG . ASP B 245 ? -8.92884 -8.99687 -2.60503 1.000 49.93932 C ? C ? 245 1 ATOM 4322 OD1 . ASP B 245 ? -9.87024 -8.18527 -2.48352 1.000 58.99194 O ? C ? 245 1 ATOM 4323 OD2 . ASP B 245 ? -8.30991 -9.47783 -1.63125 1.000 56.88729 O ? C ? 245 1 ATOM 4324 N . HIS B 246 ? -8.50945 -11.29903 -6.58150 1.000 39.14484 N ? C ? 246 1 ATOM 4325 CA . HIS B 246 ? -8.24260 -11.52140 -7.99836 1.000 30.77619 C ? C ? 246 1 ATOM 4326 C . HIS B 246 ? -9.50293 -11.94919 -8.73797 1.000 34.35167 C ? C ? 246 1 ATOM 4327 O . HIS B 246 ? -9.75880 -11.49082 -9.85691 1.000 29.87448 O ? C ? 246 1 ATOM 4328 CB . HIS B 246 ? -7.14156 -12.56826 -8.16347 1.000 36.14007 C ? C ? 246 1 ATOM 4329 CG . HIS B 246 ? -5.78429 -12.08952 -7.74569 1.000 37.43952 C ? C ? 246 1 ATOM 4330 ND1 . HIS B 246 ? -4.78244 -12.94567 -7.34024 1.000 41.82244 N ? C ? 246 1 ATOM 4331 CD2 . HIS B 246 ? -5.26325 -10.84148 -7.67265 1.000 28.82718 C ? C ? 246 1 ATOM 4332 CE1 . HIS B 246 ? -3.70468 -12.24594 -7.03192 1.000 31.88579 C ? C ? 246 1 ATOM 4333 NE2 . HIS B 246 ? -3.96972 -10.96644 -7.22556 1.000 42.38857 N ? C ? 246 1 ATOM 4334 N . VAL B 247 ? -10.30526 -12.82448 -8.12751 1.000 37.74909 N ? C ? 247 1 ATOM 4335 CA . VAL B 247 ? -11.57290 -13.21526 -8.73793 1.000 34.35266 C ? C ? 247 1 ATOM 4336 C . VAL B 247 ? -12.47479 -12.00006 -8.90702 1.000 34.08891 C ? C ? 247 1 ATOM 4337 O . VAL B 247 ? -13.15186 -11.84744 -9.93150 1.000 31.95869 O ? C ? 247 1 ATOM 4338 CB . VAL B 247 ? -12.25607 -14.31553 -7.90429 1.000 37.32665 C ? C ? 247 1 ATOM 4339 CG1 . VAL B 247 ? -13.56709 -14.73513 -8.55974 1.000 30.78223 C ? C ? 247 1 ATOM 4340 CG2 . VAL B 247 ? -11.32978 -15.50680 -7.73675 1.000 31.98838 C ? C ? 247 1 ATOM 4341 N . ASP B 248 ? -12.49336 -11.11190 -7.90932 1.000 37.06807 N ? C ? 248 1 ATOM 4342 CA . ASP B 248 ? -13.30167 -9.90131 -8.01626 1.000 39.75176 C ? C ? 248 1 ATOM 4343 C . ASP B 248 ? -12.78858 -8.99489 -9.12479 1.000 35.18417 C ? C ? 248 1 ATOM 4344 O . ASP B 248 ? -13.57811 -8.39523 -9.86509 1.000 39.57151 O ? C ? 248 1 ATOM 4345 CB . ASP B 248 ? -13.31777 -9.16122 -6.67990 1.000 43.81804 C ? C ? 248 1 ATOM 4346 CG . ASP B 248 ? -14.29963 -9.76436 -5.69742 1.000 55.07739 C ? C ? 248 1 ATOM 4347 OD1 . ASP B 248 ? -15.52105 -9.70466 -5.96368 1.000 56.01164 O ? C ? 248 1 ATOM 4348 OD2 . ASP B 248 ? -13.85172 -10.31254 -4.66761 1.000 58.41340 O ? C ? 248 1 ATOM 4349 N . ILE B 249 ? -11.46638 -8.89644 -9.26092 1.000 31.55831 N ? C ? 249 1 ATOM 4350 CA . ILE B 249 ? -10.87375 -8.03704 -10.27961 1.000 35.98734 C ? C ? 249 1 ATOM 4351 C . ILE B 249 ? -11.18464 -8.56316 -11.67772 1.000 28.36987 C ? C ? 249 1 ATOM 4352 O . ILE B 249 ? -11.45614 -7.78817 -12.60239 1.000 36.80089 O ? C ? 249 1 ATOM 4353 CB . ILE B 249 ? -9.36127 -7.90809 -10.02036 1.000 35.07160 C ? C ? 249 1 ATOM 4354 CG1 . ILE B 249 ? -9.12753 -7.02711 -8.78940 1.000 34.80925 C ? C ? 249 1 ATOM 4355 CG2 . ILE B 249 ? -8.64335 -7.35999 -11.23279 1.000 38.72242 C ? C ? 249 1 ATOM 4356 CD1 . ILE B 249 ? -7.73595 -7.10986 -8.21299 1.000 40.13724 C ? C ? 249 1 ATOM 4357 N . LEU B 250 ? -11.18357 -9.88265 -11.84937 1.000 38.24985 N ? C ? 250 1 ATOM 4358 CA . LEU B 250 ? -11.51766 -10.50328 -13.12707 1.000 29.11157 C ? C ? 250 1 ATOM 4359 C . LEU B 250 ? -13.01520 -10.51866 -13.41531 1.000 33.01867 C ? C ? 250 1 ATOM 4360 O . LEU B 250 ? -13.42864 -11.10381 -14.42240 1.000 35.51436 O ? C ? 250 1 ATOM 4361 CB . LEU B 250 ? -10.97374 -11.93386 -13.16790 1.000 29.32402 C ? C ? 250 1 ATOM 4362 CG . LEU B 250 ? -9.45094 -12.06196 -13.10616 1.000 33.31979 C ? C ? 250 1 ATOM 4363 CD1 . LEU B 250 ? -9.04689 -13.51092 -12.90842 1.000 29.88169 C ? C ? 250 1 ATOM 4364 CD2 . LEU B 250 ? -8.82160 -11.49389 -14.36905 1.000 28.89415 C ? C ? 250 1 ATOM 4365 N . GLY B 251 ? -13.82743 -9.88484 -12.57454 1.000 34.98359 N ? C ? 251 1 ATOM 4366 CA . GLY B 251 ? -15.26597 -9.92935 -12.69893 1.000 34.09632 C ? C ? 251 1 ATOM 4367 C . GLY B 251 ? -15.81480 -9.40361 -14.01325 1.000 41.08224 C ? C ? 251 1 ATOM 4368 O . GLY B 251 ? -16.52625 -10.11274 -14.73459 1.000 35.75752 O ? C ? 251 1 ATOM 4369 N . PRO B 252 ? -15.52250 -8.13615 -14.33827 1.000 43.47555 N ? C ? 252 1 ATOM 4370 CA . PRO B 252 ? -16.02680 -7.57984 -15.60935 1.000 38.75261 C ? C ? 252 1 ATOM 4371 C . PRO B 252 ? -15.58158 -8.34939 -16.84546 1.000 37.20474 C ? C ? 252 1 ATOM 4372 O . PRO B 252 ? -16.37188 -8.50005 -17.78581 1.000 33.27569 O ? C ? 252 1 ATOM 4373 CB . PRO B 252 ? -15.47689 -6.14662 -15.59749 1.000 38.78839 C ? C ? 252 1 ATOM 4374 CG . PRO B 252 ? -15.36052 -5.81473 -14.14877 1.000 36.24589 C ? C ? 252 1 ATOM 4375 CD . PRO B 252 ? -14.92877 -7.09226 -13.48181 1.000 42.37312 C ? C ? 252 1 ATOM 4376 N . LEU B 253 ? -14.33824 -8.83622 -16.88168 1.000 29.65192 N ? C ? 253 1 ATOM 4377 CA . LEU B 253 ? -13.90716 -9.64399 -18.01971 1.000 38.14886 C ? C ? 253 1 ATOM 4378 C . LEU B 253 ? -14.72202 -10.92900 -18.12145 1.000 35.64052 C ? C ? 253 1 ATOM 4379 O . LEU B 253 ? -15.06991 -11.36727 -19.22465 1.000 32.49628 O ? C ? 253 1 ATOM 4380 CB . LEU B 253 ? -12.41335 -9.96361 -17.91504 1.000 29.53066 C ? C ? 253 1 ATOM 4381 CG . LEU B 253 ? -11.41708 -8.85384 -18.27192 1.000 37.13666 C ? C ? 253 1 ATOM 4382 CD1 . LEU B 253 ? -9.97817 -9.36634 -18.21839 1.000 22.10551 C ? C ? 253 1 ATOM 4383 CD2 . LEU B 253 ? -11.72955 -8.26305 -19.64091 1.000 26.42324 C ? C ? 253 1 ATOM 4384 N . SER B 254 ? -15.04109 -11.54223 -16.97821 1.000 39.05172 N ? C ? 254 1 ATOM 4385 CA . SER B 254 ? -15.81306 -12.78096 -16.98480 1.000 33.30852 C ? C ? 254 1 ATOM 4386 C . SER B 254 ? -17.22179 -12.55240 -17.51914 1.000 39.13015 C ? C ? 254 1 ATOM 4387 O . SER B 254 ? -17.73785 -13.36169 -18.30075 1.000 38.70005 O ? C ? 254 1 ATOM 4388 CB . SER B 254 ? -15.86235 -13.36795 -15.57431 1.000 38.12566 C ? C ? 254 1 ATOM 4389 OG . SER B 254 ? -16.74345 -14.47753 -15.51133 1.000 41.39474 O ? C ? 254 1 ATOM 4390 N . ALA B 255 ? -17.85946 -11.45241 -17.10889 1.000 34.90063 N ? C ? 255 1 ATOM 4391 CA . ALA B 255 ? -19.21604 -11.16815 -17.56224 1.000 43.00212 C ? C ? 255 1 ATOM 4392 C . ALA B 255 ? -19.24679 -10.76650 -19.03089 1.000 39.82998 C ? C ? 255 1 ATOM 4393 O . ALA B 255 ? -20.21273 -11.07771 -19.73718 1.000 38.86283 O ? C ? 255 1 ATOM 4394 CB . ALA B 255 ? -19.83541 -10.06773 -16.70098 1.000 35.57938 C ? C ? 255 1 ATOM 4395 N . GLN B 256 ? -18.21535 -10.06237 -19.50194 1.000 36.61361 N ? C ? 256 1 ATOM 4396 CA . GLN B 256 ? -18.17875 -9.65260 -20.90141 1.000 36.68872 C ? C ? 256 1 ATOM 4397 C . GLN B 256 ? -18.06618 -10.85852 -21.82676 1.000 33.58597 C ? C ? 256 1 ATOM 4398 O . GLN B 256 ? -18.69652 -10.89500 -22.88864 1.000 38.24168 O ? C ? 256 1 ATOM 4399 CB . GLN B 256 ? -17.01836 -8.68272 -21.12662 1.000 40.07849 C ? C ? 256 1 ATOM 4400 CG . GLN B 256 ? -16.74773 -8.34819 -22.58899 1.000 53.41163 C ? C ? 256 1 ATOM 4401 CD . GLN B 256 ? -15.65372 -7.30666 -22.75229 1.000 60.87943 C ? C ? 256 1 ATOM 4402 OE1 . GLN B 256 ? -15.14440 -6.76897 -21.76731 1.000 55.38237 O ? C ? 256 1 ATOM 4403 NE2 . GLN B 256 ? -15.28699 -7.01685 -23.99831 1.000 52.24916 N ? C ? 256 1 ATOM 4404 N . THR B 257 ? -17.27817 -11.85790 -21.43831 1.000 33.34010 N ? C ? 257 1 ATOM 4405 CA . THR B 257 ? -17.09321 -13.05747 -22.24308 1.000 28.60968 C ? C ? 257 1 ATOM 4406 C . THR B 257 ? -18.09379 -14.15924 -21.91656 1.000 36.83935 C ? C ? 257 1 ATOM 4407 O . THR B 257 ? -18.23871 -15.09599 -22.70963 1.000 35.22767 O ? C ? 257 1 ATOM 4408 CB . THR B 257 ? -15.66944 -13.60084 -22.06309 1.000 30.87585 C ? C ? 257 1 ATOM 4409 OG1 . THR B 257 ? -15.47271 -13.99827 -20.69878 1.000 26.03277 O ? C ? 257 1 ATOM 4410 CG2 . THR B 257 ? -14.64203 -12.53525 -22.42688 1.000 28.01302 C ? C ? 257 1 ATOM 4411 N . GLY B 258 ? -18.78814 -14.07046 -20.78381 1.000 42.86356 N ? C ? 258 1 ATOM 4412 CA . GLY B 258 ? -19.70710 -15.11726 -20.38624 1.000 38.38324 C ? C ? 258 1 ATOM 4413 C . GLY B 258 ? -19.04570 -16.34140 -19.80352 1.000 40.12937 C ? C ? 258 1 ATOM 4414 O . GLY B 258 ? -19.67677 -17.40108 -19.73293 1.000 43.24071 O ? C ? 258 1 ATOM 4415 N . ILE B 259 ? -17.79171 -16.22805 -19.37710 1.000 37.41771 N ? C ? 259 1 ATOM 4416 CA . ILE B 259 ? -17.01642 -17.35044 -18.86516 1.000 31.69449 C ? C ? 259 1 ATOM 4417 C . ILE B 259 ? -16.71545 -17.09441 -17.39684 1.000 37.43409 C ? C ? 259 1 ATOM 4418 O . ILE B 259 ? -16.00889 -16.13473 -17.06263 1.000 37.94735 O ? C ? 259 1 ATOM 4419 CB . ILE B 259 ? -15.72104 -17.54687 -19.66447 1.000 33.22626 C ? C ? 259 1 ATOM 4420 CG1 . ILE B 259 ? -16.04933 -17.96813 -21.09771 1.000 37.28692 C ? C ? 259 1 ATOM 4421 CG2 . ILE B 259 ? -14.81732 -18.56452 -18.98043 1.000 36.63091 C ? C ? 259 1 ATOM 4422 CD1 . ILE B 259 ? -14.87856 -17.86855 -22.03105 1.000 36.62271 C ? C ? 259 1 ATOM 4423 N . ALA B 260 ? -17.24829 -17.95033 -16.52577 1.000 40.64445 N ? C ? 260 1 ATOM 4424 CA . ALA B 260 ? -16.98453 -17.83976 -15.09835 1.000 33.20331 C ? C ? 260 1 ATOM 4425 C . ALA B 260 ? -15.48709 -17.91004 -14.81796 1.000 33.32110 C ? C ? 260 1 ATOM 4426 O . ALA B 260 ? -14.72743 -18.58079 -15.52296 1.000 32.40884 O ? C ? 260 1 ATOM 4427 CB . ALA B 260 ? -17.71497 -18.94400 -14.33380 1.000 31.23178 C ? C ? 260 1 ATOM 4428 N . VAL B 261 ? -15.06532 -17.19908 -13.77034 1.000 34.14522 N ? C ? 261 1 ATOM 4429 CA . VAL B 261 ? -13.64329 -17.12366 -13.44294 1.000 31.77114 C ? C ? 261 1 ATOM 4430 C . VAL B 261 ? -13.09199 -18.50537 -13.11611 1.000 35.22127 C ? C ? 261 1 ATOM 4431 O . VAL B 261 ? -11.97775 -18.85678 -13.52332 1.000 31.93612 O ? C ? 261 1 ATOM 4432 CB . VAL B 261 ? -13.41561 -16.13513 -12.28469 1.000 32.02335 C ? C ? 261 1 ATOM 4433 CG1 . VAL B 261 ? -11.94524 -16.09239 -11.89712 1.000 31.30406 C ? C ? 261 1 ATOM 4434 CG2 . VAL B 261 ? -13.91654 -14.74415 -12.66724 1.000 32.39757 C ? C ? 261 1 ATOM 4435 N . LEU B 262 ? -13.85879 -19.31151 -12.37563 1.000 33.52032 N ? C ? 262 1 ATOM 4436 CA . LEU B 262 ? -13.40669 -20.65820 -12.04364 1.000 33.19403 C ? C ? 262 1 ATOM 4437 C . LEU B 262 ? -13.42498 -21.58597 -13.25247 1.000 33.90723 C ? C ? 262 1 ATOM 4438 O . LEU B 262 ? -12.68475 -22.57575 -13.26952 1.000 33.37046 O ? C ? 262 1 ATOM 4439 CB . LEU B 262 ? -14.25964 -21.23752 -10.91138 1.000 28.67933 C ? C ? 262 1 ATOM 4440 CG . LEU B 262 ? -14.00894 -20.62939 -9.52680 1.000 32.54293 C ? C ? 262 1 ATOM 4441 CD1 . LEU B 262 ? -14.97982 -21.18253 -8.49970 1.000 33.55510 C ? C ? 262 1 ATOM 4442 CD2 . LEU B 262 ? -12.57649 -20.87805 -9.08205 1.000 34.00097 C ? C ? 262 1 ATOM 4443 N . ASP B 263 ? -14.25085 -21.28913 -14.25984 1.000 31.79847 N ? C ? 263 1 ATOM 4444 CA . ASP B 263 ? -14.19704 -22.04320 -15.50793 1.000 32.33512 C ? C ? 263 1 ATOM 4445 C . ASP B 263 ? -12.92528 -21.72404 -16.28311 1.000 33.62282 C ? C ? 263 1 ATOM 4446 O . ASP B 263 ? -12.28869 -22.62516 -16.84295 1.000 35.54782 O ? C ? 263 1 ATOM 4447 CB . ASP B 263 ? -15.43593 -21.74892 -16.35437 1.000 29.76265 C ? C ? 263 1 ATOM 4448 CG . ASP B 263 ? -16.71287 -22.27756 -15.72282 1.000 41.06356 C ? C ? 263 1 ATOM 4449 OD1 . ASP B 263 ? -16.64102 -22.79814 -14.58998 1.000 46.49479 O ? C ? 263 1 ATOM 4450 OD2 . ASP B 263 ? -17.78698 -22.17905 -16.35837 1.000 34.92127 O ? C ? 263 1 ATOM 4451 N . MET B 264 ? -12.53875 -20.44649 -16.32733 1.000 31.45457 N ? C ? 264 1 ATOM 4452 CA . MET B 264 ? -11.26636 -20.08820 -16.94565 1.000 34.47231 C ? C ? 264 1 ATOM 4453 C . MET B 264 ? -10.08607 -20.65186 -16.15914 1.000 30.05749 C ? C ? 264 1 ATOM 4454 O . MET B 264 ? -9.05513 -20.99318 -16.74985 1.000 30.02470 O ? C ? 264 1 ATOM 4455 CB . MET B 264 ? -11.15045 -18.56543 -17.07469 1.000 29.14513 C ? C ? 264 1 ATOM 4456 CG . MET B 264 ? -9.93085 -18.09956 -17.85866 1.000 25.99354 C ? C ? 264 1 ATOM 4457 SD . MET B 264 ? -10.02502 -18.51314 -19.61226 1.000 32.56219 S ? C ? 264 1 ATOM 4458 CE . MET B 264 ? -11.12160 -17.22076 -20.20334 1.000 31.70418 C ? C ? 264 1 ATOM 4459 N . CYS B 265 ? -10.21307 -20.75700 -14.83371 1.000 27.56115 N ? C ? 265 1 ATOM 4460 CA . CYS B 265 ? -9.15155 -21.36876 -14.04055 1.000 26.86685 C ? C ? 265 1 ATOM 4461 C . CYS B 265 ? -8.95544 -22.82921 -14.42230 1.000 33.59852 C ? C ? 265 1 ATOM 4462 O . CYS B 265 ? -7.81804 -23.31070 -14.51077 1.000 31.54316 O ? C ? 265 1 ATOM 4463 CB . CYS B 265 ? -9.46939 -21.24963 -12.55220 1.000 34.09518 C ? C ? 265 1 ATOM 4464 SG . CYS B 265 ? -9.37118 -19.58115 -11.89782 1.000 32.88419 S ? C ? 265 1 ATOM 4465 N . ALA B 266 ? -10.05816 -23.55023 -14.64731 1.000 27.05161 N ? C ? 266 1 ATOM 4466 CA . ALA B 266 ? -9.96742 -24.93633 -15.09089 1.000 31.41417 C ? C ? 266 1 ATOM 4467 C . ALA B 266 ? -9.29168 -25.04373 -16.44971 1.000 34.82266 C ? C ? 266 1 ATOM 4468 O . ALA B 266 ? -8.57742 -26.01822 -16.71015 1.000 30.49703 O ? C ? 266 1 ATOM 4469 CB . ALA B 266 ? -11.36031 -25.56796 -15.14073 1.000 33.46762 C ? C ? 266 1 ATOM 4470 N . SER B 267 ? -9.50656 -24.06138 -17.32939 1.000 29.62754 N ? C ? 267 1 ATOM 4471 CA . SER B 267 ? -8.83496 -24.08299 -18.62292 1.000 29.35865 C ? C ? 267 1 ATOM 4472 C . SER B 267 ? -7.35144 -23.78344 -18.46858 1.000 28.76344 C ? C ? 267 1 ATOM 4473 O . SER B 267 ? -6.51736 -24.36991 -19.16890 1.000 32.71395 O ? C ? 267 1 ATOM 4474 CB . SER B 267 ? -9.49839 -23.09057 -19.57740 1.000 34.70244 C ? C ? 267 1 ATOM 4475 OG . SER B 267 ? -10.79267 -23.53704 -19.94588 1.000 32.78467 O ? C ? 267 1 ATOM 4476 N . LEU B 268 ? -7.00423 -22.87934 -17.54897 1.000 31.20275 N ? C ? 268 1 ATOM 4477 CA . LEU B 268 ? -5.59833 -22.60799 -17.27474 1.000 27.00935 C ? C ? 268 1 ATOM 4478 C . LEU B 268 ? -4.91600 -23.82017 -16.65590 1.000 27.67997 C ? C ? 268 1 ATOM 4479 O . LEU B 268 ? -3.75001 -24.10432 -16.95553 1.000 34.41791 O ? C ? 268 1 ATOM 4480 CB . LEU B 268 ? -5.46345 -21.39044 -16.35799 1.000 30.80429 C ? C ? 268 1 ATOM 4481 CG . LEU B 268 ? -4.03600 -21.04785 -15.92513 1.000 20.46494 C ? C ? 268 1 ATOM 4482 CD1 . LEU B 268 ? -3.15989 -20.80401 -17.14190 1.000 27.19045 C ? C ? 268 1 ATOM 4483 CD2 . LEU B 268 ? -4.02394 -19.83769 -15.01123 1.000 21.73285 C ? C ? 268 1 ATOM 4484 N . LYS B 269 ? -5.62430 -24.54290 -15.78485 1.000 23.25793 N ? C ? 269 1 ATOM 4485 CA . LYS B 269 ? -5.04433 -25.72983 -15.16324 1.000 32.00485 C ? C ? 269 1 ATOM 4486 C . LYS B 269 ? -4.64437 -26.75828 -16.21473 1.000 35.61695 C ? C ? 269 1 ATOM 4487 O . LYS B 269 ? -3.55017 -27.33257 -16.15417 1.000 41.00799 O ? C ? 269 1 ATOM 4488 CB . LYS B 269 ? -6.03061 -26.33491 -14.16212 1.000 30.29222 C ? C ? 269 1 ATOM 4489 CG . LYS B 269 ? -5.49907 -27.55121 -13.42315 1.000 35.97528 C ? C ? 269 1 ATOM 4490 CD . LYS B 269 ? -6.52396 -28.09359 -12.43805 1.000 43.02169 C ? C ? 269 1 ATOM 4491 CE . LYS B 269 ? -7.19242 -29.35126 -12.96573 1.000 50.40583 C ? C ? 269 1 ATOM 4492 NZ . LYS B 269 ? -6.82606 -30.55330 -12.16407 1.000 50.13834 N ? C ? 269 1 ATOM 4493 N . GLU B 270 ? -5.52058 -26.99568 -17.19539 1.000 30.53480 N ? C ? 270 1 ATOM 4494 CA . GLU B 270 ? -5.22197 -27.96690 -18.24384 1.000 36.80231 C ? C ? 270 1 ATOM 4495 C . GLU B 270 ? -4.05507 -27.51105 -19.11111 1.000 37.29877 C ? C ? 270 1 ATOM 4496 O . GLU B 270 ? -3.24039 -28.33307 -19.54776 1.000 32.47632 O ? C ? 270 1 ATOM 4497 CB . GLU B 270 ? -6.46388 -28.21149 -19.10019 1.000 31.48114 C ? C ? 270 1 ATOM 4498 CG . GLU B 270 ? -7.55689 -28.97110 -18.37554 1.000 46.52518 C ? C ? 270 1 ATOM 4499 CD . GLU B 270 ? -7.16619 -30.40509 -18.07236 1.000 56.43384 C ? C ? 270 1 ATOM 4500 OE1 . GLU B 270 ? -6.98956 -31.18727 -19.03047 1.000 71.25905 O ? C ? 270 1 ATOM 4501 OE2 . GLU B 270 ? -7.02667 -30.74813 -16.87895 1.000 52.88320 O ? C ? 270 1 ATOM 4502 N . LEU B 271 ? -3.95827 -26.20520 -19.37587 1.000 32.84718 N ? C ? 271 1 ATOM 4503 CA . LEU B 271 ? -2.83376 -25.69509 -20.15599 1.000 42.27418 C ? C ? 271 1 ATOM 4504 C . LEU B 271 ? -1.51151 -25.90371 -19.42199 1.000 39.43992 C ? C ? 271 1 ATOM 4505 O . LEU B 271 ? -0.49442 -26.23691 -20.04261 1.000 32.55958 O ? C ? 271 1 ATOM 4506 CB . LEU B 271 ? -3.04630 -24.21461 -20.48133 1.000 32.82151 C ? C ? 271 1 ATOM 4507 CG . LEU B 271 ? -4.07845 -23.88309 -21.56484 1.000 29.63610 C ? C ? 271 1 ATOM 4508 CD1 . LEU B 271 ? -4.36440 -22.38690 -21.59829 1.000 24.38832 C ? C ? 271 1 ATOM 4509 CD2 . LEU B 271 ? -3.60380 -24.36647 -22.92723 1.000 29.83350 C ? C ? 271 1 ATOM 4510 N . LEU B 272 ? -1.50692 -25.72058 -18.09768 1.000 28.51861 N ? C ? 272 1 ATOM 4511 CA . LEU B 272 ? -0.28354 -25.92900 -17.32809 1.000 32.54214 C ? C ? 272 1 ATOM 4512 C . LEU B 272 ? 0.10302 -27.40184 -17.29018 1.000 31.87257 C ? C ? 272 1 ATOM 4513 O . LEU B 272 ? 1.28736 -27.74147 -17.39638 1.000 36.01492 O ? C ? 272 1 ATOM 4514 CB . LEU B 272 ? -0.45401 -25.38924 -15.90845 1.000 28.39421 C ? C ? 272 1 ATOM 4515 CG . LEU B 272 ? -0.66616 -23.88534 -15.75380 1.000 27.83870 C ? C ? 272 1 ATOM 4516 CD1 . LEU B 272 ? -0.83059 -23.52805 -14.28952 1.000 36.49406 C ? C ? 272 1 ATOM 4517 CD2 . LEU B 272 ? 0.48974 -23.12069 -16.35960 1.000 29.57883 C ? C ? 272 1 ATOM 4518 N . GLN B 273 ? -0.88367 -28.29044 -17.14880 1.000 36.36816 N ? C ? 273 1 ATOM 4519 CA . GLN B 273 ? -0.60669 -29.71676 -17.00985 1.000 33.57584 C ? C ? 273 1 ATOM 4520 C . GLN B 273 ? -0.34789 -30.40749 -18.34446 1.000 41.00149 C ? C ? 273 1 ATOM 4521 O . GLN B 273 ? 0.36884 -31.41503 -18.38195 1.000 46.19480 O ? C ? 273 1 ATOM 4522 CB . GLN B 273 ? -1.76902 -30.40643 -16.29728 1.000 39.01014 C ? C ? 273 1 ATOM 4523 CG . GLN B 273 ? -1.96887 -29.95112 -14.86783 1.000 40.23979 C ? C ? 273 1 ATOM 4524 CD . GLN B 273 ? -3.17521 -30.59402 -14.22316 1.000 45.54498 C ? C ? 273 1 ATOM 4525 OE1 . GLN B 273 ? -4.12992 -30.97686 -14.90261 1.000 41.54771 O ? C ? 273 1 ATOM 4526 NE2 . GLN B 273 ? -3.13888 -30.72087 -12.90319 1.000 51.24800 N ? C ? 273 1 ATOM 4527 N . ASN B 274 ? -0.91545 -29.90519 -19.44008 1.000 33.01620 N ? C ? 274 1 ATOM 4528 CA . ASN B 274 ? -0.78051 -30.56230 -20.73311 1.000 39.71160 C ? C ? 274 1 ATOM 4529 C . ASN B 274 ? -0.01973 -29.73984 -21.76149 1.000 34.57087 C ? C ? 274 1 ATOM 4530 O . ASN B 274 ? 0.14780 -30.20051 -22.89367 1.000 44.26264 O ? C ? 274 1 ATOM 4531 CB . ASN B 274 ? -2.16022 -30.91694 -21.29907 1.000 35.70125 C ? C ? 274 1 ATOM 4532 CG . ASN B 274 ? -3.00002 -31.72339 -20.33108 1.000 40.66232 C ? C ? 274 1 ATOM 4533 OD1 . ASN B 274 ? -4.20104 -31.49034 -20.19214 1.000 49.95675 O ? C ? 274 1 ATOM 4534 ND2 . ASN B 274 ? -2.37217 -32.67453 -19.65168 1.000 48.95154 N ? C ? 274 1 ATOM 4535 N . GLY B 275 ? 0.44650 -28.55117 -21.41058 1.000 31.78815 N ? C ? 275 1 ATOM 4536 CA . GLY B 275 ? 1.06996 -27.70360 -22.40254 1.000 35.98441 C ? C ? 275 1 ATOM 4537 C . GLY B 275 ? 0.04551 -27.19285 -23.40458 1.000 38.51576 C ? C ? 275 1 ATOM 4538 O . GLY B 275 ? -1.16160 -27.38109 -23.26410 1.000 40.87045 O ? C ? 275 1 ATOM 4539 N . MET B 276 ? 0.55971 -26.53520 -24.44085 1.000 31.83193 N ? C ? 276 1 ATOM 4540 CA . MET B 276 ? -0.27553 -25.95961 -25.48397 1.000 38.89707 C ? C ? 276 1 ATOM 4541 C . MET B 276 ? -0.26325 -26.77174 -26.77580 1.000 38.95022 C ? C ? 276 1 ATOM 4542 O . MET B 276 ? -0.76796 -26.29171 -27.79516 1.000 44.26090 O ? C ? 276 1 ATOM 4543 CB . MET B 276 ? 0.15349 -24.51725 -25.76116 1.000 36.55496 C ? C ? 276 1 ATOM 4544 CG . MET B 276 ? -0.49227 -23.48912 -24.84159 1.000 40.01492 C ? C ? 276 1 ATOM 4545 SD . MET B 276 ? 0.24278 -21.84510 -24.99112 1.000 40.86527 S ? C ? 276 1 ATOM 4546 CE . MET B 276 ? 1.50074 -21.95688 -23.72868 1.000 38.40840 C ? C ? 276 1 ATOM 4547 N . ASN B 277 ? 0.29769 -27.98469 -26.75814 1.000 42.59079 N ? C ? 277 1 ATOM 4548 CA . ASN B 277 ? 0.25569 -28.90410 -27.90130 1.000 44.52160 C ? C ? 277 1 ATOM 4549 C . ASN B 277 ? 0.84102 -28.28288 -29.16725 1.000 44.61757 C ? C ? 277 1 ATOM 4550 O . ASN B 277 ? 0.48995 -28.68287 -30.28366 1.000 44.13688 O ? C ? 277 1 ATOM 4551 CB . ASN B 277 ? -1.17539 -29.39049 -28.16803 1.000 56.89329 C ? C ? 277 1 ATOM 4552 CG . ASN B 277 ? -1.54431 -30.61704 -27.34962 1.000 56.42510 C ? C ? 277 1 ATOM 4553 OD1 . ASN B 277 ? -1.59783 -30.56976 -26.11961 1.000 53.29638 O ? C ? 277 1 ATOM 4554 ND2 . ASN B 277 ? -1.81919 -31.72120 -28.03608 1.000 56.25056 N ? C ? 277 1 ATOM 4555 N . GLY B 278 ? 1.73228 -27.30572 -29.01712 1.000 39.75184 N ? C ? 278 1 ATOM 4556 CA . GLY B 278 ? 2.25063 -26.58249 -30.15580 1.000 47.04086 C ? C ? 278 1 ATOM 4557 C . GLY B 278 ? 1.31948 -25.53769 -30.73093 1.000 41.47308 C ? C ? 278 1 ATOM 4558 O . GLY B 278 ? 1.66860 -24.90858 -31.73871 1.000 40.64301 O ? C ? 278 1 ATOM 4559 N . ARG B 279 ? 0.14685 -25.33684 -30.13757 1.000 39.07735 N ? C ? 279 1 ATOM 4560 CA . ARG B 279 ? -0.75888 -24.30569 -30.60902 1.000 33.42953 C ? C ? 279 1 ATOM 4561 C . ARG B 279 ? -0.38437 -22.95913 -29.99743 1.000 35.88210 C ? C ? 279 1 ATOM 4562 O . ARG B 279 ? 0.39476 -22.86988 -29.04645 1.000 35.07299 O ? C ? 279 1 ATOM 4563 CB . ARG B 279 ? -2.20784 -24.66085 -30.27360 1.000 35.49244 C ? C ? 279 1 ATOM 4564 CG . ARG B 279 ? -2.59808 -26.09225 -30.59492 1.000 37.17133 C ? C ? 279 1 ATOM 4565 CD . ARG B 279 ? -4.07584 -26.34596 -30.32662 1.000 48.72545 C ? C ? 279 1 ATOM 4566 NE . ARG B 279 ? -4.86940 -26.29212 -31.54940 1.000 57.95847 N ? C ? 279 1 ATOM 4567 CZ . ARG B 279 ? -5.15596 -27.34549 -32.30312 1.000 59.55255 C ? C ? 279 1 ATOM 4568 NH1 . ARG B 279 ? -4.74901 -28.56172 -31.97467 1.000 65.10522 N ? C ? 279 1 ATOM 4569 NH2 . ARG B 279 ? -5.86683 -27.17422 -33.41519 1.000 53.98061 N ? C ? 279 1 ATOM 4570 N . THR B 280 ? -0.94815 -21.89774 -30.56050 1.000 37.08800 N ? C ? 280 1 ATOM 4571 CA . THR B 280 ? -0.69293 -20.54975 -30.08593 1.000 32.77426 C ? C ? 280 1 ATOM 4572 C . THR B 280 ? -1.97121 -19.94550 -29.52373 1.000 30.92738 C ? C ? 280 1 ATOM 4573 O . THR B 280 ? -3.08376 -20.37975 -29.83430 1.000 28.21145 O ? C ? 280 1 ATOM 4574 CB . THR B 280 ? -0.14597 -19.65043 -31.20284 1.000 34.28854 C ? C ? 280 1 ATOM 4575 OG1 . THR B 280 ? -1.14749 -19.47464 -32.21419 1.000 33.82763 O ? C ? 280 1 ATOM 4576 CG2 . THR B 280 ? 1.10291 -20.26437 -31.82048 1.000 30.79966 C ? C ? 280 1 ATOM 4577 N . ILE B 281 ? -1.79241 -18.93640 -28.67788 1.000 31.64019 N ? C ? 281 1 ATOM 4578 CA . ILE B 281 ? -2.88938 -18.14468 -28.13735 1.000 32.48432 C ? C ? 281 1 ATOM 4579 C . ILE B 281 ? -2.52074 -16.68239 -28.33563 1.000 35.42031 C ? C ? 281 1 ATOM 4580 O . ILE B 281 ? -1.52003 -16.21502 -27.77892 1.000 31.73434 O ? C ? 281 1 ATOM 4581 CB . ILE B 281 ? -3.15130 -18.45258 -26.65314 1.000 31.00769 C ? C ? 281 1 ATOM 4582 CG1 . ILE B 281 ? -3.55811 -19.91766 -26.47468 1.000 26.93268 C ? C ? 281 1 ATOM 4583 CG2 . ILE B 281 ? -4.22435 -17.53507 -26.09983 1.000 25.62152 C ? C ? 281 1 ATOM 4584 CD1 . ILE B 281 ? -3.71787 -20.34006 -25.03071 1.000 31.39917 C ? C ? 281 1 ATOM 4585 N . LEU B 282 ? -3.30943 -15.97086 -29.14657 1.000 30.06333 N ? C ? 282 1 ATOM 4586 CA . LEU B 282 ? -3.01222 -14.58520 -29.51984 1.000 28.32724 C ? C ? 282 1 ATOM 4587 C . LEU B 282 ? -1.61120 -14.45690 -30.11467 1.000 27.52257 C ? C ? 282 1 ATOM 4588 O . LEU B 282 ? -0.86340 -13.52995 -29.79874 1.000 26.94399 O ? C ? 282 1 ATOM 4589 CB . LEU B 282 ? -3.18453 -13.63811 -28.32993 1.000 27.90662 C ? C ? 282 1 ATOM 4590 CG . LEU B 282 ? -4.62000 -13.40099 -27.85859 1.000 31.05709 C ? C ? 282 1 ATOM 4591 CD1 . LEU B 282 ? -4.65316 -12.45961 -26.66495 1.000 26.97473 C ? C ? 282 1 ATOM 4592 CD2 . LEU B 282 ? -5.47273 -12.85834 -28.99532 1.000 36.24632 C ? C ? 282 1 ATOM 4593 N . GLY B 283 ? -1.24801 -15.40103 -30.97989 1.000 28.33211 N ? C ? 283 1 ATOM 4594 CA . GLY B 283 ? 0.05074 -15.35937 -31.62388 1.000 27.71226 C ? C ? 283 1 ATOM 4595 C . GLY B 283 ? 1.22690 -15.72835 -30.74818 1.000 33.22519 C ? C ? 283 1 ATOM 4596 O . GLY B 283 ? 2.37518 -15.55761 -31.16998 1.000 35.86889 O ? C ? 283 1 ATOM 4597 N . SER B 284 ? 0.98386 -16.23073 -29.54283 1.000 33.64765 N ? C ? 284 1 ATOM 4598 CA . SER B 284 ? 2.04091 -16.59395 -28.61041 1.000 28.56549 C ? C ? 284 1 ATOM 4599 C . SER B 284 ? 1.98102 -18.08738 -28.32153 1.000 32.01587 C ? C ? 284 1 ATOM 4600 O . SER B 284 ? 0.89989 -18.63780 -28.08565 1.000 28.79598 O ? C ? 284 1 ATOM 4601 CB . SER B 284 ? 1.91841 -15.79894 -27.30864 1.000 30.38609 C ? C ? 284 1 ATOM 4602 OG . SER B 284 ? 2.79158 -16.30817 -26.31239 1.000 40.27897 O ? C ? 284 1 ATOM 4603 N . ALA B 285 ? 3.14135 -18.73860 -28.34550 1.000 34.93904 N ? C ? 285 1 ATOM 4604 CA . ALA B 285 ? 3.25433 -20.13612 -27.95169 1.000 37.52450 C ? C ? 285 1 ATOM 4605 C . ALA B 285 ? 3.51882 -20.30277 -26.46284 1.000 34.61920 C ? C ? 285 1 ATOM 4606 O . ALA B 285 ? 3.69564 -21.43377 -25.99861 1.000 41.31001 O ? C ? 285 1 ATOM 4607 CB . ALA B 285 ? 4.36149 -20.82661 -28.75059 1.000 30.01878 C ? C ? 285 1 ATOM 4608 N . LEU B 286 ? 3.56194 -19.20773 -25.71344 1.000 32.83548 N ? C ? 286 1 ATOM 4609 CA . LEU B 286 ? 3.74348 -19.23541 -24.27387 1.000 30.14163 C ? C ? 286 1 ATOM 4610 C . LEU B 286 ? 2.59372 -18.48806 -23.61487 1.000 31.89356 C ? C ? 286 1 ATOM 4611 O . LEU B 286 ? 1.90706 -17.68131 -24.24796 1.000 31.71668 O ? C ? 286 1 ATOM 4612 CB . LEU B 286 ? 5.08342 -18.61031 -23.86644 1.000 33.66318 C ? C ? 286 1 ATOM 4613 CG . LEU B 286 ? 6.34509 -19.28107 -24.41213 1.000 43.04985 C ? C ? 286 1 ATOM 4614 CD1 . LEU B 286 ? 7.55250 -18.37571 -24.23702 1.000 43.74148 C ? C ? 286 1 ATOM 4615 CD2 . LEU B 286 ? 6.58218 -20.62312 -23.73530 1.000 32.45942 C ? C ? 286 1 ATOM 4616 N . LEU B 287 ? 2.38272 -18.77310 -22.33330 1.000 27.33887 N ? C ? 287 1 ATOM 4617 CA . LEU B 287 ? 1.38637 -18.05478 -21.54854 1.000 24.78473 C ? C ? 287 1 ATOM 4618 C . LEU B 287 ? 1.93415 -16.68324 -21.17269 1.000 25.28228 C ? C ? 287 1 ATOM 4619 O . LEU B 287 ? 3.01247 -16.58119 -20.57942 1.000 29.58711 O ? C ? 287 1 ATOM 4620 CB . LEU B 287 ? 1.01086 -18.85502 -20.30538 1.000 20.08697 C ? C ? 287 1 ATOM 4621 CG . LEU B 287 ? 0.33400 -20.19278 -20.60659 1.000 27.64697 C ? C ? 287 1 ATOM 4622 CD1 . LEU B 287 ? 0.10544 -20.97613 -19.33313 1.000 24.26978 C ? C ? 287 1 ATOM 4623 CD2 . LEU B 287 ? -0.97874 -19.96598 -21.33908 1.000 27.54828 C ? C ? 287 1 ATOM 4624 N . GLU B 288 ? 1.19506 -15.63359 -21.52200 1.000 24.44080 N ? C ? 288 1 ATOM 4625 CA . GLU B 288 ? 1.65568 -14.26319 -21.34813 1.000 24.53243 C ? C ? 288 1 ATOM 4626 C . GLU B 288 ? 1.14694 -13.69736 -20.02801 1.000 25.77064 C ? C ? 288 1 ATOM 4627 O . GLU B 288 ? -0.04121 -13.81617 -19.71210 1.000 24.22951 O ? C ? 288 1 ATOM 4628 CB . GLU B 288 ? 1.18574 -13.39379 -22.51340 1.000 26.19417 C ? C ? 288 1 ATOM 4629 CG . GLU B 288 ? 1.63353 -11.95443 -22.40292 1.000 36.64607 C ? C ? 288 1 ATOM 4630 CD . GLU B 288 ? 3.13361 -11.82019 -22.51448 1.000 34.65452 C ? C ? 288 1 ATOM 4631 OE1 . GLU B 288 ? 3.71014 -12.43386 -23.43749 1.000 44.96091 O ? C ? 288 1 ATOM 4632 OE2 . GLU B 288 ? 3.73694 -11.11930 -21.67529 1.000 38.36548 O ? C ? 288 1 ATOM 4633 N . ASP B 289 ? 2.04514 -13.06450 -19.26715 1.000 24.53460 N ? C ? 289 1 ATOM 4634 CA . ASP B 289 ? 1.72250 -12.59528 -17.92328 1.000 30.01268 C ? C ? 289 1 ATOM 4635 C . ASP B 289 ? 1.99025 -11.10398 -17.73275 1.000 26.31529 C ? C ? 289 1 ATOM 4636 O . ASP B 289 ? 2.04517 -10.63228 -16.59178 1.000 26.53700 O ? C ? 289 1 ATOM 4637 CB . ASP B 289 ? 2.49006 -13.40640 -16.87470 1.000 29.43077 C ? C ? 289 1 ATOM 4638 CG . ASP B 289 ? 3.97648 -13.08694 -16.84750 1.000 33.61920 C ? C ? 289 1 ATOM 4639 OD1 . ASP B 289 ? 4.59678 -12.96648 -17.92867 1.000 33.94118 O ? C ? 289 1 ATOM 4640 OD2 . ASP B 289 ? 4.52385 -12.95806 -15.73021 1.000 44.85854 O ? C ? 289 1 ATOM 4641 N . GLU B 290 ? 2.14796 -10.34635 -18.82025 1.000 22.27159 N ? C ? 290 1 ATOM 4642 CA . GLU B 290 ? 2.45713 -8.92306 -18.73967 1.000 25.99866 C ? C ? 290 1 ATOM 4643 C . GLU B 290 ? 1.26228 -8.04044 -19.08562 1.000 29.93590 C ? C ? 290 1 ATOM 4644 O . GLU B 290 ? 1.44630 -6.87712 -19.46059 1.000 25.02568 O ? C ? 290 1 ATOM 4645 CB . GLU B 290 ? 3.64038 -8.57759 -19.64364 1.000 25.68293 C ? C ? 290 1 ATOM 4646 CG . GLU B 290 ? 4.96908 -9.10673 -19.15056 1.000 29.60869 C ? C ? 290 1 ATOM 4647 CD . GLU B 290 ? 6.13603 -8.29671 -19.67184 1.000 47.41697 C ? C ? 290 1 ATOM 4648 OE1 . GLU B 290 ? 6.14080 -7.95709 -20.87544 1.000 54.65806 O ? C ? 290 1 ATOM 4649 OE2 . GLU B 290 ? 7.04071 -7.98385 -18.87102 1.000 43.30513 O ? C ? 290 1 ATOM 4650 N . PHE B 291 ? 0.04483 -8.56834 -18.96590 1.000 22.28600 N ? C ? 291 1 ATOM 4651 CA . PHE B 291 ? -1.18040 -7.79809 -19.14113 1.000 19.82736 C ? C ? 291 1 ATOM 4652 C . PHE B 291 ? -2.01902 -7.91608 -17.87814 1.000 22.96099 C ? C ? 291 1 ATOM 4653 O . PHE B 291 ? -2.43502 -9.02069 -17.51072 1.000 19.85745 O ? C ? 291 1 ATOM 4654 CB . PHE B 291 ? -1.97912 -8.28709 -20.34885 1.000 22.40761 C ? C ? 291 1 ATOM 4655 CG . PHE B 291 ? -1.32165 -8.00757 -21.66325 1.000 22.36525 C ? C ? 291 1 ATOM 4656 CD1 . PHE B 291 ? -1.43503 -6.76147 -22.25475 1.000 23.60233 C ? C ? 291 1 ATOM 4657 CD2 . PHE B 291 ? -0.60187 -8.99432 -22.31436 1.000 25.07175 C ? C ? 291 1 ATOM 4658 CE1 . PHE B 291 ? -0.83321 -6.49992 -23.46768 1.000 27.74568 C ? C ? 291 1 ATOM 4659 CE2 . PHE B 291 ? 0.00005 -8.74248 -23.52725 1.000 30.34666 C ? C ? 291 1 ATOM 4660 CZ . PHE B 291 ? -0.11625 -7.49407 -24.10660 1.000 32.30482 C ? C ? 291 1 ATOM 4661 N . THR B 292 ? -2.26029 -6.78503 -17.21870 1.000 21.63577 N ? C ? 292 1 ATOM 4662 CA . THR B 292 ? -3.17641 -6.72391 -16.08902 1.000 24.93721 C ? C ? 292 1 ATOM 4663 C . THR B 292 ? -4.61300 -6.82481 -16.58361 1.000 23.47050 C ? C ? 292 1 ATOM 4664 O . THR B 292 ? -4.88989 -6.64089 -17.77152 1.000 28.67900 O ? C ? 292 1 ATOM 4665 CB . THR B 292 ? -2.97849 -5.41799 -15.32594 1.000 28.38072 C ? C ? 292 1 ATOM 4666 OG1 . THR B 292 ? -3.56344 -4.34554 -16.07266 1.000 33.56475 O ? C ? 292 1 ATOM 4667 CG2 . THR B 292 ? -1.50590 -5.12975 -15.13359 1.000 29.21717 C ? C ? 292 1 ATOM 4668 N . PRO B 293 ? -5.56189 -7.12935 -15.69375 1.000 21.46389 N ? C ? 293 1 ATOM 4669 CA . PRO B 293 ? -6.97245 -7.04945 -16.10288 1.000 24.01591 C ? C ? 293 1 ATOM 4670 C . PRO B 293 ? -7.36696 -5.67175 -16.60325 1.000 26.44596 C ? C ? 293 1 ATOM 4671 O . PRO B 293 ? -8.18982 -5.57070 -17.52047 1.000 24.31986 O ? C ? 293 1 ATOM 4672 CB . PRO B 293 ? -7.72802 -7.43378 -14.82469 1.000 21.72697 C ? C ? 293 1 ATOM 4673 CG . PRO B 293 ? -6.77149 -8.29483 -14.08123 1.000 24.98559 C ? C ? 293 1 ATOM 4674 CD . PRO B 293 ? -5.41319 -7.71149 -14.34668 1.000 23.39271 C ? C ? 293 1 ATOM 4675 N . PHE B 294 ? -6.79639 -4.60510 -16.03671 1.000 29.63906 N ? C ? 294 1 ATOM 4676 C . PHE B 294 ? -6.54883 -3.03101 -17.91298 1.000 28.07229 C ? C ? 294 1 ATOM 4677 O . PHE B 294 ? -7.19307 -2.37830 -18.74290 1.000 30.83013 O ? C ? 294 1 ATOM 4678 CA A PHE B 294 ? -7.10636 -3.26077 -16.51538 0.539 28.36415 C ? C ? 294 1 ATOM 4679 CB A PHE B 294 ? -6.56271 -2.20951 -15.54711 0.539 30.68937 C ? C ? 294 1 ATOM 4680 CG A PHE B 294 ? -6.30843 -0.86714 -16.18706 0.539 34.04582 C ? C ? 294 1 ATOM 4681 CD1 A PHE B 294 ? -7.35606 0.00035 -16.46071 0.539 37.96345 C ? C ? 294 1 ATOM 4682 CD2 A PHE B 294 ? -5.01877 -0.47236 -16.51230 0.539 36.94724 C ? C ? 294 1 ATOM 4683 CE1 A PHE B 294 ? -7.12232 1.23466 -17.04944 0.539 34.60996 C ? C ? 294 1 ATOM 4684 CE2 A PHE B 294 ? -4.77897 0.75932 -17.10132 0.539 42.34347 C ? C ? 294 1 ATOM 4685 CZ A PHE B 294 ? -5.83279 1.61366 -17.36902 0.539 34.75200 C ? C ? 294 1 ATOM 4686 CA B PHE B 294 ? -7.11026 -3.26403 -16.51523 0.461 28.38326 C ? C ? 294 1 ATOM 4687 CB B PHE B 294 ? -6.57174 -2.22919 -15.53173 0.461 30.72588 C ? C ? 294 1 ATOM 4688 CG B PHE B 294 ? -6.57980 -2.69940 -14.10839 0.461 33.50168 C ? C ? 294 1 ATOM 4689 CD1 B PHE B 294 ? -7.73662 -2.63736 -13.35031 0.461 34.68904 C ? C ? 294 1 ATOM 4690 CD2 B PHE B 294 ? -5.43284 -3.22002 -13.53329 0.461 34.80963 C ? C ? 294 1 ATOM 4691 CE1 B PHE B 294 ? -7.74611 -3.07760 -12.04185 0.461 38.37380 C ? C ? 294 1 ATOM 4692 CE2 B PHE B 294 ? -5.43583 -3.66135 -12.22812 0.461 36.81039 C ? C ? 294 1 ATOM 4693 CZ B PHE B 294 ? -6.59345 -3.58979 -11.48009 0.461 43.81135 C ? C ? 294 1 ATOM 4694 N . ASP B 295 ? -5.34944 -3.55510 -18.19027 1.000 30.08437 N ? C ? 295 1 ATOM 4695 CA . ASP B 295 ? -4.75599 -3.39672 -19.51602 1.000 30.03329 C ? C ? 295 1 ATOM 4696 C . ASP B 295 ? -5.64704 -4.00475 -20.58495 1.000 27.20263 C ? C ? 295 1 ATOM 4697 O . ASP B 295 ? -5.82986 -3.42535 -21.66129 1.000 27.55946 O ? C ? 295 1 ATOM 4698 CB . ASP B 295 ? -3.37262 -4.04367 -19.57063 1.000 28.95708 C ? C ? 295 1 ATOM 4699 CG . ASP B 295 ? -2.37133 -3.36038 -18.67459 1.000 32.44327 C ? C ? 295 1 ATOM 4700 OD1 . ASP B 295 ? -2.56350 -2.16612 -18.35956 1.000 34.63771 O ? C ? 295 1 ATOM 4701 OD2 . ASP B 295 ? -1.38782 -4.02464 -18.28628 1.000 29.71233 O ? C ? 295 1 ATOM 4702 N . VAL B 296 ? -6.20215 -5.18443 -20.30465 1.000 27.85132 N ? C ? 296 1 ATOM 4703 CA . VAL B 296 ? -7.04737 -5.86260 -21.28090 1.000 26.46754 C ? C ? 296 1 ATOM 4704 C . VAL B 296 ? -8.28372 -5.02466 -21.57762 1.000 28.62436 C ? C ? 296 1 ATOM 4705 O . VAL B 296 ? -8.61127 -4.75335 -22.73881 1.000 29.68921 O ? C ? 296 1 ATOM 4706 CB . VAL B 296 ? -7.41566 -7.26798 -20.77552 1.000 21.85846 C ? C ? 296 1 ATOM 4707 CG1 . VAL B 296 ? -8.42708 -7.91872 -21.70218 1.000 21.82166 C ? C ? 296 1 ATOM 4708 CG2 . VAL B 296 ? -6.16410 -8.11711 -20.65831 1.000 19.77583 C ? C ? 296 1 ATOM 4709 N . VAL B 297 ? -8.97664 -4.58689 -20.52576 1.000 29.61349 N ? C ? 297 1 ATOM 4710 CA . VAL B 297 ? -10.15926 -3.74814 -20.69641 1.000 30.89794 C ? C ? 297 1 ATOM 4711 C . VAL B 297 ? -9.80649 -2.46900 -21.45012 1.000 37.46879 C ? C ? 297 1 ATOM 4712 O . VAL B 297 ? -10.54987 -2.02691 -22.33433 1.000 34.37564 O ? C ? 297 1 ATOM 4713 CB . VAL B 297 ? -10.79384 -3.45458 -19.32235 1.000 28.02567 C ? C ? 297 1 ATOM 4714 CG1 . VAL B 297 ? -11.85080 -2.37149 -19.43299 1.000 36.33605 C ? C ? 297 1 ATOM 4715 CG2 . VAL B 297 ? -11.39329 -4.72340 -18.73700 1.000 25.78842 C ? C ? 297 1 ATOM 4716 N . ARG B 298 ? -8.65515 -1.87141 -21.13253 1.000 33.42084 N ? C ? 298 1 ATOM 4717 CA . ARG B 298 ? -8.26670 -0.61261 -21.76262 1.000 38.15324 C ? C ? 298 1 ATOM 4718 C . ARG B 298 ? -8.06041 -0.78062 -23.26519 1.000 42.92139 C ? C ? 298 1 ATOM 4719 O . ARG B 298 ? -8.48693 0.06788 -24.05807 1.000 45.17012 O ? C ? 298 1 ATOM 4720 CB . ARG B 298 ? -6.99356 -0.07989 -21.10489 1.000 42.78876 C ? C ? 298 1 ATOM 4721 CG . ARG B 298 ? -6.83897 1.43084 -21.13303 1.000 48.27700 C ? C ? 298 1 ATOM 4722 CD . ARG B 298 ? -5.37927 1.81351 -21.29570 1.000 52.20642 C ? C ? 298 1 ATOM 4723 NE . ARG B 298 ? -4.50018 0.95026 -20.51460 1.000 49.92592 N ? C ? 298 1 ATOM 4724 CZ . ARG B 298 ? -3.21170 0.76648 -20.77121 1.000 53.99427 C ? C ? 298 1 ATOM 4725 NH1 . ARG B 298 ? -2.61862 1.36398 -21.79370 1.000 51.22104 N ? C ? 298 1 ATOM 4726 NH2 . ARG B 298 ? -2.50122 -0.03975 -19.98526 1.000 41.27001 N ? C ? 298 1 ATOM 4727 N . GLN B 299 ? -7.40578 -1.86982 -23.67634 1.000 31.60281 N ? C ? 299 1 ATOM 4728 CA . GLN B 299 ? -7.13836 -2.08003 -25.09509 1.000 36.07797 C ? C ? 299 1 ATOM 4729 C . GLN B 299 ? -8.39000 -2.51240 -25.84590 1.000 41.16863 C ? C ? 299 1 ATOM 4730 O . GLN B 299 ? -8.51190 -2.25092 -27.04838 1.000 45.63878 O ? C ? 299 1 ATOM 4731 CB . GLN B 299 ? -6.02537 -3.11481 -25.26926 1.000 35.05423 C ? C ? 299 1 ATOM 4732 CG . GLN B 299 ? -5.58465 -3.33715 -26.70535 1.000 36.28648 C ? C ? 299 1 ATOM 4733 CD . GLN B 299 ? -4.28262 -4.11189 -26.80489 1.000 38.83583 C ? C ? 299 1 ATOM 4734 OE1 . GLN B 299 ? -3.97927 -4.69821 -27.84183 1.000 33.48770 O ? C ? 299 1 ATOM 4735 NE2 . GLN B 299 ? -3.50146 -4.10924 -25.72693 1.000 35.28220 N ? C ? 299 1 ATOM 4736 N . CYS B 300 ? -9.33006 -3.15790 -25.16161 1.000 42.40171 N ? C ? 300 1 ATOM 4737 CA . CYS B 300 ? -10.54333 -3.65193 -25.79326 1.000 36.35968 C ? C ? 300 1 ATOM 4738 C . CYS B 300 ? -11.70411 -2.66646 -25.71190 1.000 42.74747 C ? C ? 300 1 ATOM 4739 O . CYS B 300 ? -12.75896 -2.92481 -26.29802 1.000 45.41336 O ? C ? 300 1 ATOM 4740 CB . CYS B 300 ? -10.93500 -4.99497 -25.17306 1.000 41.79758 C ? C ? 300 1 ATOM 4741 SG . CYS B 300 ? -9.65168 -6.27404 -25.35950 1.000 45.79133 S ? C ? 300 1 ATOM 4742 N . SER B 301 ? -11.53219 -1.53870 -25.01580 1.000 43.98545 N ? C ? 301 1 ATOM 4743 CA . SER B 301 ? -12.54221 -0.48976 -24.96558 1.000 45.84961 C ? C ? 301 1 ATOM 4744 C . SER B 301 ? -12.12236 0.79712 -25.66292 1.000 45.98308 C ? C ? 301 1 ATOM 4745 O . SER B 301 ? -12.99003 1.61837 -25.97440 1.000 59.68857 O ? C ? 301 1 ATOM 4746 CB . SER B 301 ? -12.90797 -0.15808 -23.50909 1.000 54.08144 C ? C ? 301 1 ATOM 4747 OG . SER B 301 ? -11.86639 0.56488 -22.86951 1.000 51.82224 O ? C ? 301 1 ATOM 4748 N . GLY B 302 ? -10.82730 0.99998 -25.90180 1.000 48.32719 N ? C ? 302 1 ATOM 4749 CA . GLY B 302 ? -10.36133 2.18475 -26.59526 1.000 51.02394 C ? C ? 302 1 ATOM 4750 C . GLY B 302 ? -10.17209 3.41330 -25.73701 1.000 49.61369 C ? C ? 302 1 ATOM 4751 O . GLY B 302 ? -10.41016 4.52966 -26.21302 1.000 42.20527 O ? C ? 302 1 ATOM 4752 N . VAL B 303 ? -9.74712 3.24550 -24.48431 1.000 45.52434 N ? C ? 303 1 ATOM 4753 CA . VAL B 303 ? -9.54099 4.38109 -23.59138 1.000 59.64688 C ? C ? 303 1 ATOM 4754 C . VAL B 303 ? -8.33993 5.18835 -24.06409 1.000 58.20327 C ? C ? 303 1 ATOM 4755 O . VAL B 303 ? -7.25600 4.63852 -24.30160 1.000 54.89871 O ? C ? 303 1 ATOM 4756 CB . VAL B 303 ? -9.35575 3.90135 -22.14324 1.000 53.74409 C ? C ? 303 1 ATOM 4757 CG1 . VAL B 303 ? -8.77403 5.01670 -21.27520 1.000 52.91526 C ? C ? 303 1 ATOM 4758 CG2 . VAL B 303 ? -10.67650 3.41372 -21.57458 1.000 51.49950 C ? C ? 303 1 ATOM 4759 N . THR B 304 ? -8.52815 6.49935 -24.20170 1.000 52.82753 N ? C ? 304 1 ATOM 4760 CA . THR B 304 ? -7.50665 7.41505 -24.69191 1.000 54.79717 C ? C ? 304 1 ATOM 4761 C . THR B 304 ? -7.05529 8.35527 -23.57335 1.000 60.45562 C ? C ? 304 1 ATOM 4762 O . THR B 304 ? -7.57105 8.32264 -22.45121 1.000 63.57109 O ? C ? 304 1 ATOM 4763 CB . THR B 304 ? -8.03238 8.19682 -25.89739 1.000 51.54397 C ? C ? 304 1 ATOM 4764 OG1 . THR B 304 ? -9.18134 8.96006 -25.51062 1.000 56.24067 O ? C ? 304 1 ATOM 4765 CG2 . THR B 304 ? -8.42740 7.23765 -27.00778 1.000 47.63934 C ? C ? 304 1 ATOM 4766 N . PHE B 305 ? -6.07470 9.20060 -23.89125 1.000 56.95063 N ? C ? 305 1 ATOM 4767 CA . PHE B 305 ? -5.49913 10.11957 -22.90904 1.000 61.92298 C ? C ? 305 1 ATOM 4768 C . PHE B 305 ? -5.27453 11.50588 -23.50511 1.000 65.27898 C ? C ? 305 1 ATOM 4769 O . PHE B 305 ? -4.73800 11.63892 -24.60623 1.000 65.75224 O ? C ? 305 1 ATOM 4770 CB . PHE B 305 ? -4.17879 9.56594 -22.36556 1.000 49.18446 C ? C ? 305 1 ATOM 4771 CG . PHE B 305 ? -4.22396 8.10098 -22.06218 1.000 50.82814 C ? C ? 305 1 ATOM 4772 CD1 . PHE B 305 ? -4.84719 7.63620 -20.91706 1.000 48.81096 C ? C ? 305 1 ATOM 4773 CD2 . PHE B 305 ? -3.65980 7.18530 -22.93194 1.000 44.04009 C ? C ? 305 1 ATOM 4774 CE1 . PHE B 305 ? -4.89977 6.28605 -20.64121 1.000 48.06076 C ? C ? 305 1 ATOM 4775 CE2 . PHE B 305 ? -3.70904 5.83392 -22.66177 1.000 44.91511 C ? C ? 305 1 ATOM 4776 CZ . PHE B 305 ? -4.32980 5.38271 -21.51529 1.000 50.47947 C ? C ? 305 1 HETATM 4777 C01 . ZQ8 B 401 ? 23.15447 2.50696 -16.20955 1.000 22.25755 C ? D ? . 1 HETATM 4778 C03 . ZQ8 B 401 ? 23.72668 1.03673 -16.29174 1.000 26.46111 C ? D ? . 1 HETATM 4779 C04 . ZQ8 B 401 ? 22.77820 0.12622 -17.16227 1.000 23.22285 C ? D ? . 1 HETATM 4780 C05 . ZQ8 B 401 ? 23.11025 -1.39659 -17.19297 1.000 30.50597 C ? D ? . 1 HETATM 4781 C06 . ZQ8 B 401 ? 24.32246 -1.63960 -18.04434 1.000 33.11039 C ? D ? . 1 HETATM 4782 C07 . ZQ8 B 401 ? 23.97005 -2.75571 -19.06637 1.000 37.37165 C ? D ? . 1 HETATM 4783 C09 . ZQ8 B 401 ? 21.98553 -2.27979 -17.85548 1.000 28.68132 C ? D ? . 1 HETATM 4784 C12 . ZQ8 B 401 ? 25.06731 -0.20418 -14.47518 1.000 27.43318 C ? D ? . 1 HETATM 4785 C13 . ZQ8 B 401 ? 25.18531 -0.70193 -12.93174 1.000 20.79186 C ? D ? . 1 HETATM 4786 C14 . ZQ8 B 401 ? 25.89996 0.33069 -12.02862 1.000 23.44296 C ? D ? . 1 HETATM 4787 C16 . ZQ8 B 401 ? 23.61692 0.69995 -9.80179 1.000 32.54315 C ? D ? . 1 HETATM 4788 C17 . ZQ8 B 401 ? 25.54587 -1.79026 -9.57462 1.000 30.08336 C ? D ? . 1 HETATM 4789 C18 . ZQ8 B 401 ? 26.66432 1.09025 -8.93764 1.000 30.66054 C ? D ? . 1 HETATM 4790 C20 . ZQ8 B 401 ? 25.15384 -3.22391 -13.18783 1.000 28.76611 C ? D ? . 1 HETATM 4791 C21 . ZQ8 B 401 ? 25.79772 -4.59404 -12.90406 1.000 30.78849 C ? D ? . 1 HETATM 4792 C22 . ZQ8 B 401 ? 26.94464 -4.89067 -12.10821 1.000 24.75211 C ? D ? . 1 HETATM 4793 C23 . ZQ8 B 401 ? 27.14396 -6.35002 -12.09640 1.000 35.32130 C ? D ? . 1 HETATM 4794 C24 . ZQ8 B 401 ? 28.08568 -7.26669 -11.51789 1.000 29.57317 C ? D ? . 1 HETATM 4795 C25 . ZQ8 B 401 ? 27.95325 -8.65107 -11.73220 1.000 31.24092 C ? D ? . 1 HETATM 4796 C26 . ZQ8 B 401 ? 26.88686 -9.16076 -12.52944 1.000 29.79872 C ? D ? . 1 HETATM 4797 C27 . ZQ8 B 401 ? 25.95509 -8.27860 -13.10299 1.000 34.60725 C ? D ? . 1 HETATM 4798 C29 . ZQ8 B 401 ? 26.06828 -6.87747 -12.89749 1.000 30.30303 C ? D ? . 1 HETATM 4799 N08 . ZQ8 B 401 ? 22.53551 -3.03665 -18.91212 1.000 28.68174 N ? D ? . 1 HETATM 4800 N11 . ZQ8 B 401 ? 23.96554 0.51828 -14.95435 1.000 22.68764 N ? D ? . 1 HETATM 4801 N19 . ZQ8 B 401 ? 25.73396 -2.02063 -12.77737 1.000 22.43988 N ? D ? . 1 HETATM 4802 N30 . ZQ8 B 401 ? 25.29120 -5.80750 -13.34742 1.000 24.74242 N ? D ? . 1 HETATM 4803 O02 . ZQ8 B 401 ? 23.43921 3.21239 -17.40995 1.000 36.91497 O ? D ? . 1 HETATM 4804 O10 . ZQ8 B 401 ? 20.79395 -2.33959 -17.52416 1.000 26.70522 O ? D ? . 1 HETATM 4805 O31 . ZQ8 B 401 ? 24.05561 -3.19967 -13.76969 1.000 26.73469 O ? D ? . 1 HETATM 4806 O32 . ZQ8 B 401 ? 26.01001 -0.49893 -15.23463 1.000 28.03283 O ? D ? . 1 HETATM 4807 CL28 . ZQ8 B 401 ? 24.65795 -8.84131 -14.06456 1.000 34.86924 Cl ? D ? . 1 HETATM 4808 SI15 . ZQ8 B 401 ? 25.44278 0.08527 -10.06025 1.000 27.97356 Si ? D ? . 1 HETATM 4809 O . HOH S 1 ? -0.92983 -11.20076 -19.02998 1.000 20.07419 O ? E ? . 1 HETATM 4810 O . HOH S 2 ? 22.42218 14.63565 0.63308 1.000 24.28564 O ? E ? . 1 HETATM 4811 O . HOH S 3 ? -2.60630 -2.73337 -46.41718 1.000 16.69017 O ? E ? . 1 HETATM 4812 O . HOH S 4 ? 5.54590 -2.60290 -25.85266 1.000 26.67936 O ? E ? . 1 HETATM 4813 O . HOH S 5 ? 3.10555 7.61939 -47.10641 1.000 21.40040 O ? E ? . 1 HETATM 4814 O . HOH S 6 ? 12.54632 -10.67728 -36.55212 1.000 19.18780 O ? E ? . 1 HETATM 4815 O . HOH S 7 ? 29.84217 24.75146 -6.86570 1.000 28.32853 O ? E ? . 1 HETATM 4816 O . HOH S 8 ? -1.85483 8.14724 -35.20108 1.000 20.83792 O ? E ? . 1 HETATM 4817 O . HOH S 9 ? -0.42512 -3.28779 -23.26119 1.000 25.67359 O ? E ? . 1 HETATM 4818 O . HOH S 10 ? 7.92969 6.83942 -7.46412 1.000 25.52425 O ? E ? . 1 HETATM 4819 O . HOH S 11 ? 13.76430 -3.55506 -9.11478 1.000 24.49049 O ? E ? . 1 HETATM 4820 O . HOH S 12 ? 8.00518 -2.65327 -1.99785 1.000 33.92384 O ? E ? . 1 HETATM 4821 O . HOH S 13 ? 5.74762 -2.64649 -29.49494 1.000 29.34798 O ? E ? . 1 HETATM 4822 O . HOH S 14 ? -1.97560 -9.31033 -50.43550 1.000 25.27672 O ? E ? . 1 HETATM 4823 O . HOH S 15 ? 16.92032 -3.08596 -1.67092 1.000 28.62356 O ? E ? . 1 HETATM 4824 O . HOH S 16 ? -7.09509 -25.86048 -21.33750 1.000 26.67084 O ? E ? . 1 HETATM 4825 O . HOH S 17 ? -11.20688 5.04433 -46.95624 1.000 19.34235 O ? E ? . 1 HETATM 4826 O . HOH S 18 ? 12.87580 7.88706 -19.56941 1.000 24.62852 O ? E ? . 1 HETATM 4827 O . HOH S 19 ? -1.82437 29.66241 -39.42226 1.000 31.25791 O ? E ? . 1 HETATM 4828 O . HOH S 20 ? 8.71595 6.03914 -50.70351 1.000 35.68781 O ? E ? . 1 HETATM 4829 O . HOH S 21 ? -1.29935 6.84994 -57.06718 1.000 31.45587 O ? E ? . 1 HETATM 4830 O . HOH S 22 ? 13.14636 -6.25276 -43.92373 1.000 27.21735 O ? E ? . 1 HETATM 4831 O . HOH S 23 ? 23.28013 8.16403 -21.16485 1.000 24.83536 O ? E ? . 1 HETATM 4832 O . HOH S 24 ? 0.01470 0.02512 -17.68215 1.000 28.63672 O ? E ? . 1 HETATM 4833 O . HOH S 25 ? -12.56756 -7.32120 -45.56911 1.000 26.08284 O ? E ? . 1 HETATM 4834 O . HOH S 26 ? 5.67578 -1.20023 -51.32692 1.000 29.67122 O ? E ? . 1 HETATM 4835 O . HOH S 27 ? 19.49804 -10.32457 -3.38704 1.000 26.02701 O ? E ? . 1 HETATM 4836 O . HOH S 28 ? 11.74834 12.16320 -4.73480 1.000 36.34497 O ? E ? . 1 HETATM 4837 O . HOH S 29 ? 27.01213 -10.10949 -45.31168 1.000 32.72512 O ? E ? . 1 HETATM 4838 O . HOH S 30 ? -11.65620 -23.54735 -2.87840 1.000 38.11460 O ? E ? . 1 HETATM 4839 O . HOH S 31 ? 23.27899 21.56807 -2.02531 1.000 33.87200 O ? E ? . 1 HETATM 4840 O . HOH S 32 ? -4.85867 -25.10412 -2.36047 1.000 44.83050 O ? E ? . 1 HETATM 4841 O . HOH S 33 ? -5.44739 2.32753 -53.14795 1.000 27.98577 O ? E ? . 1 HETATM 4842 O . HOH S 34 ? 3.32457 -1.57763 -53.34099 1.000 34.30792 O ? E ? . 1 HETATM 4843 O . HOH S 35 ? 10.55297 -4.21554 -2.62304 1.000 28.89265 O ? E ? . 1 HETATM 4844 O . HOH S 36 ? 2.98365 -29.27880 -18.95779 1.000 35.49861 O ? E ? . 1 HETATM 4845 O . HOH S 37 ? 1.07756 -2.61532 -52.49561 1.000 27.43794 O ? E ? . 1 HETATM 4846 O . HOH S 38 ? -0.12901 -12.62000 -26.75962 1.000 34.40980 O ? E ? . 1 HETATM 4847 O . HOH S 39 ? 13.33519 -10.07424 -5.46524 1.000 32.59166 O ? E ? . 1 HETATM 4848 O . HOH S 40 ? -7.67001 0.39192 -53.88882 1.000 31.53727 O ? E ? . 1 HETATM 4849 O . HOH S 41 ? -5.20290 -1.97066 -53.88088 1.000 24.39857 O ? E ? . 1 HETATM 4850 O . HOH S 42 ? 20.98971 7.91411 0.32099 1.000 31.55977 O ? E ? . 1 HETATM 4851 O . HOH S 43 ? -10.90974 -29.35775 -12.86638 1.000 34.01201 O ? E ? . 1 HETATM 4852 O . HOH S 44 ? -2.16063 -13.72015 -9.37362 1.000 31.46145 O ? E ? . 1 HETATM 4853 O . HOH S 45 ? -17.38939 -1.17994 -43.48910 1.000 28.39301 O ? E ? . 1 HETATM 4854 O . HOH S 46 ? 11.56456 -9.77471 -3.55629 1.000 25.87430 O ? E ? . 1 HETATM 4855 O . HOH S 47 ? 27.61699 -14.67286 -48.23551 1.000 27.37279 O ? E ? . 1 HETATM 4856 O . HOH S 48 ? 5.57732 -0.55523 -27.55854 1.000 29.86557 O ? E ? . 1 HETATM 4857 O . HOH S 49 ? 27.88547 -15.21746 -45.58729 1.000 31.75363 O ? E ? . 1 HETATM 4858 O . HOH S 50 ? -0.59857 -1.26501 -13.51029 1.000 23.97030 O ? E ? . 1 HETATM 4859 O . HOH S 51 ? 27.45707 -28.21927 -35.63250 1.000 51.86734 O ? E ? . 1 HETATM 4860 O . HOH S 52 ? 23.83766 -7.73860 -10.01252 1.000 27.79869 O ? E ? . 1 HETATM 4861 O . HOH S 53 ? -1.91212 2.21683 -24.11586 1.000 31.01279 O ? E ? . 1 HETATM 4862 O . HOH S 54 ? -10.29286 1.48881 -52.97874 1.000 28.57726 O ? E ? . 1 HETATM 4863 O . HOH S 55 ? 19.10708 -0.47366 -1.45186 1.000 34.50833 O ? E ? . 1 HETATM 4864 O . HOH S 56 ? -0.10250 17.07228 -17.74704 1.000 38.04362 O ? E ? . 1 HETATM 4865 O . HOH S 57 ? 10.85485 0.70197 -37.27922 1.000 29.09304 O ? E ? . 1 HETATM 4866 O . HOH S 58 ? 28.17768 22.75824 -3.98507 1.000 29.70973 O ? E ? . 1 HETATM 4867 O . HOH S 59 ? -15.02754 -15.81020 -28.55915 1.000 36.40465 O ? E ? . 1 HETATM 4868 O . HOH S 60 ? -4.81656 -20.23557 -32.08075 1.000 29.28108 O ? E ? . 1 HETATM 4869 O . HOH S 61 ? 24.21526 -26.46211 -43.81730 1.000 41.59197 O ? E ? . 1 HETATM 4870 O . HOH S 62 ? 24.57393 -24.89213 -54.18047 1.000 45.28916 O ? E ? . 1 HETATM 4871 O . HOH S 63 ? 16.82636 1.06961 -1.98883 1.000 21.78985 O ? E ? . 1 HETATM 4872 O . HOH S 64 ? 10.10352 18.12492 -8.83493 1.000 32.75645 O ? E ? . 1 HETATM 4873 O . HOH S 65 ? -12.02005 -7.71101 -15.11463 1.000 39.81429 O ? E ? . 1 HETATM 4874 O . HOH S 66 ? 10.81547 17.71159 -36.33263 1.000 31.09780 O ? E ? . 1 HETATM 4875 O . HOH S 67 ? 30.24310 23.56487 -13.99864 1.000 29.44878 O ? E ? . 1 HETATM 4876 O . HOH S 68 ? 23.24618 -5.74167 -40.34762 1.000 38.37041 O ? E ? . 1 HETATM 4877 O . HOH S 69 ? 8.80934 11.95612 -30.52472 1.000 31.89889 O ? E ? . 1 HETATM 4878 O . HOH S 70 ? -2.73971 -8.58967 -33.88157 1.000 34.34191 O ? E ? . 1 HETATM 4879 O . HOH S 71 ? 0.59902 -4.23026 -20.51473 1.000 32.61059 O ? E ? . 1 HETATM 4880 O . HOH S 72 ? -15.66027 24.89472 -42.80205 1.000 41.53084 O ? E ? . 1 HETATM 4881 O . HOH S 73 ? -2.12194 -29.22813 -31.71228 1.000 33.00935 O ? E ? . 1 HETATM 4882 O . HOH S 74 ? 21.96437 -11.24698 -3.95326 1.000 35.51069 O ? E ? . 1 HETATM 4883 O . HOH S 75 ? 2.79944 4.32137 -12.39654 1.000 30.64501 O ? E ? . 1 HETATM 4884 O . HOH S 76 ? 0.23280 4.01353 -11.65431 1.000 35.50995 O ? E ? . 1 HETATM 4885 O . HOH S 77 ? 2.38700 11.51090 -23.52641 1.000 33.31516 O ? E ? . 1 HETATM 4886 O . HOH S 78 ? -8.40144 -12.39761 -1.04505 1.000 37.43005 O ? E ? . 1 HETATM 4887 O . HOH S 79 ? -8.03102 20.35070 -50.26773 1.000 39.80346 O ? E ? . 1 HETATM 4888 O . HOH S 80 ? -15.57403 2.34220 -36.97811 1.000 35.51506 O ? E ? . 1 HETATM 4889 O . HOH S 81 ? 12.94942 -12.72874 -52.00759 1.000 38.26573 O ? E ? . 1 HETATM 4890 O . HOH S 82 ? 22.20763 7.54295 -31.57518 1.000 39.13328 O ? E ? . 1 HETATM 4891 O . HOH S 83 ? 21.08504 -7.75548 -3.32456 1.000 33.51321 O ? E ? . 1 HETATM 4892 O . HOH S 84 ? 20.33790 27.74426 -16.73643 1.000 36.74866 O ? E ? . 1 HETATM 4893 O . HOH S 85 ? -15.52125 -9.97614 -28.75143 1.000 44.33602 O ? E ? . 1 HETATM 4894 O . HOH S 86 ? 18.82396 -1.73661 1.01423 1.000 40.58297 O ? E ? . 1 HETATM 4895 O . HOH S 87 ? 7.11650 6.49386 -4.57986 1.000 36.53239 O ? E ? . 1 HETATM 4896 O . HOH S 88 ? -9.74173 -6.72779 -52.32400 1.000 27.27105 O ? E ? . 1 HETATM 4897 O . HOH S 89 ? 28.63566 -0.23014 -0.40048 1.000 39.63499 O ? E ? . 1 HETATM 4898 O . HOH S 90 ? -11.07342 15.82996 -55.27408 1.000 29.33299 O ? E ? . 1 HETATM 4899 O . HOH S 91 ? 14.25005 -0.77645 -1.06324 1.000 34.93199 O ? E ? . 1 HETATM 4900 O . HOH S 92 ? -9.58605 8.73603 -55.75589 1.000 31.69654 O ? E ? . 1 HETATM 4901 O . HOH S 93 ? 24.52901 19.39779 -0.00315 1.000 32.36251 O ? E ? . 1 HETATM 4902 O . HOH S 94 ? -3.38299 -2.49002 -23.02796 1.000 36.08371 O ? E ? . 1 HETATM 4903 O . HOH S 95 ? 28.57797 -1.98898 -11.84611 1.000 30.15685 O ? E ? . 1 HETATM 4904 O . HOH S 96 ? -5.87443 -12.55428 -36.52793 1.000 35.22112 O ? E ? . 1 HETATM 4905 O . HOH S 97 ? -3.01247 0.19718 -54.04669 1.000 44.26995 O ? E ? . 1 HETATM 4906 O . HOH S 98 ? -12.54553 8.00489 -33.44562 1.000 30.74465 O ? E ? . 1 HETATM 4907 O . HOH S 99 ? -17.12154 -16.21260 -12.14304 1.000 36.82382 O ? E ? . 1 HETATM 4908 O . HOH S 100 ? -9.12114 4.65274 -17.67271 1.000 48.12466 O ? E ? . 1 HETATM 4909 O . HOH S 101 ? 25.71353 -2.09270 -23.47197 1.000 36.37588 O ? E ? . 1 HETATM 4910 O . HOH S 102 ? 5.89619 -14.87845 -29.61219 1.000 41.41566 O ? E ? . 1 HETATM 4911 O . HOH S 103 ? 9.36392 -26.73604 -29.81963 1.000 42.92321 O ? E ? . 1 HETATM 4912 O . HOH S 104 ? -17.27246 23.79927 -50.15530 1.000 37.97832 O ? E ? . 1 HETATM 4913 O . HOH S 105 ? -21.10481 0.31116 -42.25699 1.000 36.01743 O ? E ? . 1 HETATM 4914 O . HOH S 106 ? 17.34641 -20.40060 -24.23446 1.000 43.07996 O ? E ? . 1 HETATM 4915 O . HOH S 107 ? 8.26659 -20.11132 -38.41489 1.000 35.10550 O ? E ? . 1 HETATM 4916 O . HOH S 108 ? 14.62249 -17.61316 -24.11472 1.000 40.13380 O ? E ? . 1 HETATM 4917 O . HOH S 109 ? 12.36066 -2.85252 -0.84741 1.000 40.74038 O ? E ? . 1 HETATM 4918 O . HOH S 110 ? 11.78357 0.47856 -48.89833 1.000 39.49293 O ? E ? . 1 HETATM 4919 O . HOH S 111 ? -15.64419 -9.12855 -2.60426 1.000 42.34883 O ? E ? . 1 HETATM 4920 O . HOH S 112 ? 22.93741 -15.43991 -21.53823 1.000 42.38615 O ? E ? . 1 HETATM 4921 O . HOH S 113 ? 25.28837 -26.16389 -49.21173 1.000 45.96929 O ? E ? . 1 HETATM 4922 O . HOH S 114 ? 6.21345 24.48706 -15.35155 1.000 34.47435 O ? E ? . 1 HETATM 4923 O . HOH S 115 ? 26.21871 -19.22997 -51.44440 1.000 27.37050 O ? E ? . 1 HETATM 4924 O . HOH S 116 ? 5.64101 -6.24724 -34.61852 1.000 37.32703 O ? E ? . 1 HETATM 4925 O . HOH S 117 ? 25.01897 -4.95628 1.05132 1.000 31.37348 O ? E ? . 1 HETATM 4926 O . HOH S 118 ? -3.20927 -11.69302 -36.08662 1.000 42.82023 O ? E ? . 1 HETATM 4927 O . HOH S 119 ? 10.58585 -3.54530 -34.59708 1.000 32.14059 O ? E ? . 1 HETATM 4928 O . HOH S 120 ? -16.05349 -11.06662 -51.41427 1.000 36.13689 O ? E ? . 1 HETATM 4929 O . HOH S 121 ? 1.72487 -29.63565 -25.07759 1.000 39.73034 O ? E ? . 1 HETATM 4930 O . HOH S 122 ? -23.76082 4.82828 -52.43475 1.000 42.66186 O ? E ? . 1 HETATM 4931 O . HOH S 123 ? 37.01819 7.87662 -5.51699 1.000 39.50063 O ? E ? . 1 HETATM 4932 O . HOH S 124 ? 29.71342 25.25729 -3.65427 1.000 39.75475 O ? E ? . 1 HETATM 4933 O . HOH S 125 ? -17.39087 -22.17485 -19.64641 1.000 37.32265 O ? E ? . 1 HETATM 4934 O . HOH S 126 ? -3.86830 -9.23860 -36.72093 1.000 33.19680 O ? E ? . 1 HETATM 4935 O . HOH S 127 ? -5.97158 -30.19464 -8.00080 1.000 44.93158 O ? E ? . 1 HETATM 4936 O . HOH S 128 ? -19.14926 -20.04285 -17.53497 1.000 40.74761 O ? E ? . 1 HETATM 4937 O . HOH S 129 ? 11.87320 -7.68869 -1.37239 1.000 36.19264 O ? E ? . 1 HETATM 4938 O . HOH S 130 ? 3.99479 22.96213 -16.91379 1.000 36.83484 O ? E ? . 1 HETATM 4939 O . HOH S 131 ? 19.01344 -28.41360 -28.49957 1.000 44.66763 O ? E ? . 1 HETATM 4940 O . HOH S 132 ? 30.69185 10.80368 -20.93309 1.000 43.02449 O ? E ? . 1 HETATM 4941 O . HOH S 133 ? -15.40398 6.96974 -32.58368 1.000 40.15410 O ? E ? . 1 HETATM 4942 O . HOH S 134 ? 11.50468 11.83489 -30.87412 1.000 37.97912 O ? E ? . 1 HETATM 4943 O . HOH S 135 ? 6.06007 -20.09880 -13.65502 1.000 36.88019 O ? E ? . 1 HETATM 4944 O . HOH S 136 ? -12.65632 1.66626 -54.92834 1.000 39.85660 O ? E ? . 1 HETATM 4945 O . HOH S 137 ? 7.62077 -10.35049 -29.68426 1.000 47.52595 O ? E ? . 1 HETATM 4946 O . HOH S 138 ? 10.57330 -13.97482 -21.39351 1.000 38.16962 O ? E ? . 1 HETATM 4947 O . HOH S 139 ? 8.13823 -20.72020 -35.32401 1.000 39.24352 O ? E ? . 1 HETATM 4948 O . HOH S 140 ? -1.68815 5.72106 -11.87661 1.000 46.30161 O ? E ? . 1 HETATM 4949 O . HOH S 141 ? 32.43162 -18.75641 -42.08160 1.000 48.75151 O ? E ? . 1 HETATM 4950 O . HOH S 142 ? 16.26473 -8.29064 -52.22947 1.000 40.25400 O ? E ? . 1 HETATM 4951 O . HOH S 143 ? -15.21415 5.21455 -56.18647 1.000 34.14784 O ? E ? . 1 HETATM 4952 O . HOH S 144 ? 7.29893 -5.12517 -26.06892 1.000 42.69348 O ? E ? . 1 HETATM 4953 O . HOH S 145 ? -16.12484 19.13747 -34.10349 1.000 45.58429 O ? E ? . 1 HETATM 4954 O . HOH S 146 ? -4.48262 11.84807 -8.67811 1.000 47.97568 O ? E ? . 1 HETATM 4955 O . HOH S 147 ? -16.91530 -11.57345 -2.87368 1.000 47.54368 O ? E ? . 1 HETATM 4956 O . HOH S 148 ? -4.99359 18.92366 -53.27925 1.000 49.97641 O ? E ? . 1 HETATM 4957 O . HOH S 149 ? 28.86633 20.34721 -1.22037 1.000 39.37341 O ? E ? . 1 HETATM 4958 O . HOH S 150 ? 6.57706 6.48098 -52.93670 1.000 41.08886 O ? E ? . 1 HETATM 4959 O . HOH S 151 ? 29.25074 7.49345 -19.57617 1.000 38.73986 O ? E ? . 1 HETATM 4960 O . HOH S 152 ? -21.00502 -19.73169 -11.79263 1.000 44.58024 O ? E ? . 1 HETATM 4961 O . HOH S 153 ? 15.07218 -9.27905 -19.45968 1.000 34.25730 O ? E ? . 1 HETATM 4962 O . HOH S 154 ? 17.93245 16.21737 -23.26608 1.000 34.34599 O ? E ? . 1 HETATM 4963 O . HOH S 155 ? 17.87327 9.65920 2.28037 1.000 33.73908 O ? E ? . 1 HETATM 4964 O . HOH S 156 ? 36.13597 -24.68001 -34.19915 1.000 48.01426 O ? E ? . 1 HETATM 4965 O . HOH S 157 ? -12.38278 3.49417 -18.04567 1.000 50.64574 O ? E ? . 1 HETATM 4966 O . HOH S 158 ? -11.10002 7.39962 -22.75129 1.000 41.14310 O ? E ? . 1 HETATM 4967 O . HOH S 159 ? 18.86591 -19.03156 -54.92259 1.000 41.90161 O ? E ? . 1 HETATM 4968 O . HOH S 160 ? -9.02895 -29.10476 -15.58699 1.000 43.72725 O ? E ? . 1 HETATM 4969 O . HOH S 161 ? -13.49527 1.13787 -19.98474 1.000 53.45342 O ? E ? . 1 HETATM 4970 O . HOH S 162 ? -6.22274 -22.30564 -2.46150 1.000 42.22057 O ? E ? . 1 HETATM 4971 O . HOH S 163 ? 9.14723 18.96246 -43.55532 1.000 40.27748 O ? E ? . 1 HETATM 4972 O . HOH S 164 ? 20.00729 -25.04613 -35.69335 1.000 42.85272 O ? E ? . 1 HETATM 4973 O . HOH S 165 ? 4.16192 -4.92799 -29.41349 1.000 39.81711 O ? E ? . 1 HETATM 4974 O . HOH S 166 ? -6.18697 22.43056 -27.21887 1.000 47.28462 O ? E ? . 1 HETATM 4975 O . HOH S 167 ? 19.66653 -12.20263 -55.25113 1.000 40.32960 O ? E ? . 1 HETATM 4976 O . HOH S 168 ? 23.02848 -26.66487 -33.02981 1.000 48.91392 O ? E ? . 1 HETATM 4977 O . HOH S 169 ? 25.57774 5.18566 -17.08365 1.000 40.59129 O ? E ? . 1 HETATM 4978 O . HOH S 170 ? -14.25346 5.36200 -37.62666 1.000 38.30113 O ? E ? . 1 HETATM 4979 O . HOH S 171 ? 1.23276 25.02746 -46.15748 1.000 40.48831 O ? E ? . 1 HETATM 4980 O . HOH S 172 ? 5.26582 26.70698 -18.62874 1.000 39.06956 O ? E ? . 1 HETATM 4981 O . HOH S 173 ? 24.06514 -7.16336 -0.97511 1.000 41.02369 O ? E ? . 1 HETATM 4982 O . HOH S 174 ? -17.47660 9.78859 -31.25078 1.000 43.57949 O ? E ? . 1 HETATM 4983 O . HOH S 175 ? -15.66160 -24.90727 -18.44341 1.000 45.10345 O ? E ? . 1 HETATM 4984 O . HOH S 176 ? 28.18904 17.36550 -1.47480 1.000 27.40791 O ? E ? . 1 HETATM 4985 O . HOH S 177 ? -18.43449 -20.78971 -10.81781 1.000 34.34973 O ? E ? . 1 HETATM 4986 O . HOH S 178 ? 25.77374 27.26354 -6.15960 1.000 37.69198 O ? E ? . 1 HETATM 4987 O . HOH S 179 ? -0.76203 13.21583 -49.85269 1.000 32.57631 O ? E ? . 1 HETATM 4988 O . HOH S 180 ? 6.21662 -12.56138 -11.93210 1.000 27.76813 O ? E ? . 1 HETATM 4989 O . HOH S 181 ? 19.64541 -10.82392 -0.79801 1.000 28.22477 O ? E ? . 1 HETATM 4990 O . HOH S 182 ? 28.10875 -12.10616 -49.41732 1.000 33.22291 O ? E ? . 1 HETATM 4991 O . HOH S 183 ? 24.38517 16.50119 -0.36845 1.000 37.27295 O ? E ? . 1 HETATM 4992 O . HOH S 184 ? -22.17897 -12.95635 -20.05721 1.000 46.06519 O ? E ? . 1 HETATM 4993 O . HOH S 185 ? 25.60318 23.13410 -2.38179 1.000 38.56436 O ? E ? . 1 HETATM 4994 O . HOH S 186 ? 4.15727 7.64613 -50.06371 1.000 33.58809 O ? E ? . 1 HETATM 4995 O . HOH S 187 ? -1.29134 12.82989 -26.20178 1.000 39.51070 O ? E ? . 1 HETATM 4996 O . HOH S 188 ? 27.91242 1.37402 2.58466 1.000 41.43109 O ? E ? . 1 HETATM 4997 O . HOH S 189 ? -15.16617 -2.84141 -28.42024 1.000 38.92787 O ? E ? . 1 HETATM 4998 O . HOH S 190 ? -7.20081 -4.64701 -56.55286 1.000 41.75616 O ? E ? . 1 HETATM 4999 O . HOH S 191 ? -0.21261 -19.71081 -35.48362 1.000 39.41743 O ? E ? . 1 HETATM 5000 O . HOH S 192 ? 6.22164 -17.43821 -27.93995 1.000 36.66163 O ? E ? . 1 HETATM 5001 O . HOH S 193 ? 1.50898 15.90155 -7.23391 1.000 44.40972 O ? E ? . 1 HETATM 5002 O . HOH S 194 ? 8.43724 5.26547 -42.19846 1.000 25.99184 O ? E ? . 1 HETATM 5003 O . HOH S 195 ? -12.14942 -10.16585 -39.05874 1.000 39.33476 O ? E ? . 1 HETATM 5004 O . HOH S 196 ? -16.73016 -24.28910 -9.02092 1.000 29.79140 O ? E ? . 1 HETATM 5005 O . HOH S 197 ? 33.73066 5.03092 -1.91243 1.000 28.06367 O ? E ? . 1 HETATM 5006 O . HOH S 198 ? 5.38104 17.62807 -33.31531 1.000 30.84143 O ? E ? . 1 HETATM 5007 O . HOH S 199 ? 19.78286 -13.77995 -1.17188 1.000 31.76372 O ? E ? . 1 HETATM 5008 O . HOH S 200 ? 25.91201 -16.88644 -52.72412 1.000 29.58343 O ? E ? . 1 HETATM 5009 O . HOH S 201 ? -2.29620 -7.70602 -11.39915 1.000 33.10496 O ? E ? . 1 HETATM 5010 O . HOH S 202 ? 17.03086 -3.18399 -41.61996 1.000 35.12990 O ? E ? . 1 HETATM 5011 O . HOH S 203 ? -15.83698 -18.43634 -10.83934 1.000 32.89806 O ? E ? . 1 HETATM 5012 O . HOH S 204 ? 3.22592 -31.83908 -20.44300 1.000 40.38999 O ? E ? . 1 HETATM 5013 O . HOH S 205 ? 3.11378 19.98175 -12.51079 1.000 34.92201 O ? E ? . 1 HETATM 5014 O . HOH S 206 ? 6.22101 -19.59552 -42.74690 1.000 34.46965 O ? E ? . 1 HETATM 5015 O . HOH S 207 ? 5.46594 -2.80679 -3.67974 1.000 34.82818 O ? E ? . 1 HETATM 5016 O . HOH S 208 ? 1.59537 -34.19964 -20.56722 1.000 41.13453 O ? E ? . 1 HETATM 5017 O . HOH S 209 ? -0.80817 -5.87352 -8.25082 1.000 30.37114 O ? E ? . 1 HETATM 5018 O . HOH S 210 ? 6.92310 -20.65196 -50.39858 1.000 38.64725 O ? E ? . 1 HETATM 5019 O . HOH S 211 ? 24.14061 12.87672 2.41283 1.000 36.96642 O ? E ? . 1 HETATM 5020 O . HOH S 212 ? 11.79103 17.19100 -44.45286 1.000 36.19169 O ? E ? . 1 HETATM 5021 O . HOH S 213 ? -7.38406 16.38076 -30.53361 1.000 40.28525 O ? E ? . 1 HETATM 5022 O . HOH S 214 ? -1.28099 -1.86753 -54.28208 1.000 45.41518 O ? E ? . 1 HETATM 5023 O . HOH S 215 ? -14.78211 13.83497 -56.47425 1.000 43.38092 O ? E ? . 1 HETATM 5024 O . HOH S 216 ? 12.47800 -18.42100 -10.86122 1.000 38.06419 O ? E ? . 1 HETATM 5025 O . HOH S 217 ? 11.00452 4.98930 -43.10285 1.000 39.59489 O ? E ? . 1 HETATM 5026 O . HOH S 218 ? 3.14723 -33.88836 -8.85620 1.000 38.87006 O ? E ? . 1 HETATM 5027 O . HOH S 219 ? -13.51601 3.18054 -29.36902 1.000 41.24488 O ? E ? . 1 HETATM 5028 O . HOH S 220 ? 0.36864 -9.69319 -33.21661 1.000 41.65174 O ? E ? . 1 HETATM 5029 O . HOH S 221 ? 4.01486 16.22402 -25.19521 1.000 38.00011 O ? E ? . 1 HETATM 5030 O . HOH S 222 ? 26.22690 -0.96357 -25.96294 1.000 37.24846 O ? E ? . 1 HETATM 5031 O . HOH S 223 ? 27.27597 5.29824 -19.88280 1.000 41.47109 O ? E ? . 1 HETATM 5032 O . HOH S 224 ? 3.16903 -23.80804 -28.52153 1.000 44.89298 O ? E ? . 1 HETATM 5033 O . HOH S 225 ? 37.96120 4.68029 -14.03050 1.000 52.60291 O ? E ? . 1 HETATM 5034 O . HOH S 226 ? 24.23917 4.90075 -27.52072 1.000 42.92239 O ? E ? . 1 HETATM 5035 O . HOH S 227 ? 25.27942 -2.65698 -32.33410 1.000 48.88902 O ? E ? . 1 HETATM 5036 O . HOH S 228 ? 24.66997 2.27052 -34.85430 1.000 40.79923 O ? E ? . 1 HETATM 5037 O . HOH S 229 ? -1.53828 -11.36368 -33.78569 1.000 41.75958 O ? E ? . 1 HETATM 5038 O . HOH S 230 ? 9.03409 -1.96216 0.78816 1.000 48.04095 O ? E ? . 1 HETATM 5039 O . HOH S 231 ? -14.98603 -1.53045 -19.44272 1.000 45.30315 O ? E ? . 1 HETATM 5040 O . HOH S 232 ? 38.09219 3.82849 -11.18671 1.000 54.61928 O ? E ? . 1 HETATM 5041 O . HOH S 233 ? 23.62730 -5.40954 -23.51253 1.000 47.14829 O ? E ? . 1 loop_ _atom_site_anisotrop.id _atom_site_anisotrop.pdbx_auth_atom_id _atom_site_anisotrop.pdbx_label_alt_id _atom_site_anisotrop.pdbx_auth_comp_id _atom_site_anisotrop.pdbx_auth_asym_id _atom_site_anisotrop.pdbx_auth_seq_id _atom_site_anisotrop.pdbx_PDB_ins_code _atom_site_anisotrop.U[1][1] _atom_site_anisotrop.U[2][2] _atom_site_anisotrop.U[3][3] _atom_site_anisotrop.U[1][2] _atom_site_anisotrop.U[1][3] _atom_site_anisotrop.U[2][3] 1 N . SER A 1 ? 0.60517 0.62561 0.42638 0.21785 -0.21588 0.02758 2 CA . SER A 1 ? 0.75329 0.76439 0.58341 0.23357 -0.20813 0.02448 3 C . SER A 1 ? 0.72160 0.68699 0.52262 0.22237 -0.19418 0.03071 4 O . SER A 1 ? 0.58084 0.54436 0.37541 0.19929 -0.18092 0.03322 5 CB . SER A 1 ? 0.83314 0.82170 0.65421 0.25357 -0.22176 0.02471 6 OG . SER A 1 ? 0.80798 0.84067 0.65694 0.26402 -0.23471 0.01955 7 N . GLY A 2 ? 0.79496 0.72426 0.58361 0.23319 -0.19319 0.03151 8 CA . GLY A 2 ? 0.66992 0.55337 0.43175 0.22097 -0.18225 0.03861 9 C . GLY A 2 ? 0.75877 0.66215 0.54431 0.21988 -0.16541 0.03117 10 O . GLY A 2 ? 0.79446 0.75122 0.61841 0.22295 -0.15796 0.02136 11 N . PHE A 3 ? 0.75315 0.61444 0.51808 0.21019 -0.15687 0.03628 12 CA . PHE A 3 ? 0.59646 0.47043 0.38146 0.20447 -0.13893 0.02924 13 C . PHE A 3 ? 0.60599 0.44358 0.36934 0.17908 -0.12664 0.03870 14 O . PHE A 3 ? 0.70397 0.49069 0.43523 0.17752 -0.13511 0.04832 15 CB . PHE A 3 ? 0.66062 0.52530 0.44909 0.23199 -0.14668 0.02029 16 CG . PHE A 3 ? 0.56951 0.46882 0.38680 0.23262 -0.12966 0.00941 17 CD1 . PHE A 3 ? 0.55235 0.51669 0.40782 0.23616 -0.12164 0.00141 18 CD2 . PHE A 3 ? 0.57916 0.44649 0.38446 0.22804 -0.12259 0.00831 19 CE1 . PHE A 3 ? 0.48486 0.48149 0.36369 0.23539 -0.10562 -0.00646 20 CE2 . PHE A 3 ? 0.52528 0.42370 0.35333 0.22893 -0.10764 -0.00127 21 CZ . PHE A 3 ? 0.58163 0.54472 0.44533 0.23275 -0.09849 -0.00816 22 N . ARG A 4 ? 0.61354 0.47789 0.39533 0.15911 -0.10774 0.03653 23 CA . ARG A 4 ? 0.54722 0.38947 0.31562 0.13535 -0.09427 0.04414 24 C . ARG A 4 ? 0.63182 0.49375 0.42486 0.12878 -0.07832 0.03672 25 O . ARG A 4 ? 0.64668 0.54701 0.46779 0.13670 -0.07432 0.02708 26 CB . ARG A 4 ? 0.55504 0.40835 0.31643 0.11735 -0.08788 0.04906 27 CG . ARG A 4 ? 0.70193 0.53906 0.43625 0.12221 -0.10311 0.05657 28 CD . ARG A 4 ? 0.74512 0.53681 0.44221 0.11106 -0.10418 0.07161 29 NE . ARG A 4 ? 0.68144 0.47633 0.38044 0.08915 -0.08448 0.07461 30 CZ . ARG A 4 ? 0.80897 0.58234 0.48096 0.07271 -0.07891 0.08785 31 NH1 . ARG A 4 ? 0.73832 0.48141 0.37540 0.07318 -0.09138 0.10106 32 NH2 . ARG A 4 ? 0.85396 0.63865 0.53424 0.05546 -0.06047 0.08861 33 N . LYS A 5 ? 0.58430 0.42185 0.36679 0.11295 -0.06946 0.04248 34 CA . LYS A 5 ? 0.46816 0.32303 0.27132 0.10352 -0.05449 0.03703 35 C . LYS A 5 ? 0.54379 0.43036 0.36235 0.08880 -0.04246 0.03570 36 O . LYS A 5 ? 0.55758 0.43535 0.36258 0.07495 -0.03799 0.04228 37 CB . LYS A 5 ? 0.49539 0.31552 0.28381 0.09119 -0.05144 0.04383 38 CG . LYS A 5 ? 0.62111 0.44594 0.42434 0.09326 -0.04559 0.03603 39 CD . LYS A 5 ? 0.63732 0.42956 0.42786 0.07801 -0.04439 0.04331 40 CE . LYS A 5 ? 0.73887 0.48210 0.50195 0.08455 -0.06162 0.04897 41 NZ . LYS A 5 ? 0.77950 0.51279 0.54210 0.10830 -0.07191 0.03669 42 N . MET A 6 ? 0.40808 0.33120 0.25344 0.09206 -0.03783 0.02730 43 CA . MET A 6 ? 0.39502 0.34551 0.25438 0.08100 -0.03226 0.02497 44 C . MET A 6 ? 0.37117 0.33716 0.24988 0.07029 -0.01935 0.02159 45 O . MET A 6 ? 0.40913 0.38787 0.30209 0.07644 -0.01653 0.01788 46 CB . MET A 6 ? 0.36473 0.34580 0.23946 0.09126 -0.04171 0.02041 47 CG . MET A 6 ? 0.42884 0.43312 0.31557 0.07893 -0.04079 0.01805 48 SD . MET A 6 ? 0.56077 0.59895 0.46343 0.08946 -0.05631 0.01486 49 CE . MET A 6 ? 0.44583 0.45273 0.31851 0.10705 -0.07042 0.01943 50 N . ALA A 7 ? 0.32797 0.29270 0.20524 0.05592 -0.01214 0.02248 51 CA . ALA A 7 ? 0.30407 0.28033 0.19793 0.04604 -0.00222 0.01975 52 C . ALA A 7 ? 0.31223 0.31299 0.22234 0.04060 -0.00430 0.01569 53 O . ALA A 7 ? 0.36844 0.37390 0.27381 0.04138 -0.01242 0.01453 54 CB . ALA A 7 ? 0.32555 0.28497 0.20910 0.03556 0.00607 0.02242 55 N . PHE A 8 ? 0.30022 0.31471 0.22816 0.03397 0.00139 0.01430 56 CA . PHE A 8 ? 0.31324 0.34575 0.25578 0.02467 -0.00181 0.01232 57 C . PHE A 8 ? 0.30785 0.32322 0.23828 0.01688 -0.00270 0.00934 58 O . PHE A 8 ? 0.31760 0.31449 0.23496 0.01689 0.00392 0.00938 59 CB . PHE A 8 ? 0.31721 0.36376 0.27760 0.01772 0.00416 0.01387 60 CG . PHE A 8 ? 0.24966 0.32095 0.22261 0.02583 0.00591 0.01535 61 CD1 . PHE A 8 ? 0.35480 0.45974 0.34559 0.02536 0.00100 0.01624 62 CD2 . PHE A 8 ? 0.31503 0.37812 0.28214 0.03425 0.01210 0.01525 63 CE1 . PHE A 8 ? 0.35999 0.49411 0.36300 0.03539 0.00442 0.01663 64 CE2 . PHE A 8 ? 0.31261 0.39840 0.28792 0.04490 0.01401 0.01434 65 CZ . PHE A 8 ? 0.32795 0.45149 0.32153 0.04653 0.01128 0.01485 66 N . PRO A 9 ? 0.29598 0.31845 0.23054 0.01047 -0.01135 0.00618 67 CA . PRO A 9 ? 0.37204 0.37640 0.29427 0.00477 -0.01289 0.00063 68 C . PRO A 9 ? 0.35712 0.35254 0.28565 -0.00035 -0.00492 0.00026 69 O . PRO A 9 ? 0.30756 0.31332 0.25347 -0.00638 -0.00393 0.00392 70 CB . PRO A 9 ? 0.37583 0.38958 0.30548 -0.00298 -0.02672 -0.00245 71 CG . PRO A 9 ? 0.35174 0.39124 0.29394 0.00144 -0.03223 0.00182 72 CD . PRO A 9 ? 0.34534 0.39382 0.29669 0.00815 -0.02120 0.00695 73 N . SER A 10 ? 0.31870 0.29728 0.23266 0.00269 0.00088 -0.00364 74 CA . SER A 10 ? 0.31729 0.28873 0.23704 0.00132 0.00859 -0.00394 75 C . SER A 10 ? 0.33754 0.29585 0.25616 -0.00195 0.00293 -0.01132 76 O . SER A 10 ? 0.30959 0.26045 0.23176 -0.00063 0.00761 -0.01282 77 CB . SER A 10 ? 0.30272 0.26938 0.21140 0.00724 0.01910 -0.00278 78 OG . SER A 10 ? 0.31751 0.27799 0.20686 0.01139 0.01935 -0.00830 79 N . GLY A 11 ? 0.36926 0.32258 0.28242 -0.00555 -0.00902 -0.01643 80 CA . GLY A 11 ? 0.33717 0.27008 0.24378 -0.00697 -0.01733 -0.02544 81 C . GLY A 11 ? 0.37809 0.30371 0.29987 -0.01456 -0.01988 -0.02170 82 O . GLY A 11 ? 0.38386 0.29147 0.30088 -0.00962 -0.02032 -0.02785 83 N . LYS A 12 ? 0.32810 0.26896 0.26742 -0.02560 -0.02163 -0.01131 84 CA . LYS A 12 ? 0.40514 0.33955 0.35606 -0.03501 -0.02441 -0.00506 85 C . LYS A 12 ? 0.40805 0.33876 0.36020 -0.02698 -0.01349 -0.00386 86 O . LYS A 12 ? 0.42430 0.33898 0.37865 -0.02992 -0.01777 -0.00260 87 CB . LYS A 12 ? 0.42394 0.38383 0.39244 -0.04781 -0.02522 0.00689 88 CG . LYS A 12 ? 0.39995 0.36420 0.37364 -0.06133 -0.03966 0.00804 89 CD . LYS A 12 ? 0.48982 0.49197 0.48406 -0.07121 -0.03715 0.01969 90 CE . LYS A 12 ? 0.67647 0.68258 0.68169 -0.09214 -0.05261 0.02536 91 NZ . LYS A 12 ? 0.62823 0.60531 0.61876 -0.09312 -0.06866 0.01416 92 N . VAL A 13 ? 0.35381 0.29731 0.30421 -0.01765 -0.00141 -0.00363 93 CA . VAL A 13 ? 0.40391 0.34641 0.35742 -0.01176 0.00739 -0.00219 94 C . VAL A 13 ? 0.35061 0.28190 0.29535 -0.00106 0.00989 -0.01184 95 O . VAL A 13 ? 0.30569 0.23210 0.25565 0.00310 0.01181 -0.01262 96 CB . VAL A 13 ? 0.35804 0.31753 0.31428 -0.00897 0.01711 0.00351 97 CG1 . VAL A 13 ? 0.27572 0.23402 0.23592 -0.00514 0.02387 0.00517 98 CG2 . VAL A 13 ? 0.24548 0.22013 0.21024 -0.01552 0.01556 0.01094 99 N . GLU A 14 ? 0.33377 0.26359 0.26490 0.00454 0.00991 -0.01937 100 CA . GLU A 14 ? 0.34702 0.27250 0.26837 0.01650 0.01448 -0.02931 101 C . GLU A 14 ? 0.41457 0.32060 0.33739 0.02138 0.00616 -0.03692 102 O . GLU A 14 ? 0.36914 0.27805 0.29502 0.03207 0.01173 -0.04177 103 CB . GLU A 14 ? 0.35028 0.27454 0.25177 0.02121 0.01338 -0.03682 104 CG . GLU A 14 ? 0.37819 0.31835 0.27387 0.01958 0.02144 -0.02951 105 CD . GLU A 14 ? 0.39996 0.33700 0.27282 0.02367 0.01815 -0.03587 106 OE1 . GLU A 14 ? 0.51934 0.45158 0.37696 0.03319 0.02008 -0.04659 107 OE2 . GLU A 14 ? 0.42882 0.36902 0.29794 0.01886 0.01302 -0.03086 108 N . GLY A 15 ? 0.40444 0.29075 0.32595 0.01336 -0.00840 -0.03735 109 CA . GLY A 15 ? 0.38262 0.24200 0.30216 0.01713 -0.02024 -0.04374 110 C . GLY A 15 ? 0.43622 0.29387 0.37006 0.01538 -0.01983 -0.03561 111 O . GLY A 15 ? 0.41480 0.24666 0.34636 0.01884 -0.03160 -0.03940 112 N . CYS A 16 ? 0.37347 0.25457 0.31955 0.01083 -0.00850 -0.02494 113 CA . CYS A 16 ? 0.34871 0.22946 0.30600 0.00915 -0.00855 -0.01712 114 C . CYS A 16 ? 0.35058 0.24880 0.31596 0.02059 0.00239 -0.01939 115 O . CYS A 16 ? 0.39604 0.29413 0.37050 0.02091 0.00087 -0.01422 116 CB . CYS A 16 ? 0.35728 0.25029 0.32130 -0.00572 -0.00640 -0.00308 117 SG . CYS A 16 ? 0.42108 0.30581 0.38266 -0.02329 -0.01782 0.00366 118 N . MET A 17 ? 0.39274 0.30738 0.35500 0.02847 0.01271 -0.02571 119 CA . MET A 17 ? 0.31844 0.25559 0.29105 0.03507 0.02378 -0.02523 120 C . MET A 17 ? 0.34172 0.27829 0.31789 0.05156 0.02221 -0.03638 121 O . MET A 17 ? 0.36520 0.29445 0.32938 0.06213 0.02068 -0.04828 122 CB . MET A 17 ? 0.29961 0.25637 0.26665 0.03336 0.03586 -0.02383 123 CG . MET A 17 ? 0.30843 0.26563 0.27170 0.02117 0.03637 -0.01435 124 SD . MET A 17 ? 0.33423 0.29132 0.30939 0.01226 0.03363 -0.00343 125 CE . MET A 17 ? 0.25100 0.22478 0.23906 0.01556 0.04069 -0.00169 126 N . VAL A 18 ? 0.29969 0.24458 0.29161 0.05536 0.02167 -0.03354 127 CA . VAL A 18 ? 0.35033 0.30191 0.35060 0.07361 0.02056 -0.04389 128 C . VAL A 18 ? 0.30458 0.29350 0.32456 0.07452 0.03216 -0.03955 129 O . VAL A 18 ? 0.27537 0.27620 0.29976 0.06004 0.03807 -0.02844 130 CB . VAL A 18 ? 0.33264 0.25552 0.33463 0.07873 0.00369 -0.04474 131 CG1 . VAL A 18 ? 0.35575 0.24030 0.33870 0.07386 -0.00952 -0.04709 132 CG2 . VAL A 18 ? 0.31464 0.23984 0.32758 0.06669 0.00065 -0.03078 133 N . GLN A 19 ? 0.33818 0.34594 0.37052 0.09178 0.03430 -0.04860 134 CA . GLN A 19 ? 0.36852 0.41705 0.42431 0.09226 0.04395 -0.04442 135 C . GLN A 19 ? 0.41751 0.46425 0.49150 0.09910 0.03202 -0.04349 136 O . GLN A 19 ? 0.41574 0.44400 0.48768 0.11619 0.02092 -0.05326 137 CB . GLN A 19 ? 0.31095 0.39435 0.37078 0.10732 0.05753 -0.05468 138 CG . GLN A 19 ? 0.36228 0.49355 0.45188 0.10933 0.06600 -0.05094 139 CD . GLN A 19 ? 0.39398 0.56419 0.48956 0.12900 0.07903 -0.06302 140 OE1 . GLN A 19 ? 0.49027 0.68393 0.57735 0.12367 0.09461 -0.06095 141 NE2 . GLN A 19 ? 0.57169 0.74944 0.68040 0.15325 0.07248 -0.07579 142 N . VAL A 20 ? 0.27474 0.33719 0.36432 0.08626 0.03221 -0.03206 143 CA . VAL A 20 ? 0.32391 0.38535 0.42947 0.09076 0.01952 -0.02954 144 C . VAL A 20 ? 0.36421 0.47414 0.49937 0.09224 0.02650 -0.02783 145 O . VAL A 20 ? 0.32010 0.44973 0.46138 0.07485 0.03472 -0.01843 146 CB . VAL A 20 ? 0.26800 0.30216 0.36341 0.07376 0.00995 -0.01762 147 CG1 . VAL A 20 ? 0.31185 0.33982 0.41813 0.08017 -0.00535 -0.01545 148 CG2 . VAL A 20 ? 0.27597 0.27219 0.34540 0.06838 0.00609 -0.01709 149 N . THR A 21 ? 0.31882 0.44777 0.47287 0.11282 0.02187 -0.03667 150 CA . THR A 21 ? 0.27139 0.45338 0.45912 0.11574 0.02719 -0.03538 151 C . THR A 21 ? 0.41920 0.59762 0.62369 0.12380 0.00884 -0.03431 152 O . THR A 21 ? 0.40999 0.55894 0.60605 0.14198 -0.00472 -0.04197 153 CB . THR A 21 ? 0.28308 0.50490 0.48248 0.13661 0.04061 -0.04815 154 OG1 . THR A 21 ? 0.34909 0.57126 0.52811 0.12845 0.05659 -0.04825 155 CG2 . THR A 21 ? 0.27420 0.56045 0.51285 0.13691 0.04782 -0.04478 156 N . CYS A 22 ? 0.30681 0.51162 0.53286 0.10946 0.00634 -0.02428 157 CA . CYS A 22 ? 0.37037 0.57865 0.61467 0.11596 -0.01176 -0.02243 158 C . CYS A 22 ? 0.38340 0.65646 0.66874 0.11454 -0.00623 -0.02050 159 O . CYS A 22 ? 0.40176 0.69116 0.69691 0.09105 -0.00501 -0.00933 160 CB . CYS A 22 ? 0.36658 0.53628 0.59202 0.09711 -0.02479 -0.01121 161 SG . CYS A 22 ? 0.52317 0.69207 0.76447 0.10558 -0.04928 -0.00855 162 N . GLY A 23 ? 0.39666 0.70706 0.70615 0.13995 -0.00375 -0.03167 163 CA . GLY A 23 ? 0.31686 0.69880 0.66970 0.14016 0.00345 -0.03013 164 C . GLY A 23 ? 0.37419 0.79410 0.73133 0.12363 0.02762 -0.02508 165 O . GLY A 23 ? 0.43637 0.86610 0.78340 0.13757 0.04336 -0.03439 166 N . THR A 24 ? 0.36804 0.80586 0.73691 0.09335 0.02929 -0.01004 167 CA . THR A 24 ? 0.39832 0.87170 0.77193 0.07339 0.04992 -0.00136 168 C . THR A 24 ? 0.45358 0.87556 0.78685 0.05204 0.05447 0.00623 169 O . THR A 24 ? 0.44711 0.88808 0.77534 0.03799 0.07136 0.01293 170 CB . THR A 24 ? 0.39179 0.91869 0.80527 0.05105 0.04768 0.01188 171 OG1 . THR A 24 ? 0.49902 1.05253 0.91244 0.02664 0.06597 0.02387 172 CG2 . THR A 24 ? 0.50648 0.99375 0.91402 0.03232 0.02486 0.02025 173 N . THR A 25 ? 0.39062 0.75069 0.69504 0.04988 0.04002 0.00586 174 CA . THR A 25 ? 0.42149 0.73540 0.69036 0.03174 0.04249 0.01239 175 C . THR A 25 ? 0.41531 0.69167 0.65262 0.04811 0.04684 0.00217 176 O . THR A 25 ? 0.36360 0.61650 0.59499 0.06682 0.03632 -0.00687 177 CB . THR A 25 ? 0.35458 0.63006 0.61251 0.01689 0.02436 0.01933 178 OG1 . THR A 25 ? 0.47657 0.78205 0.75981 -0.00276 0.01917 0.02941 179 CG2 . THR A 25 ? 0.30161 0.52830 0.52159 0.00493 0.02621 0.02295 180 N . THR A 26 ? 0.32457 0.59383 0.54106 0.04003 0.06052 0.00439 181 CA . THR A 26 ? 0.38289 0.61577 0.56835 0.05134 0.06330 -0.00415 182 C . THR A 26 ? 0.31174 0.50872 0.46960 0.03225 0.06363 0.00440 183 O . THR A 26 ? 0.31482 0.52459 0.47284 0.01435 0.07085 0.01458 184 CB . THR A 26 ? 0.37657 0.63858 0.56113 0.06671 0.07942 -0.01345 185 OG1 . THR A 26 ? 0.48998 0.71311 0.64133 0.07288 0.08039 -0.02041 186 CG2 . THR A 26 ? 0.42142 0.72689 0.61608 0.05047 0.09604 -0.00302 187 N . LEU A 27 ? 0.23474 0.38757 0.36961 0.03598 0.05489 0.00091 188 CA . LEU A 27 ? 0.31007 0.43117 0.41928 0.02273 0.05502 0.00666 189 C . LEU A 27 ? 0.29546 0.38586 0.38301 0.03336 0.05238 -0.00138 190 O . LEU A 27 ? 0.32732 0.41831 0.41709 0.04993 0.05078 -0.01143 191 CB . LEU A 27 ? 0.21927 0.32207 0.32709 0.00916 0.04387 0.01490 192 CG . LEU A 27 ? 0.24706 0.34188 0.36422 0.01446 0.02970 0.01371 193 CD1 . LEU A 27 ? 0.26405 0.32871 0.36520 0.02550 0.02301 0.00828 194 CD2 . LEU A 27 ? 0.22986 0.31220 0.34315 -0.00031 0.02073 0.02153 195 N . ASN A 28 ? 0.27086 0.33426 0.33784 0.02408 0.05055 0.00275 196 CA . ASN A 28 ? 0.38220 0.41958 0.43011 0.02952 0.04760 -0.00271 197 C . ASN A 28 ? 0.27700 0.28889 0.32070 0.02827 0.03507 -0.00063 198 O . ASN A 28 ? 0.27639 0.28631 0.32397 0.02085 0.03017 0.00604 199 CB . ASN A 28 ? 0.35283 0.38191 0.38248 0.02079 0.05334 0.00094 200 CG . ASN A 28 ? 0.29823 0.35054 0.32774 0.01866 0.06549 0.00250 201 OD1 . ASN A 28 ? 0.35416 0.41576 0.37821 0.02811 0.07183 -0.00489 202 ND2 . ASN A 28 ? 0.24035 0.30042 0.27330 0.00574 0.06803 0.01245 203 N . GLY A 29 ? 0.27699 0.26830 0.31057 0.03469 0.02915 -0.00600 204 CA . GLY A 29 ? 0.30941 0.27662 0.33637 0.03092 0.01786 -0.00171 205 C . GLY A 29 ? 0.36513 0.31316 0.37577 0.02582 0.01579 -0.00179 206 O . GLY A 29 ? 0.32204 0.27014 0.32596 0.02942 0.01970 -0.00834 207 N . LEU A 30 ? 0.31754 0.25164 0.32173 0.01677 0.00933 0.00606 208 CA . LEU A 30 ? 0.36408 0.28544 0.35690 0.00866 0.00643 0.00863 209 C . LEU A 30 ? 0.29821 0.19434 0.28662 0.00810 -0.00686 0.00983 210 O . LEU A 30 ? 0.32107 0.20928 0.30938 0.00467 -0.01337 0.01748 211 CB . LEU A 30 ? 0.25227 0.18175 0.24115 -0.00193 0.01014 0.01769 212 CG . LEU A 30 ? 0.30088 0.22895 0.28295 -0.01073 0.00936 0.02100 213 CD1 . LEU A 30 ? 0.28773 0.22003 0.26740 -0.00727 0.01332 0.01354 214 CD2 . LEU A 30 ? 0.24750 0.18943 0.22709 -0.01702 0.01414 0.02853 215 N . TRP A 31 ? 0.37257 0.25294 0.35461 0.01092 -0.01250 0.00268 216 CA . TRP A 31 ? 0.33660 0.18515 0.31205 0.01115 -0.02831 0.00243 217 C . TRP A 31 ? 0.36930 0.20616 0.33673 -0.00702 -0.03461 0.01147 218 O . TRP A 31 ? 0.41239 0.24630 0.37490 -0.01027 -0.03583 0.00633 219 CB . TRP A 31 ? 0.37660 0.21174 0.34842 0.02783 -0.03306 -0.01334 220 CG . TRP A 31 ? 0.43473 0.23006 0.39763 0.03181 -0.05232 -0.01597 221 CD1 . TRP A 31 ? 0.41401 0.18690 0.37449 0.02446 -0.06504 -0.00465 222 CD2 . TRP A 31 ? 0.44319 0.21235 0.39492 0.04461 -0.06274 -0.03100 223 NE1 . TRP A 31 ? 0.45703 0.18833 0.40612 0.03111 -0.08400 -0.01073 224 CE2 . TRP A 31 ? 0.46831 0.19587 0.41179 0.04447 -0.08328 -0.02815 225 CE3 . TRP A 31 ? 0.43671 0.21154 0.38154 0.05677 -0.05755 -0.04685 226 CZ2 . TRP A 31 ? 0.51314 0.20158 0.44214 0.05708 -0.10006 -0.04203 227 CZ3 . TRP A 31 ? 0.55195 0.29158 0.48172 0.07005 -0.07271 -0.06152 228 CH2 . TRP A 31 ? 0.51809 0.21345 0.44031 0.07060 -0.09441 -0.05972 229 N . LEU A 32 ? 0.34990 0.18275 0.31604 -0.01949 -0.03883 0.02554 230 CA . LEU A 32 ? 0.36115 0.18905 0.32246 -0.03933 -0.04425 0.03744 231 C . LEU A 32 ? 0.42988 0.22445 0.38282 -0.04673 -0.06075 0.04697 232 O . LEU A 32 ? 0.43819 0.22926 0.38980 -0.04282 -0.06233 0.05273 233 CB . LEU A 32 ? 0.42961 0.29072 0.39508 -0.04880 -0.03130 0.04776 234 CG . LEU A 32 ? 0.31275 0.20308 0.28428 -0.04160 -0.01682 0.04039 235 CD1 . LEU A 32 ? 0.31328 0.22941 0.28588 -0.04555 -0.00668 0.04864 236 CD2 . LEU A 32 ? 0.37072 0.26511 0.34294 -0.04627 -0.01793 0.03591 237 N . ASP A 33 ? 0.47720 0.24491 0.42313 -0.05813 -0.07491 0.04914 238 CA . ASP A 33 ? 0.52555 0.25111 0.46011 -0.06588 -0.09483 0.05803 239 C . ASP A 33 ? 0.58242 0.28527 0.51447 -0.04162 -0.10205 0.04627 240 O . ASP A 33 ? 0.51564 0.22082 0.45119 -0.02210 -0.09880 0.02781 241 CB . ASP A 33 ? 0.53814 0.27447 0.47003 -0.08680 -0.09312 0.08045 242 CG . ASP A 33 ? 0.62262 0.38937 0.56087 -0.10881 -0.08510 0.09073 243 OD1 . ASP A 33 ? 0.66802 0.41970 0.60591 -0.12032 -0.09584 0.08962 244 OD2 . ASP A 33 ? 0.68554 0.49210 0.62935 -0.11332 -0.06901 0.09875 245 N . ASP A 34 ? 0.52561 0.20932 0.45178 -0.04104 -0.11174 0.05618 246 CA . ASP A 34 ? 0.61637 0.28249 0.54320 -0.01640 -0.12002 0.04519 247 C . ASP A 34 ? 0.58182 0.28402 0.52084 -0.00584 -0.10607 0.04523 248 O . ASP A 34 ? 0.59097 0.28164 0.53035 0.00683 -0.11525 0.04543 249 CB . ASP A 34 ? 0.57785 0.19281 0.48887 -0.02012 -0.14467 0.05522 250 CG . ASP A 34 ? 0.74503 0.36996 0.64955 -0.04197 -0.14315 0.07840 251 OD1 . ASP A 34 ? 0.68390 0.34413 0.59377 -0.05365 -0.12631 0.08715 252 OD2 . ASP A 34 ? 0.60827 0.21133 0.50186 -0.04588 -0.15717 0.08604 253 N . VAL A 35 ? 0.48233 0.22582 0.43055 -0.01139 -0.08628 0.04560 254 CA . VAL A 35 ? 0.41636 0.19110 0.37415 -0.00488 -0.07473 0.04622 255 C . VAL A 35 ? 0.41929 0.22641 0.39028 0.00422 -0.05813 0.03304 256 O . VAL A 35 ? 0.40340 0.21903 0.37333 -0.00245 -0.05059 0.03023 257 CB . VAL A 35 ? 0.42659 0.21557 0.37683 -0.02278 -0.06887 0.06304 258 CG1 . VAL A 35 ? 0.39579 0.21313 0.35322 -0.01554 -0.05886 0.06120 259 CG2 . VAL A 35 ? 0.48696 0.24481 0.42141 -0.03364 -0.08492 0.07886 260 N . VAL A 36 ? 0.36386 0.18944 0.34733 0.01839 -0.05359 0.02610 261 CA . VAL A 36 ? 0.40106 0.25868 0.39662 0.02427 -0.03799 0.01711 262 C . VAL A 36 ? 0.36200 0.24208 0.36228 0.01854 -0.03085 0.02400 263 O . VAL A 36 ? 0.34639 0.22511 0.34985 0.02204 -0.03828 0.02777 264 CB . VAL A 36 ? 0.43926 0.30404 0.44709 0.04441 -0.03825 0.00303 265 CG1 . VAL A 36 ? 0.31864 0.21911 0.33824 0.04676 -0.02152 -0.00256 266 CG2 . VAL A 36 ? 0.36565 0.20368 0.36396 0.05258 -0.04674 -0.00660 267 N . TYR A 37 ? 0.37008 0.26786 0.36895 0.01055 -0.01857 0.02513 268 CA . TYR A 37 ? 0.29639 0.21079 0.29602 0.00583 -0.01287 0.02958 269 C . TYR A 37 ? 0.30231 0.23806 0.31501 0.01115 -0.00416 0.02248 270 O . TYR A 37 ? 0.30747 0.24978 0.32149 0.01279 0.00357 0.01704 271 CB . TYR A 37 ? 0.28274 0.20057 0.27013 -0.00525 -0.00667 0.03578 272 CG . TYR A 37 ? 0.35153 0.25515 0.32717 -0.01445 -0.01284 0.04521 273 CD1 . TYR A 37 ? 0.33256 0.22502 0.30634 -0.01908 -0.01573 0.04525 274 CD2 . TYR A 37 ? 0.37731 0.27903 0.34223 -0.02010 -0.01634 0.05489 275 CE1 . TYR A 37 ? 0.31344 0.19386 0.27774 -0.03143 -0.02223 0.05629 276 CE2 . TYR A 37 ? 0.36630 0.25820 0.31982 -0.03125 -0.02093 0.06625 277 CZ . TYR A 37 ? 0.40156 0.28322 0.35616 -0.03810 -0.02395 0.06773 278 OH . TYR A 37 ? 0.44486 0.31752 0.38932 -0.05297 -0.02944 0.08139 279 N . CYS A 38 ? 0.30868 0.25523 0.32998 0.01228 -0.00633 0.02359 280 CA . CYS A 38 ? 0.29252 0.26085 0.32756 0.01312 0.00068 0.01992 281 C . CYS A 38 ? 0.26187 0.23452 0.29780 0.00716 -0.00399 0.02432 282 O . CYS A 38 ? 0.28545 0.24655 0.31297 0.00621 -0.01306 0.02847 283 CB . CYS A 38 ? 0.24337 0.22637 0.29720 0.02459 0.00052 0.01321 284 SG . CYS A 38 ? 0.30054 0.28443 0.36807 0.03352 -0.01424 0.01377 285 N . PRO A 39 ? 0.28944 0.27629 0.33278 0.00201 0.00089 0.02403 286 CA . PRO A 39 ? 0.32851 0.31632 0.37272 -0.00430 -0.00677 0.02704 287 C . PRO A 39 ? 0.27826 0.27663 0.33997 0.00027 -0.01725 0.02707 288 O . PRO A 39 ? 0.28837 0.30420 0.36977 0.00796 -0.01560 0.02388 289 CB . PRO A 39 ? 0.26159 0.26093 0.31223 -0.01229 -0.00037 0.02762 290 CG . PRO A 39 ? 0.22397 0.22179 0.26699 -0.01042 0.01115 0.02594 291 CD . PRO A 39 ? 0.27351 0.27148 0.31984 -0.00032 0.01213 0.02218 292 N . ARG A 40 ? 0.26537 0.25407 0.31882 -0.00285 -0.02880 0.02988 293 CA . ARG A 40 ? 0.28165 0.27745 0.34883 0.00243 -0.04181 0.03055 294 C . ARG A 40 ? 0.32934 0.35471 0.42605 -0.00066 -0.04438 0.02960 295 O . ARG A 40 ? 0.26343 0.30367 0.37947 0.00662 -0.05386 0.02895 296 CB . ARG A 40 ? 0.29106 0.26723 0.33658 -0.00019 -0.05433 0.03419 297 CG . ARG A 40 ? 0.28326 0.25677 0.32087 -0.01002 -0.05944 0.03383 298 CD . ARG A 40 ? 0.30308 0.25888 0.31743 -0.00969 -0.07311 0.03586 299 NE . ARG A 40 ? 0.31518 0.26093 0.31399 -0.01714 -0.07879 0.03311 300 CZ . ARG A 40 ? 0.34959 0.27968 0.32404 -0.01689 -0.09094 0.03271 301 NH1 . ARG A 40 ? 0.35114 0.27516 0.31360 -0.01119 -0.09818 0.03699 302 NH2 . ARG A 40 ? 0.35344 0.27096 0.31234 -0.02223 -0.09719 0.02789 303 N . HIS A 41 ? 0.30715 0.34264 0.40876 -0.01166 -0.03707 0.03045 304 CA . HIS A 41 ? 0.25445 0.32175 0.38572 -0.01881 -0.03929 0.03217 305 C . HIS A 41 ? 0.28595 0.38753 0.44381 -0.01014 -0.02795 0.02960 306 O . HIS A 41 ? 0.25759 0.39478 0.44350 -0.01633 -0.02635 0.03196 307 CB . HIS A 41 ? 0.24952 0.31148 0.37430 -0.03632 -0.03780 0.03609 308 CG . HIS A 41 ? 0.24720 0.30707 0.36339 -0.03904 -0.02167 0.03687 309 ND1 . HIS A 41 ? 0.33843 0.36730 0.42464 -0.03894 -0.01805 0.03579 310 CD2 . HIS A 41 ? 0.23485 0.32172 0.36766 -0.04156 -0.00869 0.03888 311 CE1 . HIS A 41 ? 0.25948 0.29360 0.34421 -0.04120 -0.00519 0.03719 312 NE2 . HIS A 41 ? 0.26237 0.33040 0.37313 -0.04329 0.00107 0.03933 313 N . VAL A 42 ? 0.26586 0.35853 0.41499 0.00378 -0.02051 0.02466 314 CA . VAL A 42 ? 0.26632 0.38828 0.43714 0.01756 -0.01250 0.01904 315 C . VAL A 42 ? 0.27846 0.42422 0.47639 0.02859 -0.02451 0.01688 316 O . VAL A 42 ? 0.28055 0.46556 0.50598 0.03837 -0.01845 0.01271 317 CB . VAL A 42 ? 0.26097 0.35880 0.41196 0.03043 -0.00700 0.01294 318 CG1 . VAL A 42 ? 0.24544 0.31109 0.38170 0.03812 -0.02147 0.01288 319 CG2 . VAL A 42 ? 0.31976 0.44490 0.48716 0.04604 0.00266 0.00461 320 N . ILE A 43 ? 0.32986 0.45503 0.52022 0.02848 -0.04168 0.01951 321 CA . ILE A 43 ? 0.32919 0.47479 0.54417 0.03969 -0.05624 0.01801 322 C . ILE A 43 ? 0.29085 0.47318 0.53447 0.02642 -0.06173 0.02255 323 O . ILE A 43 ? 0.27825 0.48550 0.54778 0.03479 -0.07455 0.02160 324 CB . ILE A 43 ? 0.30494 0.41250 0.49754 0.04495 -0.07443 0.02031 325 CG1 . ILE A 43 ? 0.27494 0.36422 0.44892 0.02680 -0.08293 0.02690 326 CG2 . ILE A 43 ? 0.27862 0.34798 0.44224 0.05305 -0.07058 0.01858 327 CD1 . ILE A 43 ? 0.29522 0.35127 0.44430 0.03067 -0.09999 0.03044 328 N . CYS A 44 ? 0.24383 0.42923 0.48388 0.00561 -0.05432 0.02789 329 CA . CYS A 44 ? 0.28206 0.49599 0.54640 -0.01197 -0.06212 0.03387 330 C . CYS A 44 ? 0.31798 0.58960 0.62072 -0.01432 -0.04871 0.03535 331 O . CYS A 44 ? 0.46460 0.74475 0.76340 -0.01177 -0.02956 0.03401 332 CB . CYS A 44 ? 0.26462 0.44759 0.50341 -0.03413 -0.06385 0.03940 333 SG . CYS A 44 ? 0.37420 0.50205 0.57219 -0.03408 -0.08153 0.03810 334 N . THR A 45 ? 0.43656 0.75061 0.77634 -0.01970 -0.05902 0.03857 335 CA . THR A 45 ? 0.46928 0.84453 0.84759 -0.02950 -0.04674 0.04359 336 C . THR A 45 ? 0.41254 0.77955 0.78397 -0.06233 -0.04643 0.05521 337 O . THR A 45 ? 0.46314 0.77727 0.80078 -0.07349 -0.05671 0.05683 338 CB . THR A 45 ? 0.39533 0.82539 0.82039 -0.02197 -0.05850 0.04282 339 OG1 . THR A 45 ? 0.45738 0.87828 0.88721 -0.04180 -0.08117 0.04937 340 CG2 . THR A 45 ? 0.25790 0.67924 0.68165 0.01153 -0.06572 0.03127 341 N . SER A 46 ? 0.57382 0.99332 0.97632 -0.07776 -0.03484 0.06365 342 CA . SER A 46 ? 0.49950 0.90833 0.89489 -0.11097 -0.03605 0.07667 343 C . SER A 46 ? 0.48506 0.87230 0.88151 -0.12958 -0.06328 0.08070 344 O . SER A 46 ? 0.48234 0.81965 0.84756 -0.14748 -0.07235 0.08472 345 CB . SER A 46 ? 0.52873 1.00444 0.96033 -0.12606 -0.01917 0.08749 346 OG . SER A 46 ? 0.63566 1.13053 1.06203 -0.10657 0.00562 0.08194 347 N . GLU A 47 ? 0.45055 0.87288 0.88080 -0.12371 -0.07820 0.07846 348 CA . GLU A 47 ? 0.42067 0.82383 0.85156 -0.14073 -0.10643 0.08125 349 C . GLU A 47 ? 0.44438 0.78075 0.83033 -0.12622 -0.12155 0.07146 350 O . GLU A 47 ? 0.46334 0.76201 0.82912 -0.14159 -0.14221 0.07252 351 CB . GLU A 47 ? 0.41668 0.88411 0.90068 -0.13958 -0.11863 0.08264 352 CG . GLU A 47 ? 0.59505 1.08151 1.09141 -0.10324 -0.11819 0.07110 353 CD . GLU A 47 ? 0.72103 1.27613 1.25578 -0.08733 -0.09505 0.06958 354 OE1 . GLU A 47 ? 0.71818 1.29511 1.25719 -0.10307 -0.07502 0.07492 355 OE2 . GLU A 47 ? 0.64082 1.21517 1.18955 -0.05607 -0.09582 0.05950 356 N . ASP A 48 ? 0.47301 0.79377 0.84139 -0.09750 -0.11226 0.06214 357 CA . ASP A 48 ? 0.44850 0.71154 0.77490 -0.08510 -0.12500 0.05510 358 C . ASP A 48 ? 0.46521 0.67120 0.74550 -0.09686 -0.12319 0.05547 359 O . ASP A 48 ? 0.48409 0.64620 0.73112 -0.09542 -0.13820 0.05152 360 CB . ASP A 48 ? 0.43751 0.69533 0.75525 -0.05536 -0.11512 0.04742 361 CG . ASP A 48 ? 0.50040 0.79608 0.85218 -0.03778 -0.12622 0.04434 362 OD1 . ASP A 48 ? 0.52791 0.83185 0.89287 -0.04491 -0.14848 0.04639 363 OD2 . ASP A 48 ? 0.53292 0.84811 0.89693 -0.01565 -0.11441 0.03905 364 N . MET A 49 ? 0.38290 0.58953 0.65927 -0.10721 -0.10551 0.05990 365 CA . MET A 49 ? 0.49073 0.64351 0.72328 -0.11318 -0.10306 0.05899 366 C . MET A 49 ? 0.39727 0.51885 0.61459 -0.13418 -0.12439 0.06137 367 O . MET A 49 ? 0.34992 0.42148 0.52664 -0.13390 -0.12719 0.05744 368 CB . MET A 49 ? 0.33149 0.49295 0.56359 -0.11818 -0.08066 0.06384 369 CG . MET A 49 ? 0.43977 0.63051 0.68467 -0.09743 -0.06068 0.05989 370 SD . MET A 49 ? 0.59111 0.77232 0.81629 -0.09811 -0.03667 0.06228 371 CE . MET A 49 ? 0.57071 0.81223 0.83057 -0.08217 -0.01754 0.05990 372 N . LEU A 50 ? 0.34890 0.49845 0.59731 -0.15136 -0.14073 0.06681 373 CA . LEU A 50 ? 0.37884 0.49431 0.61137 -0.17299 -0.16420 0.06845 374 C . LEU A 50 ? 0.45574 0.52509 0.64995 -0.15990 -0.18241 0.05739 375 O . LEU A 50 ? 0.44417 0.46110 0.59782 -0.16357 -0.19154 0.05258 376 CB . LEU A 50 ? 0.39086 0.55198 0.66957 -0.19645 -0.17873 0.07775 377 CG . LEU A 50 ? 0.50510 0.70047 0.81214 -0.22092 -0.16650 0.09180 378 CD1 . LEU A 50 ? 0.41452 0.55343 0.68087 -0.23425 -0.16545 0.09479 379 CD2 . LEU A 50 ? 0.43974 0.69149 0.77714 -0.20808 -0.13802 0.09515 380 N . ASN A 51 ? 0.42524 0.51297 0.62963 -0.14332 -0.18833 0.05312 381 CA . ASN A 51 ? 0.50797 0.55658 0.67439 -0.13001 -0.20407 0.04422 382 C . ASN A 51 ? 0.40650 0.47057 0.57597 -0.10502 -0.19488 0.04177 383 O . ASN A 51 ? 0.41767 0.50156 0.60421 -0.09844 -0.20943 0.04163 384 CB . ASN A 51 ? 0.54104 0.58718 0.71339 -0.14414 -0.23509 0.04354 385 CG . ASN A 51 ? 0.66576 0.66803 0.79153 -0.13137 -0.25184 0.03405 386 OD1 . ASN A 51 ? 0.66658 0.63561 0.75179 -0.11600 -0.24007 0.02845 387 ND2 . ASN A 51 ? 0.59130 0.59610 0.72250 -0.13806 -0.27953 0.03256 388 N . PRO A 52 ? 0.39696 0.44994 0.54919 -0.09090 -0.17267 0.04016 389 CA . PRO A 52 ? 0.43689 0.50400 0.59536 -0.06950 -0.16394 0.03924 390 C . PRO A 52 ? 0.46673 0.50056 0.58811 -0.05704 -0.17604 0.03571 391 O . PRO A 52 ? 0.51079 0.50639 0.59072 -0.05779 -0.17689 0.03220 392 CB . PRO A 52 ? 0.37209 0.43539 0.52293 -0.06337 -0.13789 0.03918 393 CG . PRO A 52 ? 0.34124 0.37021 0.46169 -0.07514 -0.13596 0.03798 394 CD . PRO A 52 ? 0.46089 0.48948 0.59032 -0.09472 -0.15589 0.03973 395 N . ASN A 53 ? 0.38862 0.43838 0.52430 -0.04461 -0.18564 0.03691 396 CA . ASN A 53 ? 0.44270 0.46372 0.54370 -0.03134 -0.19422 0.03659 397 C . ASN A 53 ? 0.42799 0.45080 0.53074 -0.01578 -0.17737 0.03840 398 O . ASN A 53 ? 0.39760 0.44181 0.52654 -0.00394 -0.18137 0.03967 399 CB . ASN A 53 ? 0.41003 0.44080 0.52138 -0.02866 -0.22065 0.03771 400 CG . ASN A 53 ? 0.48238 0.47883 0.55000 -0.01822 -0.23177 0.03906 401 OD1 . ASN A 53 ? 0.53165 0.50938 0.57566 -0.00856 -0.21879 0.04161 402 ND2 . ASN A 53 ? 0.54024 0.52894 0.59605 -0.02157 -0.25672 0.03826 403 N . TYR A 54 ? 0.36454 0.36381 0.43897 -0.01520 -0.15995 0.03787 404 CA . TYR A 54 ? 0.35796 0.35816 0.43559 -0.00425 -0.14357 0.03911 405 C . TYR A 54 ? 0.39795 0.38509 0.46475 0.00922 -0.15379 0.04310 406 O . TYR A 54 ? 0.41850 0.41287 0.50122 0.02053 -0.14872 0.04325 407 CB . TYR A 54 ? 0.34089 0.31971 0.39029 -0.00806 -0.12565 0.03829 408 CG . TYR A 54 ? 0.35752 0.34895 0.42133 -0.01801 -0.11304 0.03547 409 CD1 . TYR A 54 ? 0.30175 0.31667 0.39273 -0.01543 -0.09884 0.03503 410 CD2 . TYR A 54 ? 0.33433 0.31151 0.38151 -0.02932 -0.11652 0.03324 411 CE1 . TYR A 54 ? 0.29003 0.31566 0.39096 -0.02557 -0.08754 0.03455 412 CE2 . TYR A 54 ? 0.32416 0.30782 0.38180 -0.03934 -0.10697 0.03256 413 CZ . TYR A 54 ? 0.30150 0.31040 0.38602 -0.03832 -0.09211 0.03430 414 OH . TYR A 54 ? 0.30920 0.32416 0.40128 -0.04927 -0.08274 0.03564 415 N . GLU A 55 ? 0.40466 0.36989 0.44173 0.00865 -0.16924 0.04636 416 CA . GLU A 55 ? 0.41295 0.36305 0.43746 0.01987 -0.18171 0.05259 417 C . GLU A 55 ? 0.45593 0.43123 0.51981 0.03113 -0.19572 0.05144 418 O . GLU A 55 ? 0.43944 0.41070 0.51089 0.04472 -0.19698 0.05331 419 CB . GLU A 55 ? 0.51730 0.44253 0.50070 0.01632 -0.19632 0.05681 420 CG . GLU A 55 ? 0.58587 0.49260 0.53119 0.00779 -0.18287 0.05572 421 CD . GLU A 55 ? 0.72174 0.63435 0.66908 -0.00170 -0.18447 0.04699 422 OE1 . GLU A 55 ? 0.79797 0.70617 0.73568 -0.00433 -0.20405 0.04486 423 OE2 . GLU A 55 ? 0.53247 0.45134 0.48964 -0.00685 -0.16810 0.04246 424 N . ASP A 56 ? 0.41067 0.41291 0.50105 0.02597 -0.20727 0.04795 425 CA . ASP A 56 ? 0.42184 0.45796 0.55537 0.03722 -0.22023 0.04633 426 C . ASP A 56 ? 0.38680 0.45242 0.55627 0.04576 -0.20209 0.04160 427 O . ASP A 56 ? 0.38726 0.46606 0.57855 0.06443 -0.20778 0.03976 428 CB . ASP A 56 ? 0.44972 0.51340 0.60673 0.02566 -0.23562 0.04449 429 CG . ASP A 56 ? 0.49193 0.52836 0.61464 0.02106 -0.25860 0.04736 430 OD1 . ASP A 56 ? 0.51248 0.51268 0.59462 0.02802 -0.26219 0.05211 431 OD2 . ASP A 56 ? 0.61456 0.66596 0.74973 0.00933 -0.27366 0.04536 432 N . LEU A 57 ? 0.35887 0.43447 0.53313 0.03380 -0.18121 0.03897 433 CA . LEU A 57 ? 0.33623 0.44180 0.54116 0.04113 -0.16303 0.03430 434 C . LEU A 57 ? 0.34175 0.42152 0.52951 0.05724 -0.15540 0.03284 435 O . LEU A 57 ? 0.34080 0.44105 0.55327 0.07398 -0.15132 0.02733 436 CB . LEU A 57 ? 0.31537 0.43131 0.52243 0.02317 -0.14408 0.03373 437 CG . LEU A 57 ? 0.31389 0.45707 0.54310 0.00471 -0.15148 0.03567 438 CD1 . LEU A 57 ? 0.30107 0.44151 0.52309 -0.01342 -0.13469 0.03677 439 CD2 . LEU A 57 ? 0.30805 0.50737 0.58937 0.01109 -0.15645 0.03460 440 N . LEU A 58 ? 0.35118 0.38683 0.49646 0.05245 -0.15399 0.03747 441 CA . LEU A 58 ? 0.36001 0.36770 0.48778 0.06370 -0.14952 0.03796 442 C . LEU A 58 ? 0.38887 0.38265 0.51698 0.08116 -0.17063 0.04017 443 O . LEU A 58 ? 0.45890 0.44041 0.58892 0.09630 -0.17073 0.03715 444 CB . LEU A 58 ? 0.36438 0.33561 0.44994 0.05105 -0.14173 0.04412 445 CG . LEU A 58 ? 0.37300 0.31595 0.44079 0.05669 -0.13590 0.04608 446 CD1 . LEU A 58 ? 0.39510 0.35634 0.48616 0.06431 -0.12101 0.03680 447 CD2 . LEU A 58 ? 0.37515 0.29343 0.40680 0.04208 -0.12694 0.05303 448 N . ILE A 59 ? 0.44561 0.43797 0.56985 0.08004 -0.19057 0.04502 449 CA . ILE A 59 ? 0.47689 0.45628 0.60197 0.09769 -0.21364 0.04785 450 C . ILE A 59 ? 0.45231 0.46933 0.62346 0.11885 -0.21640 0.03796 451 O . ILE A 59 ? 0.51147 0.51226 0.68373 0.13977 -0.22825 0.03628 452 CB . ILE A 59 ? 0.45942 0.43288 0.57013 0.09121 -0.23496 0.05472 453 CG1 . ILE A 59 ? 0.47876 0.40820 0.53595 0.07761 -0.23420 0.06509 454 CG2 . ILE A 59 ? 0.48807 0.46329 0.61348 0.11142 -0.26131 0.05582 455 CD1 . ILE A 59 ? 0.50327 0.42413 0.53766 0.07065 -0.25314 0.07086 456 N . ARG A 60 ? 0.42886 0.49649 0.63767 0.11425 -0.20537 0.03137 457 CA . ARG A 60 ? 0.42808 0.54177 0.68301 0.13452 -0.20429 0.02171 458 C . ARG A 60 ? 0.44874 0.55868 0.70460 0.14793 -0.18611 0.01316 459 O . ARG A 60 ? 0.44874 0.59471 0.73844 0.16942 -0.18438 0.00324 460 CB . ARG A 60 ? 0.40692 0.58016 0.70217 0.12166 -0.19727 0.01985 461 CG . ARG A 60 ? 0.44542 0.62464 0.74269 0.10783 -0.21769 0.02648 462 CD . ARG A 60 ? 0.63059 0.79203 0.92245 0.12648 -0.24601 0.02876 463 NE . ARG A 60 ? 0.70431 0.91837 1.04262 0.13388 -0.26273 0.02651 464 CZ . ARG A 60 ? 0.79098 1.02230 1.13679 0.11515 -0.27471 0.03084 465 NH1 . ARG A 60 ? 0.85794 1.05865 1.17030 0.09078 -0.27439 0.03619 466 NH2 . ARG A 60 ? 0.54896 0.82681 0.92989 0.12009 -0.28329 0.02905 467 N . LYS A 61 ? 0.40013 0.47018 0.62040 0.13710 -0.17329 0.01589 468 CA . LYS A 61 ? 0.48336 0.54633 0.70071 0.14740 -0.15750 0.00750 469 C . LYS A 61 ? 0.56948 0.57910 0.75935 0.16281 -0.17183 0.00786 470 O . LYS A 61 ? 0.50499 0.47344 0.66520 0.15560 -0.18715 0.01892 471 CB . LYS A 61 ? 0.49244 0.54743 0.69056 0.12517 -0.13530 0.01004 472 CG . LYS A 61 ? 0.43630 0.53720 0.65817 0.10910 -0.12093 0.01009 473 CD . LYS A 61 ? 0.41367 0.56800 0.67590 0.12368 -0.11081 0.00032 474 CE . LYS A 61 ? 0.29403 0.49242 0.57822 0.10374 -0.09619 0.00336 475 NZ . LYS A 61 ? 0.33059 0.58769 0.65415 0.11677 -0.08402 -0.00444 476 N . SER A 62 ? 0.49945 0.50902 0.69743 0.18377 -0.16734 -0.00414 477 CA . SER A 62 ? 0.53600 0.49076 0.70747 0.19821 -0.18072 -0.00578 478 C . SER A 62 ? 0.52823 0.46423 0.68134 0.19125 -0.16287 -0.01073 479 O . SER A 62 ? 0.51504 0.48354 0.67796 0.17930 -0.14045 -0.01384 480 CB . SER A 62 ? 0.49856 0.46365 0.68798 0.22842 -0.19136 -0.01777 481 OG . SER A 62 ? 0.59511 0.57088 0.79419 0.23142 -0.20789 -0.01166 482 N . ASN A 63 ? 0.58365 0.46455 0.70888 0.19803 -0.17491 -0.01080 483 CA . ASN A 63 ? 0.53062 0.39048 0.63745 0.19109 -0.16162 -0.01570 484 C . ASN A 63 ? 0.50374 0.40195 0.63373 0.21086 -0.14617 -0.03498 485 O . ASN A 63 ? 0.52918 0.44002 0.65519 0.19946 -0.12614 -0.03839 486 CB . ASN A 63 ? 0.62365 0.41835 0.69644 0.19108 -0.17884 -0.01180 487 CG . ASN A 63 ? 0.62427 0.38278 0.66846 0.16515 -0.18796 0.00963 488 OD1 . ASN A 63 ? 0.57027 0.34500 0.61119 0.14333 -0.17501 0.01932 489 ND2 . ASN A 63 ? 0.61416 0.33229 0.63497 0.16244 -0.20443 0.01637 490 N . HIS A 64 ? 0.53499 0.45611 0.68646 0.23774 -0.15244 -0.04686 491 CA . HIS A 64 ? 0.54796 0.50927 0.71767 0.25628 -0.13557 -0.06475 492 C . HIS A 64 ? 0.44952 0.48154 0.65515 0.25214 -0.11537 -0.06610 493 O . HIS A 64 ? 0.53020 0.60094 0.74905 0.26315 -0.09729 -0.07846 494 CB . HIS A 64 ? 0.54147 0.50809 0.71887 0.28123 -0.14517 -0.07520 495 CG . HIS A 64 ? 0.71566 0.70183 0.91352 0.28452 -0.15877 -0.06724 496 ND1 . HIS A 64 ? 0.62980 0.68349 0.86785 0.28534 -0.14955 -0.06634 497 CD2 . HIS A 64 ? 0.73649 0.68412 0.91939 0.28575 -0.18158 -0.05933 498 CE1 . HIS A 64 ? 0.59063 0.64586 0.83791 0.28779 -0.16702 -0.05893 499 NE2 . HIS A 64 ? 0.71715 0.70815 0.93029 0.28896 -0.18620 -0.05475 500 N . ASN A 65 ? 0.45673 0.50513 0.66996 0.22724 -0.11388 -0.05070 501 CA . ASN A 65 ? 0.38268 0.49003 0.62113 0.21087 -0.09319 -0.04737 502 C . ASN A 65 ? 0.45338 0.55152 0.67072 0.18681 -0.07342 -0.04297 503 O . ASN A 65 ? 0.47913 0.61770 0.71185 0.17040 -0.05725 -0.03840 504 CB . ASN A 65 ? 0.37104 0.49481 0.62402 0.19464 -0.10306 -0.03413 505 CG . ASN A 65 ? 0.45771 0.60614 0.73998 0.21803 -0.12123 -0.03844 506 OD1 . ASN A 65 ? 0.50677 0.62785 0.78043 0.21737 -0.14286 -0.03048 507 ND2 . ASN A 65 ? 0.38529 0.58825 0.70213 0.23987 -0.11259 -0.05102 508 N . PHE A 66 ? 0.41359 0.45962 0.59680 0.18357 -0.07583 -0.04348 509 CA . PHE A 66 ? 0.43121 0.46691 0.59408 0.16224 -0.05961 -0.03938 510 C . PHE A 66 ? 0.47822 0.50530 0.62965 0.17760 -0.05183 -0.05384 511 O . PHE A 66 ? 0.46795 0.45045 0.59988 0.19021 -0.06583 -0.06002 512 CB . PHE A 66 ? 0.46851 0.45570 0.60170 0.14159 -0.06873 -0.02614 513 CG . PHE A 66 ? 0.48665 0.48027 0.62450 0.12640 -0.07551 -0.01307 514 CD1 . PHE A 66 ? 0.35958 0.38087 0.50466 0.10732 -0.06270 -0.00691 515 CD2 . PHE A 66 ? 0.39498 0.36293 0.52642 0.13140 -0.09643 -0.00704 516 CE1 . PHE A 66 ? 0.35174 0.37497 0.49747 0.09445 -0.07084 0.00304 517 CE2 . PHE A 66 ? 0.53122 0.50396 0.66290 0.11822 -0.10354 0.00394 518 CZ . PHE A 66 ? 0.50153 0.50183 0.64018 0.10013 -0.09081 0.00801 519 N . LEU A 67 ? 0.48590 0.55307 0.64694 0.17572 -0.03090 -0.05875 520 CA . LEU A 67 ? 0.47797 0.54285 0.62610 0.19013 -0.02145 -0.07324 521 C . LEU A 67 ? 0.44516 0.48270 0.56559 0.16803 -0.01385 -0.06718 522 O . LEU A 67 ? 0.47562 0.53931 0.59943 0.15002 0.00193 -0.05952 523 CB . LEU A 67 ? 0.52277 0.65218 0.69619 0.20193 -0.00233 -0.08133 524 CG . LEU A 67 ? 0.57587 0.73166 0.76906 0.23734 -0.00649 -0.09803 525 CD1 . LEU A 67 ? 0.70788 0.81699 0.87251 0.26091 -0.01630 -0.11541 526 CD2 . LEU A 67 ? 0.62603 0.78630 0.84277 0.24423 -0.02453 -0.09308 527 N . VAL A 68 ? 0.39514 0.38005 0.48876 0.16915 -0.02646 -0.07017 528 CA . VAL A 68 ? 0.53231 0.49225 0.60140 0.15014 -0.02171 -0.06557 529 C . VAL A 68 ? 0.53027 0.47967 0.58288 0.16621 -0.01911 -0.08243 530 O . VAL A 68 ? 0.54886 0.47041 0.59334 0.18720 -0.03339 -0.09510 531 CB . VAL A 68 ? 0.55672 0.46839 0.60810 0.13420 -0.03804 -0.05388 532 CG1 . VAL A 68 ? 0.45208 0.34674 0.48312 0.11501 -0.03256 -0.04928 533 CG2 . VAL A 68 ? 0.43088 0.35318 0.49452 0.12115 -0.04094 -0.03893 534 N . GLN A 69 ? 0.51456 0.48310 0.55960 0.15732 -0.00257 -0.08308 535 CA . GLN A 69 ? 0.55983 0.52113 0.58561 0.17148 0.00102 -0.09917 536 C . GLN A 69 ? 0.53203 0.47398 0.53598 0.15060 0.00384 -0.09312 537 O . GLN A 69 ? 0.41379 0.37763 0.42268 0.13145 0.01606 -0.08039 538 CB . GLN A 69 ? 0.47377 0.48967 0.51262 0.18726 0.02056 -0.10839 539 CG . GLN A 69 ? 0.71569 0.72670 0.74224 0.21886 0.01794 -0.13156 540 CD . GLN A 69 ? 0.78974 0.86353 0.83057 0.23454 0.03980 -0.13947 541 OE1 . GLN A 69 ? 0.83175 0.93789 0.89735 0.24820 0.04138 -0.14186 542 NE2 . GLN A 69 ? 0.79783 0.88944 0.82248 0.22683 0.05620 -0.13947 543 N . ALA A 70 ? 0.55852 0.45829 0.53849 0.15475 -0.00937 -0.10254 544 CA . ALA A 70 ? 0.56031 0.44188 0.51998 0.13742 -0.00970 -0.09915 545 C . ALA A 70 ? 0.65634 0.53867 0.59578 0.15492 -0.00566 -0.11794 546 O . ALA A 70 ? 0.67613 0.52077 0.59708 0.16826 -0.02147 -0.13251 547 CB . ALA A 70 ? 0.59239 0.42501 0.54111 0.12319 -0.03046 -0.09249 548 N . GLY A 71 ? 0.57849 0.50161 0.51871 0.15444 0.01457 -0.11732 549 CA . GLY A 71 ? 0.64276 0.57538 0.56341 0.17422 0.02151 -0.13540 550 C . GLY A 71 ? 0.63951 0.59044 0.57031 0.20415 0.02384 -0.15091 551 O . GLY A 71 ? 0.71807 0.70458 0.67724 0.20662 0.03251 -0.14400 552 N . ASN A 72 ? 0.66704 0.59486 0.57620 0.22466 0.01451 -0.17033 553 CA . ASN A 72 ? 0.66149 0.60551 0.58177 0.24667 0.01380 -0.18006 554 C . ASN A 72 ? 0.72397 0.62812 0.65202 0.25266 -0.00935 -0.18075 555 O . ASN A 72 ? 0.71935 0.63055 0.65460 0.27253 -0.01374 -0.18957 556 CB . ASN A 72 ? 0.67755 0.61756 0.57166 0.26142 0.01380 -0.19620 557 CG . ASN A 72 ? 0.91187 0.78674 0.77779 0.26140 -0.01231 -0.20541 558 OD1 . ASN A 72 ? 0.98535 0.82462 0.84138 0.24217 -0.02363 -0.19830 559 ND2 . ASN A 72 ? 0.89209 0.75210 0.74540 0.28235 -0.02276 -0.22088 560 N . VAL A 73 ? 0.73919 0.60221 0.66497 0.23546 -0.02450 -0.17064 561 CA . VAL A 73 ? 0.79764 0.61816 0.72665 0.23602 -0.04789 -0.16718 562 C . VAL A 73 ? 0.64658 0.48866 0.60516 0.23104 -0.04409 -0.15321 563 O . VAL A 73 ? 0.59362 0.45622 0.56224 0.20888 -0.03254 -0.13760 564 CB . VAL A 73 ? 0.85239 0.61229 0.75837 0.21641 -0.06906 -0.16222 565 CG1 . VAL A 73 ? 0.84714 0.56446 0.75413 0.21387 -0.09295 -0.15542 566 CG2 . VAL A 73 ? 0.72807 0.46908 0.60557 0.22067 -0.07407 -0.17623 567 N . GLN A 74 ? 0.65673 0.49895 0.62940 0.24480 -0.05369 -0.15414 568 CA . GLN A 74 ? 0.66270 0.52341 0.66284 0.24171 -0.05400 -0.14142 569 C . GLN A 74 ? 0.71436 0.51821 0.70462 0.22832 -0.07854 -0.12949 570 O . GLN A 74 ? 0.77925 0.54207 0.75221 0.23362 -0.09728 -0.13438 571 CB . GLN A 74 ? 0.55918 0.46155 0.58256 0.26429 -0.04905 -0.14849 572 CG . GLN A 74 ? 0.69436 0.63512 0.75153 0.26083 -0.04396 -0.13621 573 CD . GLN A 74 ? 0.83739 0.81385 0.91800 0.28204 -0.04401 -0.14238 574 OE1 . GLN A 74 ? 0.88109 0.85173 0.97626 0.28406 -0.05754 -0.13513 575 NE2 . GLN A 74 ? 0.80143 0.81580 0.88492 0.29759 -0.02920 -0.15522 576 N . LEU A 75 ? 0.67075 0.47730 0.67036 0.20507 -0.07687 -0.11032 577 CA . LEU A 75 ? 0.66270 0.42115 0.65153 0.18763 -0.09711 -0.09507 578 C . LEU A 75 ? 0.80148 0.56337 0.80720 0.19785 -0.10768 -0.08898 579 O . LEU A 75 ? 0.70312 0.51522 0.73450 0.20230 -0.09456 -0.08688 580 CB . LEU A 75 ? 0.65192 0.41685 0.63795 0.15255 -0.08765 -0.07536 581 CG . LEU A 75 ? 0.60966 0.37630 0.58166 0.14004 -0.07738 -0.07873 582 CD1 . LEU A 75 ? 0.46894 0.24194 0.44024 0.10846 -0.07063 -0.05924 583 CD2 . LEU A 75 ? 0.70671 0.42243 0.65378 0.14740 -0.09571 -0.09123 584 N . ARG A 76 ? 0.73935 0.45486 0.72979 0.19432 -0.12972 -0.08286 585 CA . ARG A 76 ? 0.73406 0.44918 0.73491 0.20123 -0.14182 -0.07568 586 C . ARG A 76 ? 0.69170 0.39797 0.69248 0.17696 -0.14544 -0.05293 587 O . ARG A 76 ? 0.73576 0.40306 0.71499 0.15429 -0.15548 -0.03927 588 CB . ARG A 76 ? 0.65650 0.32782 0.63800 0.20905 -0.16350 -0.08013 589 CG . ARG A 76 ? 0.75240 0.41485 0.73895 0.21390 -0.17908 -0.07124 590 CD . ARG A 76 ? 0.74488 0.36644 0.71291 0.22675 -0.20031 -0.07951 591 NE . ARG A 76 ? 0.82308 0.47227 0.80528 0.25979 -0.19744 -0.10002 592 CZ . ARG A 76 ? 0.86867 0.49211 0.83524 0.27767 -0.20974 -0.11551 593 NH1 . ARG A 76 ? 1.06579 0.63446 1.00264 0.26533 -0.22656 -0.11355 594 NH2 . ARG A 76 ? 0.86985 0.52500 0.85134 0.30833 -0.20555 -0.13314 595 N . VAL A 77 ? 0.59354 0.34282 0.61816 0.17825 -0.13553 -0.04779 596 CA . VAL A 77 ? 0.54423 0.29502 0.56678 0.15364 -0.13619 -0.02655 597 C . VAL A 77 ? 0.61312 0.32510 0.62551 0.15914 -0.16144 -0.01789 598 O . VAL A 77 ? 0.59671 0.32316 0.62311 0.17971 -0.16815 -0.02569 599 CB . VAL A 77 ? 0.47332 0.28362 0.52211 0.15026 -0.11837 -0.02447 600 CG1 . VAL A 77 ? 0.46120 0.26899 0.50375 0.12848 -0.12162 -0.00519 601 CG2 . VAL A 77 ? 0.44824 0.29317 0.50321 0.14211 -0.09419 -0.03048 602 N . ILE A 78 ? 0.57810 0.25329 0.56561 0.13461 -0.17022 -0.00048 603 CA . ILE A 78 ? 0.62565 0.27160 0.59810 0.13049 -0.18882 0.01027 604 C . ILE A 78 ? 0.60374 0.25598 0.57125 0.11233 -0.18948 0.03053 605 O . ILE A 78 ? 0.73288 0.36036 0.68293 0.10342 -0.20318 0.04284 606 CB . ILE A 78 ? 0.69153 0.29096 0.63724 0.11716 -0.20070 0.01392 607 CG1 . ILE A 78 ? 0.66296 0.25680 0.59608 0.08750 -0.19114 0.02705 608 CG2 . ILE A 78 ? 0.68683 0.27619 0.63346 0.13869 -0.20443 -0.00776 609 CD1 . ILE A 78 ? 0.68660 0.24098 0.59730 0.07097 -0.20314 0.03205 610 N . GLY A 79 ? 0.63948 0.32504 0.62004 0.10641 -0.17496 0.03381 611 CA . GLY A 79 ? 0.56513 0.26381 0.53889 0.08894 -0.17249 0.05022 612 C . GLY A 79 ? 0.54661 0.29656 0.53678 0.08033 -0.14860 0.04645 613 O . GLY A 79 ? 0.52921 0.29689 0.52727 0.07796 -0.13202 0.03738 614 N . HIS A 80 ? 0.65369 0.42453 0.64691 0.07578 -0.14850 0.05320 615 CA . HIS A 80 ? 0.52265 0.33558 0.52879 0.06729 -0.12968 0.05005 616 C . HIS A 80 ? 0.57159 0.38325 0.55794 0.05103 -0.13090 0.06393 617 O . HIS A 80 ? 0.55165 0.34705 0.52686 0.05342 -0.14780 0.07250 618 CB . HIS A 80 ? 0.53914 0.39005 0.57818 0.08376 -0.12816 0.03772 619 CG . HIS A 80 ? 0.58308 0.43350 0.62910 0.09520 -0.14781 0.04068 620 ND1 . HIS A 80 ? 0.58846 0.42448 0.64307 0.11731 -0.16487 0.03521 621 CD2 . HIS A 80 ? 0.56392 0.42601 0.60899 0.08903 -0.15475 0.04759 622 CE1 . HIS A 80 ? 0.51075 0.35153 0.57113 0.12405 -0.18148 0.03967 623 NE2 . HIS A 80 ? 0.59604 0.45251 0.65029 0.10626 -0.17586 0.04730 624 N . SER A 81 ? 0.52858 0.35686 0.50867 0.03628 -0.11370 0.06541 625 CA . SER A 81 ? 0.45142 0.28105 0.40991 0.02281 -0.11209 0.07585 626 C . SER A 81 ? 0.50224 0.36168 0.46878 0.01748 -0.09550 0.06870 627 O . SER A 81 ? 0.48261 0.35570 0.46344 0.01811 -0.08248 0.06039 628 CB . SER A 81 ? 0.55614 0.36279 0.48648 0.00797 -0.11077 0.08968 629 OG . SER A 81 ? 0.86196 0.67778 0.77117 -0.00339 -0.10461 0.09770 630 N . MET A 82 ? 0.44416 0.31031 0.39858 0.01269 -0.09768 0.07184 631 CA . MET A 82 ? 0.42431 0.31095 0.38136 0.00794 -0.08603 0.06528 632 C . MET A 82 ? 0.43074 0.31251 0.35751 -0.00176 -0.07858 0.07173 633 O . MET A 82 ? 0.54060 0.41100 0.44357 -0.00444 -0.08697 0.08049 634 CB . MET A 82 ? 0.39451 0.29383 0.36363 0.01169 -0.09641 0.06056 635 CG . MET A 82 ? 0.45830 0.37088 0.42662 0.00548 -0.08855 0.05435 636 SD . MET A 82 ? 0.49259 0.42362 0.48584 0.00652 -0.10148 0.04841 637 CE . MET A 82 ? 0.50023 0.41821 0.48144 0.01220 -0.12420 0.05521 638 N . GLN A 83 ? 0.39134 0.28364 0.31836 -0.00585 -0.06289 0.06750 639 CA . GLN A 83 ? 0.41108 0.30680 0.31355 -0.01183 -0.05344 0.07085 640 C . GLN A 83 ? 0.35547 0.26248 0.26069 -0.00943 -0.04727 0.06006 641 O . GLN A 83 ? 0.39600 0.31124 0.31604 -0.00907 -0.03774 0.05403 642 CB . GLN A 83 ? 0.38124 0.27867 0.28177 -0.01817 -0.04252 0.07630 643 CG . GLN A 83 ? 0.46731 0.37681 0.34647 -0.02309 -0.03132 0.08005 644 CD . GLN A 83 ? 0.57298 0.48870 0.45420 -0.03179 -0.02236 0.08733 645 OE1 . GLN A 83 ? 0.65926 0.56804 0.55777 -0.03327 -0.02375 0.08623 646 NE2 . GLN A 83 ? 0.66110 0.59192 0.52453 -0.03749 -0.01355 0.09445 647 N . ASN A 84 ? 0.37767 0.28156 0.26613 -0.00791 -0.05462 0.05776 648 CA . ASN A 84 ? 0.36292 0.26934 0.25178 -0.00610 -0.05434 0.04737 649 C . ASN A 84 ? 0.33300 0.24624 0.25415 -0.00689 -0.05575 0.04237 650 O . ASN A 84 ? 0.36761 0.28337 0.30561 -0.00630 -0.06671 0.04336 651 CB . ASN A 84 ? 0.37853 0.28975 0.25266 -0.00448 -0.04058 0.04343 652 CG . ASN A 84 ? 0.43135 0.34491 0.27562 -0.00351 -0.03626 0.04901 653 OD1 . ASN A 84 ? 0.50617 0.41299 0.32659 -0.00088 -0.04429 0.04823 654 ND2 . ASN A 84 ? 0.41703 0.34226 0.26207 -0.00646 -0.02380 0.05522 655 N . CYS A 85 ? 0.31583 0.23477 0.24601 -0.00782 -0.04475 0.03769 656 CA . CYS A 85 ? 0.32557 0.25368 0.28273 -0.01023 -0.04424 0.03420 657 C . CYS A 85 ? 0.34420 0.28231 0.32069 -0.00860 -0.03459 0.03546 658 O . CYS A 85 ? 0.31668 0.26558 0.31173 -0.01026 -0.02985 0.03272 659 CB . CYS A 85 ? 0.30071 0.22421 0.25186 -0.01318 -0.04140 0.02873 660 SG . CYS A 85 ? 0.36203 0.26900 0.29271 -0.01504 -0.05724 0.02390 661 N . VAL A 86 ? 0.28323 0.21693 0.25396 -0.00621 -0.03237 0.03981 662 CA . VAL A 86 ? 0.32172 0.25960 0.30751 -0.00367 -0.02649 0.03932 663 C . VAL A 86 ? 0.32799 0.25869 0.31898 0.00106 -0.03677 0.04282 664 O . VAL A 86 ? 0.35326 0.27261 0.32943 0.00014 -0.04586 0.04895 665 CB . VAL A 86 ? 0.35648 0.29174 0.33142 -0.00612 -0.01598 0.04063 666 CG1 . VAL A 86 ? 0.33955 0.28129 0.31205 -0.00754 -0.00710 0.03611 667 CG2 . VAL A 86 ? 0.41825 0.34557 0.37228 -0.00959 -0.01793 0.04808 668 N . LEU A 87 ? 0.32617 0.26250 0.33620 0.00747 -0.03594 0.03861 669 CA . LEU A 87 ? 0.36465 0.29034 0.37965 0.01554 -0.04678 0.03987 670 C . LEU A 87 ? 0.39477 0.30214 0.39861 0.01428 -0.04483 0.04209 671 O . LEU A 87 ? 0.37197 0.28405 0.37722 0.01230 -0.03417 0.03796 672 CB . LEU A 87 ? 0.41663 0.36104 0.45904 0.02657 -0.04798 0.03194 673 CG . LEU A 87 ? 0.52876 0.47786 0.58417 0.03515 -0.06306 0.03239 674 CD1 . LEU A 87 ? 0.56609 0.52367 0.61965 0.02683 -0.06831 0.03601 675 CD2 . LEU A 87 ? 0.42941 0.40410 0.51426 0.04805 -0.06079 0.02345 676 N . LYS A 88 ? 0.42990 0.31469 0.42153 0.01417 -0.05688 0.04952 677 CA . LYS A 88 ? 0.41778 0.28019 0.39854 0.01031 -0.05941 0.05350 678 C . LYS A 88 ? 0.47138 0.31500 0.45963 0.02380 -0.07347 0.04928 679 O . LYS A 88 ? 0.52309 0.35128 0.50611 0.02786 -0.08824 0.05521 680 CB . LYS A 88 ? 0.39427 0.24319 0.35135 -0.00360 -0.06244 0.06802 681 CG . LYS A 88 ? 0.54118 0.41097 0.48965 -0.01203 -0.04956 0.07022 682 CD . LYS A 88 ? 0.51674 0.38464 0.44849 -0.02602 -0.04427 0.08104 683 CE . LYS A 88 ? 0.53322 0.38226 0.44538 -0.03375 -0.05557 0.09616 684 NZ . LYS A 88 ? 0.69153 0.54430 0.59029 -0.05021 -0.04947 0.10884 685 N . LEU A 89 ? 0.46832 0.31240 0.46683 0.03256 -0.06982 0.03827 686 CA . LEU A 89 ? 0.48832 0.31538 0.49351 0.05000 -0.08241 0.03020 687 C . LEU A 89 ? 0.51728 0.30645 0.50484 0.04491 -0.09138 0.03281 688 O . LEU A 89 ? 0.51657 0.30691 0.50142 0.03945 -0.08275 0.02811 689 CB . LEU A 89 ? 0.41077 0.26626 0.43752 0.06541 -0.07230 0.01449 690 CG . LEU A 89 ? 0.39846 0.29463 0.44523 0.06609 -0.06235 0.01281 691 CD1 . LEU A 89 ? 0.34470 0.27026 0.41085 0.07896 -0.05105 -0.00049 692 CD2 . LEU A 89 ? 0.35410 0.25214 0.40876 0.07215 -0.07633 0.01728 693 N . LYS A 90 ? 0.48060 0.23428 0.45522 0.04560 -0.11051 0.04104 694 CA . LYS A 90 ? 0.53235 0.24379 0.48996 0.03987 -0.12330 0.04411 695 C . LYS A 90 ? 0.60572 0.30157 0.56993 0.06354 -0.13162 0.02562 696 O . LYS A 90 ? 0.53207 0.23081 0.50756 0.08561 -0.13950 0.01726 697 CB . LYS A 90 ? 0.58086 0.25562 0.51852 0.02966 -0.14215 0.06214 698 CG . LYS A 90 ? 0.59470 0.22882 0.51278 0.01269 -0.15348 0.07139 699 CD . LYS A 90 ? 0.67471 0.29752 0.57454 -0.00656 -0.16105 0.09104 700 CE . LYS A 90 ? 0.86214 0.45759 0.75571 0.00686 -0.18071 0.08874 701 NZ . LYS A 90 ? 0.84525 0.42513 0.71835 -0.01312 -0.18935 0.10806 702 N . VAL A 91 ? 0.54781 0.22972 0.50503 0.06025 -0.13010 0.01826 703 CA . VAL A 91 ? 0.54124 0.20741 0.49963 0.08345 -0.13699 -0.00163 704 C . VAL A 91 ? 0.66362 0.27414 0.59966 0.07765 -0.15892 0.00093 705 O . VAL A 91 ? 0.68135 0.27565 0.60402 0.05111 -0.16366 0.01831 706 CB . VAL A 91 ? 0.56221 0.26044 0.52821 0.08619 -0.11730 -0.01534 707 CG1 . VAL A 91 ? 0.46785 0.22116 0.45679 0.09439 -0.09742 -0.01955 708 CG2 . VAL A 91 ? 0.56372 0.26131 0.51959 0.05901 -0.11029 -0.00489 709 N . ASP A 92 ? 0.69971 0.29727 0.63349 0.09967 -0.16759 -0.01697 710 CA . ASP A 92 ? 0.85187 0.40748 0.76556 0.09436 -0.18705 -0.01677 711 C . ASP A 92 ? 0.80801 0.34717 0.70867 0.07826 -0.18789 -0.01888 712 O . ASP A 92 ? 0.80377 0.30772 0.68754 0.06742 -0.20526 -0.01490 713 CB . ASP A 92 ? 0.71401 0.26105 0.62829 0.12561 -0.19752 -0.03587 714 CG . ASP A 92 ? 0.86461 0.43278 0.78527 0.14840 -0.18579 -0.05957 715 OD1 . ASP A 92 ? 0.79711 0.39415 0.72695 0.14461 -0.16727 -0.06201 716 OD2 . ASP A 92 ? 0.97487 0.53145 0.88976 0.17091 -0.19516 -0.07596 717 N . THR A 93 ? 0.79231 0.35546 0.70008 0.07586 -0.17120 -0.02463 718 CA . THR A 93 ? 0.80457 0.35558 0.70119 0.06130 -0.17237 -0.02768 719 C . THR A 93 ? 0.64221 0.21560 0.54551 0.03706 -0.15805 -0.01356 720 O . THR A 93 ? 0.57243 0.18839 0.49118 0.04225 -0.13818 -0.01394 721 CB . THR A 93 ? 0.79639 0.35329 0.69051 0.08612 -0.16761 -0.05334 722 OG1 . THR A 93 ? 0.93832 0.53475 0.84979 0.10666 -0.14871 -0.06297 723 CG2 . THR A 93 ? 0.83612 0.36460 0.71802 0.10558 -0.18528 -0.06647 724 N . ALA A 94 ? 0.71911 0.28068 0.61427 0.00904 -0.16443 -0.00025 725 CA . ALA A 94 ? 0.64186 0.23094 0.54428 -0.01403 -0.15051 0.01204 726 C . ALA A 94 ? 0.57506 0.18512 0.47957 -0.00742 -0.13975 -0.00446 727 O . ALA A 94 ? 0.60973 0.18841 0.50122 0.00227 -0.15296 -0.02004 728 CB . ALA A 94 ? 0.61229 0.19326 0.50930 -0.04605 -0.15944 0.03263 729 N . ASN A 95 ? 0.52539 0.18554 0.44341 -0.01170 -0.11721 -0.00140 730 CA . ASN A 95 ? 0.50798 0.18990 0.42650 -0.00692 -0.10664 -0.01419 731 C . ASN A 95 ? 0.53736 0.20170 0.44785 -0.02812 -0.11931 -0.01025 732 O . ASN A 95 ? 0.51614 0.19758 0.43439 -0.05204 -0.11670 0.00731 733 CB . ASN A 95 ? 0.48347 0.21782 0.41685 -0.00818 -0.08242 -0.00914 734 CG . ASN A 95 ? 0.49478 0.25073 0.42662 -0.00115 -0.07150 -0.02135 735 OD1 . ASN A 95 ? 0.47193 0.20681 0.39089 0.00602 -0.08070 -0.03498 736 ND2 . ASN A 95 ? 0.45025 0.24549 0.39235 -0.00255 -0.05311 -0.01673 737 N . PRO A 96 ? 0.57092 0.20347 0.46619 -0.02030 -0.13361 -0.02629 738 CA . PRO A 96 ? 0.69010 0.30634 0.57872 -0.04233 -0.14811 -0.02283 739 C . PRO A 96 ? 0.55232 0.21303 0.45026 -0.05001 -0.13292 -0.02205 740 O . PRO A 96 ? 0.57570 0.23322 0.47332 -0.07017 -0.14364 -0.01714 741 CB . PRO A 96 ? 0.64245 0.20930 0.50839 -0.02562 -0.16819 -0.04449 742 CG . PRO A 96 ? 0.67729 0.26373 0.54234 0.00752 -0.15181 -0.06264 743 CD . PRO A 96 ? 0.62680 0.24076 0.51005 0.01013 -0.13682 -0.04959 744 N . LYS A 97 ? 0.54651 0.24736 0.45282 -0.03508 -0.11015 -0.02621 745 CA . LYS A 97 ? 0.55420 0.29604 0.46878 -0.04077 -0.09592 -0.02364 746 C . LYS A 97 ? 0.52255 0.30163 0.45569 -0.05364 -0.08173 -0.00517 747 O . LYS A 97 ? 0.43361 0.24807 0.37430 -0.05343 -0.06810 -0.00347 748 CB . LYS A 97 ? 0.55415 0.31359 0.46251 -0.01745 -0.08119 -0.03909 749 CG . LYS A 97 ? 0.57406 0.30328 0.46094 -0.00029 -0.09187 -0.05996 750 CD . LYS A 97 ? 0.67183 0.42123 0.54869 0.00642 -0.08367 -0.06953 751 CE . LYS A 97 ? 0.73634 0.47769 0.59434 0.03289 -0.07977 -0.09005 752 NZ . LYS A 97 ? 0.80370 0.57634 0.67291 0.04738 -0.05824 -0.08871 753 N . THR A 98 ? 0.48694 0.25696 0.42481 -0.06328 -0.08545 0.00809 754 CA . THR A 98 ? 0.42453 0.22852 0.37588 -0.07386 -0.07239 0.02449 755 C . THR A 98 ? 0.41428 0.24673 0.37552 -0.09252 -0.07109 0.03367 756 O . THR A 98 ? 0.43964 0.25771 0.40073 -0.11179 -0.08629 0.04054 757 CB . THR A 98 ? 0.43014 0.21494 0.37982 -0.08346 -0.07998 0.03822 758 OG1 . THR A 98 ? 0.47327 0.23360 0.41599 -0.06401 -0.08298 0.02908 759 CG2 . THR A 98 ? 0.40214 0.22373 0.36168 -0.09215 -0.06543 0.05356 760 N . PRO A 99 ? 0.37305 0.24517 0.34351 -0.08768 -0.05505 0.03417 761 CA . PRO A 99 ? 0.35934 0.26433 0.34214 -0.10224 -0.05363 0.04240 762 C . PRO A 99 ? 0.37084 0.30035 0.36395 -0.11692 -0.04756 0.06039 763 O . PRO A 99 ? 0.35171 0.27286 0.34010 -0.11432 -0.04333 0.06597 764 CB . PRO A 99 ? 0.37551 0.30735 0.36030 -0.08565 -0.03975 0.03377 765 CG . PRO A 99 ? 0.35945 0.28603 0.33904 -0.06993 -0.02846 0.03051 766 CD . PRO A 99 ? 0.38203 0.27038 0.35244 -0.06836 -0.03878 0.02737 767 N . LYS A 100 ? 0.34891 0.31164 0.35601 -0.13218 -0.04745 0.06946 768 CA . LYS A 100 ? 0.38048 0.38103 0.39827 -0.14208 -0.03648 0.08496 769 C . LYS A 100 ? 0.37915 0.40111 0.39523 -0.12063 -0.01856 0.07908 770 O . LYS A 100 ? 0.39298 0.43120 0.41233 -0.10655 -0.01269 0.06912 771 CB . LYS A 100 ? 0.37644 0.41776 0.41344 -0.15905 -0.03837 0.09347 772 CG . LYS A 100 ? 0.49524 0.57110 0.54293 -0.17864 -0.03231 0.11354 773 CD . LYS A 100 ? 0.64659 0.76687 0.71768 -0.19696 -0.03579 0.12193 774 CE . LYS A 100 ? 0.43045 0.51923 0.50209 -0.21092 -0.05805 0.11766 775 NZ . LYS A 100 ? 0.55383 0.68809 0.65118 -0.23236 -0.06391 0.12756 776 N . TYR A 101 ? 0.30726 0.32497 0.31583 -0.11818 -0.01198 0.08518 777 CA . TYR A 101 ? 0.36805 0.39392 0.37110 -0.09798 0.00091 0.07779 778 C . TYR A 101 ? 0.33884 0.38830 0.33956 -0.10105 0.01063 0.08882 779 O . TYR A 101 ? 0.32522 0.37939 0.32583 -0.11895 0.00775 0.10350 780 CB . TYR A 101 ? 0.39018 0.37813 0.38179 -0.08505 -0.00263 0.06800 781 CG . TYR A 101 ? 0.41146 0.37449 0.39423 -0.09034 -0.00845 0.07573 782 CD1 . TYR A 101 ? 0.38991 0.31961 0.36840 -0.10064 -0.02361 0.07891 783 CD2 . TYR A 101 ? 0.35292 0.32195 0.32936 -0.08386 -0.00107 0.07909 784 CE1 . TYR A 101 ? 0.42661 0.33003 0.39551 -0.10384 -0.03118 0.08637 785 CE2 . TYR A 101 ? 0.42277 0.36847 0.38981 -0.08787 -0.00814 0.08659 786 CZ . TYR A 101 ? 0.43657 0.34957 0.40024 -0.09750 -0.02317 0.09068 787 OH . TYR A 101 ? 0.59336 0.47989 0.54628 -0.10007 -0.03235 0.09867 788 N . LYS A 102 ? 0.38249 0.44437 0.37860 -0.08354 0.02139 0.08170 789 CA . LYS A 102 ? 0.33778 0.42112 0.32696 -0.08096 0.03115 0.08794 790 C . LYS A 102 ? 0.35510 0.42649 0.33385 -0.06075 0.03572 0.07613 791 O . LYS A 102 ? 0.32703 0.39053 0.30829 -0.04923 0.03534 0.06490 792 CB . LYS A 102 ? 0.36371 0.49673 0.36395 -0.08335 0.04034 0.09279 793 CG . LYS A 102 ? 0.50855 0.66916 0.49943 -0.07962 0.05174 0.09863 794 CD . LYS A 102 ? 0.53611 0.75236 0.54129 -0.07893 0.06162 0.10154 795 CE . LYS A 102 ? 0.60356 0.82851 0.61878 -0.06069 0.06172 0.08674 796 NZ . LYS A 102 ? 0.54527 0.82663 0.57290 -0.05190 0.07194 0.08629 797 N . PHE A 103 ? 0.28278 0.35123 0.24836 -0.05810 0.03868 0.07964 798 CA . PHE A 103 ? 0.42657 0.48427 0.38148 -0.04143 0.04113 0.06946 799 C . PHE A 103 ? 0.38142 0.46916 0.32952 -0.03083 0.05094 0.06680 800 O . PHE A 103 ? 0.44845 0.55912 0.39057 -0.03646 0.05652 0.07574 801 CB . PHE A 103 ? 0.37524 0.40731 0.31839 -0.04316 0.03515 0.07280 802 CG . PHE A 103 ? 0.35248 0.35414 0.30179 -0.04665 0.02512 0.07141 803 CD1 . PHE A 103 ? 0.34131 0.33706 0.30194 -0.04487 0.02328 0.06427 804 CD2 . PHE A 103 ? 0.37762 0.35726 0.31979 -0.04960 0.01703 0.07646 805 CE1 . PHE A 103 ? 0.33506 0.30538 0.29939 -0.04487 0.01499 0.06097 806 CE2 . PHE A 103 ? 0.37610 0.32996 0.32443 -0.04889 0.00757 0.07335 807 CZ . PHE A 103 ? 0.33722 0.28733 0.29645 -0.04592 0.00728 0.06495 808 N . VAL A 104 ? 0.31227 0.39954 0.25958 -0.01495 0.05270 0.05468 809 CA . VAL A 104 ? 0.32364 0.43339 0.26195 0.00022 0.05982 0.04856 810 C . VAL A 104 ? 0.32638 0.40795 0.24964 0.01447 0.05549 0.03724 811 O . VAL A 104 ? 0.37350 0.42667 0.29941 0.01289 0.04879 0.03398 812 CB . VAL A 104 ? 0.41495 0.55425 0.36691 0.00739 0.06387 0.04487 813 CG1 . VAL A 104 ? 0.36626 0.53387 0.33623 -0.01034 0.06581 0.05691 814 CG2 . VAL A 104 ? 0.37980 0.49551 0.33555 0.01511 0.05744 0.03588 815 N . ARG A 105 ? 0.39132 0.48217 0.29800 0.02804 0.05909 0.03130 816 CA . ARG A 105 ? 0.32939 0.39272 0.21908 0.04213 0.05292 0.01953 817 C . ARG A 105 ? 0.32684 0.40294 0.21257 0.06181 0.05532 0.00891 818 O . ARG A 105 ? 0.32360 0.42760 0.20048 0.07350 0.06250 0.00568 819 CB . ARG A 105 ? 0.35132 0.40663 0.21936 0.04374 0.05130 0.01915 820 CG . ARG A 105 ? 0.40924 0.43276 0.25870 0.05617 0.04187 0.00672 821 CD . ARG A 105 ? 0.38777 0.40160 0.21482 0.05642 0.03786 0.00623 822 NE . ARG A 105 ? 0.46684 0.44730 0.27605 0.06622 0.02591 -0.00596 823 CZ . ARG A 105 ? 0.37212 0.32280 0.18774 0.05723 0.01448 -0.00578 824 NH1 . ARG A 105 ? 0.37214 0.32314 0.21068 0.04173 0.01446 0.00412 825 NH2 . ARG A 105 ? 0.39053 0.31125 0.18919 0.06412 0.00220 -0.01607 826 N . ILE A 106 ? 0.35873 0.41543 0.24991 0.06654 0.04920 0.00366 827 CA . ILE A 106 ? 0.36138 0.42740 0.25058 0.08574 0.04900 -0.00541 828 C . ILE A 106 ? 0.34867 0.39325 0.21180 0.10528 0.04328 -0.01833 829 O . ILE A 106 ? 0.37651 0.39541 0.22422 0.10134 0.03792 -0.01993 830 CB . ILE A 106 ? 0.36823 0.41696 0.26804 0.08355 0.04273 -0.00509 831 CG1 . ILE A 106 ? 0.38359 0.38766 0.27405 0.07686 0.03335 -0.00579 832 CG2 . ILE A 106 ? 0.31286 0.38327 0.23541 0.06726 0.04705 0.00494 833 CD1 . ILE A 106 ? 0.33443 0.32061 0.22936 0.07564 0.02768 -0.00490 834 N . GLN A 107 ? 0.43084 0.48487 0.28847 0.12742 0.04265 -0.02839 835 CA . GLN A 107 ? 0.41280 0.44297 0.24351 0.15071 0.03486 -0.04351 836 C . GLN A 107 ? 0.46527 0.44943 0.28894 0.15581 0.01999 -0.04827 837 O . GLN A 107 ? 0.38474 0.36820 0.22509 0.14728 0.01875 -0.04118 838 CB . GLN A 107 ? 0.44521 0.51752 0.27349 0.17591 0.04328 -0.05276 839 CG . GLN A 107 ? 0.52008 0.63567 0.34574 0.17406 0.05770 -0.04942 840 CD . GLN A 107 ? 0.88532 1.01234 0.69202 0.20034 0.05788 -0.06365 841 OE1 . GLN A 107 ? 1.00224 1.08575 0.78415 0.21559 0.04445 -0.07687 842 NE2 . GLN A 107 ? 0.96140 1.14358 0.78397 0.20096 0.06982 -0.05870 843 N . PRO A 108 ? 0.47684 0.41932 0.27347 0.16856 0.00720 -0.05966 844 CA . PRO A 108 ? 0.46114 0.35757 0.24797 0.17379 -0.00859 -0.06306 845 C . PRO A 108 ? 0.48422 0.39834 0.27821 0.19364 -0.00832 -0.06708 846 O . PRO A 108 ? 0.47218 0.42344 0.26703 0.21532 -0.00080 -0.07570 847 CB . PRO A 108 ? 0.52664 0.37966 0.28011 0.18775 -0.02296 -0.07698 848 CG . PRO A 108 ? 0.56099 0.44713 0.30521 0.19905 -0.01231 -0.08454 849 CD . PRO A 108 ? 0.46635 0.39759 0.23747 0.17699 0.00456 -0.06924 850 N . GLY A 109 ? 0.46281 0.35377 0.26264 0.18590 -0.01631 -0.06002 851 CA . GLY A 109 ? 0.46573 0.37098 0.27375 0.20159 -0.01835 -0.06140 852 C . GLY A 109 ? 0.42364 0.37110 0.26183 0.18582 -0.00692 -0.04919 853 O . GLY A 109 ? 0.52032 0.47050 0.36513 0.19215 -0.01192 -0.04715 854 N . GLN A 110 ? 0.45704 0.43381 0.31154 0.16575 0.00609 -0.04121 855 C . GLN A 110 ? 0.39114 0.37322 0.27375 0.12905 0.00999 -0.02085 856 O . GLN A 110 ? 0.42299 0.36963 0.29365 0.11861 0.00549 -0.01883 857 CA A GLN A 110 ? 0.44438 0.45631 0.32525 0.14991 0.01464 -0.03056 858 CB A GLN A 110 ? 0.39831 0.44925 0.29341 0.13688 0.02840 -0.02533 859 CG A GLN A 110 ? 0.44370 0.53907 0.34125 0.15486 0.03691 -0.03200 860 CD A GLN A 110 ? 0.44554 0.58535 0.36104 0.13742 0.05036 -0.02198 861 OE1 A GLN A 110 ? 0.31830 0.45398 0.22457 0.12823 0.05501 -0.01921 862 NE2 A GLN A 110 ? 0.50870 0.68957 0.44916 0.13164 0.05487 -0.01560 863 CA B GLN A 110 ? 0.44299 0.45483 0.32383 0.14999 0.01459 -0.03059 864 CB B GLN A 110 ? 0.39960 0.45086 0.29473 0.13722 0.02838 -0.02544 865 CG B GLN A 110 ? 0.44056 0.53864 0.34028 0.15522 0.03683 -0.03172 866 CD B GLN A 110 ? 0.45050 0.58024 0.36641 0.16957 0.03554 -0.03396 867 OE1 B GLN A 110 ? 0.42828 0.57949 0.36588 0.15504 0.03720 -0.02499 868 NE2 B GLN A 110 ? 0.41968 0.55094 0.32430 0.19949 0.03076 -0.04691 869 N . THR A 111 ? 0.22868 0.34852 0.41706 0.03088 0.00938 -0.05134 870 CA . THR A 111 ? 0.23654 0.32418 0.40521 0.02855 -0.00087 -0.04272 871 C . THR A 111 ? 0.21097 0.30154 0.38287 0.01134 0.00316 -0.03529 872 O . THR A 111 ? 0.18837 0.30518 0.38148 0.00016 0.01088 -0.03657 873 CB . THR A 111 ? 0.22300 0.30591 0.39510 0.04356 -0.01875 -0.04912 874 OG1 . THR A 111 ? 0.21196 0.33302 0.41838 0.04326 -0.02194 -0.05898 875 CG2 . THR A 111 ? 0.23641 0.30372 0.39792 0.06245 -0.02633 -0.05513 876 N . PHE A 112 ? 0.23134 0.29363 0.38076 0.00928 -0.00234 -0.02760 877 CA . PHE A 112 ? 0.24045 0.29808 0.38812 -0.00272 -0.00250 -0.02250 878 C . PHE A 112 ? 0.26647 0.29850 0.39070 0.00304 -0.01235 -0.01902 879 O . PHE A 112 ? 0.31540 0.33115 0.42129 0.01162 -0.01476 -0.01651 880 CB . PHE A 112 ? 0.18822 0.24259 0.32800 -0.01472 0.01052 -0.01500 881 CG . PHE A 112 ? 0.18738 0.22471 0.30458 -0.01102 0.01553 -0.01034 882 CD1 . PHE A 112 ? 0.23326 0.27681 0.35076 -0.00661 0.02184 -0.01326 883 CD2 . PHE A 112 ? 0.20676 0.22452 0.30407 -0.01182 0.01347 -0.00477 884 CE1 . PHE A 112 ? 0.22731 0.25511 0.32646 -0.00519 0.02453 -0.01034 885 CE2 . PHE A 112 ? 0.27080 0.27854 0.35266 -0.01073 0.01792 -0.00152 886 CZ . PHE A 112 ? 0.27638 0.28779 0.35957 -0.00851 0.02275 -0.00412 887 N . SER A 113 ? 0.20507 0.23283 0.32871 -0.00222 -0.01808 -0.01900 888 CA . SER A 113 ? 0.21575 0.22319 0.31534 0.00385 -0.02595 -0.01701 889 C . SER A 113 ? 0.29900 0.29412 0.38047 -0.00102 -0.01728 -0.01023 890 O . SER A 113 ? 0.24164 0.23871 0.32948 -0.01001 -0.01190 -0.00857 891 CB . SER A 113 ? 0.22549 0.23423 0.33261 0.00396 -0.03955 -0.02407 892 OG . SER A 113 ? 0.29354 0.31757 0.41949 0.01022 -0.04997 -0.03222 893 N . VAL A 114 ? 0.21992 0.20311 0.27844 0.00491 -0.01622 -0.00613 894 CA . VAL A 114 ? 0.21705 0.19517 0.26102 0.00264 -0.00909 -0.00203 895 C . VAL A 114 ? 0.24589 0.21716 0.27383 0.00925 -0.01625 -0.00505 896 O . VAL A 114 ? 0.24974 0.21627 0.26471 0.01659 -0.02246 -0.00570 897 CB . VAL A 114 ? 0.24731 0.22322 0.28053 0.00193 -0.00064 0.00395 898 CG1 . VAL A 114 ? 0.23284 0.21081 0.25389 0.00090 0.00542 0.00611 899 CG2 . VAL A 114 ? 0.20588 0.18713 0.25248 -0.00289 0.00540 0.00428 900 N . LEU A 115 ? 0.25029 0.21899 0.27601 0.00853 -0.01658 -0.00753 901 CA . LEU A 115 ? 0.24709 0.21009 0.25532 0.01769 -0.02281 -0.01278 902 C . LEU A 115 ? 0.26452 0.23526 0.26065 0.02048 -0.01252 -0.00997 903 O . LEU A 115 ? 0.26497 0.23686 0.26515 0.01922 -0.00971 -0.01060 904 CB . LEU A 115 ? 0.25668 0.20842 0.27035 0.01707 -0.03330 -0.01974 905 CG . LEU A 115 ? 0.35146 0.29488 0.34544 0.02975 -0.04180 -0.02844 906 CD1 . LEU A 115 ? 0.34921 0.29265 0.33068 0.03841 -0.05018 -0.03338 907 CD2 . LEU A 115 ? 0.46870 0.39311 0.46652 0.02811 -0.05316 -0.03476 908 N . ALA A 116 ? 0.26331 0.24022 0.24449 0.02376 -0.00712 -0.00653 909 CA . ALA A 116 ? 0.32389 0.31553 0.29823 0.02355 0.00424 -0.00400 910 C . ALA A 116 ? 0.28449 0.28275 0.24785 0.03573 0.00136 -0.01323 911 O . ALA A 116 ? 0.40326 0.39590 0.35145 0.04538 -0.00606 -0.01892 912 CB . ALA A 116 ? 0.36797 0.36281 0.32892 0.01955 0.01217 0.00462 913 N . CYS A 117 ? 0.29863 0.30871 0.26860 0.03757 0.00549 -0.01641 914 CA . CYS A 117 ? 0.33297 0.34835 0.29446 0.05262 0.00049 -0.02775 915 C . CYS A 117 ? 0.35173 0.39819 0.31614 0.05555 0.01186 -0.02971 916 O . CYS A 117 ? 0.24999 0.30831 0.22805 0.04450 0.02004 -0.02342 917 CB . CYS A 117 ? 0.28304 0.27644 0.25047 0.05597 -0.01203 -0.03293 918 SG . CYS A 117 ? 0.38599 0.34891 0.35523 0.05055 -0.02606 -0.03326 919 N . TYR A 118 ? 0.32916 0.39135 0.28171 0.07124 0.01164 -0.04030 920 CA . TYR A 118 ? 0.32396 0.42373 0.28255 0.07733 0.02155 -0.04613 921 C . TYR A 118 ? 0.35797 0.45929 0.30792 0.10161 0.01072 -0.06346 922 O . TYR A 118 ? 0.36720 0.45655 0.29821 0.11377 0.00357 -0.07096 923 CB . TYR A 118 ? 0.31264 0.44192 0.26389 0.06987 0.03872 -0.03992 924 CG . TYR A 118 ? 0.34890 0.46874 0.30522 0.04697 0.04673 -0.02300 925 CD1 . TYR A 118 ? 0.31973 0.41075 0.26125 0.04196 0.04244 -0.01451 926 CD2 . TYR A 118 ? 0.35553 0.49351 0.33154 0.03204 0.05595 -0.01734 927 CE1 . TYR A 118 ? 0.43767 0.51620 0.38206 0.02456 0.04720 -0.00073 928 CE2 . TYR A 118 ? 0.35735 0.48121 0.33599 0.01271 0.06081 -0.00367 929 CZ . TYR A 118 ? 0.33792 0.43082 0.29988 0.00997 0.05636 0.00465 930 OH . TYR A 118 ? 0.45157 0.52700 0.41437 -0.00594 0.05892 0.01674 931 N . ASN A 119 ? 0.41185 0.52498 0.37409 0.11036 0.00711 -0.07095 932 CA . ASN A 119 ? 0.37503 0.48481 0.32897 0.13649 -0.00639 -0.08866 933 C . ASN A 119 ? 0.36359 0.42038 0.30242 0.14209 -0.02600 -0.09133 934 O . ASN A 119 ? 0.36815 0.41311 0.29111 0.16275 -0.03819 -0.10619 935 CB . ASN A 119 ? 0.36068 0.50978 0.30535 0.15361 0.00182 -0.10185 936 CG . ASN A 119 ? 0.46839 0.67563 0.43271 0.14896 0.02020 -0.10214 937 OD1 . ASN A 119 ? 0.51131 0.73327 0.49500 0.15091 0.01763 -0.10551 938 ND2 . ASN A 119 ? 0.56213 0.80285 0.52099 0.14168 0.03850 -0.09818 939 N . GLY A 120 ? 0.34658 0.37239 0.29112 0.12314 -0.02922 -0.07785 940 CA . GLY A 120 ? 0.42496 0.40376 0.36055 0.12232 -0.04616 -0.07838 941 C . GLY A 120 ? 0.44389 0.41079 0.36891 0.12058 -0.05031 -0.08053 942 O . GLY A 120 ? 0.52760 0.45791 0.44925 0.11693 -0.06503 -0.08171 943 N . SER A 121 ? 0.49280 0.48875 0.41158 0.12221 -0.03850 -0.08074 944 CA . SER A 121 ? 0.37452 0.35980 0.27881 0.12325 -0.04384 -0.08322 945 C . SER A 121 ? 0.53138 0.52073 0.44333 0.10315 -0.03390 -0.06720 946 O . SER A 121 ? 0.40030 0.41484 0.31809 0.09425 -0.01722 -0.05723 947 CB . SER A 121 ? 0.41828 0.42902 0.30114 0.14303 -0.03937 -0.09547 948 OG . SER A 121 ? 0.56847 0.57222 0.44221 0.16622 -0.05214 -0.11407 949 N . PRO A 122 ? 0.49281 0.45801 0.40613 0.09583 -0.04490 -0.06534 950 CA . PRO A 122 ? 0.50458 0.47282 0.42539 0.08050 -0.03800 -0.05212 951 C . PRO A 122 ? 0.47171 0.45559 0.37099 0.08555 -0.02983 -0.04913 952 O . PRO A 122 ? 0.54297 0.52638 0.41965 0.10040 -0.03634 -0.05915 953 CB . PRO A 122 ? 0.51165 0.45464 0.44126 0.07516 -0.05472 -0.05539 954 CG . PRO A 122 ? 0.59817 0.52478 0.51350 0.09036 -0.07092 -0.07163 955 CD . PRO A 122 ? 0.45240 0.38613 0.36322 0.10066 -0.06569 -0.07618 956 N . SER A 123 ? 0.43936 0.43419 0.34268 0.07304 -0.01606 -0.03497 957 CA . SER A 123 ? 0.42645 0.43029 0.30635 0.07376 -0.00716 -0.02747 958 C . SER A 123 ? 0.49187 0.47694 0.36767 0.06784 -0.01384 -0.01895 959 O . SER A 123 ? 0.52857 0.50989 0.37672 0.07387 -0.01472 -0.01569 960 CB . SER A 123 ? 0.41866 0.44683 0.30202 0.06340 0.01315 -0.01721 961 OG . SER A 123 ? 0.53970 0.56145 0.44472 0.04732 0.01675 -0.00718 962 N . GLY A 124 ? 0.41990 0.39417 0.32060 0.05795 -0.01890 -0.01584 963 CA . GLY A 124 ? 0.41127 0.37150 0.31161 0.05530 -0.02644 -0.01020 964 C . GLY A 124 ? 0.38795 0.34466 0.32078 0.04587 -0.03034 -0.01044 965 O . GLY A 124 ? 0.36116 0.32424 0.31240 0.03869 -0.02396 -0.01072 966 N . VAL A 125 ? 0.34193 0.29029 0.28025 0.04734 -0.04120 -0.01089 967 CA . VAL A 125 ? 0.35322 0.30419 0.32279 0.03968 -0.04417 -0.01224 968 C . VAL A 125 ? 0.30117 0.24623 0.26859 0.04115 -0.04558 -0.00583 969 O . VAL A 125 ? 0.36525 0.29938 0.30947 0.05060 -0.05354 -0.00389 970 CB . VAL A 125 ? 0.29561 0.24759 0.28335 0.04085 -0.05942 -0.02422 971 CG1 . VAL A 125 ? 0.37539 0.32119 0.34798 0.05320 -0.07601 -0.03075 972 CG2 . VAL A 125 ? 0.30380 0.26582 0.32570 0.03066 -0.05860 -0.02494 973 N . TYR A 126 ? 0.28274 0.23240 0.27058 0.03348 -0.03874 -0.00281 974 CA . TYR A 126 ? 0.32201 0.26338 0.30917 0.03687 -0.04159 0.00108 975 C . TYR A 126 ? 0.30584 0.26046 0.32445 0.03139 -0.03794 -0.00309 976 O . TYR A 126 ? 0.28862 0.25525 0.32306 0.02232 -0.02973 -0.00465 977 CB . TYR A 126 ? 0.33447 0.25970 0.29559 0.03369 -0.03243 0.01352 978 CG . TYR A 126 ? 0.31896 0.25272 0.28573 0.02137 -0.01668 0.01770 979 CD1 . TYR A 126 ? 0.29949 0.23514 0.28308 0.01460 -0.01086 0.01812 980 CD2 . TYR A 126 ? 0.39790 0.33997 0.35302 0.01865 -0.00890 0.01928 981 CE1 . TYR A 126 ? 0.29493 0.23921 0.28342 0.00461 0.00094 0.02047 982 CE2 . TYR A 126 ? 0.39766 0.35136 0.36048 0.00939 0.00335 0.02120 983 CZ . TYR A 126 ? 0.36827 0.32234 0.34769 0.00195 0.00755 0.02205 984 OH . TYR A 126 ? 0.36777 0.33415 0.35458 -0.00610 0.01727 0.02259 985 N . GLN A 127 ? 0.30144 0.25292 0.32600 0.03862 -0.04450 -0.00507 986 CA . GLN A 127 ? 0.34931 0.31797 0.40308 0.03708 -0.04156 -0.01148 987 C . GLN A 127 ? 0.35425 0.31164 0.40097 0.03432 -0.03241 -0.00616 988 O . GLN A 127 ? 0.40648 0.33891 0.42956 0.03809 -0.03534 0.00063 989 CB . GLN A 127 ? 0.31709 0.29515 0.38628 0.05025 -0.05636 -0.02132 990 CG . GLN A 127 ? 0.39403 0.40199 0.49931 0.04910 -0.05247 -0.03102 991 CD . GLN A 127 ? 0.39189 0.42758 0.52527 0.03806 -0.05081 -0.03694 992 OE1 . GLN A 127 ? 0.32532 0.35329 0.44989 0.03018 -0.05127 -0.03359 993 NE2 . GLN A 127 ? 0.34005 0.40813 0.50730 0.03718 -0.04894 -0.04623 994 N . CYS A 128 ? 0.41535 0.38893 0.48051 0.02697 -0.02203 -0.00903 995 CA . CYS A 128 ? 0.35276 0.31790 0.41300 0.02412 -0.01437 -0.00682 996 C . CYS A 128 ? 0.26793 0.25284 0.35075 0.02858 -0.01199 -0.01659 997 O . CYS A 128 ? 0.32651 0.33735 0.43187 0.02853 -0.01157 -0.02294 998 CB . CYS A 128 ? 0.35284 0.31919 0.40699 0.01145 -0.00267 -0.00091 999 SG . CYS A 128 ? 0.50460 0.45164 0.53198 0.00599 -0.00090 0.00968 1000 N . ALA A 129 ? 0.37352 0.34729 0.45024 0.03150 -0.00993 -0.01832 1001 CA . ALA A 129 ? 0.31802 0.31113 0.41171 0.03780 -0.00617 -0.02901 1002 C . ALA A 129 ? 0.36512 0.35494 0.45123 0.03010 0.00388 -0.02786 1003 O . ALA A 129 ? 0.33890 0.30330 0.40696 0.02532 0.00249 -0.02225 1004 CB . ALA A 129 ? 0.31713 0.29860 0.41003 0.05609 -0.01853 -0.03781 1005 N . MET A 130 ? 0.22355 0.24040 0.32313 0.02803 0.01392 -0.03308 1006 CA . MET A 130 ? 0.22410 0.24020 0.31490 0.02428 0.02181 -0.03448 1007 C . MET A 130 ? 0.32754 0.33226 0.41381 0.03795 0.01581 -0.04568 1008 O . MET A 130 ? 0.26946 0.29385 0.36898 0.05069 0.01571 -0.05699 1009 CB . MET A 130 ? 0.29270 0.33888 0.39362 0.01822 0.03457 -0.03487 1010 CG . MET A 130 ? 0.31267 0.35817 0.39975 0.01549 0.04194 -0.03573 1011 SD . MET A 130 ? 0.31508 0.33570 0.38345 0.00518 0.03890 -0.02635 1012 CE . MET A 130 ? 0.23549 0.26416 0.30737 -0.00569 0.04322 -0.01507 1013 N . ARG A 131 ? 0.27629 0.25013 0.34506 0.03540 0.01016 -0.04372 1014 CA . ARG A 131 ? 0.29550 0.24773 0.35647 0.04800 0.00070 -0.05436 1015 C . ARG A 131 ? 0.31654 0.28774 0.37944 0.05538 0.00712 -0.06747 1016 O . ARG A 131 ? 0.27335 0.27025 0.33934 0.04816 0.01944 -0.06544 1017 CB . ARG A 131 ? 0.33690 0.24899 0.37921 0.03857 -0.00707 -0.04757 1018 CG . ARG A 131 ? 0.39974 0.29609 0.43502 0.02819 -0.00946 -0.03238 1019 CD . ARG A 131 ? 0.40977 0.28953 0.44131 0.04117 -0.02085 -0.03215 1020 NE . ARG A 131 ? 0.50606 0.34687 0.52298 0.05025 -0.03406 -0.03746 1021 CZ . ARG A 131 ? 0.58294 0.40412 0.59412 0.06783 -0.04783 -0.04157 1022 NH1 . ARG A 131 ? 0.45711 0.29797 0.47823 0.07780 -0.05031 -0.04170 1023 NH2 . ARG A 131 ? 0.64792 0.42705 0.64271 0.07648 -0.06150 -0.04675 1024 N . HIS A 132 ? 0.32546 0.28060 0.38282 0.07135 -0.00239 -0.08126 1025 CA . HIS A 132 ? 0.32845 0.29932 0.38320 0.08169 0.00228 -0.09644 1026 C . HIS A 132 ? 0.36372 0.32757 0.40443 0.06831 0.00646 -0.09321 1027 O . HIS A 132 ? 0.32500 0.31274 0.36221 0.07168 0.01576 -0.10019 1028 CB . HIS A 132 ? 0.36821 0.31413 0.41598 0.10308 -0.01269 -0.11339 1029 CG . HIS A 132 ? 0.51822 0.47084 0.55674 0.11485 -0.01120 -0.13104 1030 ND1 . HIS A 132 ? 0.57812 0.57530 0.62633 0.12992 0.00016 -0.14457 1031 CD2 . HIS A 132 ? 0.60316 0.52500 0.62295 0.11366 -0.01981 -0.13831 1032 CE1 . HIS A 132 ? 0.49404 0.48668 0.52635 0.13967 -0.00127 -0.15960 1033 NE2 . HIS A 132 ? 0.61476 0.56056 0.63010 0.13027 -0.01469 -0.15682 1034 N . ASN A 133 ? 0.32837 0.26259 0.36071 0.05328 -0.00009 -0.08290 1035 CA . ASN A 133 ? 0.35596 0.28669 0.37915 0.04068 0.00142 -0.08111 1036 C . ASN A 133 ? 0.29588 0.24810 0.32388 0.02620 0.01216 -0.06668 1037 O . ASN A 133 ? 0.29317 0.24148 0.31629 0.01492 0.01108 -0.06310 1038 CB . ASN A 133 ? 0.35097 0.24133 0.36562 0.03134 -0.01200 -0.08037 1039 CG . ASN A 133 ? 0.36233 0.23622 0.37943 0.01880 -0.01376 -0.06406 1040 OD1 . ASN A 133 ? 0.34125 0.23368 0.36604 0.01793 -0.00633 -0.05446 1041 ND2 . ASN A 133 ? 0.39572 0.23374 0.40467 0.00806 -0.02373 -0.06086 1042 N . PHE A 134 ? 0.32051 0.29483 0.35897 0.02696 0.02073 -0.05975 1043 CA . PHE A 134 ? 0.25283 0.24386 0.29414 0.01579 0.02938 -0.04752 1044 C . PHE A 134 ? 0.32339 0.29962 0.36368 0.00354 0.02515 -0.03711 1045 O . PHE A 134 ? 0.32052 0.30464 0.35834 -0.00410 0.02849 -0.03122 1046 CB . PHE A 134 ? 0.25346 0.25974 0.28467 0.01508 0.03646 -0.04939 1047 CG . PHE A 134 ? 0.29843 0.32836 0.33021 0.02406 0.04616 -0.05555 1048 CD1 . PHE A 134 ? 0.24675 0.29798 0.28986 0.02007 0.05599 -0.04801 1049 CD2 . PHE A 134 ? 0.27980 0.31245 0.30132 0.03584 0.04567 -0.06973 1050 CE1 . PHE A 134 ? 0.25385 0.33286 0.30036 0.02536 0.06743 -0.05296 1051 CE2 . PHE A 134 ? 0.28726 0.34795 0.30914 0.04448 0.05719 -0.07591 1052 CZ . PHE A 134 ? 0.27368 0.35970 0.30925 0.03808 0.06923 -0.06675 1053 N . THR A 135 ? 0.31920 0.27459 0.35982 0.00267 0.01785 -0.03477 1054 CA . THR A 135 ? 0.28853 0.23480 0.32783 -0.00846 0.01669 -0.02365 1055 C . THR A 135 ? 0.24771 0.19230 0.29014 -0.00426 0.01544 -0.01782 1056 O . THR A 135 ? 0.31330 0.26307 0.36188 0.00682 0.01367 -0.02334 1057 CB . THR A 135 ? 0.29099 0.21113 0.32306 -0.01671 0.00950 -0.02326 1058 OG1 . THR A 135 ? 0.37270 0.26664 0.39892 -0.00821 0.00077 -0.02703 1059 CG2 . THR A 135 ? 0.31305 0.23571 0.34408 -0.02064 0.00780 -0.03181 1060 N . ILE A 136 ? 0.32714 0.26789 0.36577 -0.01219 0.01605 -0.00793 1061 CA . ILE A 136 ? 0.33012 0.26532 0.36666 -0.00788 0.01255 -0.00259 1062 C . ILE A 136 ? 0.33880 0.25276 0.36074 -0.01604 0.01021 0.00698 1063 O . ILE A 136 ? 0.36872 0.28234 0.38790 -0.02806 0.01423 0.01048 1064 CB . ILE A 136 ? 0.27709 0.23335 0.32100 -0.00769 0.01674 -0.00017 1065 CG1 . ILE A 136 ? 0.26973 0.23272 0.30904 -0.01669 0.02181 0.00546 1066 CG2 . ILE A 136 ? 0.28182 0.25822 0.33889 -0.00382 0.02089 -0.00668 1067 CD1 . ILE A 136 ? 0.23211 0.20815 0.27507 -0.01506 0.02309 0.00669 1068 N . LYS A 137 ? 0.36014 0.25833 0.37258 -0.00967 0.00367 0.01128 1069 CA . LYS A 137 ? 0.41509 0.29041 0.40757 -0.01685 0.00205 0.02293 1070 C . LYS A 137 ? 0.41105 0.30073 0.39910 -0.01476 0.00466 0.02784 1071 O . LYS A 137 ? 0.45856 0.34263 0.44149 -0.00344 -0.00319 0.02732 1072 CB . LYS A 137 ? 0.36376 0.20241 0.34105 -0.00868 -0.01017 0.02435 1073 CG . LYS A 137 ? 0.51419 0.33963 0.49756 -0.00471 -0.01557 0.01422 1074 CD . LYS A 137 ? 0.50266 0.28037 0.46501 -0.00079 -0.02869 0.01760 1075 CE . LYS A 137 ? 0.61888 0.38804 0.57984 0.02291 -0.04185 0.01015 1076 NZ . LYS A 137 ? 0.59901 0.31670 0.53837 0.03084 -0.05772 0.01058 1077 N . GLY A 138 ? 0.36110 0.27065 0.35172 -0.02386 0.01414 0.03046 1078 CA . GLY A 138 ? 0.38540 0.30860 0.37062 -0.02032 0.01613 0.03249 1079 C . GLY A 138 ? 0.41279 0.33602 0.38065 -0.02946 0.02344 0.04220 1080 O . GLY A 138 ? 0.43022 0.33576 0.38652 -0.03993 0.02556 0.05065 1081 N . SER A 139 ? 0.34621 0.28910 0.31144 -0.02597 0.02746 0.04078 1082 CA . SER A 139 ? 0.42534 0.37803 0.37502 -0.03267 0.03691 0.04803 1083 C . SER A 139 ? 0.38223 0.36753 0.34593 -0.03024 0.04290 0.03957 1084 O . SER A 139 ? 0.40704 0.39954 0.36854 -0.01808 0.03866 0.03302 1085 CB . SER A 139 ? 0.39998 0.33915 0.32241 -0.02424 0.03271 0.05367 1086 OG . SER A 139 ? 0.52510 0.47476 0.42860 -0.03175 0.04439 0.06214 1087 N . PHE A 140 ? 0.31009 0.31320 0.28820 -0.04082 0.05049 0.03847 1088 CA . PHE A 140 ? 0.32514 0.35840 0.31795 -0.03631 0.05369 0.02910 1089 C . PHE A 140 ? 0.38332 0.44476 0.38046 -0.04774 0.06577 0.03135 1090 O . PHE A 140 ? 0.36192 0.41972 0.36361 -0.06446 0.07022 0.03771 1091 CB . PHE A 140 ? 0.28858 0.32137 0.29987 -0.03510 0.04823 0.02202 1092 CG . PHE A 140 ? 0.33317 0.34757 0.34445 -0.02560 0.03918 0.01912 1093 CD1 . PHE A 140 ? 0.34414 0.36141 0.35417 -0.01442 0.03439 0.01367 1094 CD2 . PHE A 140 ? 0.35316 0.34865 0.36698 -0.02821 0.03519 0.02083 1095 CE1 . PHE A 140 ? 0.28278 0.28632 0.29629 -0.00985 0.02711 0.01161 1096 CE2 . PHE A 140 ? 0.31670 0.30384 0.33483 -0.02080 0.02889 0.01738 1097 CZ . PHE A 140 ? 0.25872 0.25094 0.27785 -0.01354 0.02551 0.01357 1098 N . LEU A 141 ? 0.37463 0.46499 0.37152 -0.03881 0.07052 0.02500 1099 CA . LEU A 141 ? 0.32724 0.45674 0.33335 -0.04691 0.08311 0.02379 1100 C . LEU A 141 ? 0.33293 0.49116 0.36190 -0.03726 0.07939 0.00945 1101 O . LEU A 141 ? 0.24532 0.38714 0.27851 -0.02676 0.06780 0.00339 1102 CB . LEU A 141 ? 0.32665 0.47154 0.31198 -0.04073 0.09201 0.02598 1103 CG . LEU A 141 ? 0.35115 0.46934 0.30691 -0.04875 0.09606 0.04136 1104 CD1 . LEU A 141 ? 0.43202 0.56952 0.36454 -0.03772 0.10387 0.04019 1105 CD2 . LEU A 141 ? 0.39944 0.51369 0.35734 -0.07518 0.10599 0.05541 1106 N . ASN A 142 ? 0.33003 0.53256 0.37299 -0.04049 0.08922 0.00414 1107 CA . ASN A 142 ? 0.33766 0.57024 0.40001 -0.02625 0.08372 -0.01135 1108 C . ASN A 142 ? 0.30063 0.52286 0.34857 -0.00039 0.07418 -0.02049 1109 O . ASN A 142 ? 0.27255 0.49393 0.30175 0.00745 0.07796 -0.01985 1110 CB . ASN A 142 ? 0.25772 0.54742 0.34007 -0.03272 0.09657 -0.01724 1111 CG . ASN A 142 ? 0.38133 0.68428 0.48671 -0.05824 0.10123 -0.01288 1112 OD1 . ASN A 142 ? 0.56064 0.83921 0.67278 -0.06248 0.09046 -0.01316 1113 ND2 . ASN A 142 ? 0.43300 0.77547 0.55012 -0.07620 0.11748 -0.00927 1114 N . GLY A 143 ? 0.22790 0.43863 0.28172 0.01250 0.06073 -0.02873 1115 CA . GLY A 143 ? 0.30468 0.49772 0.34464 0.03478 0.04912 -0.03687 1116 C . GLY A 143 ? 0.29378 0.43969 0.31694 0.03419 0.04106 -0.02948 1117 O . GLY A 143 ? 0.30247 0.43061 0.31299 0.04947 0.03137 -0.03548 1118 N . SER A 144 ? 0.22602 0.35198 0.25002 0.01754 0.04368 -0.01811 1119 CA . SER A 144 ? 0.24227 0.33115 0.25579 0.01703 0.03630 -0.01271 1120 C . SER A 144 ? 0.26365 0.33324 0.28305 0.01699 0.02805 -0.01276 1121 O . SER A 144 ? 0.24648 0.29062 0.26110 0.01594 0.02256 -0.00936 1122 CB . SER A 144 ? 0.21958 0.29668 0.22852 0.00274 0.04229 -0.00165 1123 OG . SER A 144 ? 0.23745 0.31811 0.25856 -0.01116 0.04678 0.00280 1124 N . CYS A 145 ? 0.29184 0.37514 0.32110 0.01791 0.02717 -0.01665 1125 CA . CYS A 145 ? 0.23982 0.30445 0.26877 0.01848 0.02013 -0.01554 1126 C . CYS A 145 ? 0.25587 0.29668 0.27270 0.02992 0.00994 -0.01759 1127 O . CYS A 145 ? 0.22592 0.27050 0.23689 0.04328 0.00490 -0.02503 1128 CB . CYS A 145 ? 0.22596 0.31066 0.26414 0.02063 0.01855 -0.02098 1129 SG . CYS A 145 ? 0.27064 0.37171 0.32374 0.00234 0.02684 -0.01817 1130 N . GLY A 146 ? 0.21645 0.23253 0.22922 0.02419 0.00692 -0.01140 1131 CA . GLY A 146 ? 0.30584 0.29446 0.30817 0.02855 -0.00198 -0.01062 1132 C . GLY A 146 ? 0.26450 0.24204 0.26822 0.02233 -0.00197 -0.00824 1133 O . GLY A 146 ? 0.24591 0.20025 0.24526 0.02050 -0.00906 -0.00664 1134 N . SER A 147 ? 0.25586 0.24805 0.26477 0.01866 0.00456 -0.00788 1135 CA . SER A 147 ? 0.22909 0.21227 0.24001 0.01338 0.00330 -0.00560 1136 C . SER A 147 ? 0.25835 0.23355 0.27863 0.00261 0.00512 0.00011 1137 O . SER A 147 ? 0.23879 0.21992 0.26270 -0.00203 0.01114 0.00334 1138 CB . SER A 147 ? 0.22417 0.22069 0.23428 0.01166 0.00977 -0.00394 1139 OG . SER A 147 ? 0.24391 0.25249 0.24429 0.02066 0.01067 -0.00880 1140 N . VAL A 148 ? 0.22450 0.18924 0.24952 -0.00117 -0.00020 0.00002 1141 CA . VAL A 148 ? 0.26740 0.23027 0.30361 -0.01178 0.00272 0.00446 1142 C . VAL A 148 ? 0.24978 0.22172 0.29924 -0.01486 0.00289 0.00315 1143 O . VAL A 148 ? 0.22450 0.19567 0.27184 -0.00939 -0.00340 -0.00075 1144 CB . VAL A 148 ? 0.30412 0.24823 0.33832 -0.01699 -0.00375 0.00605 1145 CG1 . VAL A 148 ? 0.24963 0.18069 0.26743 -0.01113 -0.00590 0.00771 1146 CG2 . VAL A 148 ? 0.24908 0.18236 0.28406 -0.01452 -0.01557 -0.00023 1147 N . GLY A 149 ? 0.22957 0.21110 0.29093 -0.02156 0.00958 0.00556 1148 CA . GLY A 149 ? 0.23508 0.22830 0.31269 -0.02275 0.00867 0.00252 1149 C . GLY A 149 ? 0.21572 0.21501 0.30999 -0.03346 0.00882 0.00269 1150 O . GLY A 149 ? 0.22206 0.21691 0.31296 -0.04180 0.01446 0.00820 1151 N . PHE A 150 ? 0.20951 0.21939 0.32139 -0.03397 0.00227 -0.00299 1152 CA . PHE A 150 ? 0.21334 0.23137 0.34511 -0.04731 0.00103 -0.00365 1153 C . PHE A 150 ? 0.20818 0.25206 0.36668 -0.04564 -0.00317 -0.01210 1154 O . PHE A 150 ? 0.20373 0.24967 0.35957 -0.03187 -0.00985 -0.01745 1155 CB . PHE A 150 ? 0.23056 0.22525 0.35445 -0.05122 -0.01076 -0.00433 1156 CG . PHE A 150 ? 0.23351 0.22192 0.35203 -0.03904 -0.02503 -0.01281 1157 CD1 . PHE A 150 ? 0.29670 0.27301 0.39053 -0.02519 -0.02642 -0.01276 1158 CD2 . PHE A 150 ? 0.27915 0.27651 0.41708 -0.04173 -0.03691 -0.02119 1159 CE1 . PHE A 150 ? 0.25959 0.23081 0.34338 -0.01378 -0.03789 -0.01946 1160 CE2 . PHE A 150 ? 0.24811 0.23847 0.37614 -0.02867 -0.05121 -0.02931 1161 CZ . PHE A 150 ? 0.24921 0.22546 0.34774 -0.01447 -0.05093 -0.02770 1162 N . ASN A 151 ? 0.21259 0.27664 0.39651 -0.06014 0.00074 -0.01288 1163 CA . ASN A 151 ? 0.21158 0.30480 0.42810 -0.06142 -0.00613 -0.02308 1164 C . ASN A 151 ? 0.26144 0.35105 0.49347 -0.07964 -0.01379 -0.02373 1165 O . ASN A 151 ? 0.30709 0.37191 0.52467 -0.09239 -0.01086 -0.01466 1166 CB . ASN A 151 ? 0.22336 0.35560 0.46388 -0.06318 0.00751 -0.02593 1167 CG . ASN A 151 ? 0.23329 0.36664 0.46112 -0.04319 0.01020 -0.02904 1168 OD1 . ASN A 151 ? 0.23867 0.38012 0.47421 -0.02780 -0.00045 -0.03839 1169 ND2 . ASN A 151 ? 0.27359 0.39586 0.48037 -0.04307 0.02260 -0.02152 1170 N . ILE A 152 ? 0.22993 0.34227 0.49123 -0.08052 -0.02571 -0.03521 1171 CA . ILE A 152 ? 0.24842 0.35933 0.52970 -0.09972 -0.03567 -0.03830 1172 C . ILE A 152 ? 0.32571 0.48787 0.65517 -0.11120 -0.03299 -0.04688 1173 O . ILE A 152 ? 0.40153 0.59275 0.74850 -0.09463 -0.03957 -0.05886 1174 CB . ILE A 152 ? 0.28629 0.37085 0.55411 -0.08856 -0.05912 -0.04747 1175 CG1 . ILE A 152 ? 0.36909 0.40969 0.59211 -0.07787 -0.05959 -0.04002 1176 CG2 . ILE A 152 ? 0.32504 0.40891 0.61741 -0.10872 -0.07248 -0.05378 1177 CD1 . ILE A 152 ? 0.30158 0.31666 0.50622 -0.06580 -0.08028 -0.04924 1178 N . ASP A 153 ? 0.44867 0.62244 0.79916 -0.13945 -0.02338 -0.04061 1179 CA . ASP A 153 ? 0.49730 0.72562 0.89918 -0.15631 -0.01917 -0.04860 1180 C . ASP A 153 ? 0.44853 0.66223 0.86237 -0.17776 -0.03493 -0.05080 1181 O . ASP A 153 ? 0.56973 0.76365 0.97251 -0.20318 -0.02686 -0.03709 1182 CB . ASP A 153 ? 0.54657 0.80241 0.95455 -0.17235 0.00854 -0.03657 1183 CG . ASP A 153 ? 0.77133 1.02283 1.15132 -0.15176 0.02284 -0.03189 1184 OD1 . ASP A 153 ? 0.77545 1.04129 1.15691 -0.12533 0.01666 -0.04338 1185 OD2 . ASP A 153 ? 0.78198 1.01093 1.13387 -0.16103 0.03811 -0.01628 1186 N . TYR A 154 ? 0.57115 0.78963 0.99787 -0.16511 -0.05855 -0.06734 1187 CA . TYR A 154 ? 0.45511 0.65321 0.88362 -0.17862 -0.07777 -0.07266 1188 C . TYR A 154 ? 0.51138 0.64392 0.90131 -0.18159 -0.08600 -0.06508 1189 O . TYR A 154 ? 0.57490 0.67844 0.94407 -0.15998 -0.10382 -0.07313 1190 CB . TYR A 154 ? 0.51538 0.74381 0.96952 -0.20996 -0.06805 -0.06723 1191 CG . TYR A 154 ? 0.55973 0.78478 1.02801 -0.22096 -0.08990 -0.07885 1192 CD1 . TYR A 154 ? 0.62146 0.87195 1.10996 -0.20078 -0.10975 -0.09803 1193 CD2 . TYR A 154 ? 0.56136 0.75529 1.01992 -0.25079 -0.09118 -0.07153 1194 CE1 . TYR A 154 ? 0.79515 1.04315 1.29605 -0.20984 -0.13038 -0.10962 1195 CE2 . TYR A 154 ? 0.69457 0.88468 1.16638 -0.26126 -0.11142 -0.08384 1196 CZ . TYR A 154 ? 0.66471 0.88357 1.15879 -0.24069 -0.13110 -0.10279 1197 OH . TYR A 154 ? 0.73807 0.95371 1.24492 -0.25008 -0.15210 -0.11576 1198 N . ASP A 155 ? 0.49410 0.60191 0.87001 -0.20650 -0.07393 -0.04979 1199 CA . ASP A 155 ? 0.57621 0.61919 0.91310 -0.20730 -0.08297 -0.04314 1200 C . ASP A 155 ? 0.47889 0.49601 0.78640 -0.20788 -0.06493 -0.02443 1201 O . ASP A 155 ? 0.51395 0.47720 0.78578 -0.20438 -0.07262 -0.01853 1202 CB . ASP A 155 ? 0.61032 0.63085 0.94705 -0.23279 -0.09008 -0.04324 1203 CG . ASP A 155 ? 0.60413 0.65099 0.95711 -0.26511 -0.06679 -0.03151 1204 OD1 . ASP A 155 ? 0.59507 0.68043 0.95797 -0.26597 -0.04578 -0.02332 1205 OD2 . ASP A 155 ? 0.64189 0.67064 0.99674 -0.28942 -0.06905 -0.03144 1206 N . CYS A 156 ? 0.45342 0.43163 0.73068 -0.02493 -0.05857 0.03372 1207 CA . CYS A 156 ? 0.42049 0.39565 0.67668 -0.03086 -0.05032 0.04508 1208 C . CYS A 156 ? 0.35692 0.33589 0.57842 -0.02416 -0.04078 0.03755 1209 O . CYS A 156 ? 0.34975 0.33717 0.55984 -0.02196 -0.02956 0.03440 1210 CB . CYS A 156 ? 0.41406 0.39521 0.67441 -0.04298 -0.03652 0.06385 1211 SG . CYS A 156 ? 0.45970 0.43727 0.69552 -0.04930 -0.02800 0.07862 1212 N . VAL A 157 ? 0.31935 0.29202 0.52583 -0.02118 -0.04571 0.03502 1213 CA . VAL A 157 ? 0.26983 0.24579 0.44641 -0.01594 -0.03762 0.02918 1214 C . VAL A 157 ? 0.29958 0.27587 0.45847 -0.02372 -0.02511 0.04165 1215 O . VAL A 157 ? 0.30836 0.27793 0.46865 -0.02855 -0.02916 0.05012 1216 CB . VAL A 157 ? 0.26852 0.24009 0.43966 -0.00721 -0.05014 0.01812 1217 CG1 . VAL A 157 ? 0.25768 0.23475 0.40147 -0.00217 -0.04121 0.01263 1218 CG2 . VAL A 157 ? 0.23452 0.20630 0.42449 0.00199 -0.06478 0.00539 1219 N . SER A 158 ? 0.30083 0.28467 0.44285 -0.02399 -0.01091 0.04226 1220 CA . SER A 158 ? 0.33941 0.32493 0.46164 -0.02857 0.00039 0.05078 1221 C . SER A 158 ? 0.26743 0.25150 0.36792 -0.02306 0.00104 0.04247 1222 O . SER A 158 ? 0.28368 0.27252 0.37378 -0.01885 0.00709 0.03555 1223 CB . SER A 158 ? 0.28711 0.28229 0.40542 -0.03137 0.01423 0.05540 1224 OG . SER A 158 ? 0.48926 0.48817 0.62575 -0.03826 0.01627 0.06696 1225 N . PHE A 159 ? 0.28712 0.26466 0.38208 -0.02326 -0.00551 0.04362 1226 CA . PHE A 159 ? 0.23777 0.21512 0.31380 -0.01919 -0.00436 0.03713 1227 C . PHE A 159 ? 0.28568 0.26613 0.34382 -0.02231 0.00774 0.04224 1228 O . PHE A 159 ? 0.30278 0.28253 0.35877 -0.02728 0.01129 0.05249 1229 CB . PHE A 159 ? 0.28849 0.25851 0.36513 -0.01802 -0.01578 0.03615 1230 CG . PHE A 159 ? 0.23561 0.20314 0.32856 -0.01265 -0.02959 0.02823 1231 CD1 . PHE A 159 ? 0.29991 0.27271 0.38912 -0.00408 -0.03296 0.01598 1232 CD2 . PHE A 159 ? 0.22494 0.18567 0.33774 -0.01556 -0.03968 0.03314 1233 CE1 . PHE A 159 ? 0.28744 0.25985 0.39037 0.00304 -0.04638 0.00717 1234 CE2 . PHE A 159 ? 0.25050 0.20864 0.37947 -0.00923 -0.05442 0.02390 1235 CZ . PHE A 159 ? 0.27945 0.24397 0.40245 0.00087 -0.05791 0.01009 1236 N . CYS A 160 ? 0.22100 0.20529 0.26673 -0.01882 0.01354 0.03531 1237 CA . CYS A 160 ? 0.26461 0.25157 0.29483 -0.02036 0.02323 0.03766 1238 C . CYS A 160 ? 0.27856 0.26439 0.29544 -0.01766 0.02310 0.03142 1239 O . CYS A 160 ? 0.26178 0.24847 0.26651 -0.01838 0.02864 0.03250 1240 CB . CYS A 160 ? 0.25675 0.24991 0.28764 -0.01984 0.03193 0.03652 1241 SG . CYS A 160 ? 0.27025 0.26533 0.30456 -0.01411 0.03083 0.02638 1242 N . TYR A 161 ? 0.23224 0.21746 0.25187 -0.01409 0.01674 0.02472 1243 CA . TYR A 161 ? 0.25005 0.23654 0.26047 -0.01202 0.01767 0.01924 1244 C . TYR A 161 ? 0.22149 0.20772 0.23535 -0.00888 0.00855 0.01464 1245 O . TYR A 161 ? 0.23679 0.22404 0.26054 -0.00577 0.00222 0.01222 1246 CB . TYR A 161 ? 0.20326 0.19446 0.21326 -0.00979 0.02368 0.01527 1247 CG . TYR A 161 ? 0.25467 0.24793 0.25926 -0.00854 0.02479 0.01106 1248 CD1 . TYR A 161 ? 0.29867 0.28991 0.29518 -0.01069 0.02864 0.01101 1249 CD2 . TYR A 161 ? 0.24082 0.23932 0.24966 -0.00471 0.02178 0.00712 1250 CE1 . TYR A 161 ? 0.26481 0.25769 0.26021 -0.01034 0.02887 0.00747 1251 CE2 . TYR A 161 ? 0.20992 0.21202 0.21663 -0.00445 0.02352 0.00492 1252 CZ . TYR A 161 ? 0.28036 0.27889 0.28166 -0.00791 0.02681 0.00528 1253 OH . TYR A 161 ? 0.26835 0.27014 0.27117 -0.00843 0.02773 0.00335 1254 N . MET A 162 ? 0.27433 0.25995 0.28069 -0.00884 0.00713 0.01236 1255 CA . MET A 162 ? 0.28485 0.27329 0.29392 -0.00503 -0.00028 0.00650 1256 C . MET A 162 ? 0.25052 0.24389 0.25452 -0.00479 0.00390 0.00279 1257 O . MET A 162 ? 0.24376 0.23383 0.24038 -0.00767 0.00716 0.00401 1258 CB . MET A 162 ? 0.25930 0.24116 0.26800 -0.00541 -0.00940 0.00778 1259 CG . MET A 162 ? 0.30156 0.28708 0.31239 -0.00081 -0.01765 0.00049 1260 SD . MET A 162 ? 0.31748 0.29351 0.33032 -0.00005 -0.03104 0.00142 1261 CE . MET A 162 ? 0.20661 0.18145 0.23483 0.00315 -0.03920 0.00046 1262 N . HIS A 163 ? 0.24247 0.24464 0.25133 -0.00091 0.00356 -0.00157 1263 CA . HIS A 163 ? 0.26599 0.27418 0.27399 -0.00162 0.00870 -0.00313 1264 C . HIS A 163 ? 0.29477 0.30384 0.30165 -0.00199 0.00401 -0.00664 1265 O . HIS A 163 ? 0.25663 0.26732 0.26549 0.00123 -0.00384 -0.01002 1266 CB . HIS A 163 ? 0.23663 0.25629 0.25030 0.00290 0.01106 -0.00452 1267 CG . HIS A 163 ? 0.26381 0.29032 0.27949 0.00123 0.01679 -0.00370 1268 ND1 . HIS A 163 ? 0.26444 0.28587 0.27876 -0.00339 0.02312 -0.00051 1269 CD2 . HIS A 163 ? 0.26737 0.30587 0.28819 0.00342 0.01670 -0.00533 1270 CE1 . HIS A 163 ? 0.29680 0.32524 0.31671 -0.00467 0.02616 0.00036 1271 NE2 . HIS A 163 ? 0.29734 0.33713 0.32138 -0.00091 0.02312 -0.00188 1272 N . HIS A 164 ? 0.25122 0.25925 0.25617 -0.00536 0.00784 -0.00680 1273 CA . HIS A 164 ? 0.24443 0.25263 0.24900 -0.00587 0.00320 -0.01086 1274 C . HIS A 164 ? 0.25672 0.27307 0.26932 -0.00742 0.00651 -0.01265 1275 O . HIS A 164 ? 0.33753 0.36073 0.35537 -0.00618 0.00237 -0.01666 1276 CB . HIS A 164 ? 0.20678 0.20417 0.20157 -0.00793 0.00174 -0.01023 1277 CG . HIS A 164 ? 0.28020 0.27087 0.26876 -0.00658 -0.00441 -0.00832 1278 ND1 . HIS A 164 ? 0.28231 0.26947 0.27037 -0.00685 -0.00349 -0.00306 1279 CD2 . HIS A 164 ? 0.27102 0.25737 0.25489 -0.00513 -0.01207 -0.01028 1280 CE1 . HIS A 164 ? 0.26928 0.25002 0.25372 -0.00629 -0.01018 -0.00082 1281 NE2 . HIS A 164 ? 0.40512 0.38488 0.38582 -0.00494 -0.01550 -0.00505 1282 N . MET A 165 ? 0.25917 0.27495 0.27437 -0.01025 0.01331 -0.00960 1283 CA . MET A 165 ? 0.26042 0.28169 0.28572 -0.01302 0.01534 -0.01024 1284 C . MET A 165 ? 0.29359 0.31521 0.32367 -0.01529 0.02264 -0.00504 1285 O . MET A 165 ? 0.28067 0.29673 0.30449 -0.01462 0.02584 -0.00240 1286 CB . MET A 165 ? 0.25991 0.27368 0.28370 -0.01499 0.01076 -0.01509 1287 CG . MET A 165 ? 0.28483 0.28718 0.29960 -0.01573 0.01217 -0.01490 1288 SD . MET A 165 ? 0.53735 0.53227 0.54717 -0.01492 0.00511 -0.02229 1289 CE . MET A 165 ? 0.49001 0.47754 0.49737 -0.01547 0.00871 -0.02248 1290 N . VAL A 166 ? 0.30710 0.33556 0.34978 -0.01813 0.02490 -0.00318 1291 CA . VAL A 166 ? 0.24330 0.27084 0.29310 -0.02108 0.03065 0.00256 1292 C . VAL A 166 ? 0.26890 0.28860 0.32674 -0.02552 0.02757 -0.00044 1293 O . VAL A 166 ? 0.29123 0.31261 0.35459 -0.02659 0.02240 -0.00547 1294 CB . VAL A 166 ? 0.25591 0.29900 0.31591 -0.02061 0.03599 0.00944 1295 CG1 . VAL A 166 ? 0.26588 0.32074 0.33849 -0.02239 0.03391 0.00809 1296 CG2 . VAL A 166 ? 0.21953 0.26029 0.28628 -0.02357 0.04176 0.01724 1297 N . LEU A 167 ? 0.28119 0.29206 0.34012 -0.02725 0.02951 0.00144 1298 CA . LEU A 167 ? 0.29703 0.29862 0.36342 -0.02999 0.02488 -0.00306 1299 C . LEU A 167 ? 0.29592 0.30065 0.38286 -0.03519 0.02658 0.00305 1300 O . LEU A 167 ? 0.34034 0.35380 0.43230 -0.03615 0.03308 0.01231 1301 CB . LEU A 167 ? 0.28356 0.27330 0.33852 -0.02754 0.02451 -0.00614 1302 CG . LEU A 167 ? 0.37406 0.36052 0.41107 -0.02322 0.02218 -0.01161 1303 CD1 . LEU A 167 ? 0.39167 0.37039 0.41868 -0.02049 0.02345 -0.01346 1304 CD2 . LEU A 167 ? 0.43765 0.42265 0.47483 -0.02246 0.01474 -0.01925 1305 N . PRO A 168 ? 0.33772 0.33596 0.43790 -0.03828 0.02037 -0.00158 1306 CA . PRO A 168 ? 0.40200 0.40281 0.52596 -0.04447 0.02124 0.00566 1307 C . PRO A 168 ? 0.41595 0.41290 0.54176 -0.04565 0.02683 0.01513 1308 O . PRO A 168 ? 0.45017 0.45388 0.59259 -0.05033 0.03097 0.02601 1309 CB . PRO A 168 ? 0.40371 0.39403 0.53958 -0.04600 0.01095 -0.00401 1310 CG . PRO A 168 ? 0.31775 0.30736 0.43808 -0.04086 0.00575 -0.01512 1311 CD . PRO A 168 ? 0.29868 0.28856 0.39454 -0.03592 0.01149 -0.01346 1312 N . THR A 169 ? 0.31603 0.30328 0.42565 -0.04135 0.02724 0.01199 1313 CA . THR A 169 ? 0.39153 0.37435 0.50170 -0.04146 0.03169 0.01988 1314 C . THR A 169 ? 0.40360 0.39775 0.50426 -0.03883 0.04057 0.02876 1315 O . THR A 169 ? 0.35474 0.34636 0.45416 -0.03787 0.04453 0.03569 1316 CB . THR A 169 ? 0.40161 0.37090 0.49958 -0.03714 0.02806 0.01175 1317 OG1 . THR A 169 ? 0.32849 0.29994 0.40646 -0.03210 0.02878 0.00506 1318 CG2 . THR A 169 ? 0.27762 0.23567 0.38721 -0.03829 0.01826 0.00304 1319 N . GLY A 170 ? 0.35250 0.35886 0.44658 -0.03668 0.04271 0.02790 1320 CA . GLY A 170 ? 0.27947 0.29706 0.36411 -0.03226 0.04916 0.03369 1321 C . GLY A 170 ? 0.32465 0.33807 0.39041 -0.02652 0.04886 0.02774 1322 O . GLY A 170 ? 0.38042 0.40314 0.43885 -0.02187 0.05205 0.02999 1323 N . VAL A 171 ? 0.30821 0.30910 0.36689 -0.02622 0.04484 0.02024 1324 CA . VAL A 171 ? 0.30309 0.30113 0.34635 -0.02177 0.04493 0.01582 1325 C . VAL A 171 ? 0.28725 0.28982 0.32477 -0.02059 0.04169 0.01103 1326 O . VAL A 171 ? 0.26393 0.27037 0.30824 -0.02281 0.03876 0.00934 1327 CB . VAL A 171 ? 0.25354 0.23945 0.29146 -0.02121 0.04281 0.01060 1328 CG1 . VAL A 171 ? 0.29556 0.27605 0.33930 -0.02159 0.04487 0.01490 1329 CG2 . VAL A 171 ? 0.27092 0.25129 0.31148 -0.02302 0.03678 0.00356 1330 N . HIS A 172 ? 0.28153 0.28343 0.30802 -0.01719 0.04158 0.00899 1331 CA . HIS A 172 ? 0.31867 0.32403 0.34029 -0.01569 0.03786 0.00581 1332 C . HIS A 172 ? 0.26400 0.26119 0.27560 -0.01534 0.03529 0.00195 1333 O . HIS A 172 ? 0.26886 0.26062 0.27599 -0.01491 0.03759 0.00193 1334 CB . HIS A 172 ? 0.24502 0.25861 0.26521 -0.01149 0.03879 0.00794 1335 CG . HIS A 172 ? 0.30731 0.33204 0.33498 -0.01003 0.04219 0.01246 1336 ND1 . HIS A 172 ? 0.18924 0.21587 0.21750 -0.00796 0.04701 0.01743 1337 CD2 . HIS A 172 ? 0.27620 0.31222 0.31097 -0.00991 0.04188 0.01344 1338 CE1 . HIS A 172 ? 0.26299 0.30186 0.29742 -0.00647 0.04994 0.02228 1339 NE2 . HIS A 172 ? 0.27716 0.32282 0.31625 -0.00777 0.04725 0.01999 1340 N . ALA A 173 ? 0.22042 0.21788 0.22840 -0.01501 0.03055 -0.00092 1341 CA . ALA A 173 ? 0.21772 0.20902 0.21538 -0.01432 0.02820 -0.00286 1342 C . ALA A 173 ? 0.29030 0.28312 0.28461 -0.01293 0.02414 -0.00212 1343 O . ALA A 173 ? 0.26336 0.26169 0.26306 -0.01204 0.02108 -0.00317 1344 CB . ALA A 173 ? 0.23591 0.22302 0.23166 -0.01479 0.02457 -0.00790 1345 N . GLY A 174 ? 0.29020 0.27874 0.27641 -0.01247 0.02385 -0.00003 1346 CA . GLY A 174 ? 0.24764 0.23549 0.23232 -0.01163 0.01903 0.00186 1347 C . GLY A 174 ? 0.24190 0.22496 0.21745 -0.01203 0.01927 0.00587 1348 O . GLY A 174 ? 0.28438 0.26619 0.25280 -0.01181 0.02280 0.00571 1349 N . THR A 175 ? 0.24701 0.22813 0.22346 -0.01211 0.01508 0.00973 1350 CA . THR A 175 ? 0.23195 0.20940 0.20102 -0.01296 0.01507 0.01617 1351 C . THR A 175 ? 0.25892 0.23680 0.23546 -0.01480 0.01693 0.02266 1352 O . THR A 175 ? 0.32021 0.30018 0.30702 -0.01435 0.01609 0.02067 1353 CB . THR A 175 ? 0.22651 0.19940 0.19139 -0.01203 0.00686 0.01667 1354 OG1 . THR A 175 ? 0.27290 0.24470 0.24795 -0.01177 0.00007 0.01636 1355 CG2 . THR A 175 ? 0.22783 0.20107 0.18825 -0.00996 0.00382 0.00893 1356 N . ASP A 176 ? 0.29189 0.26883 0.26374 -0.01642 0.01938 0.03070 1357 CA . ASP A 176 ? 0.33435 0.31068 0.31654 -0.01911 0.01858 0.03833 1358 C . ASP A 176 ? 0.30710 0.27692 0.29495 -0.01933 0.00799 0.03992 1359 O . ASP A 176 ? 0.31612 0.28312 0.29902 -0.01701 0.00206 0.03462 1360 CB . ASP A 176 ? 0.31657 0.29647 0.29367 -0.02115 0.02578 0.04805 1361 CG . ASP A 176 ? 0.46094 0.43918 0.42332 -0.02005 0.02501 0.05307 1362 OD1 . ASP A 176 ? 0.31610 0.28772 0.27643 -0.01935 0.01675 0.05233 1363 OD2 . ASP A 176 ? 0.41637 0.40086 0.36854 -0.01888 0.03248 0.05737 1364 N . LEU A 177 ? 0.28177 0.24910 0.28165 -0.02199 0.00469 0.04695 1365 CA . LEU A 177 ? 0.31129 0.27120 0.31916 -0.02167 -0.00732 0.04755 1366 C . LEU A 177 ? 0.32355 0.27734 0.32272 -0.02327 -0.01041 0.05647 1367 O . LEU A 177 ? 0.33097 0.27693 0.33690 -0.02322 -0.02130 0.05829 1368 CB . LEU A 177 ? 0.29635 0.25469 0.32408 -0.02337 -0.01225 0.05022 1369 CG . LEU A 177 ? 0.26161 0.22260 0.29874 -0.01831 -0.01791 0.03820 1370 CD1 . LEU A 177 ? 0.26082 0.21863 0.29590 -0.01373 -0.02849 0.03054 1371 CD2 . LEU A 177 ? 0.30867 0.27811 0.33908 -0.01614 -0.00809 0.03188 1372 N . GLU A 178 ? 0.31915 0.27646 0.30313 -0.02366 -0.00193 0.06165 1373 CA . GLU A 178 ? 0.35044 0.30331 0.32151 -0.02307 -0.00445 0.06878 1374 C . GLU A 178 ? 0.33674 0.28950 0.29240 -0.01808 -0.00614 0.05866 1375 O . GLU A 178 ? 0.38451 0.33447 0.32658 -0.01597 -0.00802 0.06273 1376 CB . GLU A 178 ? 0.32835 0.28718 0.29204 -0.02529 0.00551 0.08214 1377 CG . GLU A 178 ? 0.46623 0.42554 0.44776 -0.03122 0.00665 0.09435 1378 CD . GLU A 178 ? 0.73040 0.69516 0.70512 -0.03362 0.01423 0.11137 1379 OE1 . GLU A 178 ? 0.80988 0.77600 0.76434 -0.02962 0.01622 0.11378 1380 OE2 . GLU A 178 ? 0.83413 0.80296 0.82421 -0.03903 0.01813 0.12244 1381 N . GLY A 179 ? 0.29109 0.24727 0.24942 -0.01599 -0.00570 0.04610 1382 CA . GLY A 179 ? 0.32823 0.28486 0.27709 -0.01209 -0.00810 0.03610 1383 C . GLY A 179 ? 0.33608 0.29810 0.27298 -0.01008 -0.00010 0.03297 1384 O . GLY A 179 ? 0.35976 0.32183 0.29066 -0.00690 -0.00293 0.02434 1385 N . ASN A 180 ? 0.34646 0.31347 0.28100 -0.01134 0.00890 0.03890 1386 CA . ASN A 180 ? 0.34287 0.31542 0.26652 -0.00807 0.01533 0.03452 1387 C . ASN A 180 ? 0.32738 0.30260 0.25995 -0.00865 0.01820 0.02536 1388 O . ASN A 180 ? 0.33643 0.31390 0.27930 -0.01144 0.02218 0.02749 1389 CB . ASN A 180 ? 0.37198 0.35096 0.28898 -0.00805 0.02378 0.04446 1390 CG . ASN A 180 ? 0.39534 0.37283 0.30349 -0.00772 0.02207 0.05644 1391 OD1 . ASN A 180 ? 0.37819 0.35381 0.27204 -0.00296 0.01816 0.05485 1392 ND2 . ASN A 180 ? 0.39896 0.37723 0.31646 -0.01265 0.02458 0.06897 1393 N . PHE A 181 ? 0.30955 0.28438 0.23918 -0.00592 0.01570 0.01560 1394 CA . PHE A 181 ? 0.33865 0.31559 0.27717 -0.00676 0.01841 0.00861 1395 C . PHE A 181 ? 0.31488 0.29600 0.25150 -0.00624 0.02634 0.01026 1396 O . PHE A 181 ? 0.34520 0.32939 0.27051 -0.00320 0.02939 0.01283 1397 CB . PHE A 181 ? 0.28341 0.25911 0.22102 -0.00433 0.01386 -0.00113 1398 CG . PHE A 181 ? 0.29317 0.26853 0.24216 -0.00627 0.00880 -0.00528 1399 CD1 . PHE A 181 ? 0.27484 0.25330 0.23642 -0.00874 0.01160 -0.00720 1400 CD2 . PHE A 181 ? 0.27322 0.24640 0.22002 -0.00496 0.00133 -0.00695 1401 CE1 . PHE A 181 ? 0.31190 0.29345 0.28376 -0.00979 0.00802 -0.01016 1402 CE2 . PHE A 181 ? 0.31824 0.29383 0.27603 -0.00595 -0.00307 -0.01132 1403 CZ . PHE A 181 ? 0.27376 0.25463 0.24410 -0.00831 0.00077 -0.01267 1404 N . TYR A 182 ? 0.30111 0.28350 0.24841 -0.00842 0.02965 0.00894 1405 CA . TYR A 182 ? 0.31011 0.29557 0.25702 -0.00710 0.03557 0.00713 1406 C . TYR A 182 ? 0.29535 0.27868 0.24145 -0.00458 0.03283 -0.00199 1407 O . TYR A 182 ? 0.33646 0.31729 0.29177 -0.00654 0.02969 -0.00561 1408 CB . TYR A 182 ? 0.31117 0.29782 0.26961 -0.00966 0.03904 0.00901 1409 CG . TYR A 182 ? 0.27502 0.26399 0.23740 -0.01173 0.04117 0.01682 1410 CD1 . TYR A 182 ? 0.27881 0.27288 0.23878 -0.01135 0.04707 0.02132 1411 CD2 . TYR A 182 ? 0.29781 0.28475 0.26819 -0.01370 0.03663 0.01920 1412 CE1 . TYR A 182 ? 0.30472 0.30119 0.27204 -0.01408 0.04857 0.02899 1413 CE2 . TYR A 182 ? 0.21212 0.20006 0.18932 -0.01560 0.03676 0.02564 1414 CZ . TYR A 182 ? 0.36387 0.35628 0.34051 -0.01640 0.04284 0.03102 1415 OH . TYR A 182 ? 0.30212 0.29583 0.28910 -0.01912 0.04257 0.03800 1416 N . GLY A 183 ? 0.27204 0.25726 0.20821 0.00019 0.03347 -0.00573 1417 CA . GLY A 183 ? 0.29355 0.27590 0.23073 0.00336 0.02899 -0.01561 1418 C . GLY A 183 ? 0.34615 0.32670 0.27562 0.00697 0.02199 -0.02058 1419 O . GLY A 183 ? 0.37535 0.35720 0.29516 0.00797 0.02131 -0.01570 1420 N . PRO A 184 ? 0.38965 0.36661 0.32443 0.00917 0.01578 -0.03046 1421 CA . PRO A 184 ? 0.36181 0.33713 0.29016 0.01380 0.00776 -0.03731 1422 C . PRO A 184 ? 0.35914 0.33144 0.29775 0.00915 0.00277 -0.03761 1423 O . PRO A 184 ? 0.43356 0.40382 0.37273 0.01213 -0.00515 -0.04534 1424 CB . PRO A 184 ? 0.36671 0.33974 0.29948 0.01868 0.00238 -0.04896 1425 CG . PRO A 184 ? 0.37841 0.34847 0.32874 0.01220 0.00541 -0.04710 1426 CD . PRO A 184 ? 0.28222 0.25612 0.22939 0.00831 0.01500 -0.03605 1427 N . PHE A 185 ? 0.36362 0.33674 0.31075 0.00279 0.00677 -0.03020 1428 CA . PHE A 185 ? 0.30361 0.27666 0.26336 -0.00131 0.00297 -0.03108 1429 C . PHE A 185 ? 0.37590 0.34872 0.32754 0.00032 -0.00176 -0.02995 1430 O . PHE A 185 ? 0.25652 0.22906 0.19558 0.00196 0.00013 -0.02379 1431 CB . PHE A 185 ? 0.33193 0.30775 0.30295 -0.00671 0.00880 -0.02456 1432 CG . PHE A 185 ? 0.36601 0.34111 0.34347 -0.00793 0.01346 -0.02432 1433 CD1 . PHE A 185 ? 0.34628 0.31923 0.33595 -0.00905 0.01043 -0.02958 1434 CD2 . PHE A 185 ? 0.30130 0.27740 0.27402 -0.00787 0.01997 -0.01896 1435 CE1 . PHE A 185 ? 0.30431 0.27499 0.30029 -0.00991 0.01350 -0.02912 1436 CE2 . PHE A 185 ? 0.36107 0.33594 0.33929 -0.00824 0.02339 -0.01939 1437 CZ . PHE A 185 ? 0.27962 0.25119 0.26888 -0.00914 0.01997 -0.02431 1438 N . VAL A 186 ? 0.32579 0.29890 0.28613 -0.00025 -0.00831 -0.03560 1439 CA . VAL A 186 ? 0.32513 0.29765 0.27997 0.00163 -0.01441 -0.03609 1440 C . VAL A 186 ? 0.30994 0.28726 0.28007 -0.00248 -0.01551 -0.03581 1441 O . VAL A 186 ? 0.33307 0.31474 0.31872 -0.00603 -0.01329 -0.03733 1442 CB . VAL A 186 ? 0.30734 0.27725 0.25617 0.00729 -0.02305 -0.04540 1443 CG1 . VAL A 186 ? 0.39469 0.36247 0.32589 0.01353 -0.02197 -0.04596 1444 CG2 . VAL A 186 ? 0.28885 0.26040 0.25629 0.00540 -0.02717 -0.05426 1445 N . ASP A 187 ? 0.30606 0.28332 0.27203 -0.00147 -0.01919 -0.03345 1446 CA . ASP A 187 ? 0.23941 0.22334 0.21836 -0.00342 -0.02091 -0.03417 1447 C . ASP A 187 ? 0.32786 0.31479 0.31416 -0.00186 -0.02868 -0.04292 1448 O . ASP A 187 ? 0.30594 0.29270 0.28949 0.00099 -0.03581 -0.04570 1449 CB . ASP A 187 ? 0.26736 0.24984 0.24109 -0.00245 -0.02253 -0.02872 1450 CG . ASP A 187 ? 0.35685 0.33112 0.31587 0.00110 -0.02900 -0.02745 1451 OD1 . ASP A 187 ? 0.42394 0.39439 0.37358 0.00386 -0.03136 -0.03065 1452 OD2 . ASP A 187 ? 0.32104 0.29263 0.27818 0.00170 -0.03236 -0.02309 1453 N . ARG A 188 ? 0.32755 0.31709 0.32522 -0.00387 -0.02781 -0.04746 1454 CA . ARG A 188 ? 0.32855 0.32216 0.33858 -0.00350 -0.03463 -0.05605 1455 C . ARG A 188 ? 0.39913 0.40116 0.43101 -0.00914 -0.02974 -0.05503 1456 O . ARG A 188 ? 0.33204 0.33139 0.36624 -0.01186 -0.02388 -0.05115 1457 CB . ARG A 188 ? 0.36222 0.34785 0.36360 0.00104 -0.04148 -0.06370 1458 CG . ARG A 188 ? 0.49857 0.48787 0.51719 0.00084 -0.04872 -0.07355 1459 CD . ARG A 188 ? 0.48117 0.46258 0.48898 0.00766 -0.05741 -0.08276 1460 NE . ARG A 188 ? 0.55316 0.53138 0.56876 0.00724 -0.05751 -0.08694 1461 CZ . ARG A 188 ? 0.57657 0.55766 0.61628 0.00386 -0.06164 -0.09319 1462 NH1 . ARG A 188 ? 0.64466 0.63422 0.70376 -0.00003 -0.06420 -0.09502 1463 NH2 . ARG A 188 ? 0.63943 0.61537 0.68542 0.00457 -0.06374 -0.09776 1464 N . GLN A 189 ? 0.31302 0.32589 0.36145 -0.01076 -0.03212 -0.05789 1465 CA . GLN A 189 ? 0.26956 0.29304 0.34019 -0.01656 -0.02647 -0.05422 1466 C . GLN A 189 ? 0.32895 0.34747 0.41307 -0.01953 -0.02930 -0.05830 1467 O . GLN A 189 ? 0.28486 0.30629 0.38275 -0.01974 -0.03654 -0.06586 1468 CB . GLN A 189 ? 0.31071 0.35016 0.39589 -0.01687 -0.02787 -0.05582 1469 CG . GLN A 189 ? 0.32651 0.38054 0.43468 -0.02270 -0.02051 -0.04936 1470 CD . GLN A 189 ? 0.35398 0.42745 0.47471 -0.02165 -0.02073 -0.05048 1471 OE1 . GLN A 189 ? 0.50126 0.58081 0.61166 -0.01685 -0.02024 -0.05006 1472 NE2 . GLN A 189 ? 0.35296 0.43696 0.49743 -0.02568 -0.02225 -0.05253 1473 N . THR A 190 ? 0.29733 0.30836 0.37911 -0.02142 -0.02464 -0.05410 1474 CA . THR A 190 ? 0.29683 0.30200 0.39308 -0.02394 -0.02813 -0.05790 1475 C . THR A 190 ? 0.33539 0.33565 0.43042 -0.02659 -0.02062 -0.05020 1476 O . THR A 190 ? 0.32870 0.32712 0.40643 -0.02466 -0.01445 -0.04474 1477 CB . THR A 190 ? 0.35682 0.35120 0.44212 -0.01753 -0.03844 -0.06973 1478 OG1 . THR A 190 ? 0.39983 0.38864 0.50199 -0.01913 -0.04377 -0.07515 1479 CG2 . THR A 190 ? 0.37824 0.36431 0.43515 -0.01180 -0.03592 -0.06831 1480 N . ALA A 191 ? 0.40224 0.40004 0.51749 -0.03104 -0.02204 -0.04993 1481 CA . ALA A 191 ? 0.39043 0.38185 0.50571 -0.03301 -0.01673 -0.04375 1482 C . ALA A 191 ? 0.41803 0.39732 0.51265 -0.02628 -0.02023 -0.05081 1483 O . ALA A 191 ? 0.42883 0.40195 0.52230 -0.02181 -0.02974 -0.06190 1484 CB . ALA A 191 ? 0.29821 0.28854 0.44242 -0.03947 -0.01919 -0.04161 1485 N . GLN A 192 ? 0.33647 0.31381 0.41501 -0.02475 -0.01271 -0.04477 1486 CA . GLN A 192 ? 0.34830 0.31803 0.40585 -0.01805 -0.01401 -0.04984 1487 C . GLN A 192 ? 0.26494 0.22955 0.32314 -0.01865 -0.00962 -0.04618 1488 O . GLN A 192 ? 0.37267 0.34066 0.43414 -0.02262 -0.00166 -0.03644 1489 CB . GLN A 192 ? 0.26358 0.23662 0.29927 -0.01470 -0.00987 -0.04661 1490 CG . GLN A 192 ? 0.27557 0.25218 0.30877 -0.01301 -0.01546 -0.05079 1491 CD . GLN A 192 ? 0.31760 0.29642 0.33284 -0.01071 -0.01219 -0.04600 1492 OE1 . GLN A 192 ? 0.32948 0.30510 0.32862 -0.00773 -0.00872 -0.04319 1493 NE2 . GLN A 192 ? 0.31008 0.29495 0.32968 -0.01201 -0.01375 -0.04499 1494 N . ALA A 193 ? 0.34801 0.30507 0.40226 -0.01346 -0.01550 -0.05484 1495 CA . ALA A 193 ? 0.37457 0.32610 0.42971 -0.01269 -0.01329 -0.05367 1496 C . ALA A 193 ? 0.44591 0.40021 0.47966 -0.00937 -0.00483 -0.04892 1497 O . ALA A 193 ? 0.46980 0.42688 0.48523 -0.00424 -0.00452 -0.05152 1498 CB . ALA A 193 ? 0.33093 0.27462 0.38936 -0.00657 -0.02398 -0.06660 1499 N . ALA A 194 ? 0.41368 0.36747 0.45079 -0.01229 0.00182 -0.04137 1500 CA . ALA A 194 ? 0.40498 0.36174 0.42589 -0.00972 0.00953 -0.03690 1501 C . ALA A 194 ? 0.38282 0.33600 0.39549 -0.00333 0.00808 -0.04342 1502 O . ALA A 194 ? 0.44413 0.40166 0.44199 0.00006 0.01361 -0.04154 1503 CB . ALA A 194 ? 0.42878 0.38808 0.45642 -0.01467 0.01706 -0.02629 1504 N . GLY A 195 ? 0.44171 0.38784 0.46501 -0.00137 0.00033 -0.05118 1505 CA . GLY A 195 ? 0.39844 0.34189 0.41515 0.00595 -0.00226 -0.05892 1506 C . GLY A 195 ? 0.48377 0.42374 0.50679 0.00385 0.00203 -0.05360 1507 O . GLY A 195 ? 0.42104 0.36255 0.44850 -0.00225 0.00901 -0.04281 1508 N . THR A 196 ? 0.37425 0.30984 0.39703 0.01031 -0.00309 -0.06228 1509 CA . THR A 196 ? 0.39260 0.32346 0.42131 0.00980 -0.00099 -0.05914 1510 C . THR A 196 ? 0.43422 0.37324 0.45035 0.00928 0.01051 -0.05089 1511 O . THR A 196 ? 0.40388 0.35189 0.40415 0.01393 0.01481 -0.05286 1512 CB . THR A 196 ? 0.39535 0.32155 0.42381 0.01896 -0.00970 -0.07241 1513 OG1 . THR A 196 ? 0.60820 0.52393 0.65457 0.01842 -0.02217 -0.07951 1514 CG2 . THR A 196 ? 0.48023 0.40311 0.51068 0.02015 -0.00696 -0.07003 1515 N . ASP A 197 ? 0.40453 0.34096 0.42868 0.00386 0.01523 -0.04119 1516 CA . ASP A 197 ? 0.42187 0.36499 0.43738 0.00363 0.02454 -0.03414 1517 C . ASP A 197 ? 0.43376 0.37356 0.44933 0.00840 0.02412 -0.03754 1518 O . ASP A 197 ? 0.60636 0.53644 0.63377 0.00736 0.01956 -0.03693 1519 CB . ASP A 197 ? 0.39485 0.33905 0.41723 -0.00314 0.02950 -0.02246 1520 CG . ASP A 197 ? 0.57459 0.52662 0.58815 -0.00259 0.03755 -0.01677 1521 OD1 . ASP A 197 ? 0.47835 0.43611 0.48129 0.00119 0.04007 -0.02035 1522 OD2 . ASP A 197 ? 0.48738 0.44074 0.50549 -0.00552 0.04109 -0.00861 1523 N . THR A 198 ? 0.49522 0.44341 0.49875 0.01354 0.02865 -0.04059 1524 CA . THR A 198 ? 0.55111 0.49869 0.55402 0.01888 0.02875 -0.04466 1525 C . THR A 198 ? 0.42435 0.37661 0.42595 0.01671 0.03677 -0.03628 1526 O . THR A 198 ? 0.52718 0.48669 0.52457 0.01328 0.04264 -0.02986 1527 CB . THR A 198 ? 0.59284 0.54931 0.58472 0.02747 0.02812 -0.05492 1528 OG1 . THR A 198 ? 0.61056 0.58044 0.59205 0.02710 0.03712 -0.04992 1529 CG2 . THR A 198 ? 0.52707 0.48156 0.51734 0.03078 0.02029 -0.06351 1530 N . THR A 199 ? 0.44350 0.39089 0.44950 0.01938 0.03572 -0.03711 1531 CA . THR A 199 ? 0.41917 0.37059 0.42448 0.01893 0.04185 -0.03093 1532 C . THR A 199 ? 0.37709 0.34168 0.37449 0.02270 0.04733 -0.03420 1533 O . THR A 199 ? 0.33753 0.30658 0.33095 0.02861 0.04583 -0.04273 1534 CB . THR A 199 ? 0.48306 0.42484 0.49497 0.02153 0.03826 -0.03110 1535 OG1 . THR A 199 ? 0.48391 0.41395 0.50527 0.01734 0.03321 -0.02643 1536 CG2 . THR A 199 ? 0.46088 0.40638 0.47206 0.02181 0.04363 -0.02485 1537 N . ILE A 200 ? 0.36407 0.33592 0.36035 0.01961 0.05333 -0.02739 1538 CA . ILE A 200 ? 0.29528 0.28002 0.28804 0.02163 0.05886 -0.02807 1539 C . ILE A 200 ? 0.25950 0.24566 0.25568 0.02669 0.05925 -0.03206 1540 O . ILE A 200 ? 0.35303 0.33742 0.35391 0.02613 0.06024 -0.02827 1541 CB . ILE A 200 ? 0.34870 0.33889 0.34275 0.01665 0.06305 -0.01994 1542 CG1 . ILE A 200 ? 0.32421 0.31115 0.31574 0.01196 0.06137 -0.01626 1543 CG2 . ILE A 200 ? 0.21698 0.22063 0.21005 0.01743 0.06839 -0.01923 1544 CD1 . ILE A 200 ? 0.42703 0.41841 0.41088 0.01305 0.06117 -0.01955 1545 N . THR A 201 ? 0.27643 0.26666 0.26989 0.03280 0.05789 -0.04063 1546 CA . THR A 201 ? 0.26521 0.25619 0.26220 0.03868 0.05687 -0.04623 1547 C . THR A 201 ? 0.31478 0.31671 0.31586 0.03815 0.06297 -0.04270 1548 O . THR A 201 ? 0.23403 0.23188 0.24026 0.04012 0.06164 -0.04289 1549 CB . THR A 201 ? 0.32707 0.32417 0.31988 0.04644 0.05441 -0.05719 1550 OG1 . THR A 201 ? 0.32948 0.31656 0.32003 0.04704 0.04742 -0.06127 1551 CG2 . THR A 201 ? 0.37502 0.37012 0.37217 0.05327 0.05108 -0.06446 1552 N . VAL A 202 ? 0.24742 0.26305 0.24733 0.03561 0.06907 -0.03910 1553 CA . VAL A 202 ? 0.26245 0.28891 0.27005 0.03454 0.07400 -0.03574 1554 C . VAL A 202 ? 0.27826 0.29620 0.29179 0.03099 0.07208 -0.03019 1555 O . VAL A 202 ? 0.26683 0.28817 0.28818 0.03287 0.07244 -0.03089 1556 CB . VAL A 202 ? 0.30109 0.34297 0.30807 0.03132 0.08058 -0.03052 1557 CG1 . VAL A 202 ? 0.28245 0.31893 0.28702 0.02434 0.08032 -0.02228 1558 CG2 . VAL A 202 ? 0.29884 0.35441 0.31739 0.03095 0.08543 -0.02835 1559 N . ASN A 203 ? 0.20869 0.21659 0.21879 0.02694 0.06955 -0.02548 1560 CA . ASN A 203 ? 0.24530 0.24694 0.25931 0.02547 0.06748 -0.02089 1561 C . ASN A 203 ? 0.28503 0.27766 0.29961 0.03042 0.06378 -0.02354 1562 O . ASN A 203 ? 0.28822 0.28081 0.30685 0.03290 0.06280 -0.02247 1563 CB . ASN A 203 ? 0.21684 0.21279 0.22714 0.02052 0.06620 -0.01537 1564 CG . ASN A 203 ? 0.26366 0.26715 0.27442 0.01591 0.06873 -0.01138 1565 OD1 . ASN A 203 ? 0.28091 0.29416 0.29563 0.01567 0.07198 -0.01123 1566 ND2 . ASN A 203 ? 0.20905 0.20845 0.21672 0.01212 0.06716 -0.00754 1567 N . VAL A 204 ? 0.24061 0.22503 0.25160 0.03246 0.06076 -0.02701 1568 CA . VAL A 204 ? 0.31148 0.28603 0.32358 0.03707 0.05664 -0.02835 1569 C . VAL A 204 ? 0.25287 0.23351 0.26871 0.04310 0.05692 -0.03431 1570 O . VAL A 204 ? 0.26887 0.24548 0.28650 0.04697 0.05482 -0.03345 1571 CB . VAL A 204 ? 0.26365 0.22734 0.27414 0.03788 0.05177 -0.03146 1572 CG1 . VAL A 204 ? 0.31097 0.26335 0.32368 0.04263 0.04684 -0.03182 1573 CG2 . VAL A 204 ? 0.27546 0.23342 0.28502 0.03170 0.05098 -0.02546 1574 N . LEU A 205 ? 0.25723 0.24919 0.27435 0.04457 0.05968 -0.04029 1575 CA . LEU A 205 ? 0.26150 0.26195 0.28427 0.05015 0.06037 -0.04644 1576 C . LEU A 205 ? 0.26498 0.27167 0.29510 0.04907 0.06226 -0.04288 1577 O . LEU A 205 ? 0.26754 0.27372 0.30220 0.05443 0.05975 -0.04640 1578 CB . LEU A 205 ? 0.27752 0.29265 0.30063 0.05174 0.06427 -0.05218 1579 CG . LEU A 205 ? 0.25908 0.26942 0.27560 0.05593 0.06042 -0.05926 1580 CD1 . LEU A 205 ? 0.33613 0.36440 0.35044 0.05814 0.06531 -0.06376 1581 CD2 . LEU A 205 ? 0.27577 0.27697 0.29417 0.06334 0.05387 -0.06658 1582 N . ALA A 206 ? 0.27799 0.29020 0.31010 0.04285 0.06551 -0.03670 1583 CA . ALA A 206 ? 0.31944 0.33641 0.36043 0.04214 0.06526 -0.03416 1584 C . ALA A 206 ? 0.28320 0.28973 0.32150 0.04625 0.06031 -0.03293 1585 O . ALA A 206 ? 0.34738 0.35652 0.39233 0.05086 0.05770 -0.03558 1586 CB . ALA A 206 ? 0.23978 0.26170 0.28303 0.03486 0.06788 -0.02753 1587 N . TRP A 207 ? 0.26937 0.26514 0.29846 0.04509 0.05890 -0.02869 1588 CA . TRP A 207 ? 0.23972 0.22732 0.26479 0.04933 0.05539 -0.02544 1589 C . TRP A 207 ? 0.35211 0.33453 0.37660 0.05705 0.05210 -0.03004 1590 O . TRP A 207 ? 0.30498 0.28571 0.32873 0.06322 0.04913 -0.02954 1591 CB . TRP A 207 ? 0.26458 0.24383 0.28245 0.04514 0.05559 -0.01859 1592 CG . TRP A 207 ? 0.37384 0.34636 0.38709 0.04901 0.05339 -0.01280 1593 CD1 . TRP A 207 ? 0.35180 0.32845 0.36365 0.05205 0.05278 -0.00903 1594 CD2 . TRP A 207 ? 0.34155 0.30293 0.35116 0.05072 0.05137 -0.00931 1595 NE1 . TRP A 207 ? 0.35240 0.32298 0.35844 0.05593 0.05176 -0.00258 1596 CE2 . TRP A 207 ? 0.34185 0.30219 0.34731 0.05441 0.05093 -0.00174 1597 CE3 . TRP A 207 ? 0.30663 0.25899 0.31682 0.05003 0.04918 -0.01189 1598 CZ2 . TRP A 207 ? 0.40609 0.35671 0.40845 0.05629 0.04941 0.00546 1599 CZ3 . TRP A 207 ? 0.39424 0.33495 0.40293 0.05171 0.04616 -0.00601 1600 CH2 . TRP A 207 ? 0.38979 0.32966 0.39481 0.05422 0.04681 0.00366 1601 N . LEU A 208 ? 0.28439 0.26468 0.30875 0.05799 0.05182 -0.03528 1602 CA . LEU A 208 ? 0.31543 0.29072 0.34006 0.06585 0.04773 -0.04084 1603 C . LEU A 208 ? 0.34534 0.33139 0.37838 0.07078 0.04747 -0.04748 1604 O . LEU A 208 ? 0.29771 0.27996 0.33076 0.07844 0.04322 -0.05041 1605 CB . LEU A 208 ? 0.31094 0.28215 0.33436 0.06658 0.04619 -0.04653 1606 CG . LEU A 208 ? 0.34986 0.30673 0.36798 0.06367 0.04329 -0.04138 1607 CD1 . LEU A 208 ? 0.37257 0.32659 0.39118 0.06561 0.04004 -0.04964 1608 CD2 . LEU A 208 ? 0.34231 0.28634 0.35745 0.06740 0.03912 -0.03495 1609 N . TYR A 209 ? 0.26332 0.26298 0.30463 0.06658 0.05164 -0.04948 1610 CA . TYR A 209 ? 0.24077 0.25133 0.29411 0.06990 0.05102 -0.05450 1611 C . TYR A 209 ? 0.33377 0.34167 0.38815 0.07280 0.04717 -0.05174 1612 O . TYR A 209 ? 0.34085 0.35068 0.40092 0.08016 0.04285 -0.05722 1613 CB . TYR A 209 ? 0.30591 0.33186 0.36986 0.06344 0.05665 -0.05435 1614 CG . TYR A 209 ? 0.31796 0.35368 0.38458 0.06470 0.06014 -0.06030 1615 CD1 . TYR A 209 ? 0.34874 0.39073 0.42324 0.07173 0.05816 -0.06898 1616 CD2 . TYR A 209 ? 0.30319 0.34343 0.36425 0.06002 0.06508 -0.05802 1617 CE1 . TYR A 209 ? 0.38042 0.43399 0.45739 0.07407 0.06140 -0.07525 1618 CE2 . TYR A 209 ? 0.35689 0.40873 0.41919 0.06301 0.06818 -0.06421 1619 CZ . TYR A 209 ? 0.37573 0.43479 0.44614 0.07001 0.06654 -0.07281 1620 OH . TYR A 209 ? 0.36544 0.43843 0.43702 0.07409 0.06967 -0.07972 1621 N . ALA A 210 ? 0.32008 0.32440 0.36884 0.06824 0.04803 -0.04423 1622 CA . ALA A 210 ? 0.35767 0.36067 0.40538 0.07278 0.04387 -0.04228 1623 C . ALA A 210 ? 0.36366 0.35808 0.40201 0.08232 0.03972 -0.04261 1624 O . ALA A 210 ? 0.28860 0.28508 0.32845 0.09065 0.03488 -0.04582 1625 CB . ALA A 210 ? 0.25258 0.25386 0.29451 0.06686 0.04571 -0.03442 1626 N . ALA A 211 ? 0.32542 0.30989 0.35454 0.08178 0.04078 -0.03924 1627 CA . ALA A 211 ? 0.32849 0.30363 0.34922 0.09038 0.03679 -0.03778 1628 C . ALA A 211 ? 0.35075 0.32811 0.37725 0.09892 0.03244 -0.04770 1629 O . ALA A 211 ? 0.46946 0.44439 0.49170 0.10865 0.02776 -0.04862 1630 CB . ALA A 211 ? 0.34512 0.30809 0.35880 0.08689 0.03765 -0.03214 1631 N . VAL A 212 ? 0.32192 0.30526 0.35789 0.09623 0.03391 -0.05534 1632 CA . VAL A 212 ? 0.34610 0.33325 0.38941 0.10418 0.02993 -0.06559 1633 C . VAL A 212 ? 0.34034 0.33727 0.39384 0.10874 0.02683 -0.07039 1634 O . VAL A 212 ? 0.36257 0.35781 0.41525 0.11337 0.02121 -0.07241 1635 CB . VAL A 212 ? 0.33458 0.32944 0.38623 0.10036 0.03321 -0.07228 1636 CG1 . VAL A 212 ? 0.35555 0.35776 0.41698 0.10659 0.02970 -0.08199 1637 CG2 . VAL A 212 ? 0.37385 0.35752 0.41588 0.09886 0.03322 -0.07035 1638 N . ILE A 213 ? 0.41060 0.41639 0.47261 0.10173 0.02968 -0.06817 1639 CA . ILE A 213 ? 0.42219 0.43565 0.49540 0.10399 0.02510 -0.07148 1640 C . ILE A 213 ? 0.41493 0.42151 0.47587 0.11074 0.01909 -0.06806 1641 O . ILE A 213 ? 0.39475 0.40407 0.45956 0.11390 0.01276 -0.07136 1642 CB . ILE A 213 ? 0.39992 0.42173 0.48441 0.09558 0.02838 -0.06883 1643 CG1 . ILE A 213 ? 0.29049 0.32148 0.38634 0.08658 0.03490 -0.06924 1644 CG2 . ILE A 213 ? 0.34512 0.37255 0.44186 0.09859 0.02144 -0.07234 1645 CD1 . ILE A 213 ? 0.25685 0.29451 0.36162 0.07622 0.03861 -0.06325 1646 N . ASN A 214 ? 0.40249 0.45360 0.28284 0.02872 -0.03111 -0.05093 1647 CA . ASN A 214 ? 0.43657 0.47555 0.27760 0.02411 -0.02982 -0.04862 1648 C . ASN A 214 ? 0.54435 0.57527 0.35578 0.03446 -0.04875 -0.03352 1649 O . ASN A 214 ? 0.64892 0.66345 0.42334 0.02930 -0.04612 -0.02379 1650 CB . ASN A 214 ? 0.43637 0.45610 0.27179 0.01710 -0.00763 -0.04389 1651 CG . ASN A 214 ? 0.56152 0.58363 0.41403 0.00889 0.00864 -0.06105 1652 OD1 . ASN A 214 ? 0.66869 0.69188 0.50140 0.00237 0.01308 -0.07524 1653 ND2 . ASN A 214 ? 0.56550 0.58518 0.45225 0.00956 0.01633 -0.06017 1654 N . GLY A 215 ? 0.53212 0.57426 0.35808 0.04939 -0.06786 -0.03115 1655 CA . GLY A 215 ? 0.60953 0.64022 0.40791 0.06317 -0.09034 -0.01739 1656 C . GLY A 215 ? 0.61797 0.60713 0.39605 0.06687 -0.09026 0.00390 1657 O . GLY A 215 ? 0.82630 0.79356 0.56830 0.07241 -0.10695 0.01944 1658 N . ASP A 216 ? 0.49205 0.46812 0.29031 0.06214 -0.07370 0.00630 1659 CA . ASP A 216 ? 0.52462 0.46151 0.30657 0.06145 -0.07381 0.02544 1660 C . ASP A 216 ? 0.54694 0.47785 0.35671 0.07807 -0.08261 0.02271 1661 O . ASP A 216 ? 0.59886 0.54225 0.44032 0.07451 -0.06877 0.01415 1662 CB . ASP A 216 ? 0.56629 0.49766 0.34852 0.04142 -0.04843 0.02951 1663 CG . ASP A 216 ? 0.61966 0.51801 0.36462 0.02997 -0.04839 0.05186 1664 OD1 . ASP A 216 ? 0.73282 0.60239 0.44952 0.03791 -0.06982 0.06606 1665 OD2 . ASP A 216 ? 0.67453 0.57648 0.41870 0.01281 -0.02758 0.05574 1666 N . ARG A 217 ? 0.52881 0.43937 0.32461 0.09745 -0.10643 0.02962 1667 CA . ARG A 217 ? 0.60734 0.52120 0.43082 0.11888 -0.11614 0.02005 1668 C . ARG A 217 ? 0.68186 0.54293 0.48205 0.13445 -0.13566 0.03334 1669 O . ARG A 217 ? 0.69227 0.55514 0.50883 0.16032 -0.15013 0.02322 1670 CB . ARG A 217 ? 0.61626 0.57760 0.46302 0.13647 -0.12836 0.00342 1671 CG . ARG A 217 ? 0.55023 0.50719 0.36805 0.14786 -0.15198 0.01162 1672 CD . ARG A 217 ? 0.58452 0.59136 0.43078 0.16993 -0.16850 -0.00457 1673 NE . ARG A 217 ? 0.55737 0.61898 0.44248 0.15706 -0.15111 -0.02405 1674 CZ . ARG A 217 ? 0.45978 0.55855 0.38509 0.16823 -0.14810 -0.03979 1675 NH1 . ARG A 217 ? 0.47523 0.56562 0.41002 0.19614 -0.16036 -0.04250 1676 NH2 . ARG A 217 ? 0.44565 0.59009 0.40027 0.15058 -0.13261 -0.05365 1677 N . TRP A 218 ? 0.64060 0.45435 0.40271 0.11902 -0.13639 0.05493 1678 CA . TRP A 218 ? 0.68240 0.43543 0.41696 0.13096 -0.15770 0.06948 1679 C . TRP A 218 ? 0.72248 0.45696 0.47855 0.13816 -0.15514 0.05978 1680 O . TRP A 218 ? 0.74074 0.43288 0.48600 0.15984 -0.17609 0.06041 1681 CB . TRP A 218 ? 0.82568 0.53424 0.51343 0.10491 -0.15646 0.09673 1682 CG . TRP A 218 ? 0.69295 0.40972 0.38844 0.07344 -0.12849 0.10018 1683 CD1 . TRP A 218 ? 0.65151 0.40670 0.35065 0.05240 -0.10537 0.09868 1684 CD2 . TRP A 218 ? 0.75087 0.43866 0.45242 0.06105 -0.12217 0.10442 1685 NE1 . TRP A 218 ? 0.74403 0.50006 0.45493 0.03024 -0.08508 0.10231 1686 CE2 . TRP A 218 ? 0.75308 0.46973 0.46559 0.03322 -0.09541 0.10669 1687 CE3 . TRP A 218 ? 0.71218 0.35251 0.41071 0.07140 -0.13745 0.10477 1688 CZ2 . TRP A 218 ? 0.73403 0.43946 0.45708 0.01438 -0.08462 0.11116 1689 CZ3 . TRP A 218 ? 0.70635 0.33067 0.41115 0.05014 -0.12645 0.10818 1690 CH2 . TRP A 218 ? 0.73807 0.39759 0.45620 0.02130 -0.10079 0.11231 1691 N . PHE A 219 ? 0.66021 0.42340 0.44448 0.12140 -0.13119 0.05021 1692 CA . PHE A 219 ? 0.65453 0.40286 0.45507 0.12310 -0.12741 0.04165 1693 C . PHE A 219 ? 0.66622 0.44554 0.49811 0.15149 -0.13278 0.01739 1694 O . PHE A 219 ? 0.63280 0.39951 0.47413 0.15671 -0.13181 0.00730 1695 CB . PHE A 219 ? 0.63410 0.40589 0.45269 0.09511 -0.10176 0.04233 1696 CG . PHE A 219 ? 0.51915 0.34777 0.36222 0.08868 -0.08467 0.03338 1697 CD1 . PHE A 219 ? 0.57684 0.44813 0.45460 0.09788 -0.07808 0.01457 1698 CD2 . PHE A 219 ? 0.51546 0.35286 0.34406 0.07211 -0.07522 0.04325 1699 CE1 . PHE A 219 ? 0.46960 0.38418 0.36677 0.08935 -0.06439 0.00734 1700 CE2 . PHE A 219 ? 0.48710 0.36829 0.33543 0.06688 -0.06102 0.03261 1701 CZ . PHE A 219 ? 0.43201 0.34832 0.31448 0.07487 -0.05661 0.01540 1702 N . LEU A 220 ? 0.66745 0.49081 0.51514 0.16818 -0.13799 0.00698 1703 CA . LEU A 220 ? 0.66307 0.53035 0.54472 0.19255 -0.14024 -0.01669 1704 C . LEU A 220 ? 0.67598 0.50863 0.54830 0.22734 -0.16436 -0.02309 1705 O . LEU A 220 ? 0.82886 0.62874 0.67635 0.24226 -0.18633 -0.01147 1706 CB . LEU A 220 ? 0.55647 0.48604 0.45934 0.19562 -0.13917 -0.02515 1707 CG . LEU A 220 ? 0.48531 0.45256 0.40359 0.16598 -0.11587 -0.02587 1708 CD1 . LEU A 220 ? 0.43613 0.45790 0.37164 0.16877 -0.11934 -0.03560 1709 CD2 . LEU A 220 ? 0.45502 0.44139 0.39876 0.15673 -0.09779 -0.03618 1710 N . ASN A 221 ? 0.71727 0.55596 0.60752 0.24142 -0.16111 -0.04207 1711 CA . ASN A 221 ? 0.90913 0.72708 0.79818 0.27584 -0.17942 -0.05609 1712 C . ASN A 221 ? 0.83875 0.73512 0.76961 0.29394 -0.17137 -0.08328 1713 O . ASN A 221 ? 0.74057 0.69853 0.69951 0.28431 -0.15573 -0.09043 1714 CB . ASN A 221 ? 0.72447 0.47938 0.59232 0.27073 -0.18041 -0.05731 1715 CG . ASN A 221 ? 0.77334 0.54881 0.65652 0.25502 -0.16027 -0.06751 1716 OD1 . ASN A 221 ? 0.71386 0.55583 0.62954 0.25991 -0.14630 -0.08647 1717 ND2 . ASN A 221 ? 0.78471 0.51114 0.64490 0.22701 -0.15566 -0.05307 1718 N . ARG A 222 ? 0.75442 0.64942 0.68887 0.31857 -0.18195 -0.09795 1719 CA . ARG A 222 ? 0.76943 0.73870 0.74046 0.33504 -0.17442 -0.12354 1720 C . ARG A 222 ? 0.72184 0.69577 0.69930 0.33766 -0.16221 -0.14348 1721 O . ARG A 222 ? 0.75047 0.77244 0.74974 0.35465 -0.15870 -0.16543 1722 CB . ARG A 222 ? 0.72518 0.69979 0.69927 0.36301 -0.19317 -0.12921 1723 CG . ARG A 222 ? 0.82656 0.80195 0.79318 0.36036 -0.20640 -0.11013 1724 CD . ARG A 222 ? 0.91434 0.97218 0.91642 0.37195 -0.20712 -0.12312 1725 NE . ARG A 222 ? 0.92999 1.06386 0.96623 0.35676 -0.18463 -0.13810 1726 CZ . ARG A 222 ? 0.91710 1.11062 0.98300 0.36728 -0.17533 -0.16110 1727 NH1 . ARG A 222 ? 0.83251 1.02330 0.90185 0.39720 -0.18685 -0.17463 1728 NH2 . ARG A 222 ? 0.82861 1.08621 0.92021 0.34637 -0.15407 -0.17009 1729 N . PHE A 223 ? 0.78316 0.71096 0.74129 0.32012 -0.15567 -0.13637 1730 CA . PHE A 223 ? 0.69074 0.62007 0.65028 0.31950 -0.14469 -0.15446 1731 C . PHE A 223 ? 0.73247 0.72758 0.71736 0.30076 -0.12099 -0.16086 1732 O . PHE A 223 ? 0.64138 0.66454 0.63857 0.28480 -0.11349 -0.14823 1733 CB . PHE A 223 ? 0.69063 0.53331 0.61395 0.30793 -0.15179 -0.14403 1734 CG . PHE A 223 ? 0.81330 0.58487 0.70748 0.31929 -0.17469 -0.13355 1735 CD1 . PHE A 223 ? 0.85212 0.62625 0.75016 0.34912 -0.18707 -0.14939 1736 CD2 . PHE A 223 ? 0.82359 0.52744 0.68627 0.29879 -0.18353 -0.10693 1737 CE1 . PHE A 223 ? 0.85343 0.55950 0.72392 0.35990 -0.20905 -0.13898 1738 CE2 . PHE A 223 ? 0.88304 0.52238 0.71690 0.30518 -0.20398 -0.09525 1739 CZ . PHE A 223 ? 0.92449 0.56256 0.76196 0.33664 -0.21747 -0.11125 1740 N . THR A 224 ? 0.75109 0.77048 0.74191 0.30205 -0.10947 -0.18067 1741 CA . THR A 224 ? 0.60958 0.68160 0.61624 0.28097 -0.08691 -0.18577 1742 C . THR A 224 ? 0.64363 0.67889 0.62802 0.27537 -0.08273 -0.19569 1743 O . THR A 224 ? 0.75407 0.73154 0.71556 0.28872 -0.09666 -0.20165 1744 CB . THR A 224 ? 0.70696 0.87045 0.74582 0.28274 -0.07417 -0.20087 1745 OG1 . THR A 224 ? 0.54403 0.75748 0.59712 0.25473 -0.05314 -0.19689 1746 CG2 . THR A 224 ? 0.63308 0.80912 0.67018 0.30118 -0.07398 -0.22482 1747 N . THR A 225 ? 0.59156 0.65924 0.57988 0.24737 -0.06417 -0.19267 1748 CA . THR A 225 ? 0.49680 0.53581 0.46202 0.23435 -0.06032 -0.19887 1749 C . THR A 225 ? 0.63086 0.73929 0.60854 0.21256 -0.03885 -0.20293 1750 O . THR A 225 ? 0.51476 0.67656 0.51528 0.19696 -0.02739 -0.19157 1751 CB . THR A 225 ? 0.57132 0.54222 0.51335 0.20685 -0.06736 -0.17237 1752 OG1 . THR A 225 ? 0.53916 0.48469 0.45916 0.19423 -0.06648 -0.18012 1753 CG2 . THR A 225 ? 0.56967 0.56767 0.52667 0.17471 -0.05565 -0.14494 1754 N . THR A 226 ? 0.61234 0.71705 0.57140 0.21020 -0.03457 -0.21922 1755 CA . THR A 226 ? 0.49297 0.65063 0.45360 0.18266 -0.01643 -0.21642 1756 C . THR A 226 ? 0.47069 0.59719 0.42202 0.14596 -0.01669 -0.18447 1757 O . THR A 226 ? 0.44679 0.50977 0.38423 0.14178 -0.02969 -0.17185 1758 CB . THR A 226 ? 0.49754 0.66533 0.43735 0.19232 -0.01204 -0.24596 1759 OG1 . THR A 226 ? 0.66024 0.75030 0.56878 0.19121 -0.02711 -0.24750 1760 CG2 . THR A 226 ? 0.52596 0.72569 0.48202 0.22458 -0.01244 -0.26999 1761 N . LEU A 227 ? 0.47847 0.65197 0.43871 0.11916 -0.00258 -0.17056 1762 CA . LEU A 227 ? 0.37919 0.52944 0.33366 0.08802 -0.00317 -0.14184 1763 C . LEU A 227 ? 0.50119 0.60979 0.42780 0.08074 -0.01199 -0.14507 1764 O . LEU A 227 ? 0.53962 0.60919 0.46178 0.06458 -0.01988 -0.12488 1765 CB . LEU A 227 ? 0.40759 0.61173 0.37204 0.06329 0.01127 -0.12841 1766 CG . LEU A 227 ? 0.49457 0.68299 0.46205 0.03529 0.01090 -0.09668 1767 CD1 . LEU A 227 ? 0.47802 0.63114 0.45985 0.03890 0.00447 -0.08207 1768 CD2 . LEU A 227 ? 0.34999 0.58730 0.32597 0.01419 0.02343 -0.08485 1769 N . ASN A 228 ? 0.55113 0.67039 0.45911 0.09239 -0.01079 -0.17232 1770 CA . ASN A 228 ? 0.59186 0.67107 0.46969 0.08456 -0.02064 -0.17971 1771 C . ASN A 228 ? 0.51530 0.52025 0.38235 0.09631 -0.03853 -0.18191 1772 O . ASN A 228 ? 0.52742 0.49138 0.38087 0.07633 -0.04881 -0.16848 1773 CB . ASN A 228 ? 0.52076 0.63100 0.37859 0.09623 -0.01380 -0.21288 1774 CG . ASN A 228 ? 0.56748 0.63545 0.39006 0.08796 -0.02515 -0.22506 1775 OD1 . ASN A 228 ? 0.61788 0.64712 0.42191 0.11065 -0.03415 -0.25377 1776 ND2 . ASN A 228 ? 0.67011 0.74319 0.48270 0.05574 -0.02669 -0.20373 1777 N . ASP A 229 ? 0.57835 0.56638 0.45129 0.12732 -0.04359 -0.19725 1778 CA . ASP A 229 ? 0.70113 0.61243 0.55933 0.13810 -0.06228 -0.19699 1779 C . ASP A 229 ? 0.64411 0.52915 0.51125 0.11497 -0.06656 -0.16173 1780 O . ASP A 229 ? 0.63445 0.46383 0.48405 0.10026 -0.07893 -0.15178 1781 CB . ASP A 229 ? 0.81779 0.72121 0.68268 0.17863 -0.06819 -0.21729 1782 CG . ASP A 229 ? 1.02272 0.83761 0.86425 0.19261 -0.09035 -0.21983 1783 OD1 . ASP A 229 ? 1.04297 0.80464 0.86345 0.16729 -0.09985 -0.20605 1784 OD2 . ASP A 229 ? 1.07396 0.87297 0.91836 0.22850 -0.09947 -0.23486 1785 N . PHE A 230 ? 0.56084 0.48716 0.45481 0.11030 -0.05597 -0.14383 1786 CA . PHE A 230 ? 0.64691 0.55472 0.54991 0.09091 -0.05743 -0.11378 1787 C . PHE A 230 ? 0.58890 0.49394 0.48821 0.05945 -0.05649 -0.09688 1788 O . PHE A 230 ? 0.54489 0.41386 0.43972 0.04417 -0.06374 -0.08000 1789 CB . PHE A 230 ? 0.62241 0.57655 0.55274 0.09189 -0.04580 -0.10242 1790 CG . PHE A 230 ? 0.59526 0.54086 0.53567 0.07118 -0.04332 -0.07471 1791 CD1 . PHE A 230 ? 0.52723 0.43452 0.46205 0.07458 -0.05123 -0.06395 1792 CD2 . PHE A 230 ? 0.53734 0.51325 0.49132 0.04937 -0.03334 -0.05968 1793 CE1 . PHE A 230 ? 0.51202 0.41748 0.45552 0.05644 -0.04650 -0.04154 1794 CE2 . PHE A 230 ? 0.49387 0.46407 0.45926 0.03475 -0.03041 -0.03788 1795 CZ . PHE A 230 ? 0.57602 0.51408 0.53667 0.03823 -0.03559 -0.03023 1796 N . ASN A 231 ? 0.54391 0.49062 0.44526 0.04862 -0.04810 -0.10009 1797 CA . ASN A 231 ? 0.54377 0.49319 0.44338 0.02096 -0.04979 -0.08330 1798 C . ASN A 231 ? 0.55555 0.45664 0.43045 0.01191 -0.06480 -0.08988 1799 O . ASN A 231 ? 0.69214 0.58353 0.57022 -0.01102 -0.07029 -0.07160 1800 CB . ASN A 231 ? 0.51421 0.51410 0.41406 0.01201 -0.04062 -0.08524 1801 CG . ASN A 231 ? 0.43293 0.47439 0.35789 0.00879 -0.02777 -0.06928 1802 OD1 . ASN A 231 ? 0.42165 0.45492 0.36529 0.00624 -0.02648 -0.05181 1803 ND2 . ASN A 231 ? 0.42393 0.50934 0.34697 0.00711 -0.01803 -0.07588 1804 N . LEU A 232 ? 0.56277 0.43347 0.41397 0.02959 -0.07226 -0.11678 1805 CA . LEU A 232 ? 0.62050 0.43293 0.44471 0.02010 -0.08884 -0.12432 1806 C . LEU A 232 ? 0.61289 0.38053 0.44051 0.00917 -0.09737 -0.10276 1807 O . LEU A 232 ? 0.70369 0.44666 0.52328 -0.01710 -0.10681 -0.09143 1808 CB . LEU A 232 ? 0.73538 0.51513 0.53385 0.04731 -0.09582 -0.15927 1809 CG . LEU A 232 ? 0.87133 0.69780 0.66185 0.05920 -0.08582 -0.18587 1810 CD1 . LEU A 232 ? 0.90087 0.69775 0.67264 0.09457 -0.09115 -0.22277 1811 CD2 . LEU A 232 ? 0.93089 0.76789 0.70263 0.03101 -0.08913 -0.18622 1812 N . VAL A 233 ? 0.58692 0.34779 0.42566 0.02698 -0.09426 -0.09643 1813 CA . VAL A 233 ? 0.62662 0.35098 0.46574 0.01518 -0.10010 -0.07400 1814 C . VAL A 233 ? 0.72091 0.48625 0.58639 -0.00928 -0.08936 -0.04722 1815 O . VAL A 233 ? 0.72809 0.47333 0.59330 -0.03070 -0.09329 -0.02867 1816 CB . VAL A 233 ? 0.76877 0.47634 0.60833 0.04252 -0.10145 -0.07559 1817 CG1 . VAL A 233 ? 0.71750 0.38033 0.54754 0.02888 -0.10915 -0.05265 1818 CG2 . VAL A 233 ? 0.72868 0.40528 0.54855 0.07384 -0.11175 -0.10512 1819 N . ALA A 234 ? 0.60305 0.42612 0.49147 -0.00667 -0.07586 -0.04493 1820 CA . ALA A 234 ? 0.61513 0.47421 0.52993 -0.02423 -0.06660 -0.02168 1821 C . ALA A 234 ? 0.55705 0.41818 0.47236 -0.05100 -0.07348 -0.01190 1822 O . ALA A 234 ? 0.61102 0.47676 0.54101 -0.06775 -0.07232 0.00697 1823 CB . ALA A 234 ? 0.55923 0.46976 0.49372 -0.01607 -0.05374 -0.02180 1824 N . MET A 235 ? 0.55177 0.41477 0.45149 -0.05572 -0.08061 -0.02555 1825 CA . MET A 235 ? 0.58739 0.45848 0.48773 -0.08209 -0.08962 -0.01707 1826 C . MET A 235 ? 0.60071 0.43245 0.49377 -0.10188 -0.09991 -0.00881 1827 O . MET A 235 ? 0.70315 0.55617 0.61369 -0.12532 -0.10251 0.00813 1828 CB . MET A 235 ? 0.74210 0.61243 0.61680 -0.08397 -0.09787 -0.03739 1829 CG . MET A 235 ? 0.81969 0.72701 0.69340 -0.06709 -0.08739 -0.04815 1830 SD . MET A 235 ? 1.04927 1.01681 0.95599 -0.07343 -0.07664 -0.02202 1831 CE . MET A 235 ? 0.42289 0.40479 0.33826 -0.04785 -0.06004 -0.02935 1832 N . LYS A 236 ? 0.62246 0.39769 0.49008 -0.09333 -0.10674 -0.01977 1833 CA . LYS A 236 ? 0.64355 0.37209 0.49636 -0.11665 -0.11874 -0.01140 1834 C . LYS A 236 ? 0.64333 0.39235 0.52075 -0.13039 -0.10942 0.01520 1835 O . LYS A 236 ? 0.64252 0.38919 0.52342 -0.16055 -0.11471 0.02922 1836 CB . LYS A 236 ? 0.65638 0.31239 0.47368 -0.10096 -0.12993 -0.02753 1837 CG . LYS A 236 ? 0.94890 0.54275 0.74034 -0.12912 -0.14695 -0.02212 1838 CD . LYS A 236 ? 1.00342 0.53591 0.77406 -0.11989 -0.15271 -0.01517 1839 CE . LYS A 236 ? 0.99524 0.46323 0.73815 -0.15454 -0.16988 -0.00509 1840 NZ . LYS A 236 ? 0.92508 0.43902 0.69208 -0.19597 -0.16436 0.01808 1841 N . TYR A 237 ? 0.67049 0.44303 0.56485 -0.10998 -0.09507 0.02112 1842 CA . TYR A 237 ? 0.61457 0.40784 0.52893 -0.11894 -0.08395 0.04229 1843 C . TYR A 237 ? 0.52192 0.38226 0.47565 -0.12021 -0.07082 0.05253 1844 O . TYR A 237 ? 0.52970 0.41388 0.50228 -0.11670 -0.05776 0.06384 1845 CB . TYR A 237 ? 0.60032 0.37190 0.50425 -0.09665 -0.07853 0.04165 1846 CG . TYR A 237 ? 0.65060 0.35173 0.51630 -0.09131 -0.09386 0.03417 1847 CD1 . TYR A 237 ? 0.61346 0.27202 0.45886 -0.11433 -0.10167 0.04932 1848 CD2 . TYR A 237 ? 0.78264 0.45985 0.63236 -0.06309 -0.10098 0.01215 1849 CE1 . TYR A 237 ? 0.69768 0.28221 0.50510 -0.10867 -0.11863 0.04433 1850 CE2 . TYR A 237 ? 0.80877 0.41784 0.62477 -0.05311 -0.11706 0.00398 1851 CZ . TYR A 237 ? 0.86783 0.42581 0.66132 -0.07559 -0.12712 0.02093 1852 OH . TYR A 237 ? 1.09522 0.57568 0.85201 -0.06493 -0.14599 0.01469 1853 N . ASN A 238 ? 0.43452 0.32301 0.39843 -0.12398 -0.07515 0.04825 1854 CA . ASN A 238 ? 0.50312 0.44951 0.50323 -0.12527 -0.06748 0.05989 1855 C . ASN A 238 ? 0.49632 0.46285 0.51131 -0.10088 -0.05322 0.05981 1856 O . ASN A 238 ? 0.42927 0.42862 0.47297 -0.09840 -0.04305 0.07123 1857 CB . ASN A 238 ? 0.41571 0.38878 0.44068 -0.14679 -0.06476 0.07728 1858 CG . ASN A 238 ? 0.60742 0.63926 0.67092 -0.14718 -0.06236 0.08760 1859 OD1 . ASN A 238 ? 0.63846 0.68413 0.70293 -0.14082 -0.06897 0.08415 1860 ND2 . ASN A 238 ? 0.65079 0.71874 0.74552 -0.15362 -0.05310 0.10050 1861 N . TYR A 239 ? 0.44272 0.39057 0.43870 -0.08284 -0.05271 0.04529 1862 CA . TYR A 239 ? 0.41104 0.37814 0.41859 -0.06378 -0.04130 0.04350 1863 C . TYR A 239 ? 0.42493 0.41577 0.43373 -0.06102 -0.04302 0.03955 1864 O . TYR A 239 ? 0.40631 0.38845 0.39467 -0.06505 -0.05195 0.02873 1865 CB . TYR A 239 ? 0.43231 0.37191 0.42123 -0.04673 -0.03921 0.03116 1866 CG . TYR A 239 ? 0.41366 0.34201 0.40505 -0.04508 -0.03300 0.03921 1867 CD1 . TYR A 239 ? 0.45293 0.36341 0.43847 -0.06173 -0.03630 0.04955 1868 CD2 . TYR A 239 ? 0.36000 0.29740 0.35707 -0.02980 -0.02402 0.03661 1869 CE1 . TYR A 239 ? 0.46904 0.37215 0.45207 -0.06244 -0.02954 0.05786 1870 CE2 . TYR A 239 ? 0.38303 0.31162 0.37757 -0.02912 -0.01874 0.04310 1871 CZ . TYR A 239 ? 0.49799 0.40989 0.48427 -0.04506 -0.02092 0.05406 1872 OH . TYR A 239 ? 0.47672 0.38256 0.45589 -0.04658 -0.01466 0.06146 1873 N . GLU A 240 ? 0.37310 0.39137 0.40277 -0.05529 -0.03488 0.04835 1874 CA . GLU A 240 ? 0.31969 0.35855 0.34710 -0.05530 -0.03639 0.04874 1875 C . GLU A 240 ? 0.35483 0.38719 0.35948 -0.04573 -0.03381 0.03036 1876 O . GLU A 240 ? 0.35015 0.36805 0.35068 -0.03370 -0.02893 0.02038 1877 CB . GLU A 240 ? 0.30533 0.36419 0.35662 -0.05083 -0.02930 0.06257 1878 CG . GLU A 240 ? 0.48973 0.54108 0.54674 -0.03861 -0.01756 0.05777 1879 CD . GLU A 240 ? 0.61837 0.68135 0.68218 -0.03577 -0.01226 0.06266 1880 OE1 . GLU A 240 ? 0.55411 0.62795 0.62737 -0.04082 -0.01675 0.07671 1881 OE2 . GLU A 240 ? 0.35040 0.41075 0.40956 -0.02954 -0.00517 0.05335 1882 N . PRO A 241 ? 0.40656 0.45348 0.39604 -0.05039 -0.03729 0.02510 1883 CA . PRO A 241 ? 0.43870 0.49174 0.41061 -0.04041 -0.03193 0.00614 1884 C . PRO A 241 ? 0.33551 0.40594 0.32212 -0.03315 -0.02019 0.00940 1885 O . PRO A 241 ? 0.35994 0.44065 0.36311 -0.03939 -0.01719 0.02697 1886 CB . PRO A 241 ? 0.39332 0.46667 0.34658 -0.05167 -0.03642 0.00430 1887 CG . PRO A 241 ? 0.48303 0.55061 0.43930 -0.06635 -0.04888 0.01797 1888 CD . PRO A 241 ? 0.42813 0.49102 0.41484 -0.06522 -0.04672 0.03572 1889 N . LEU A 242 ? 0.40153 0.47431 0.38254 -0.01938 -0.01497 -0.00848 1890 CA . LEU A 242 ? 0.38837 0.48202 0.38253 -0.01484 -0.00502 -0.00845 1891 C . LEU A 242 ? 0.38217 0.51265 0.36734 -0.02113 0.00130 -0.01467 1892 O . LEU A 242 ? 0.37736 0.51971 0.34728 -0.01322 0.00192 -0.03480 1893 CB . LEU A 242 ? 0.36037 0.44340 0.35704 0.00348 -0.00438 -0.02292 1894 CG . LEU A 242 ? 0.32422 0.42420 0.33785 0.00563 0.00318 -0.02020 1895 CD1 . LEU A 242 ? 0.36810 0.44915 0.39449 -0.00099 0.00385 -0.00256 1896 CD2 . LEU A 242 ? 0.33500 0.43680 0.34866 0.02516 0.00161 -0.03752 1897 N . THR A 243 ? 0.36464 0.51192 0.35753 -0.03560 0.00600 0.00227 1898 CA . THR A 243 ? 0.34213 0.52563 0.32365 -0.04790 0.01265 0.00157 1899 C . THR A 243 ? 0.31771 0.52978 0.31072 -0.04587 0.02323 -0.00756 1900 O . THR A 243 ? 0.32789 0.52843 0.33795 -0.03719 0.02374 -0.00901 1901 CB . THR A 243 ? 0.43472 0.61680 0.41368 -0.06792 0.00917 0.02837 1902 OG1 . THR A 243 ? 0.30097 0.46918 0.29970 -0.07106 0.01090 0.04341 1903 CG2 . THR A 243 ? 0.30503 0.46488 0.27925 -0.06898 -0.00333 0.03806 1904 N . GLN A 244 ? 0.32118 0.57570 0.30378 -0.05554 0.03180 -0.01447 1905 CA . GLN A 244 ? 0.34135 0.63415 0.33740 -0.05900 0.04228 -0.02179 1906 C . GLN A 244 ? 0.29356 0.57162 0.30318 -0.07584 0.04223 0.00018 1907 O . GLN A 244 ? 0.31189 0.60278 0.33852 -0.07459 0.04601 -0.00588 1908 CB . GLN A 244 ? 0.39600 0.74318 0.37743 -0.07206 0.05334 -0.02993 1909 CG . GLN A 244 ? 0.29967 0.69864 0.29759 -0.08027 0.06533 -0.03730 1910 CD . GLN A 244 ? 0.34126 0.75641 0.36025 -0.05147 0.06554 -0.06380 1911 OE1 . GLN A 244 ? 0.30276 0.71932 0.31613 -0.02617 0.06347 -0.08649 1912 NE2 . GLN A 244 ? 0.26815 0.69245 0.30989 -0.05486 0.06606 -0.06112 1913 N . ASP A 245 ? 0.31520 0.56480 0.31735 -0.09047 0.03629 0.02474 1914 CA . ASP A 245 ? 0.33504 0.55915 0.34856 -0.10260 0.03419 0.04408 1915 C . ASP A 245 ? 0.36317 0.55602 0.39521 -0.08439 0.03058 0.03809 1916 O . ASP A 245 ? 0.33055 0.51440 0.37401 -0.08985 0.03224 0.04063 1917 CB . ASP A 245 ? 0.51234 0.71011 0.51464 -0.11573 0.02583 0.07077 1918 CG . ASP A 245 ? 0.80826 1.03520 0.78479 -0.13196 0.02720 0.07676 1919 OD1 . ASP A 245 ? 0.72924 0.96955 0.69412 -0.12175 0.02621 0.06290 1920 OD2 . ASP A 245 ? 0.82060 1.05476 0.78533 -0.15645 0.02881 0.09530 1921 N . HIS A 246 ? 0.34895 0.52462 0.38124 -0.06521 0.02552 0.02998 1922 CA . HIS A 246 ? 0.31319 0.46408 0.35835 -0.04955 0.02338 0.02405 1923 C . HIS A 246 ? 0.32582 0.49833 0.37757 -0.04095 0.02743 0.00549 1924 O . HIS A 246 ? 0.29372 0.45449 0.35528 -0.03813 0.02741 0.00420 1925 CB . HIS A 246 ? 0.32534 0.45523 0.36597 -0.03596 0.01694 0.02126 1926 CG . HIS A 246 ? 0.29948 0.41079 0.34114 -0.04228 0.01110 0.03957 1927 ND1 . HIS A 246 ? 0.33997 0.44605 0.37295 -0.04065 0.00424 0.03993 1928 CD2 . HIS A 246 ? 0.30900 0.40647 0.36083 -0.04901 0.00949 0.05739 1929 CE1 . HIS A 246 ? 0.33229 0.42913 0.37262 -0.04662 -0.00138 0.05802 1930 NE2 . HIS A 246 ? 0.32942 0.41988 0.38173 -0.04954 0.00162 0.06879 1931 N . VAL A 247 ? 0.27795 0.48447 0.32451 -0.03520 0.03022 -0.01043 1932 CA . VAL A 247 ? 0.25158 0.48689 0.30841 -0.02378 0.03225 -0.02880 1933 C . VAL A 247 ? 0.27236 0.53235 0.34126 -0.04293 0.03775 -0.02442 1934 O . VAL A 247 ? 0.28602 0.55061 0.36655 -0.03796 0.03577 -0.03158 1935 CB . VAL A 247 ? 0.25218 0.52353 0.30336 -0.01116 0.03482 -0.04870 1936 CG1 . VAL A 247 ? 0.23255 0.54212 0.29978 0.00350 0.03573 -0.06788 1937 CG2 . VAL A 247 ? 0.27510 0.51170 0.31134 0.00627 0.02694 -0.05450 1938 N . ASP A 248 ? 0.25851 0.53329 0.32216 -0.06745 0.04338 -0.01175 1939 CA . ASP A 248 ? 0.31276 0.60299 0.38456 -0.09171 0.04739 -0.00467 1940 C . ASP A 248 ? 0.35604 0.59641 0.43178 -0.09528 0.04168 0.00639 1941 O . ASP A 248 ? 0.29787 0.54361 0.38227 -0.10765 0.04202 0.00402 1942 CB . ASP A 248 ? 0.26422 0.57264 0.32340 -0.11986 0.05326 0.01077 1943 CG . ASP A 248 ? 0.39581 0.76480 0.45037 -0.11951 0.06235 -0.00353 1944 OD1 . ASP A 248 ? 0.35363 0.75560 0.42061 -0.09765 0.06416 -0.02728 1945 OD2 . ASP A 248 ? 0.36291 0.74678 0.40015 -0.14006 0.06725 0.00873 1946 N . ILE A 249 ? 0.31933 0.51420 0.38936 -0.08500 0.03655 0.01671 1947 CA . ILE A 249 ? 0.26591 0.41695 0.34069 -0.08305 0.03280 0.02300 1948 C . ILE A 249 ? 0.29134 0.44340 0.37287 -0.06729 0.03146 0.00629 1949 O . ILE A 249 ? 0.35743 0.49518 0.44267 -0.07317 0.03066 0.00364 1950 CB . ILE A 249 ? 0.28547 0.40035 0.35698 -0.07369 0.02859 0.03636 1951 CG1 . ILE A 249 ? 0.33389 0.43993 0.39797 -0.09112 0.02632 0.05698 1952 CG2 . ILE A 249 ? 0.29279 0.37137 0.37158 -0.06350 0.02704 0.03601 1953 CD1 . ILE A 249 ? 0.27799 0.36436 0.34054 -0.08145 0.02020 0.06950 1954 N . LEU A 250 ? 0.27834 0.44403 0.35845 -0.04760 0.02970 -0.00516 1955 CA . LEU A 250 ? 0.30968 0.47483 0.39180 -0.03154 0.02578 -0.01815 1956 C . LEU A 250 ? 0.31675 0.52466 0.40842 -0.03505 0.02523 -0.03172 1957 O . LEU A 250 ? 0.37156 0.58396 0.46440 -0.02099 0.01939 -0.04219 1958 CB . LEU A 250 ? 0.21769 0.37466 0.29208 -0.00989 0.02135 -0.02317 1959 CG . LEU A 250 ? 0.23918 0.35753 0.30637 -0.00630 0.02035 -0.01144 1960 CD1 . LEU A 250 ? 0.26637 0.37921 0.32372 0.00754 0.01536 -0.01603 1961 CD2 . LEU A 250 ? 0.22376 0.31602 0.28985 -0.00256 0.02010 -0.00946 1962 N . GLY A 251 ? 0.31269 0.55496 0.41093 -0.05472 0.03044 -0.03064 1963 CA . GLY A 251 ? 0.31110 0.60686 0.42321 -0.06075 0.03091 -0.04374 1964 C . GLY A 251 ? 0.25271 0.54570 0.37059 -0.06492 0.02492 -0.05017 1965 O . GLY A 251 ? 0.22737 0.55043 0.35382 -0.04997 0.01858 -0.06413 1966 N . PRO A 252 ? 0.32873 0.58525 0.44102 -0.08483 0.02539 -0.04100 1967 CA . PRO A 252 ? 0.29143 0.53997 0.40431 -0.09007 0.01920 -0.04956 1968 C . PRO A 252 ? 0.28240 0.51737 0.38815 -0.06300 0.01202 -0.05804 1969 O . PRO A 252 ? 0.34177 0.59888 0.45074 -0.06134 0.00436 -0.06956 1970 CB . PRO A 252 ? 0.29449 0.48859 0.39730 -0.10833 0.02131 -0.03844 1971 CG . PRO A 252 ? 0.35028 0.54703 0.45330 -0.12508 0.02718 -0.02335 1972 CD . PRO A 252 ? 0.34821 0.57377 0.45323 -0.10572 0.03025 -0.02367 1973 N . LEU A 253 ? 0.32145 0.52174 0.41618 -0.04411 0.01323 -0.05135 1974 CA . LEU A 253 ? 0.34604 0.53293 0.43002 -0.02175 0.00636 -0.05626 1975 C . LEU A 253 ? 0.27648 0.50312 0.36734 -0.00331 -0.00177 -0.06595 1976 O . LEU A 253 ? 0.34057 0.57087 0.42543 0.00994 -0.01192 -0.07226 1977 CB . LEU A 253 ? 0.28198 0.42682 0.35394 -0.01058 0.01007 -0.04554 1978 CG . LEU A 253 ? 0.31303 0.41973 0.38020 -0.02069 0.01665 -0.03862 1979 CD1 . LEU A 253 ? 0.30191 0.38094 0.36340 -0.01002 0.02040 -0.02826 1980 CD2 . LEU A 253 ? 0.35271 0.44908 0.41017 -0.02315 0.01422 -0.04810 1981 N . SER A 254 ? 0.30099 0.55803 0.40319 -0.00078 0.00186 -0.06784 1982 C . SER A 254 ? 0.28855 0.63984 0.41894 0.01469 -0.01127 -0.09221 1983 O . SER A 254 ? 0.39190 0.76639 0.52775 0.03682 -0.02349 -0.10200 1984 CA A SER A 254 ? 0.30065 0.59832 0.41273 0.02084 -0.00546 -0.08055 1985 CB A SER A 254 ? 0.26552 0.58672 0.38424 0.02410 0.00220 -0.08326 1986 OG A SER A 254 ? 0.26894 0.63374 0.40033 0.04783 -0.00381 -0.09947 1987 CA B SER A 254 ? 0.30070 0.59824 0.41273 0.02092 -0.00551 -0.08055 1988 CB B SER A 254 ? 0.26560 0.58668 0.38425 0.02459 0.00202 -0.08339 1989 OG B SER A 254 ? 0.20984 0.57380 0.34282 -0.00069 0.01179 -0.08374 1990 N . ALA A 255 ? 0.35442 0.72504 0.49427 -0.01608 -0.00446 -0.09052 1991 CA . ALA A 255 ? 0.26083 0.68617 0.41954 -0.02833 -0.01031 -0.10144 1992 C . ALA A 255 ? 0.35265 0.75618 0.49972 -0.02539 -0.02302 -0.10449 1993 O . ALA A 255 ? 0.40755 0.85493 0.56685 -0.01695 -0.03537 -0.11542 1994 CB . ALA A 255 ? 0.32061 0.76430 0.48811 -0.06764 -0.00025 -0.09671 1995 N . GLN A 256 ? 0.37980 0.71991 0.50326 -0.03163 -0.02043 -0.09577 1996 CA . GLN A 256 ? 0.40683 0.72589 0.51377 -0.03097 -0.03037 -0.10000 1997 C . GLN A 256 ? 0.38548 0.70452 0.48212 0.00079 -0.04348 -0.10151 1998 O . GLN A 256 ? 0.34141 0.67756 0.43314 0.00462 -0.05739 -0.10839 1999 CB . GLN A 256 ? 0.33599 0.59077 0.42085 -0.04147 -0.02194 -0.09257 2000 CG . GLN A 256 ? 0.41587 0.64928 0.47948 -0.04356 -0.02930 -0.09969 2001 CD . GLN A 256 ? 0.60631 0.78182 0.65124 -0.05090 -0.01883 -0.09624 2002 OE1 . GLN A 256 ? 0.62114 0.77419 0.67296 -0.05948 -0.00828 -0.08858 2003 NE2 . GLN A 256 ? 0.56414 0.71757 0.58481 -0.04624 -0.02209 -0.10220 2004 N . THR A 257 ? 0.40560 0.70273 0.49638 0.02250 -0.04115 -0.09436 2005 CA . THR A 257 ? 0.37645 0.66141 0.45324 0.05167 -0.05495 -0.09286 2006 C . THR A 257 ? 0.39036 0.72438 0.48903 0.07523 -0.06545 -0.10252 2007 O . THR A 257 ? 0.36897 0.70004 0.45885 0.10038 -0.08245 -0.10306 2008 CB . THR A 257 ? 0.36593 0.59418 0.42172 0.06104 -0.04880 -0.08013 2009 OG1 . THR A 257 ? 0.34731 0.58182 0.41721 0.06246 -0.03918 -0.07969 2010 CG2 . THR A 257 ? 0.36152 0.54836 0.39957 0.04237 -0.03791 -0.07232 2011 N . GLY A 258 ? 0.29642 0.67584 0.42221 0.06863 -0.05604 -0.11012 2012 CA . GLY A 258 ? 0.39871 0.82901 0.54760 0.09412 -0.06258 -0.12258 2013 C . GLY A 258 ? 0.36117 0.75666 0.49880 0.12156 -0.06303 -0.12138 2014 O . GLY A 258 ? 0.40254 0.82801 0.55429 0.15125 -0.07204 -0.13365 2015 N . ILE A 259 ? 0.33411 0.66809 0.44775 0.11306 -0.05445 -0.10837 2016 CA . ILE A 259 ? 0.43726 0.73097 0.53636 0.13339 -0.05577 -0.10654 2017 C . ILE A 259 ? 0.36262 0.66241 0.46736 0.11711 -0.03790 -0.10658 2018 O . ILE A 259 ? 0.24400 0.51981 0.34092 0.09157 -0.02690 -0.09415 2019 CB . ILE A 259 ? 0.36836 0.59042 0.43445 0.13462 -0.06199 -0.09035 2020 CG1 . ILE A 259 ? 0.31552 0.53330 0.37061 0.14799 -0.08045 -0.08821 2021 CG2 . ILE A 259 ? 0.32631 0.50496 0.37691 0.15095 -0.06475 -0.08857 2022 CD1 . ILE A 259 ? 0.36973 0.52811 0.39069 0.14020 -0.08322 -0.07095 2023 N . ALA A 260 ? 0.33258 0.66570 0.45004 0.13336 -0.03568 -0.12121 2024 CA . ALA A 260 ? 0.25090 0.59360 0.36912 0.11870 -0.01987 -0.12203 2025 C . ALA A 260 ? 0.32489 0.59958 0.41665 0.11259 -0.01829 -0.10785 2026 O . ALA A 260 ? 0.31234 0.53619 0.38571 0.12763 -0.02965 -0.10294 2027 CB . ALA A 260 ? 0.28311 0.67118 0.41465 0.14226 -0.01839 -0.14390 2028 N . VAL A 261 ? 0.30812 0.58413 0.39790 0.08841 -0.00501 -0.09980 2029 CA . VAL A 261 ? 0.26203 0.48375 0.33194 0.07949 -0.00362 -0.08549 2030 C . VAL A 261 ? 0.26806 0.46008 0.32222 0.10127 -0.01152 -0.09420 2031 O . VAL A 261 ? 0.33493 0.47369 0.37158 0.10391 -0.01901 -0.08459 2032 CB . VAL A 261 ? 0.29991 0.53468 0.37170 0.05237 0.00921 -0.07561 2033 CG1 . VAL A 261 ? 0.29317 0.48168 0.34826 0.04591 0.00868 -0.06260 2034 CG2 . VAL A 261 ? 0.30256 0.54786 0.38519 0.02999 0.01428 -0.06518 2035 N . LEU A 262 ? 0.35736 0.58334 0.41663 0.11642 -0.00987 -0.11368 2036 CA . LEU A 262 ? 0.34032 0.53224 0.38224 0.13884 -0.01866 -0.12589 2037 C . LEU A 262 ? 0.39071 0.54295 0.42473 0.16491 -0.03647 -0.12770 2038 O . LEU A 262 ? 0.44679 0.54456 0.45900 0.17652 -0.04703 -0.12912 2039 CB . LEU A 262 ? 0.32400 0.56540 0.37325 0.15277 -0.01184 -0.15074 2040 CG . LEU A 262 ? 0.33939 0.61003 0.38514 0.12585 0.00402 -0.14730 2041 CD1 . LEU A 262 ? 0.33126 0.64801 0.37699 0.14013 0.01177 -0.17408 2042 CD2 . LEU A 262 ? 0.31359 0.52798 0.33660 0.10770 0.00132 -0.12972 2043 N . ASP A 263 ? 0.37473 0.55026 0.42325 0.17218 -0.04166 -0.12639 2044 CA . ASP A 263 ? 0.45626 0.59034 0.49235 0.19363 -0.06050 -0.12255 2045 C . ASP A 263 ? 0.46856 0.54353 0.48151 0.17387 -0.06297 -0.09837 2046 O . ASP A 263 ? 0.47091 0.48820 0.45997 0.18400 -0.07644 -0.09200 2047 CB . ASP A 263 ? 0.43586 0.61808 0.49336 0.20560 -0.06681 -0.12795 2048 CG . ASP A 263 ? 0.49109 0.73893 0.57539 0.22921 -0.06563 -0.15345 2049 OD1 . ASP A 263 ? 0.60684 0.86966 0.69277 0.23072 -0.05508 -0.16692 2050 OD2 . ASP A 263 ? 0.57258 0.85820 0.67410 0.24363 -0.07491 -0.15964 2051 N . MET A 264 ? 0.39427 0.48273 0.41365 0.14538 -0.05002 -0.08501 2052 CA . MET A 264 ? 0.40661 0.44981 0.40831 0.12705 -0.04889 -0.06465 2053 C . MET A 264 ? 0.43586 0.43950 0.42237 0.11883 -0.04774 -0.05912 2054 O . MET A 264 ? 0.41956 0.37722 0.38655 0.11246 -0.05324 -0.04547 2055 CB . MET A 264 ? 0.39181 0.46005 0.40667 0.10281 -0.03521 -0.05595 2056 CG . MET A 264 ? 0.44510 0.47834 0.44604 0.08755 -0.03227 -0.03851 2057 SD . MET A 264 ? 0.47633 0.48741 0.45677 0.09771 -0.04526 -0.03271 2058 CE . MET A 264 ? 0.43647 0.49969 0.43629 0.09735 -0.04415 -0.04370 2059 N . CYS A 265 ? 0.35082 0.37440 0.34448 0.11623 -0.04085 -0.06919 2060 CA . CYS A 265 ? 0.37906 0.36723 0.35669 0.10891 -0.04271 -0.06690 2061 C . CYS A 265 ? 0.40552 0.34188 0.36026 0.12785 -0.05959 -0.07263 2062 O . CYS A 265 ? 0.45850 0.34758 0.39416 0.11619 -0.06526 -0.06231 2063 CB . CYS A 265 ? 0.34059 0.36268 0.32518 0.10524 -0.03410 -0.07959 2064 SG . CYS A 265 ? 0.48030 0.54713 0.48389 0.07789 -0.01728 -0.06724 2065 N . ALA A 266 ? 0.42019 0.36460 0.37721 0.15693 -0.06895 -0.08895 2066 CA . ALA A 266 ? 0.47655 0.36376 0.41036 0.17900 -0.08828 -0.09374 2067 C . ALA A 266 ? 0.54489 0.38372 0.45876 0.16918 -0.09797 -0.06987 2068 O . ALA A 266 ? 0.54300 0.31828 0.42954 0.16738 -0.11073 -0.06265 2069 CB . ALA A 266 ? 0.49471 0.40819 0.44062 0.21629 -0.09716 -0.11558 2070 N . SER A 267 ? 0.54643 0.41390 0.47086 0.16063 -0.09207 -0.05776 2071 CA . SER A 267 ? 0.53263 0.36281 0.43588 0.14796 -0.09776 -0.03521 2072 C . SER A 267 ? 0.48905 0.29509 0.38259 0.11672 -0.08847 -0.01906 2073 O . SER A 267 ? 0.57520 0.33081 0.44239 0.10657 -0.09709 -0.00363 2074 CB . SER A 267 ? 0.46540 0.33693 0.38140 0.14463 -0.09168 -0.03016 2075 OG . SER A 267 ? 0.57094 0.46516 0.49514 0.17239 -0.10395 -0.04251 2076 N . LEU A 268 ? 0.45466 0.29838 0.36969 0.10015 -0.07166 -0.02103 2077 CA . LEU A 268 ? 0.55152 0.38168 0.46354 0.07311 -0.06400 -0.00707 2078 C . LEU A 268 ? 0.54652 0.33323 0.44034 0.07022 -0.07472 -0.01035 2079 O . LEU A 268 ? 0.58601 0.34380 0.46724 0.04849 -0.07612 0.00430 2080 CB . LEU A 268 ? 0.46004 0.33851 0.39934 0.06018 -0.04715 -0.00813 2081 CG . LEU A 268 ? 0.41731 0.29297 0.36094 0.03604 -0.04043 0.00424 2082 CD1 . LEU A 268 ? 0.46565 0.32594 0.40147 0.02113 -0.03737 0.02212 2083 CD2 . LEU A 268 ? 0.45512 0.37434 0.42432 0.02851 -0.02774 0.00349 2084 N . LYS A 269 ? 0.49651 0.27992 0.38847 0.09098 -0.08219 -0.03094 2085 CA . LYS A 269 ? 0.63687 0.37287 0.50747 0.09001 -0.09400 -0.03854 2086 C . LYS A 269 ? 0.66800 0.33415 0.50716 0.08880 -0.11132 -0.02603 2087 O . LYS A 269 ? 0.64527 0.26693 0.46498 0.06925 -0.11856 -0.01942 2088 CB . LYS A 269 ? 0.67416 0.42155 0.54716 0.11795 -0.09801 -0.06708 2089 CG . LYS A 269 ? 0.83391 0.53873 0.68517 0.11617 -0.10769 -0.08102 2090 CD . LYS A 269 ? 0.75726 0.47465 0.60912 0.14891 -0.11071 -0.11313 2091 CE . LYS A 269 ? 1.06205 0.71528 0.89111 0.17893 -0.13216 -0.12398 2092 NZ . LYS A 269 ? 1.09971 0.67551 0.89461 0.16855 -0.14747 -0.12752 2093 N . GLU A 270 ? 0.81472 0.46986 0.64671 0.10722 -0.11958 -0.02121 2094 CA . GLU A 270 ? 0.79129 0.37655 0.58861 0.10557 -0.13788 -0.00549 2095 C . GLU A 270 ? 0.81019 0.39047 0.59829 0.06996 -0.12982 0.02288 2096 O . GLU A 270 ? 0.79690 0.31936 0.55541 0.05124 -0.14069 0.03855 2097 CB . GLU A 270 ? 0.74666 0.32508 0.53846 0.13942 -0.15194 -0.00918 2098 CG . GLU A 270 ? 0.91254 0.42948 0.66795 0.13472 -0.16926 0.01487 2099 CD . GLU A 270 ? 1.15040 0.65998 0.90153 0.16939 -0.18658 0.00681 2100 OE1 . GLU A 270 ? 1.35360 0.86212 1.11330 0.19451 -0.19346 -0.01674 2101 OE2 . GLU A 270 ? 1.10999 0.62234 0.85062 0.16972 -0.19182 0.02319 2102 N . LEU A 271 ? 0.79267 0.43278 0.60517 0.05942 -0.11059 0.02885 2103 CA . LEU A 271 ? 0.72985 0.37584 0.53758 0.02838 -0.09962 0.05175 2104 C . LEU A 271 ? 0.69561 0.33311 0.50531 -0.00127 -0.09516 0.05829 2105 O . LEU A 271 ? 0.73924 0.35477 0.53199 -0.02826 -0.09506 0.07812 2106 CB . LEU A 271 ? 0.60634 0.31696 0.44188 0.02753 -0.08004 0.05098 2107 CG . LEU A 271 ? 0.65876 0.38434 0.49119 0.04766 -0.08317 0.04834 2108 CD1 . LEU A 271 ? 0.63498 0.42003 0.49549 0.04356 -0.06374 0.04381 2109 CD2 . LEU A 271 ? 0.74363 0.42883 0.53902 0.04058 -0.09356 0.06828 2110 N . LEU A 272 ? 0.63177 0.29094 0.46158 0.00112 -0.09160 0.04247 2111 CA . LEU A 272 ? 0.69980 0.35661 0.53310 -0.02721 -0.08969 0.04793 2112 C . LEU A 272 ? 0.77407 0.35839 0.57238 -0.03832 -0.10933 0.05102 2113 O . LEU A 272 ? 0.71802 0.28968 0.50991 -0.07113 -0.10991 0.06553 2114 CB . LEU A 272 ? 0.62360 0.32077 0.48204 -0.02171 -0.08327 0.03103 2115 CG . LEU A 272 ? 0.59875 0.36175 0.49108 -0.01669 -0.06501 0.03059 2116 CD1 . LEU A 272 ? 0.53730 0.33063 0.44559 -0.01148 -0.06226 0.01577 2117 CD2 . LEU A 272 ? 0.49791 0.28867 0.40636 -0.04019 -0.05239 0.04938 2118 N . GLN A 273 ? 0.80196 0.33819 0.57813 -0.01160 -0.12621 0.03732 2119 CA . GLN A 273 ? 0.79047 0.24629 0.53040 -0.01780 -0.14775 0.03669 2120 C . GLN A 273 ? 0.91883 0.32512 0.62780 -0.02885 -0.15812 0.06030 2121 O . GLN A 273 ? 0.99514 0.36763 0.68561 -0.05300 -0.16578 0.06853 2122 CB . GLN A 273 ? 0.90177 0.32975 0.63350 0.02076 -0.16126 0.00784 2123 CG . GLN A 273 ? 0.85410 0.33516 0.61165 0.02922 -0.15006 -0.01638 2124 CD . GLN A 273 ? 0.94875 0.42459 0.70484 0.07141 -0.15736 -0.04645 2125 OE1 . GLN A 273 ? 0.95848 0.41851 0.70946 0.10071 -0.16592 -0.04874 2126 NE2 . GLN A 273 ? 0.94418 0.43768 0.70483 0.07516 -0.15421 -0.07028 2127 N . ASN A 274 ? 0.90189 0.32177 0.60979 -0.01202 -0.15575 0.06922 2128 CA . ASN A 274 ? 0.87237 0.26653 0.55510 -0.02087 -0.16230 0.08929 2129 C . ASN A 274 ? 0.90599 0.33451 0.59061 -0.05296 -0.14524 0.11438 2130 O . ASN A 274 ? 0.94310 0.35321 0.60464 -0.06757 -0.14853 0.13249 2131 CB . ASN A 274 ? 0.91818 0.30519 0.59447 0.01834 -0.17362 0.08250 2132 CG . ASN A 274 ? 1.00843 0.37576 0.68873 0.05472 -0.18758 0.05445 2133 OD1 . ASN A 274 ? 1.05674 0.40579 0.73733 0.05018 -0.19035 0.04014 2134 ND2 . ASN A 274 ? 0.98426 0.36024 0.66813 0.09063 -0.19617 0.04548 2135 N . GLY A 275 ? 0.83994 0.31989 0.55115 -0.06377 -0.12670 0.11526 2136 CA . GLY A 275 ? 0.82032 0.34615 0.53833 -0.08649 -0.10729 0.13347 2137 C . GLY A 275 ? 0.88490 0.42497 0.59494 -0.06367 -0.10608 0.13506 2138 O . GLY A 275 ? 0.83793 0.36142 0.54390 -0.03001 -0.11975 0.12220 2139 N . MET A 276 ? 0.89047 0.46658 0.59897 -0.08263 -0.08927 0.14980 2140 CA . MET A 276 ? 0.74493 0.33758 0.44164 -0.06681 -0.08734 0.15202 2141 C . MET A 276 ? 0.98504 0.52957 0.63221 -0.07903 -0.10067 0.17596 2142 O . MET A 276 ? 1.01521 0.56692 0.64360 -0.06792 -0.10289 0.18090 2143 CB . MET A 276 ? 0.73955 0.40588 0.46495 -0.07516 -0.05954 0.14767 2144 CG . MET A 276 ? 0.74632 0.46047 0.51949 -0.05715 -0.04865 0.12387 2145 SD . MET A 276 ? 0.82572 0.61427 0.63362 -0.06728 -0.01815 0.11889 2146 CE . MET A 276 ? 0.70390 0.49969 0.48284 -0.06035 -0.01526 0.12175 2147 N . ASN A 277 ? 0.95453 0.46660 0.59032 -0.09992 -0.10735 0.18462 2148 CA . ASN A 277 ? 1.03392 0.50984 0.63356 -0.10910 -0.11919 0.20147 2149 C . ASN A 277 ? 1.09021 0.60334 0.67414 -0.12788 -0.10254 0.21782 2150 O . ASN A 277 ? 1.12189 0.61548 0.67455 -0.12323 -0.11280 0.22925 2151 CB . ASN A 277 ? 1.19065 0.62156 0.77345 -0.07304 -0.14515 0.19476 2152 CG . ASN A 277 ? 1.29090 0.66549 0.86889 -0.06591 -0.16482 0.18651 2153 OD1 . ASN A 277 ? 1.21877 0.59303 0.81932 -0.05349 -0.16601 0.16729 2154 ND2 . ASN A 277 ? 1.12458 0.44956 0.67014 -0.07374 -0.18082 0.20065 2155 N . GLY A 278 ? 1.01752 0.58735 0.62345 -0.14831 -0.07649 0.21780 2156 CA . GLY A 278 ? 1.00502 0.61741 0.59789 -0.16538 -0.05710 0.22861 2157 C . GLY A 278 ? 1.04825 0.68215 0.63053 -0.14321 -0.05440 0.22245 2158 O . GLY A 278 ? 0.93891 0.60352 0.50241 -0.15499 -0.04060 0.22945 2159 N . ARG A 279 ? 0.98385 0.60460 0.57620 -0.11162 -0.06756 0.20795 2160 CA . ARG A 279 ? 0.89418 0.55063 0.49182 -0.08783 -0.06393 0.19315 2161 C . ARG A 279 ? 0.88318 0.60971 0.52955 -0.08749 -0.03529 0.17150 2162 O . ARG A 279 ? 0.80390 0.54913 0.48072 -0.10075 -0.02182 0.16868 2163 CB . ARG A 279 ? 0.92864 0.56039 0.53440 -0.04970 -0.08861 0.17889 2164 CG . ARG A 279 ? 0.89183 0.45392 0.46032 -0.04165 -0.11889 0.19497 2165 CD . ARG A 279 ? 0.93529 0.48658 0.51136 0.00011 -0.14218 0.17991 2166 NE . ARG A 279 ? 0.89422 0.49008 0.46930 0.01247 -0.13966 0.17256 2167 CZ . ARG A 279 ? 0.99102 0.58477 0.56271 0.04355 -0.16207 0.16593 2168 NH1 . ARG A 279 ? 0.91208 0.46991 0.49007 0.06833 -0.18465 0.16196 2169 NH2 . ARG A 279 ? 0.91684 0.55793 0.49006 0.04887 -0.15789 0.15756 2170 N . THR A 280 ? 0.88358 0.64689 0.53627 -0.07204 -0.02801 0.15622 2171 CA . THR A 280 ? 0.76544 0.58609 0.46022 -0.06824 -0.00382 0.13480 2172 C . THR A 280 ? 0.70856 0.54186 0.43003 -0.03913 -0.01181 0.11206 2173 O . THR A 280 ? 0.79104 0.60655 0.49385 -0.02267 -0.03141 0.11101 2174 CB . THR A 280 ? 0.64401 0.50182 0.32137 -0.08221 0.01743 0.13442 2175 OG1 . THR A 280 ? 0.95305 0.79654 0.58797 -0.07585 0.00384 0.13847 2176 CG2 . THR A 280 ? 0.70580 0.56876 0.36712 -0.11442 0.03185 0.15455 2177 N . ILE A 281 ? 0.66442 0.53056 0.43032 -0.03394 0.00267 0.09513 2178 CA . ILE A 281 ? 0.56469 0.45022 0.35834 -0.01312 -0.00001 0.07403 2179 C . ILE A 281 ? 0.52386 0.44871 0.33676 -0.01655 0.02233 0.05986 2180 O . ILE A 281 ? 0.50847 0.45137 0.34596 -0.02473 0.03875 0.05931 2181 CB . ILE A 281 ? 0.47620 0.35580 0.30186 -0.00331 -0.00669 0.06788 2182 CG1 . ILE A 281 ? 0.57421 0.40936 0.37834 0.00261 -0.02894 0.07849 2183 CG2 . ILE A 281 ? 0.50117 0.40549 0.35412 0.01324 -0.00752 0.04816 2184 CD1 . ILE A 281 ? 0.48006 0.30873 0.30981 0.01294 -0.03556 0.06959 2185 N . LEU A 282 ? 0.50756 0.44474 0.30865 -0.00976 0.02155 0.04779 2186 CA . LEU A 282 ? 0.46081 0.42690 0.27312 -0.01162 0.04096 0.03126 2187 C . LEU A 282 ? 0.47816 0.45895 0.28135 -0.02681 0.06187 0.03789 2188 O . LEU A 282 ? 0.45734 0.46184 0.28849 -0.02633 0.08044 0.02727 2189 CB . LEU A 282 ? 0.41563 0.39472 0.27276 -0.00289 0.04653 0.01662 2190 CG . LEU A 282 ? 0.39791 0.37626 0.26743 0.00871 0.03156 0.00558 2191 CD1 . LEU A 282 ? 0.37423 0.36245 0.28363 0.01188 0.03837 -0.00340 2192 CD2 . LEU A 282 ? 0.44352 0.42979 0.29206 0.00989 0.02762 -0.00742 2193 N . GLY A 283 ? 0.52080 0.48881 0.28483 -0.04034 0.05846 0.05630 2194 CA . GLY A 283 ? 0.54191 0.53095 0.29545 -0.05869 0.07950 0.06417 2195 C . GLY A 283 ? 0.53613 0.53607 0.32334 -0.06787 0.08911 0.07288 2196 O . GLY A 283 ? 0.55683 0.59032 0.35164 -0.07994 0.11069 0.07338 2197 N . SER A 284 ? 0.53084 0.50788 0.33895 -0.06254 0.07370 0.07844 2198 CA . SER A 284 ? 0.48019 0.46595 0.31852 -0.07255 0.07867 0.08669 2199 C . SER A 284 ? 0.52703 0.47023 0.34291 -0.08467 0.05932 0.10709 2200 O . SER A 284 ? 0.51960 0.42564 0.31872 -0.07228 0.03837 0.10763 2201 CB . SER A 284 ? 0.44581 0.44341 0.33094 -0.05569 0.07850 0.07191 2202 OG . SER A 284 ? 0.51754 0.52268 0.42877 -0.06568 0.07916 0.08090 2203 N . ALA A 285 ? 0.58924 0.53857 0.40578 -0.10877 0.06586 0.12278 2204 CA . ALA A 285 ? 0.57040 0.47374 0.36571 -0.12426 0.04743 0.14173 2205 C . ALA A 285 ? 0.53163 0.43006 0.36187 -0.12098 0.03957 0.13692 2206 O . ALA A 285 ? 0.57798 0.43581 0.39272 -0.13379 0.02381 0.14896 2207 CB . ALA A 285 ? 0.60885 0.51808 0.37944 -0.15925 0.05703 0.16377 2208 N . LEU A 286 ? 0.49187 0.42710 0.36517 -0.10504 0.04898 0.11988 2209 CA . LEU A 286 ? 0.44915 0.38409 0.35352 -0.10017 0.04123 0.11434 2210 C . LEU A 286 ? 0.52180 0.45723 0.44222 -0.07210 0.03638 0.09622 2211 O . LEU A 286 ? 0.51797 0.46180 0.43329 -0.05837 0.04150 0.08683 2212 CB . LEU A 286 ? 0.46469 0.44989 0.40886 -0.11179 0.05660 0.11523 2213 CG . LEU A 286 ? 0.49112 0.49812 0.42980 -0.14219 0.06756 0.13133 2214 CD1 . LEU A 286 ? 0.43425 0.50700 0.42125 -0.14335 0.08561 0.12634 2215 CD2 . LEU A 286 ? 0.63701 0.60325 0.55552 -0.16641 0.05015 0.14668 2216 N . LEU A 287 ? 0.49022 0.41893 0.42891 -0.06639 0.02665 0.09116 2217 CA . LEU A 287 ? 0.44621 0.38256 0.40279 -0.04487 0.02403 0.07583 2218 C . LEU A 287 ? 0.38666 0.36477 0.37969 -0.04140 0.03896 0.07036 2219 O . LEU A 287 ? 0.35703 0.35589 0.37280 -0.05114 0.04279 0.07611 2220 CB . LEU A 287 ? 0.44502 0.35889 0.40141 -0.04085 0.00845 0.07218 2221 CG . LEU A 287 ? 0.48020 0.34666 0.40176 -0.03703 -0.00871 0.07383 2222 CD1 . LEU A 287 ? 0.50544 0.35209 0.42751 -0.03129 -0.02210 0.06566 2223 CD2 . LEU A 287 ? 0.45598 0.31772 0.36359 -0.01847 -0.01204 0.06677 2224 N A GLU A 288 ? 0.35244 0.34124 0.35089 -0.02736 0.04552 0.05916 2225 CA A GLU A 288 ? 0.32765 0.34571 0.35679 -0.02077 0.05798 0.05272 2226 C A GLU A 288 ? 0.27502 0.29318 0.32391 -0.01245 0.05059 0.04832 2227 O A GLU A 288 ? 0.26518 0.26915 0.30360 -0.00576 0.04221 0.04173 2228 CB A GLU A 288 ? 0.30136 0.32408 0.32168 -0.01242 0.06790 0.04160 2229 CG A GLU A 288 ? 0.35435 0.39835 0.40336 -0.00298 0.08007 0.03249 2230 CD A GLU A 288 ? 0.35022 0.42473 0.41661 -0.00725 0.09460 0.03634 2231 OE1 A GLU A 288 ? 0.41503 0.49729 0.46137 -0.01740 0.10272 0.03984 2232 OE2 A GLU A 288 ? 0.30159 0.39529 0.40181 -0.00073 0.09751 0.03665 2233 N B GLU A 288 ? 0.35256 0.34134 0.35110 -0.02731 0.04547 0.05913 2234 CA B GLU A 288 ? 0.32323 0.34136 0.35238 -0.02080 0.05803 0.05274 2235 C B GLU A 288 ? 0.27743 0.29584 0.32649 -0.01229 0.05081 0.04816 2236 O B GLU A 288 ? 0.27793 0.28253 0.31681 -0.00540 0.04277 0.04132 2237 CB B GLU A 288 ? 0.31337 0.33625 0.33345 -0.01264 0.06806 0.04176 2238 CG B GLU A 288 ? 0.36546 0.39377 0.36238 -0.02222 0.07764 0.04610 2239 CD B GLU A 288 ? 0.37985 0.44328 0.39941 -0.02822 0.09449 0.04875 2240 OE1 B GLU A 288 ? 0.41803 0.50059 0.47201 -0.01790 0.09970 0.04250 2241 OE2 B GLU A 288 ? 0.34647 0.42007 0.34973 -0.04329 0.10206 0.05776 2242 N . ASP A 289 ? 0.24901 0.28717 0.32656 -0.01331 0.05345 0.05267 2243 CA . ASP A 289 ? 0.30441 0.34342 0.39759 -0.00819 0.04608 0.05218 2244 C . ASP A 289 ? 0.25792 0.31013 0.37676 0.00191 0.05308 0.04962 2245 O . ASP A 289 ? 0.30975 0.36487 0.44373 0.00399 0.04666 0.05438 2246 CB . ASP A 289 ? 0.23125 0.27519 0.33077 -0.01826 0.03651 0.06168 2247 CG . ASP A 289 ? 0.30425 0.37761 0.43143 -0.02305 0.04137 0.07028 2248 OD1 . ASP A 289 ? 0.35040 0.43969 0.48498 -0.02230 0.05377 0.06948 2249 OD2 . ASP A 289 ? 0.45685 0.54207 0.59879 -0.02748 0.03271 0.07723 2250 N . GLU A 290 ? 0.24745 0.30467 0.36870 0.00875 0.06519 0.04190 2251 CA . GLU A 290 ? 0.31869 0.38109 0.46303 0.02164 0.07110 0.03674 2252 C . GLU A 290 ? 0.30543 0.34447 0.43674 0.02744 0.07190 0.02405 2253 O . GLU A 290 ? 0.28296 0.31794 0.42434 0.03828 0.07912 0.01463 2254 CB . GLU A 290 ? 0.25830 0.34761 0.41941 0.02726 0.08538 0.03362 2255 CG . GLU A 290 ? 0.37953 0.49872 0.55495 0.01651 0.08517 0.04637 2256 CD . GLU A 290 ? 0.50371 0.65218 0.72007 0.02655 0.08446 0.05167 2257 OE1 . GLU A 290 ? 0.33929 0.49871 0.57586 0.04458 0.09400 0.04206 2258 OE2 . GLU A 290 ? 0.43658 0.59703 0.66458 0.01761 0.07313 0.06447 2259 N . PHE A 291 ? 0.24175 0.26649 0.35191 0.02061 0.06404 0.02220 2260 CA . PHE A 291 ? 0.27627 0.28433 0.37646 0.02129 0.06227 0.01147 2261 C . PHE A 291 ? 0.29004 0.29388 0.39136 0.01468 0.05163 0.01756 2262 O . PHE A 291 ? 0.22843 0.23874 0.31965 0.00984 0.04541 0.02070 2263 CB . PHE A 291 ? 0.30688 0.31245 0.38101 0.01878 0.06331 0.00160 2264 CG . PHE A 291 ? 0.34819 0.35797 0.41415 0.02292 0.07516 -0.00652 2265 CD1 . PHE A 291 ? 0.41218 0.41320 0.47919 0.02902 0.08233 -0.02114 2266 CD2 . PHE A 291 ? 0.34839 0.36928 0.40221 0.01906 0.07922 -0.00023 2267 CE1 . PHE A 291 ? 0.40992 0.41870 0.46652 0.03334 0.09504 -0.03161 2268 CE2 . PHE A 291 ? 0.42093 0.45127 0.46403 0.02030 0.09207 -0.00723 2269 CZ . PHE A 291 ? 0.33355 0.36053 0.37813 0.02849 0.10081 -0.02413 2270 N . THR A 292 ? 0.27755 0.26923 0.38901 0.01431 0.04956 0.01880 2271 CA . THR A 292 ? 0.24477 0.23545 0.35325 0.00398 0.04145 0.02464 2272 C . THR A 292 ? 0.29072 0.28355 0.38415 -0.00337 0.04033 0.01295 2273 O . THR A 292 ? 0.26022 0.24794 0.34536 -0.00049 0.04414 0.00075 2274 CB . THR A 292 ? 0.26309 0.23529 0.38301 0.00268 0.03810 0.03282 2275 OG1 . THR A 292 ? 0.31175 0.26060 0.42894 0.00413 0.04147 0.02108 2276 CG2 . THR A 292 ? 0.29312 0.26796 0.43234 0.01374 0.03724 0.04378 2277 N . PRO A 293 ? 0.24016 0.24598 0.32998 -0.01312 0.03509 0.01563 2278 CA . PRO A 293 ? 0.29985 0.31611 0.38189 -0.02104 0.03350 0.00439 2279 C . PRO A 293 ? 0.26691 0.26306 0.34881 -0.02893 0.03471 -0.00204 2280 O . PRO A 293 ? 0.27341 0.27422 0.34759 -0.03161 0.03409 -0.01529 2281 CB . PRO A 293 ? 0.23703 0.27544 0.32009 -0.03120 0.03012 0.01007 2282 CG . PRO A 293 ? 0.27170 0.31335 0.35512 -0.02354 0.02877 0.01870 2283 CD . PRO A 293 ? 0.26052 0.27964 0.35201 -0.01692 0.03080 0.02656 2284 N . PHE A 294 ? 0.28538 0.25612 0.37417 -0.03229 0.03454 0.00672 2285 CA . PHE A 294 ? 0.35096 0.29145 0.43701 -0.03886 0.03430 -0.00099 2286 C . PHE A 294 ? 0.36932 0.29664 0.45116 -0.02434 0.04022 -0.01639 2287 O . PHE A 294 ? 0.39295 0.30667 0.46477 -0.03042 0.04005 -0.03135 2288 CB . PHE A 294 ? 0.39857 0.30721 0.49127 -0.04249 0.03029 0.01354 2289 CG . PHE A 294 ? 0.64195 0.50597 0.73136 -0.04346 0.02910 0.00453 2290 CD1 . PHE A 294 ? 0.57142 0.42270 0.64966 -0.06516 0.02541 -0.00344 2291 CD2 . PHE A 294 ? 0.65553 0.49137 0.75390 -0.02256 0.03124 0.00240 2292 CE1 . PHE A 294 ? 0.65676 0.45928 0.72855 -0.06725 0.02284 -0.01383 2293 CE2 . PHE A 294 ? 0.74792 0.53744 0.84179 -0.02013 0.02971 -0.00935 2294 CZ . PHE A 294 ? 0.66677 0.43521 0.74519 -0.04316 0.02497 -0.01766 2295 N . ASP A 295 ? 0.33829 0.27227 0.42635 -0.00741 0.04577 -0.01354 2296 CA . ASP A 295 ? 0.35386 0.28402 0.43590 0.00495 0.05409 -0.02779 2297 C . ASP A 295 ? 0.37171 0.31706 0.43383 -0.00033 0.05354 -0.04012 2298 O . ASP A 295 ? 0.41606 0.35135 0.46495 0.00132 0.05735 -0.05624 2299 CB . ASP A 295 ? 0.32614 0.27233 0.41910 0.01873 0.06055 -0.01998 2300 CG . ASP A 295 ? 0.36465 0.29940 0.48003 0.02895 0.06071 -0.01093 2301 OD1 . ASP A 295 ? 0.42179 0.32613 0.54066 0.03013 0.05761 -0.01430 2302 OD2 . ASP A 295 ? 0.34015 0.29511 0.46947 0.03554 0.06232 -0.00010 2303 N . VAL A 296 ? 0.31300 0.28259 0.37163 -0.00497 0.04779 -0.03361 2304 CA . VAL A 296 ? 0.29699 0.28226 0.33835 -0.00694 0.04367 -0.04315 2305 C . VAL A 296 ? 0.35645 0.33980 0.39323 -0.02056 0.03807 -0.05536 2306 O . VAL A 296 ? 0.34647 0.33003 0.36704 -0.02196 0.03656 -0.06906 2307 CB . VAL A 296 ? 0.27660 0.28492 0.31797 -0.00425 0.03723 -0.03432 2308 CG1 . VAL A 296 ? 0.28533 0.30900 0.31060 -0.00265 0.02963 -0.04291 2309 CG2 . VAL A 296 ? 0.26304 0.26876 0.30589 0.00482 0.04139 -0.02298 2310 N . VAL A 297 ? 0.32982 0.31240 0.37869 -0.03364 0.03440 -0.05004 2311 CA . VAL A 297 ? 0.39331 0.37539 0.43892 -0.05219 0.02875 -0.06040 2312 C . VAL A 297 ? 0.46401 0.40642 0.49983 -0.05414 0.03157 -0.07339 2313 O . VAL A 297 ? 0.48028 0.42096 0.50354 -0.06469 0.02714 -0.08923 2314 CB . VAL A 297 ? 0.38096 0.37190 0.43946 -0.06996 0.02558 -0.04914 2315 CG1 . VAL A 297 ? 0.36128 0.35206 0.41691 -0.09464 0.01983 -0.05876 2316 CG2 . VAL A 297 ? 0.31022 0.34436 0.37653 -0.06587 0.02390 -0.04200 2317 N . ARG A 298 ? 0.49997 0.41125 0.54166 -0.04261 0.03808 -0.06866 2318 CA . ARG A 298 ? 0.50186 0.37250 0.53540 -0.03881 0.04147 -0.08402 2319 C . ARG A 298 ? 0.54104 0.41988 0.55491 -0.03015 0.04658 -0.10320 2320 O . ARG A 298 ? 0.56721 0.42501 0.56477 -0.03721 0.04491 -0.12297 2321 CB . ARG A 298 ? 0.50935 0.35466 0.55792 -0.02133 0.04716 -0.07507 2322 CG . ARG A 298 ? 0.68448 0.47685 0.73080 -0.01811 0.04653 -0.08696 2323 CD . ARG A 298 ? 0.77040 0.55428 0.81806 0.00868 0.05837 -0.10204 2324 NE . ARG A 298 ? 0.71048 0.51655 0.78042 0.02789 0.06454 -0.08648 2325 CZ . ARG A 298 ? 0.76438 0.57165 0.84515 0.05195 0.07524 -0.09528 2326 NH1 . ARG A 298 ? 0.55017 0.33414 0.62000 0.06298 0.08228 -0.12122 2327 NH2 . ARG A 298 ? 0.57353 0.40941 0.67711 0.06486 0.07915 -0.07932 2328 N . GLN A 299 ? 0.47303 0.38046 0.48462 -0.01716 0.05203 -0.09731 2329 CA . GLN A 299 ? 0.49436 0.41076 0.48290 -0.01038 0.05750 -0.11147 2330 C . GLN A 299 ? 0.55736 0.49668 0.52731 -0.02195 0.04659 -0.11716 2331 O . GLN A 299 ? 0.59039 0.53072 0.53498 -0.02209 0.04740 -0.13241 2332 CB . GLN A 299 ? 0.42014 0.35518 0.41138 0.00449 0.06722 -0.10003 2333 CG . GLN A 299 ? 0.42388 0.36638 0.38956 0.01048 0.07659 -0.11278 2334 CD . GLN A 299 ? 0.48279 0.44236 0.45442 0.02137 0.08883 -0.10128 2335 OE1 . GLN A 299 ? 0.51982 0.49372 0.46852 0.02227 0.09616 -0.10449 2336 NE2 . GLN A 299 ? 0.44639 0.40656 0.44746 0.02717 0.09053 -0.08688 2337 N . CYS A 300 ? 0.42541 0.38657 0.40722 -0.03074 0.03607 -0.10628 2338 CA . CYS A 300 ? 0.57857 0.56886 0.54902 -0.03797 0.02377 -0.11117 2339 C . CYS A 300 ? 0.64945 0.64283 0.62479 -0.05943 0.01423 -0.12173 2340 O . CYS A 300 ? 0.64954 0.67749 0.62544 -0.06667 0.00240 -0.12416 2341 CB . CYS A 300 ? 0.36678 0.38670 0.34753 -0.02950 0.01824 -0.09489 2342 SG . CYS A 300 ? 0.50875 0.52278 0.47799 -0.01078 0.02635 -0.08204 2343 N . SER A 301 ? 0.71907 0.67687 0.69850 -0.07005 0.01802 -0.12777 2344 CA . SER A 301 ? 0.59471 0.54635 0.57337 -0.09563 0.00886 -0.13905 2345 C . SER A 301 ? 0.72854 0.62723 0.69104 -0.10134 0.01177 -0.15736 2346 O . SER A 301 ? 0.82326 0.71036 0.77929 -0.12538 0.00272 -0.16969 2347 CB . SER A 301 ? 0.74791 0.70854 0.75061 -0.11186 0.00623 -0.12340 2348 OG . SER A 301 ? 0.80306 0.72098 0.81288 -0.10783 0.01350 -0.11317 2349 N . GLY A 302 ? 0.75403 0.62141 0.71074 -0.08051 0.02367 -0.16102 2350 CA . GLY A 302 ? 0.75180 0.56874 0.69224 -0.08007 0.02702 -0.18304 2351 C . GLY A 302 ? 0.68701 0.45257 0.63952 -0.08846 0.02455 -0.17903 2352 O . GLY A 302 ? 0.74740 0.46989 0.68503 -0.10300 0.01857 -0.19748 2353 N . VAL A 303 ? 0.72529 0.49033 0.70146 -0.08059 0.02736 -0.15493 2354 CA . VAL A 303 ? 0.92594 0.63971 0.91112 -0.08830 0.02266 -0.14594 2355 C . VAL A 303 ? 0.89249 0.55327 0.87298 -0.06370 0.02921 -0.16171 2356 O . VAL A 303 ? 0.84273 0.51750 0.83358 -0.03468 0.04058 -0.15992 2357 CB . VAL A 303 ? 0.92737 0.66085 0.93578 -0.08704 0.02249 -0.11485 2358 CG1 . VAL A 303 ? 0.86852 0.54661 0.88124 -0.09766 0.01502 -0.10182 2359 CG2 . VAL A 303 ? 0.75197 0.54365 0.76593 -0.10630 0.01821 -0.10380 2360 N . THR A 304 ? 0.85476 0.45520 0.82048 -0.07533 0.02180 -0.17827 2361 CA . THR A 304 ? 0.88078 0.42401 0.84121 -0.05007 0.02643 -0.19804 2362 C . THR A 304 ? 0.88493 0.37036 0.85947 -0.04677 0.01775 -0.17943 2363 O . THR A 304 ? 0.99158 0.48294 0.97630 -0.06730 0.00916 -0.15060 2364 CB . THR A 304 ? 0.86107 0.36664 0.79025 -0.06185 0.02269 -0.23356 2365 OG1 . THR A 304 ? 1.00600 0.47709 0.92537 -0.10082 0.00604 -0.22954 2366 CG2 . THR A 304 ? 0.83131 0.39474 0.74306 -0.06400 0.02941 -0.24974 2367 N . PHE A 305 ? 0.90044 0.32964 0.87421 -0.01942 0.01962 -0.19645 2368 CA . PHE A 305 ? 1.04560 0.41476 1.03259 -0.00889 0.00931 -0.17849 2369 C . PHE A 305 ? 1.03124 0.32127 0.98918 0.00110 0.00111 -0.19885 2370 O . PHE A 305 ? 1.17771 0.46169 1.13134 0.03751 0.01134 -0.21936 2371 CB . PHE A 305 ? 0.88675 0.29032 0.90533 0.02903 0.01835 -0.16281 2372 CG . PHE A 305 ? 0.83389 0.32294 0.86617 0.02342 0.02712 -0.14323 2373 CD1 . PHE A 305 ? 0.85628 0.36660 0.89516 -0.00102 0.01854 -0.11079 2374 CD2 . PHE A 305 ? 0.75436 0.30021 0.78953 0.04108 0.04382 -0.15803 2375 CE1 . PHE A 305 ? 0.80524 0.38781 0.85462 -0.00425 0.02568 -0.09621 2376 CE2 . PHE A 305 ? 0.78142 0.39573 0.82597 0.03522 0.04963 -0.14000 2377 CZ . PHE A 305 ? 0.84191 0.47251 0.89402 0.01405 0.04013 -0.11054 2410 N . SER B 1 ? 0.61031 0.70388 0.67323 -0.10461 -0.19419 -0.05736 2411 CA . SER B 1 ? 0.69672 0.75255 0.72068 -0.11409 -0.19471 -0.06044 2412 C . SER B 1 ? 0.65250 0.67961 0.64964 -0.10611 -0.17589 -0.05931 2413 O . SER B 1 ? 0.44421 0.46650 0.43174 -0.09266 -0.17117 -0.05575 2414 CB . SER B 1 ? 0.52178 0.56277 0.52034 -0.11476 -0.21515 -0.06233 2415 OG . SER B 1 ? 0.46442 0.50290 0.45364 -0.09981 -0.21946 -0.05753 2416 N . GLY B 2 ? 0.65015 0.65836 0.63656 -0.11477 -0.16639 -0.06235 2417 CA . GLY B 2 ? 0.51646 0.49984 0.48177 -0.10732 -0.14974 -0.06281 2418 C . GLY B 2 ? 0.53190 0.53151 0.52058 -0.10145 -0.13383 -0.05729 2419 O . GLY B 2 ? 0.50496 0.53594 0.52378 -0.09936 -0.13392 -0.05343 2420 N . PHE B 3 ? 0.57492 0.55305 0.54928 -0.09812 -0.12039 -0.05807 2421 CA . PHE B 3 ? 0.38101 0.36979 0.37213 -0.09310 -0.10563 -0.05286 2422 C . PHE B 3 ? 0.42152 0.38718 0.39111 -0.08204 -0.09376 -0.05422 2423 O . PHE B 3 ? 0.38957 0.32861 0.33907 -0.08388 -0.09295 -0.05994 2424 CB . PHE B 3 ? 0.37169 0.36386 0.37722 -0.10729 -0.10357 -0.05104 2425 CG . PHE B 3 ? 0.34558 0.35966 0.37346 -0.10552 -0.09130 -0.04490 2426 CD1 . PHE B 3 ? 0.36302 0.41509 0.42001 -0.10545 -0.09174 -0.04289 2427 CD2 . PHE B 3 ? 0.38402 0.38125 0.40387 -0.10335 -0.08005 -0.04219 2428 CE1 . PHE B 3 ? 0.30598 0.37901 0.38157 -0.10401 -0.07961 -0.03905 2429 CE2 . PHE B 3 ? 0.35071 0.36726 0.38776 -0.10286 -0.06928 -0.03664 2430 CZ . PHE B 3 ? 0.32304 0.37761 0.38693 -0.10358 -0.06826 -0.03545 2431 N . ARG B 4 ? 0.44310 0.41963 0.41829 -0.07044 -0.08513 -0.04995 2432 CA . ARG B 4 ? 0.39639 0.35737 0.35449 -0.06024 -0.07389 -0.05097 2433 C . ARG B 4 ? 0.39774 0.37041 0.37290 -0.05450 -0.06191 -0.04535 2434 O . ARG B 4 ? 0.38736 0.38281 0.38518 -0.05540 -0.06196 -0.04086 2435 CB . ARG B 4 ? 0.39714 0.35598 0.33789 -0.05332 -0.07640 -0.05094 2436 CG . ARG B 4 ? 0.47851 0.42689 0.39920 -0.05932 -0.08941 -0.05579 2437 CD . ARG B 4 ? 0.58397 0.50768 0.47734 -0.06007 -0.08486 -0.06506 2438 NE . ARG B 4 ? 0.58126 0.50082 0.46339 -0.05101 -0.07099 -0.06567 2439 CZ . ARG B 4 ? 0.69294 0.59775 0.54942 -0.04900 -0.06521 -0.07441 2440 NH1 . ARG B 4 ? 0.71471 0.60405 0.55100 -0.05443 -0.07220 -0.08402 2441 NH2 . ARG B 4 ? 0.76207 0.66935 0.61333 -0.04182 -0.05188 -0.07454 2442 N . LYS B 5 ? 0.38303 0.34147 0.34761 -0.04818 -0.05182 -0.04679 2443 CA . LYS B 5 ? 0.42995 0.39722 0.40655 -0.04195 -0.04111 -0.04172 2444 C . LYS B 5 ? 0.44514 0.42353 0.42193 -0.03381 -0.03913 -0.03853 2445 O . LYS B 5 ? 0.49546 0.46444 0.45522 -0.02869 -0.03561 -0.04032 2446 CB . LYS B 5 ? 0.36938 0.31856 0.33621 -0.03743 -0.03343 -0.04483 2447 CG . LYS B 5 ? 0.48758 0.44398 0.46697 -0.03355 -0.02474 -0.03923 2448 CD . LYS B 5 ? 0.44067 0.37770 0.41454 -0.03165 -0.02228 -0.04180 2449 CE . LYS B 5 ? 0.41372 0.33610 0.38606 -0.04239 -0.03064 -0.04231 2450 NZ . LYS B 5 ? 0.53108 0.42991 0.49761 -0.03964 -0.03129 -0.04416 2451 N . MET B 6 ? 0.35957 0.35806 0.35552 -0.03311 -0.04163 -0.03434 2452 CA . MET B 6 ? 0.35526 0.36123 0.35200 -0.02604 -0.04525 -0.03156 2453 C . MET B 6 ? 0.32505 0.33928 0.33268 -0.01898 -0.03618 -0.02802 2454 O . MET B 6 ? 0.35487 0.38214 0.38005 -0.02044 -0.03106 -0.02739 2455 CB . MET B 6 ? 0.35643 0.37902 0.36881 -0.02805 -0.05784 -0.03173 2456 CG . MET B 6 ? 0.43232 0.45814 0.44475 -0.01985 -0.06615 -0.02900 2457 SD . MET B 6 ? 0.56450 0.61097 0.59821 -0.02116 -0.08370 -0.03113 2458 CE . MET B 6 ? 0.33874 0.37199 0.35456 -0.03408 -0.09002 -0.03462 2459 N . ALA B 7 ? 0.28175 0.28806 0.27717 -0.01297 -0.03448 -0.02563 2460 CA . ALA B 7 ? 0.27015 0.28155 0.27350 -0.00663 -0.02776 -0.02256 2461 C . ALA B 7 ? 0.28299 0.30250 0.29637 -0.00057 -0.03687 -0.02077 2462 O . ALA B 7 ? 0.33003 0.34757 0.33941 -0.00057 -0.04911 -0.02055 2463 CB . ALA B 7 ? 0.36487 0.36260 0.34973 -0.00506 -0.02027 -0.02106 2464 N . PHE B 8 ? 0.33303 0.36046 0.35917 0.00527 -0.03208 -0.02012 2465 CA . PHE B 8 ? 0.33618 0.36798 0.37192 0.01360 -0.04115 -0.01992 2466 C . PHE B 8 ? 0.30894 0.31853 0.32147 0.01513 -0.04785 -0.01453 2467 O . PHE B 8 ? 0.26153 0.25795 0.25435 0.01025 -0.04041 -0.01162 2468 CB . PHE B 8 ? 0.28365 0.32708 0.33587 0.01946 -0.03362 -0.02219 2469 CG . PHE B 8 ? 0.24958 0.31767 0.32411 0.01681 -0.02770 -0.02723 2470 CD1 . PHE B 8 ? 0.31669 0.40686 0.41416 0.02069 -0.03475 -0.03274 2471 CD2 . PHE B 8 ? 0.26237 0.33246 0.33500 0.00980 -0.01562 -0.02642 2472 CE1 . PHE B 8 ? 0.33972 0.45633 0.45735 0.01554 -0.02763 -0.03750 2473 CE2 . PHE B 8 ? 0.26690 0.35821 0.35601 0.00425 -0.01014 -0.02956 2474 CZ . PHE B 8 ? 0.25635 0.37238 0.36777 0.00609 -0.01502 -0.03518 2475 N . PRO B 9 ? 0.34504 0.35046 0.35937 0.02131 -0.06251 -0.01316 2476 CA . PRO B 9 ? 0.28172 0.26300 0.27258 0.02162 -0.06957 -0.00627 2477 C . PRO B 9 ? 0.33824 0.31393 0.32734 0.02308 -0.05919 -0.00465 2478 O . PRO B 9 ? 0.29224 0.28029 0.30209 0.02999 -0.05501 -0.00920 2479 CB . PRO B 9 ? 0.34892 0.32832 0.34967 0.03098 -0.08910 -0.00631 2480 CG . PRO B 9 ? 0.35198 0.35548 0.37606 0.03228 -0.09298 -0.01295 2481 CD . PRO B 9 ? 0.32954 0.35206 0.36751 0.02777 -0.07465 -0.01781 2482 N . SER B 10 ? 0.34164 0.30053 0.30557 0.01547 -0.05456 0.00118 2483 CA . SER B 10 ? 0.34898 0.30499 0.31093 0.01408 -0.04343 0.00257 2484 C . SER B 10 ? 0.34458 0.28071 0.29579 0.01565 -0.05252 0.00832 2485 O . SER B 10 ? 0.31871 0.25051 0.26617 0.01277 -0.04485 0.01011 2486 CB . SER B 10 ? 0.31466 0.26981 0.26003 0.00415 -0.03069 0.00375 2487 OG . SER B 10 ? 0.33073 0.27067 0.24877 -0.00404 -0.03592 0.00920 2488 N . GLY B 11 ? 0.40028 0.32284 0.34676 0.02013 -0.07029 0.01128 2489 CA . GLY B 11 ? 0.37355 0.26939 0.30323 0.01953 -0.08183 0.01857 2490 C . GLY B 11 ? 0.38437 0.27887 0.32901 0.02758 -0.08009 0.01483 2491 O . GLY B 11 ? 0.44371 0.31823 0.37237 0.02201 -0.08142 0.02072 2492 N . LYS B 12 ? 0.32051 0.23653 0.29469 0.03940 -0.07697 0.00465 2493 CA . LYS B 12 ? 0.33106 0.24690 0.31826 0.04746 -0.07483 -0.00093 2494 C . LYS B 12 ? 0.37044 0.29024 0.35202 0.03853 -0.05795 0.00033 2495 O . LYS B 12 ? 0.44342 0.35086 0.42185 0.03945 -0.05859 0.00024 2496 CB . LYS B 12 ? 0.34790 0.29018 0.36704 0.06076 -0.07369 -0.01329 2497 CG . LYS B 12 ? 0.34805 0.28676 0.37951 0.07417 -0.09309 -0.01742 2498 CD . LYS B 12 ? 0.52163 0.48477 0.58495 0.08872 -0.09057 -0.03204 2499 CE . LYS B 12 ? 0.51375 0.50905 0.60293 0.09360 -0.09164 -0.03951 2500 NZ . LYS B 12 ? 0.50883 0.49996 0.61216 0.10897 -0.11340 -0.04441 2501 N . VAL B 13 ? 0.37574 0.31146 0.35634 0.03036 -0.04435 0.00098 2502 CA . VAL B 13 ? 0.35185 0.29297 0.32972 0.02326 -0.03015 0.00170 2503 C . VAL B 13 ? 0.32914 0.25334 0.28307 0.01116 -0.02968 0.01037 2504 O . VAL B 13 ? 0.38522 0.30763 0.33644 0.00614 -0.02342 0.01168 2505 CB . VAL B 13 ? 0.35667 0.31970 0.34436 0.02087 -0.01764 -0.00186 2506 CG1 . VAL B 13 ? 0.33100 0.29980 0.31872 0.01586 -0.00552 -0.00171 2507 CG2 . VAL B 13 ? 0.37169 0.35246 0.38091 0.02909 -0.01790 -0.00922 2508 N . GLU B 14 ? 0.32796 0.24131 0.26365 0.00487 -0.03595 0.01623 2509 CA . GLU B 14 ? 0.40356 0.30424 0.31441 -0.00947 -0.03371 0.02439 2510 C . GLU B 14 ? 0.41410 0.29304 0.31550 -0.01290 -0.04121 0.02978 2511 O . GLU B 14 ? 0.48028 0.35699 0.37008 -0.02535 -0.03428 0.03431 2512 CB . GLU B 14 ? 0.33972 0.22929 0.22855 -0.01603 -0.04159 0.03001 2513 CG . GLU B 14 ? 0.40016 0.30790 0.29348 -0.01521 -0.03456 0.02455 2514 CD . GLU B 14 ? 0.38204 0.27696 0.25274 -0.02059 -0.04531 0.02933 2515 OE1 . GLU B 14 ? 0.48341 0.35922 0.32657 -0.03188 -0.05075 0.03823 2516 OE2 . GLU B 14 ? 0.41945 0.32269 0.29831 -0.01494 -0.04905 0.02468 2517 N . GLY B 15 ? 0.36057 0.22384 0.26780 -0.00200 -0.05582 0.02846 2518 CA . GLY B 15 ? 0.49170 0.32949 0.38942 -0.00398 -0.06533 0.03247 2519 C . GLY B 15 ? 0.53157 0.37849 0.44329 -0.00200 -0.05607 0.02656 2520 O . GLY B 15 ? 0.52678 0.35157 0.43113 -0.00354 -0.06427 0.02854 2521 N . CYS B 16 ? 0.39861 0.27484 0.32839 0.00081 -0.04076 0.01966 2522 CA . CYS B 16 ? 0.41607 0.30228 0.35806 0.00250 -0.03256 0.01414 2523 C . CYS B 16 ? 0.43322 0.33512 0.37338 -0.00957 -0.01868 0.01677 2524 O . CYS B 16 ? 0.37317 0.28368 0.32230 -0.00955 -0.01278 0.01317 2525 CB . CYS B 16 ? 0.38053 0.28727 0.34555 0.01625 -0.02799 0.00359 2526 SG . CYS B 16 ? 0.46657 0.36552 0.44263 0.03309 -0.04233 -0.00371 2527 N . MET B 17 ? 0.33461 0.24171 0.26395 -0.01928 -0.01371 0.02184 2528 CA . MET B 17 ? 0.29981 0.22656 0.23175 -0.02831 -0.00022 0.02173 2529 C . MET B 17 ? 0.34655 0.26381 0.26448 -0.04359 -0.00058 0.02845 2530 O . MET B 17 ? 0.35394 0.25083 0.25076 -0.05309 -0.00831 0.03629 2531 CB . MET B 17 ? 0.30145 0.24133 0.22971 -0.03069 0.00668 0.02109 2532 CG . MET B 17 ? 0.33842 0.28713 0.27995 -0.01818 0.00649 0.01499 2533 SD . MET B 17 ? 0.39958 0.36396 0.36517 -0.00818 0.01206 0.00777 2534 CE . MET B 17 ? 0.30175 0.28400 0.27198 -0.01507 0.02418 0.00657 2535 N . VAL B 18 ? 0.33388 0.26538 0.26285 -0.04709 0.00670 0.02595 2536 CA . VAL B 18 ? 0.37851 0.30725 0.29847 -0.06332 0.00780 0.03139 2537 C . VAL B 18 ? 0.35024 0.31149 0.28440 -0.06818 0.02178 0.02739 2538 O . VAL B 18 ? 0.35656 0.33684 0.30701 -0.05733 0.02830 0.02052 2539 CB . VAL B 18 ? 0.36323 0.27402 0.28373 -0.06294 -0.00120 0.03153 2540 CG1 . VAL B 18 ? 0.37162 0.24921 0.27942 -0.05640 -0.01646 0.03381 2541 CG2 . VAL B 18 ? 0.32479 0.25237 0.26663 -0.05108 0.00320 0.02288 2542 N . GLN B 19 ? 0.34272 0.30990 0.27111 -0.08500 0.02534 0.03160 2543 CA . GLN B 19 ? 0.35573 0.35677 0.30048 -0.09029 0.03769 0.02687 2544 C . GLN B 19 ? 0.35473 0.36001 0.31218 -0.09294 0.03478 0.02594 2545 O . GLN B 19 ? 0.37286 0.35830 0.31787 -0.10432 0.02702 0.03208 2546 CB . GLN B 19 ? 0.46835 0.48060 0.39937 -0.10941 0.04572 0.03098 2547 CG . GLN B 19 ? 0.45940 0.51208 0.41062 -0.11421 0.05939 0.02382 2548 CD . GLN B 19 ? 0.48349 0.54930 0.42050 -0.13740 0.06793 0.02806 2549 OE1 . GLN B 19 ? 0.58657 0.67490 0.52281 -0.13981 0.07977 0.02269 2550 NE2 . GLN B 19 ? 0.59321 0.64480 0.51754 -0.15574 0.06211 0.03728 2551 N . VAL B 20 ? 0.29199 0.32015 0.27246 -0.08279 0.03924 0.01852 2552 CA . VAL B 20 ? 0.29454 0.32850 0.28745 -0.08441 0.03549 0.01703 2553 C . VAL B 20 ? 0.34427 0.41502 0.35709 -0.09045 0.04440 0.01277 2554 O . VAL B 20 ? 0.30124 0.39355 0.32941 -0.07989 0.05104 0.00608 2555 CB . VAL B 20 ? 0.37886 0.40613 0.38037 -0.06747 0.03021 0.01244 2556 CG1 . VAL B 20 ? 0.34075 0.37293 0.35155 -0.07058 0.02536 0.01105 2557 CG2 . VAL B 20 ? 0.39822 0.39517 0.38411 -0.06046 0.02266 0.01423 2558 N . THR B 21 ? 0.38627 0.46432 0.39988 -0.10730 0.04377 0.01594 2559 CA . THR B 21 ? 0.35672 0.47415 0.39285 -0.11437 0.05161 0.01108 2560 C . THR B 21 ? 0.39556 0.51713 0.44489 -0.11653 0.04337 0.01039 2561 O . THR B 21 ? 0.38906 0.48628 0.42371 -0.12699 0.03466 0.01626 2562 CB . THR B 21 ? 0.40178 0.53238 0.42851 -0.13692 0.06004 0.01515 2563 OG1 . THR B 21 ? 0.37552 0.49711 0.38396 -0.13624 0.06596 0.01673 2564 CG2 . THR B 21 ? 0.41181 0.59141 0.46702 -0.14194 0.07045 0.00707 2565 N . CYS B 22 ? 0.37233 0.52252 0.44836 -0.10621 0.04455 0.00291 2566 CA . CYS B 22 ? 0.32094 0.48115 0.41208 -0.10875 0.03630 0.00159 2567 C . CYS B 22 ? 0.35095 0.55847 0.47310 -0.11140 0.04301 -0.00550 2568 O . CYS B 22 ? 0.34759 0.57453 0.48881 -0.09495 0.04594 -0.01311 2569 CB . CYS B 22 ? 0.37497 0.51911 0.46710 -0.09078 0.02686 -0.00039 2570 SG . CYS B 22 ? 0.45174 0.60331 0.55649 -0.09449 0.01441 -0.00140 2571 N . GLY B 23 ? 0.36078 0.58699 0.48883 -0.13209 0.04483 -0.00363 2572 CA . GLY B 23 ? 0.38417 0.66139 0.54428 -0.13642 0.05284 -0.01168 2573 C . GLY B 23 ? 0.40369 0.70280 0.56723 -0.13359 0.06863 -0.01765 2574 O . GLY B 23 ? 0.40189 0.69448 0.54411 -0.15004 0.07727 -0.01246 2575 N . THR B 24 ? 0.45234 0.77457 0.64020 -0.11279 0.07136 -0.02864 2576 CA . THR B 24 ? 0.47201 0.81296 0.66333 -0.10625 0.08513 -0.03698 2577 C . THR B 24 ? 0.43297 0.74617 0.60816 -0.08931 0.08527 -0.03756 2578 O . THR B 24 ? 0.49189 0.81478 0.66346 -0.08595 0.09651 -0.04387 2579 CB . THR B 24 ? 0.48674 0.86492 0.71318 -0.09191 0.08613 -0.04977 2580 OG1 . THR B 24 ? 0.45806 0.84561 0.68292 -0.08277 0.09746 -0.05855 2581 CG2 . THR B 24 ? 0.51691 0.89730 0.76704 -0.07142 0.07312 -0.05460 2582 N . THR B 25 ? 0.45089 0.72684 0.61337 -0.07855 0.07244 -0.03107 2583 CA . THR B 25 ? 0.32704 0.57485 0.47471 -0.06242 0.07066 -0.03089 2584 C . THR B 25 ? 0.35744 0.57020 0.47051 -0.07243 0.07118 -0.02079 2585 O . THR B 25 ? 0.30726 0.50025 0.40598 -0.08409 0.06473 -0.01208 2586 CB . THR B 25 ? 0.36636 0.59668 0.52003 -0.04612 0.05705 -0.02996 2587 OG1 . THR B 25 ? 0.32717 0.58776 0.51270 -0.03710 0.05322 -0.03826 2588 CG2 . THR B 25 ? 0.27419 0.48030 0.41563 -0.03100 0.05596 -0.03051 2589 N . THR B 26 ? 0.32952 0.53347 0.42949 -0.06714 0.07735 -0.02263 2590 CA . THR B 26 ? 0.32095 0.49243 0.38976 -0.07410 0.07615 -0.01384 2591 C . THR B 26 ? 0.32230 0.47389 0.38453 -0.05712 0.07309 -0.01570 2592 O . THR B 26 ? 0.30535 0.47056 0.37614 -0.04750 0.07899 -0.02421 2593 CB . THR B 26 ? 0.30435 0.48663 0.35856 -0.09117 0.08714 -0.01269 2594 OG1 . THR B 26 ? 0.53503 0.73076 0.59092 -0.11114 0.08874 -0.00830 2595 CG2 . THR B 26 ? 0.32018 0.46709 0.34221 -0.09512 0.08344 -0.00405 2596 N . LEU B 27 ? 0.27900 0.39945 0.32683 -0.05369 0.06386 -0.00881 2597 CA . LEU B 27 ? 0.27352 0.37579 0.31424 -0.04075 0.06086 -0.00956 2598 C . LEU B 27 ? 0.33723 0.41007 0.35534 -0.04526 0.05487 -0.00160 2599 O . LEU B 27 ? 0.29287 0.35673 0.29876 -0.05808 0.05283 0.00444 2600 CB . LEU B 27 ? 0.32188 0.42330 0.37728 -0.02679 0.05476 -0.01251 2601 CG . LEU B 27 ? 0.32855 0.42662 0.38969 -0.02772 0.04707 -0.00949 2602 CD1 . LEU B 27 ? 0.26428 0.33593 0.30769 -0.03073 0.04098 -0.00341 2603 CD2 . LEU B 27 ? 0.21715 0.31923 0.29223 -0.01513 0.04209 -0.01295 2604 N . ASN B 28 ? 0.27025 0.32779 0.28356 -0.03477 0.05099 -0.00186 2605 CA . ASN B 28 ? 0.36688 0.39973 0.36296 -0.03554 0.04454 0.00346 2606 C . ASN B 28 ? 0.31707 0.33630 0.31506 -0.03045 0.03673 0.00475 2607 O . ASN B 28 ? 0.29987 0.32681 0.31010 -0.02459 0.03636 0.00177 2608 CB . ASN B 28 ? 0.28260 0.31051 0.27412 -0.02787 0.04488 0.00125 2609 CG . ASN B 28 ? 0.29668 0.33834 0.28542 -0.03137 0.05310 -0.00256 2610 OD1 . ASN B 28 ? 0.27870 0.31792 0.25179 -0.04227 0.05529 0.00082 2611 ND2 . ASN B 28 ? 0.28324 0.33802 0.28537 -0.02251 0.05721 -0.00995 2612 N . GLY B 29 ? 0.28134 0.27919 0.26584 -0.03246 0.02970 0.00871 2613 CA . GLY B 29 ? 0.28502 0.26984 0.27023 -0.02653 0.02277 0.00752 2614 C . GLY B 29 ? 0.28663 0.25408 0.26402 -0.01985 0.01615 0.00761 2615 O . GLY B 29 ? 0.34537 0.30372 0.31175 -0.02320 0.01356 0.01139 2616 N . LEU B 30 ? 0.30851 0.27293 0.29179 -0.01048 0.01311 0.00287 2617 CA . LEU B 30 ? 0.35575 0.30953 0.33782 -0.00163 0.00686 0.00022 2618 C . LEU B 30 ? 0.33488 0.26882 0.31088 0.00014 -0.00212 -0.00159 2619 O . LEU B 30 ? 0.35267 0.28837 0.33262 0.00263 -0.00141 -0.00662 2620 CB . LEU B 30 ? 0.31438 0.28315 0.30886 0.00724 0.01126 -0.00563 2621 CG . LEU B 30 ? 0.34140 0.30825 0.34048 0.01662 0.00648 -0.01014 2622 CD1 . LEU B 30 ? 0.31648 0.28006 0.31143 0.01585 0.00316 -0.00625 2623 CD2 . LEU B 30 ? 0.26878 0.25334 0.27964 0.02166 0.01244 -0.01606 2624 N . TRP B 31 ? 0.38617 0.29902 0.35083 -0.00104 -0.01175 0.00224 2625 CA . TRP B 31 ? 0.37426 0.26121 0.33015 -0.00010 -0.02316 0.00133 2626 C . TRP B 31 ? 0.43255 0.31243 0.39547 0.01584 -0.03132 -0.00662 2627 O . TRP B 31 ? 0.40843 0.27940 0.36839 0.01979 -0.03912 -0.00401 2628 CB . TRP B 31 ? 0.36465 0.22920 0.30114 -0.01333 -0.03063 0.01185 2629 CG . TRP B 31 ? 0.43626 0.26889 0.36043 -0.01556 -0.04392 0.01272 2630 CD1 . TRP B 31 ? 0.42833 0.25360 0.35674 -0.00982 -0.04712 0.00461 2631 CD2 . TRP B 31 ? 0.44460 0.24493 0.34735 -0.02502 -0.05709 0.02230 2632 NE1 . TRP B 31 ? 0.39690 0.18607 0.30919 -0.01413 -0.06196 0.00768 2633 CE2 . TRP B 31 ? 0.41271 0.18496 0.30870 -0.02393 -0.06885 0.01941 2634 CE3 . TRP B 31 ? 0.47185 0.26235 0.35781 -0.03527 -0.06078 0.03324 2635 CZ2 . TRP B 31 ? 0.50571 0.23807 0.37923 -0.03282 -0.08529 0.02798 2636 CZ3 . TRP B 31 ? 0.48157 0.23397 0.34366 -0.04523 -0.07645 0.04261 2637 CH2 . TRP B 31 ? 0.50129 0.22388 0.35759 -0.04398 -0.08909 0.04038 2638 N . LEU B 32 ? 0.38194 0.26741 0.35440 0.02494 -0.02976 -0.01711 2639 CA . LEU B 32 ? 0.38559 0.26999 0.36852 0.04111 -0.03583 -0.02811 2640 C . LEU B 32 ? 0.43164 0.29602 0.40980 0.04594 -0.04330 -0.03616 2641 O . LEU B 32 ? 0.40340 0.27294 0.37920 0.04080 -0.03684 -0.03899 2642 CB . LEU B 32 ? 0.39010 0.30729 0.39037 0.04759 -0.02383 -0.03604 2643 CG . LEU B 32 ? 0.36559 0.30175 0.37085 0.04288 -0.01661 -0.02956 2644 CD1 . LEU B 32 ? 0.26899 0.23337 0.28640 0.04395 -0.00431 -0.03514 2645 CD2 . LEU B 32 ? 0.30677 0.23809 0.31569 0.04963 -0.02601 -0.02877 2646 N . ASP B 33 ? 0.44558 0.28573 0.42190 0.05636 -0.05829 -0.04039 2647 CA . ASP B 33 ? 0.52864 0.34126 0.49756 0.06154 -0.06901 -0.04826 2648 C . ASP B 33 ? 0.50384 0.29773 0.45340 0.04250 -0.07000 -0.03708 2649 O . ASP B 33 ? 0.43099 0.21545 0.36882 0.02923 -0.07254 -0.02274 2650 CB . ASP B 33 ? 0.58835 0.42107 0.57122 0.07413 -0.06111 -0.06621 2651 CG . ASP B 33 ? 0.68776 0.54221 0.69207 0.09166 -0.06030 -0.07781 2652 OD1 . ASP B 33 ? 0.67665 0.51578 0.68428 0.10066 -0.07426 -0.07678 2653 OD2 . ASP B 33 ? 0.63620 0.52360 0.65375 0.09546 -0.04634 -0.08767 2654 N . ASP B 34 ? 0.39334 0.18413 0.33900 0.03932 -0.06751 -0.04335 2655 CA . ASP B 34 ? 0.53165 0.30800 0.46179 0.02038 -0.06905 -0.03353 2656 C . ASP B 34 ? 0.43763 0.24602 0.37386 0.01046 -0.05332 -0.03128 2657 O . ASP B 34 ? 0.45545 0.25888 0.38457 -0.00054 -0.05372 -0.03007 2658 CB . ASP B 34 ? 0.46214 0.20415 0.38031 0.02178 -0.08232 -0.04092 2659 CG . ASP B 34 ? 0.54435 0.29870 0.47069 0.03446 -0.07696 -0.05895 2660 OD1 . ASP B 34 ? 0.51246 0.30177 0.45336 0.04170 -0.06321 -0.06492 2661 OD2 . ASP B 34 ? 0.57897 0.30672 0.49509 0.03599 -0.08678 -0.06726 2662 N . VAL B 35 ? 0.47790 0.31769 0.42717 0.01401 -0.04113 -0.03052 2663 CA . VAL B 35 ? 0.41445 0.28244 0.37010 0.00690 -0.02841 -0.02841 2664 C . VAL B 35 ? 0.41408 0.29930 0.37470 0.00090 -0.02131 -0.01830 2665 O . VAL B 35 ? 0.36476 0.25335 0.32980 0.00786 -0.02118 -0.01775 2666 CB . VAL B 35 ? 0.37541 0.26402 0.34042 0.01754 -0.02038 -0.03981 2667 CG1 . VAL B 35 ? 0.34460 0.25738 0.31357 0.00979 -0.01026 -0.03564 2668 CG2 . VAL B 35 ? 0.38587 0.25902 0.34461 0.02387 -0.02622 -0.05228 2669 N . VAL B 36 ? 0.32244 0.21956 0.28324 -0.01150 -0.01594 -0.01152 2670 CA . VAL B 36 ? 0.34722 0.26394 0.31410 -0.01626 -0.00778 -0.00474 2671 C . VAL B 36 ? 0.34250 0.28414 0.32100 -0.01354 0.00094 -0.00765 2672 O . VAL B 36 ? 0.31628 0.26180 0.29545 -0.01727 0.00067 -0.00943 2673 CB . VAL B 36 ? 0.41359 0.32762 0.37364 -0.03218 -0.00824 0.00411 2674 CG1 . VAL B 36 ? 0.34711 0.28567 0.31538 -0.03545 0.00181 0.00771 2675 CG2 . VAL B 36 ? 0.31534 0.20062 0.25930 -0.03700 -0.01827 0.00937 2676 N . TYR B 37 ? 0.32132 0.27734 0.30743 -0.00763 0.00697 -0.00777 2677 CA . TYR B 37 ? 0.28197 0.25718 0.27691 -0.00536 0.01343 -0.00906 2678 C . TYR B 37 ? 0.30592 0.29443 0.30697 -0.00990 0.01818 -0.00419 2679 O . TYR B 37 ? 0.28884 0.27599 0.28797 -0.01094 0.01948 -0.00161 2680 CB . TYR B 37 ? 0.26783 0.24881 0.26670 0.00367 0.01629 -0.01352 2681 CG . TYR B 37 ? 0.34295 0.31576 0.33889 0.01028 0.01311 -0.02123 2682 CD1 . TYR B 37 ? 0.33585 0.29481 0.32983 0.01540 0.00703 -0.02346 2683 CD2 . TYR B 37 ? 0.36522 0.34418 0.35983 0.01188 0.01560 -0.02708 2684 CE1 . TYR B 37 ? 0.29332 0.24605 0.28761 0.02406 0.00350 -0.03300 2685 CE2 . TYR B 37 ? 0.39936 0.37398 0.39214 0.01884 0.01413 -0.03686 2686 CZ . TYR B 37 ? 0.37867 0.34085 0.37309 0.02599 0.00809 -0.04064 2687 OH . TYR B 37 ? 0.41466 0.37365 0.41017 0.03544 0.00598 -0.05273 2688 N . CYS B 38 ? 0.28650 0.28791 0.29469 -0.01193 0.02006 -0.00383 2689 CA . CYS B 38 ? 0.24789 0.26423 0.26514 -0.01389 0.02428 -0.00194 2690 C . CYS B 38 ? 0.26827 0.29577 0.29448 -0.01075 0.02353 -0.00293 2691 O . CYS B 38 ? 0.24581 0.26967 0.26871 -0.01096 0.01949 -0.00361 2692 CB . CYS B 38 ? 0.22046 0.24066 0.23778 -0.02413 0.02483 0.00058 2693 SG . CYS B 38 ? 0.36840 0.39493 0.39107 -0.03164 0.02031 0.00060 2694 N . PRO B 39 ? 0.23747 0.27678 0.27363 -0.00751 0.02620 -0.00343 2695 CA . PRO B 39 ? 0.26057 0.30726 0.30528 -0.00369 0.02243 -0.00375 2696 C . PRO B 39 ? 0.29659 0.35183 0.34776 -0.00872 0.01801 -0.00359 2697 O . PRO B 39 ? 0.24772 0.31198 0.30412 -0.01518 0.02026 -0.00405 2698 CB . PRO B 39 ? 0.18176 0.23808 0.23710 0.00162 0.02552 -0.00616 2699 CG . PRO B 39 ? 0.19046 0.24085 0.23802 0.00108 0.03112 -0.00658 2700 CD . PRO B 39 ? 0.24542 0.28948 0.28383 -0.00628 0.03154 -0.00444 2701 N . ARG B 40 ? 0.24959 0.30219 0.29913 -0.00732 0.01121 -0.00252 2702 CA . ARG B 40 ? 0.25216 0.31138 0.30619 -0.01264 0.00496 -0.00237 2703 C . ARG B 40 ? 0.32421 0.40530 0.39991 -0.01141 0.00340 -0.00427 2704 O . ARG B 40 ? 0.19486 0.28707 0.27854 -0.01798 -0.00028 -0.00479 2705 CB . ARG B 40 ? 0.26609 0.31595 0.30951 -0.01197 -0.00282 -0.00065 2706 CG . ARG B 40 ? 0.24297 0.29423 0.29111 -0.00524 -0.00870 0.00158 2707 CD . ARG B 40 ? 0.24860 0.29004 0.28205 -0.00800 -0.01748 0.00458 2708 NE . ARG B 40 ? 0.20982 0.24650 0.24277 -0.00302 -0.02529 0.00869 2709 CZ . ARG B 40 ? 0.36570 0.39190 0.38283 -0.00613 -0.03423 0.01313 2710 NH1 . ARG B 40 ? 0.31319 0.33481 0.31411 -0.01353 -0.03534 0.01251 2711 NH2 . ARG B 40 ? 0.23764 0.25571 0.25307 -0.00216 -0.04310 0.01820 2712 N . HIS B 41 ? 0.22858 0.31727 0.31521 -0.00310 0.00585 -0.00650 2713 CA . HIS B 41 ? 0.23065 0.34342 0.34113 0.00052 0.00485 -0.01115 2714 C . HIS B 41 ? 0.28554 0.41688 0.40434 -0.00748 0.01465 -0.01445 2715 O . HIS B 41 ? 0.20778 0.36494 0.34836 -0.00521 0.01674 -0.02033 2716 CB . HIS B 41 ? 0.28501 0.39761 0.40411 0.01339 0.00319 -0.01435 2717 CG . HIS B 41 ? 0.28103 0.38749 0.39313 0.01557 0.01289 -0.01649 2718 ND1 . HIS B 41 ? 0.31921 0.44352 0.44165 0.01534 0.02230 -0.02288 2719 CD2 . HIS B 41 ? 0.29827 0.38422 0.39399 0.01735 0.01424 -0.01353 2720 CE1 . HIS B 41 ? 0.28185 0.39431 0.39267 0.01719 0.02805 -0.02344 2721 NE2 . HIS B 41 ? 0.29975 0.38955 0.39589 0.01860 0.02294 -0.01781 2722 N . VAL B 42 ? 0.20930 0.32846 0.31112 -0.01710 0.02012 -0.01108 2723 CA . VAL B 42 ? 0.25434 0.38735 0.35889 -0.02916 0.02730 -0.01165 2724 C . VAL B 42 ? 0.28748 0.43931 0.40632 -0.03797 0.02267 -0.01219 2725 O . VAL B 42 ? 0.30144 0.47614 0.43125 -0.04783 0.02898 -0.01437 2726 CB . VAL B 42 ? 0.21049 0.31939 0.29096 -0.03745 0.02970 -0.00641 2727 CG1 . VAL B 42 ? 0.27892 0.36800 0.34709 -0.04114 0.02115 -0.00295 2728 CG2 . VAL B 42 ? 0.31180 0.43064 0.38978 -0.05145 0.03702 -0.00524 2729 N . ILE B 43 ? 0.23749 0.38183 0.35605 -0.03590 0.01173 -0.01044 2730 CA . ILE B 43 ? 0.32555 0.48702 0.45756 -0.04457 0.00512 -0.01097 2731 C . ILE B 43 ? 0.27407 0.46585 0.43602 -0.03571 0.00091 -0.01677 2732 O . ILE B 43 ? 0.29448 0.50523 0.47230 -0.04169 -0.00600 -0.01803 2733 CB . ILE B 43 ? 0.31451 0.45341 0.43015 -0.04752 -0.00602 -0.00720 2734 CG1 . ILE B 43 ? 0.29431 0.42455 0.40827 -0.03404 -0.01433 -0.00694 2735 CG2 . ILE B 43 ? 0.19784 0.30689 0.28652 -0.05350 -0.00314 -0.00384 2736 CD1 . ILE B 43 ? 0.27344 0.38249 0.36773 -0.03721 -0.02391 -0.00418 2737 N . CYS B 44 ? 0.25688 0.45328 0.42794 -0.02120 0.00347 -0.02098 2738 CA . CYS B 44 ? 0.24648 0.46791 0.44671 -0.00917 -0.00287 -0.02778 2739 C . CYS B 44 ? 0.22680 0.48643 0.45255 -0.01087 0.00847 -0.03707 2740 O . CYS B 44 ? 0.37084 0.63129 0.58762 -0.01567 0.02216 -0.03855 2741 CB . CYS B 44 ? 0.35525 0.55836 0.55144 0.00800 -0.00806 -0.02832 2742 SG . CYS B 44 ? 0.38198 0.54932 0.55387 0.01062 -0.02302 -0.01882 2743 N . THR B 45 ? 0.36155 0.65444 0.61925 -0.00700 0.00244 -0.04390 2744 CA . THR B 45 ? 0.34142 0.67634 0.62964 -0.00336 0.01254 -0.05631 2745 C . THR B 45 ? 0.36468 0.69810 0.66625 0.02029 0.00828 -0.06480 2746 O . THR B 45 ? 0.41852 0.71674 0.70299 0.03069 -0.00196 -0.05907 2747 CB . THR B 45 ? 0.30078 0.67690 0.62129 -0.01030 0.00796 -0.06129 2748 OG1 . THR B 45 ? 0.41432 0.79407 0.75582 0.00671 -0.01051 -0.06427 2749 CG2 . THR B 45 ? 0.37793 0.74362 0.68091 -0.03270 0.00553 -0.05091 2750 N . SER B 46 ? 0.44859 0.82058 0.78073 0.02840 0.01609 -0.07929 2751 CA . SER B 46 ? 0.50408 0.86956 0.84695 0.05178 0.01063 -0.08818 2752 C . SER B 46 ? 0.50301 0.86114 0.86188 0.06693 -0.01249 -0.08702 2753 O . SER B 46 ? 0.35816 0.68815 0.71101 0.08297 -0.02421 -0.08646 2754 CB . SER B 46 ? 0.55892 0.94928 0.91382 0.05495 0.02379 -0.09967 2755 OG . SER B 46 ? 0.62115 1.01072 0.95511 0.04233 0.04281 -0.09983 2756 N . GLU B 47 ? 0.44853 0.82868 0.82511 0.06074 -0.02059 -0.08547 2757 CA . GLU B 47 ? 0.46141 0.83317 0.84993 0.07328 -0.04439 -0.08281 2758 C . GLU B 47 ? 0.49364 0.82338 0.85210 0.06962 -0.05818 -0.06860 2759 O . GLU B 47 ? 0.53485 0.84202 0.89107 0.08242 -0.07815 -0.06461 2760 CB . GLU B 47 ? 0.34958 0.75492 0.76149 0.06511 -0.04886 -0.08386 2761 CG . GLU B 47 ? 0.60626 1.01061 1.03597 0.08113 -0.07148 -0.08450 2762 CD . GLU B 47 ? 0.72745 1.15027 1.18073 0.09796 -0.06828 -0.09735 2763 OE1 . GLU B 47 ? 0.60782 1.01212 1.05314 0.11120 -0.06409 -0.10287 2764 OE2 . GLU B 47 ? 0.53819 0.99448 1.01843 0.09760 -0.07035 -0.10266 2765 N . ASP B 48 ? 0.39925 0.71018 0.72566 0.05057 -0.04725 -0.05858 2766 CA . ASP B 48 ? 0.43209 0.70059 0.72263 0.04434 -0.05716 -0.04439 2767 C . ASP B 48 ? 0.40287 0.63330 0.67024 0.05504 -0.05983 -0.04010 2768 O . ASP B 48 ? 0.31426 0.51431 0.56099 0.05633 -0.07391 -0.03072 2769 CB . ASP B 48 ? 0.29290 0.55266 0.55838 0.02326 -0.04498 -0.03740 2770 CG . ASP B 48 ? 0.43532 0.72551 0.71819 0.00916 -0.04546 -0.03912 2771 OD1 . ASP B 48 ? 0.43040 0.74222 0.73925 0.01480 -0.05955 -0.04270 2772 OD2 . ASP B 48 ? 0.37142 0.66285 0.64197 -0.00793 -0.03324 -0.03662 2773 N . MET B 49 ? 0.44261 0.67449 0.71180 0.06130 -0.04676 -0.04683 2774 CA . MET B 49 ? 0.46770 0.66302 0.71217 0.06732 -0.04712 -0.04224 2775 C . MET B 49 ? 0.37574 0.55135 0.62403 0.08329 -0.06734 -0.04105 2776 O . MET B 49 ? 0.28754 0.42743 0.51001 0.08411 -0.07174 -0.03332 2777 CB . MET B 49 ? 0.46996 0.67356 0.71716 0.07024 -0.02987 -0.05113 2778 CG . MET B 49 ? 0.45676 0.67829 0.69865 0.05377 -0.01149 -0.05152 2779 SD . MET B 49 ? 0.73511 0.93351 0.94781 0.04843 0.00383 -0.04912 2780 CE . MET B 49 ? 0.47861 0.69605 0.68528 0.02788 0.01933 -0.04723 2781 N . LEU B 50 ? 0.33371 0.53134 0.61346 0.09526 -0.08081 -0.04817 2782 CA . LEU B 50 ? 0.34805 0.52353 0.63152 0.11174 -0.10320 -0.04686 2783 C . LEU B 50 ? 0.44863 0.59027 0.70159 0.10315 -0.11952 -0.03033 2784 O . LEU B 50 ? 0.40018 0.50391 0.62995 0.10644 -0.13026 -0.02219 2785 CB . LEU B 50 ? 0.38417 0.59488 0.71260 0.12827 -0.11466 -0.06010 2786 CG . LEU B 50 ? 0.55742 0.74374 0.88721 0.14624 -0.13081 -0.06249 2787 CD1 . LEU B 50 ? 0.56861 0.72588 0.88413 0.14715 -0.15748 -0.04927 2788 CD2 . LEU B 50 ? 0.41132 0.56673 0.72282 0.15213 -0.12535 -0.06383 2789 N . ASN B 51 ? 0.40555 0.55986 0.65621 0.09065 -0.12158 -0.02534 2790 CA . ASN B 51 ? 0.34347 0.46864 0.56262 0.08066 -0.13538 -0.01102 2791 C . ASN B 51 ? 0.37985 0.51581 0.58633 0.06181 -0.12403 -0.00785 2792 O . ASN B 51 ? 0.34519 0.49764 0.56198 0.05694 -0.13346 -0.00767 2793 CB . ASN B 51 ? 0.45118 0.57493 0.68420 0.09112 -0.16303 -0.00897 2794 CG . ASN B 51 ? 0.53038 0.62262 0.72635 0.07950 -0.17797 0.00615 2795 OD1 . ASN B 51 ? 0.55658 0.62218 0.71526 0.06709 -0.16899 0.01489 2796 ND2 . ASN B 51 ? 0.50901 0.60616 0.71529 0.08321 -0.20093 0.00857 2797 N . PRO B 52 ? 0.42217 0.54761 0.60611 0.05110 -0.10516 -0.00565 2798 CA . PRO B 52 ? 0.37253 0.50686 0.54656 0.03488 -0.09431 -0.00461 2799 C . PRO B 52 ? 0.31350 0.42303 0.45458 0.02408 -0.10279 0.00499 2800 O . PRO B 52 ? 0.34292 0.42373 0.45680 0.02367 -0.10594 0.01215 2801 CB . PRO B 52 ? 0.33072 0.46113 0.49477 0.03091 -0.07308 -0.00683 2802 CG . PRO B 52 ? 0.32961 0.43471 0.48030 0.03968 -0.07520 -0.00369 2803 CD . PRO B 52 ? 0.35974 0.46564 0.52886 0.05407 -0.09387 -0.00514 2804 N . ASN B 53 ? 0.24971 0.37150 0.39267 0.01402 -0.10620 0.00450 2805 CA . ASN B 53 ? 0.27483 0.37607 0.38508 0.00169 -0.11023 0.01057 2806 C . ASN B 53 ? 0.26434 0.36577 0.36434 -0.00909 -0.09209 0.00745 2807 O . ASN B 53 ? 0.24484 0.36204 0.35534 -0.01749 -0.09041 0.00384 2808 CB . ASN B 53 ? 0.27775 0.38871 0.39494 -0.00214 -0.12877 0.01154 2809 CG . ASN B 53 ? 0.29868 0.38544 0.37802 -0.01383 -0.13521 0.01724 2810 OD1 . ASN B 53 ? 0.36515 0.43928 0.42130 -0.02262 -0.12203 0.01637 2811 ND2 . ASN B 53 ? 0.34680 0.42706 0.41941 -0.01340 -0.15632 0.02229 2812 N . TYR B 54 ? 0.25243 0.33537 0.33205 -0.00914 -0.07973 0.00899 2813 CA . TYR B 54 ? 0.25139 0.33318 0.32416 -0.01614 -0.06380 0.00567 2814 C . TYR B 54 ? 0.27092 0.34430 0.32572 -0.02785 -0.06594 0.00496 2815 O . TYR B 54 ? 0.28798 0.36489 0.34507 -0.03480 -0.05830 0.00161 2816 CB . TYR B 54 ? 0.22824 0.29296 0.28424 -0.01281 -0.05270 0.00708 2817 CG . TYR B 54 ? 0.26440 0.33751 0.33826 -0.00339 -0.04644 0.00534 2818 CD1 . TYR B 54 ? 0.23804 0.32598 0.32689 -0.00408 -0.03511 0.00060 2819 CD2 . TYR B 54 ? 0.31850 0.38251 0.39159 0.00518 -0.05256 0.00841 2820 CE1 . TYR B 54 ? 0.29069 0.38632 0.39338 0.00422 -0.02896 -0.00240 2821 CE2 . TYR B 54 ? 0.30740 0.37674 0.39548 0.01422 -0.04752 0.00526 2822 CZ . TYR B 54 ? 0.31201 0.39833 0.41502 0.01409 -0.03521 -0.00085 2823 OH . TYR B 54 ? 0.28851 0.38031 0.40420 0.02284 -0.02982 -0.00536 2824 N . GLU B 55 ? 0.26304 0.32285 0.29732 -0.03088 -0.07681 0.00796 2825 CA . GLU B 55 ? 0.34894 0.40089 0.36617 -0.04161 -0.08047 0.00544 2826 C . GLU B 55 ? 0.29716 0.36866 0.33690 -0.04783 -0.08738 0.00297 2827 O . GLU B 55 ? 0.37178 0.44156 0.40894 -0.05683 -0.08280 -0.00068 2828 CB . GLU B 55 ? 0.30207 0.33815 0.29206 -0.04448 -0.09175 0.00885 2829 CG . GLU B 55 ? 0.39152 0.40934 0.35422 -0.04340 -0.08269 0.01014 2830 CD . GLU B 55 ? 0.69896 0.71630 0.66868 -0.03487 -0.08129 0.01600 2831 OE1 . GLU B 55 ? 0.51282 0.54014 0.50428 -0.02845 -0.09124 0.01919 2832 OE2 . GLU B 55 ? 0.76312 0.77050 0.71765 -0.03444 -0.07080 0.01657 2833 N . ASP B 56 ? 0.27537 0.36601 0.33873 -0.04324 -0.09910 0.00467 2834 CA . ASP B 56 ? 0.31397 0.42965 0.40321 -0.04984 -0.10584 0.00169 2835 C . ASP B 56 ? 0.28814 0.42184 0.39809 -0.05316 -0.09093 -0.00207 2836 O . ASP B 56 ? 0.35915 0.50013 0.47323 -0.06612 -0.08975 -0.00418 2837 CB . ASP B 56 ? 0.37147 0.50712 0.48599 -0.04124 -0.12188 0.00291 2838 CG . ASP B 56 ? 0.36410 0.48479 0.45851 -0.04351 -0.14142 0.00729 2839 OD1 . ASP B 56 ? 0.35534 0.45373 0.41704 -0.05327 -0.14124 0.00792 2840 OD2 . ASP B 56 ? 0.44183 0.57264 0.55258 -0.03510 -0.15774 0.00953 2841 N . LEU B 57 ? 0.24995 0.38949 0.37076 -0.04302 -0.08004 -0.00262 2842 CA . LEU B 57 ? 0.25000 0.40747 0.38795 -0.04675 -0.06576 -0.00595 2843 C . LEU B 57 ? 0.26628 0.40372 0.38148 -0.05853 -0.05647 -0.00517 2844 O . LEU B 57 ? 0.31318 0.46244 0.43698 -0.07045 -0.05145 -0.00628 2845 CB . LEU B 57 ? 0.24590 0.40797 0.39350 -0.03325 -0.05649 -0.00729 2846 CG . LEU B 57 ? 0.31809 0.49910 0.49162 -0.01918 -0.06563 -0.00982 2847 CD1 . LEU B 57 ? 0.20432 0.38501 0.38347 -0.00690 -0.05552 -0.01242 2848 CD2 . LEU B 57 ? 0.21158 0.43124 0.41994 -0.02284 -0.07021 -0.01534 2849 N . LEU B 58 ? 0.23443 0.34166 0.32068 -0.05569 -0.05456 -0.00352 2850 CA . LEU B 58 ? 0.29195 0.37813 0.35797 -0.06361 -0.04762 -0.00417 2851 C . LEU B 58 ? 0.27713 0.35599 0.33459 -0.07727 -0.05650 -0.00547 2852 O . LEU B 58 ? 0.32381 0.39104 0.37305 -0.08700 -0.05301 -0.00598 2853 CB . LEU B 58 ? 0.27195 0.33286 0.31345 -0.05556 -0.04338 -0.00429 2854 CG . LEU B 58 ? 0.34585 0.38371 0.36783 -0.05953 -0.03770 -0.00670 2855 CD1 . LEU B 58 ? 0.25046 0.29275 0.28156 -0.06265 -0.02880 -0.00525 2856 CD2 . LEU B 58 ? 0.28708 0.30771 0.28988 -0.05065 -0.03351 -0.00867 2857 N . ILE B 59 ? 0.28090 0.36419 0.33886 -0.07873 -0.06954 -0.00571 2858 CA . ILE B 59 ? 0.38914 0.46549 0.43864 -0.09238 -0.07976 -0.00759 2859 C . ILE B 59 ? 0.36248 0.46176 0.43541 -0.10587 -0.07962 -0.00717 2860 O . ILE B 59 ? 0.41494 0.50231 0.47815 -0.12049 -0.08338 -0.00808 2861 CB . ILE B 59 ? 0.42391 0.50105 0.46783 -0.09058 -0.09493 -0.00744 2862 CG1 . ILE B 59 ? 0.35892 0.40764 0.36941 -0.08430 -0.09409 -0.00870 2863 CG2 . ILE B 59 ? 0.32146 0.40325 0.36782 -0.10542 -0.10809 -0.00924 2864 CD1 . ILE B 59 ? 0.41233 0.45901 0.41136 -0.08305 -0.10827 -0.00700 2865 N . ARG B 60 ? 0.34225 0.47460 0.44571 -0.10207 -0.07510 -0.00648 2866 CA . ARG B 60 ? 0.38658 0.54663 0.51356 -0.11620 -0.07181 -0.00681 2867 C . ARG B 60 ? 0.36494 0.51352 0.48158 -0.12473 -0.05826 -0.00477 2868 O . ARG B 60 ? 0.28683 0.45485 0.41699 -0.14047 -0.05438 -0.00388 2869 CB . ARG B 60 ? 0.35236 0.55514 0.51706 -0.10777 -0.07039 -0.00929 2870 CG . ARG B 60 ? 0.51969 0.73277 0.69620 -0.09742 -0.08647 -0.01046 2871 CD . ARG B 60 ? 0.54242 0.80121 0.76189 -0.09011 -0.08753 -0.01499 2872 NE . ARG B 60 ? 0.71113 0.96871 0.93683 -0.06832 -0.08988 -0.01579 2873 CZ . ARG B 60 ? 0.58102 0.82933 0.80346 -0.05794 -0.10683 -0.01384 2874 NH1 . ARG B 60 ? 0.36348 0.60363 0.57529 -0.06656 -0.12255 -0.01152 2875 NH2 . ARG B 60 ? 0.42640 0.67111 0.65397 -0.03939 -0.10913 -0.01389 2876 N . LYS B 61 ? 0.32599 0.44459 0.41901 -0.11581 -0.05167 -0.00374 2877 CA . LYS B 61 ? 0.33328 0.43765 0.41461 -0.12180 -0.04114 -0.00112 2878 C . LYS B 61 ? 0.44171 0.50623 0.49363 -0.13002 -0.04713 -0.00056 2879 O . LYS B 61 ? 0.40551 0.44745 0.44016 -0.12229 -0.05377 -0.00387 2880 CB . LYS B 61 ? 0.26317 0.36291 0.34119 -0.10537 -0.03073 -0.00108 2881 CG . LYS B 61 ? 0.31520 0.44960 0.42050 -0.09579 -0.02497 -0.00302 2882 CD . LYS B 61 ? 0.29327 0.45803 0.41802 -0.10857 -0.01690 -0.00317 2883 CE . LYS B 61 ? 0.21405 0.41417 0.36725 -0.09663 -0.01067 -0.00813 2884 NZ . LYS B 61 ? 0.41431 0.64770 0.58555 -0.10942 0.00015 -0.01012 2885 N . SER B 62 ? 0.41402 0.46957 0.45939 -0.14611 -0.04506 0.00318 2886 CA . SER B 62 ? 0.42047 0.43413 0.43802 -0.15370 -0.05153 0.00391 2887 C . SER B 62 ? 0.39336 0.38710 0.39737 -0.14863 -0.04365 0.00715 2888 O . SER B 62 ? 0.35206 0.36615 0.36755 -0.14262 -0.03270 0.00922 2889 CB . SER B 62 ? 0.39490 0.40749 0.41201 -0.17870 -0.05899 0.00723 2890 OG . SER B 62 ? 0.43375 0.46353 0.46293 -0.18360 -0.06845 0.00377 2891 N . ASN B 63 ? 0.42579 0.37812 0.40491 -0.15042 -0.05070 0.00681 2892 CA . ASN B 63 ? 0.42435 0.35413 0.38966 -0.14457 -0.04668 0.00981 2893 C . ASN B 63 ? 0.42914 0.37277 0.39862 -0.16004 -0.03952 0.01875 2894 O . ASN B 63 ? 0.50652 0.45501 0.47622 -0.15244 -0.03087 0.02117 2895 CB . ASN B 63 ? 0.44266 0.32461 0.38245 -0.14470 -0.05858 0.00727 2896 CG . ASN B 63 ? 0.48253 0.35118 0.41571 -0.12534 -0.06181 -0.00368 2897 OD1 . ASN B 63 ? 0.42817 0.31584 0.37073 -0.10960 -0.05362 -0.00712 2898 ND2 . ASN B 63 ? 0.43253 0.26796 0.34824 -0.12741 -0.07371 -0.00971 2899 N . HIS B 64 ? 0.39600 0.34773 0.36807 -0.18315 -0.04264 0.02346 2900 CA . HIS B 64 ? 0.39793 0.36372 0.37070 -0.20205 -0.03506 0.03198 2901 C . HIS B 64 ? 0.41771 0.43545 0.41814 -0.19855 -0.02009 0.03010 2902 O . HIS B 64 ? 0.42823 0.46349 0.42998 -0.21319 -0.01093 0.03532 2903 CB . HIS B 64 ? 0.42989 0.38960 0.39662 -0.23080 -0.04290 0.03753 2904 CG . HIS B 64 ? 0.43876 0.43533 0.43078 -0.23798 -0.04401 0.03298 2905 ND1 . HIS B 64 ? 0.55521 0.53689 0.54489 -0.23520 -0.05695 0.02742 2906 CD2 . HIS B 64 ? 0.41855 0.46734 0.43946 -0.24733 -0.03466 0.03227 2907 CE1 . HIS B 64 ? 0.53199 0.55389 0.54749 -0.24298 -0.05685 0.02475 2908 NE2 . HIS B 64 ? 0.41672 0.48091 0.45347 -0.24966 -0.04348 0.02719 2909 N . ASN B 65 ? 0.42347 0.46515 0.44455 -0.18011 -0.01793 0.02247 2910 CA . ASN B 65 ? 0.35244 0.43796 0.39935 -0.17208 -0.00550 0.01901 2911 C . ASN B 65 ? 0.39549 0.47395 0.43538 -0.15587 0.00306 0.01872 2912 O . ASN B 65 ? 0.41883 0.52917 0.47727 -0.14829 0.01330 0.01502 2913 CB . ASN B 65 ? 0.31243 0.42219 0.38282 -0.15876 -0.00955 0.01193 2914 CG . ASN B 65 ? 0.38711 0.51502 0.47129 -0.17489 -0.01744 0.01131 2915 OD1 . ASN B 65 ? 0.34529 0.46212 0.42730 -0.17101 -0.02913 0.00873 2916 ND2 . ASN B 65 ? 0.42747 0.58494 0.52531 -0.19443 -0.01096 0.01336 2917 N . PHE B 66 ? 0.43357 0.47185 0.44861 -0.14971 -0.00174 0.02142 2918 CA . PHE B 66 ? 0.45845 0.48851 0.46644 -0.13503 0.00443 0.02122 2919 C . PHE B 66 ? 0.47382 0.48267 0.45969 -0.14833 0.00519 0.02916 2920 O . PHE B 66 ? 0.48689 0.46087 0.45228 -0.15735 -0.00526 0.03390 2921 CB . PHE B 66 ? 0.39701 0.40181 0.39664 -0.11574 -0.00202 0.01705 2922 CG . PHE B 66 ? 0.39607 0.41807 0.41181 -0.10378 -0.00334 0.01079 2923 CD1 . PHE B 66 ? 0.44884 0.49523 0.48104 -0.09112 0.00385 0.00766 2924 CD2 . PHE B 66 ? 0.37541 0.38614 0.38724 -0.10563 -0.01314 0.00817 2925 CE1 . PHE B 66 ? 0.40190 0.45972 0.44572 -0.08108 0.00032 0.00357 2926 CE2 . PHE B 66 ? 0.44136 0.46576 0.46401 -0.09603 -0.01570 0.00364 2927 CZ . PHE B 66 ? 0.45697 0.50420 0.49528 -0.08398 -0.00944 0.00211 2928 N . LEU B 67 ? 0.45787 0.48561 0.44611 -0.14966 0.01636 0.03040 2929 CA . LEU B 67 ? 0.46653 0.47591 0.43115 -0.16283 0.01750 0.03871 2930 C . LEU B 67 ? 0.51857 0.51157 0.47388 -0.14470 0.01777 0.03765 2931 O . LEU B 67 ? 0.48585 0.50324 0.45344 -0.13432 0.02783 0.03266 2932 CB . LEU B 67 ? 0.50922 0.55459 0.48065 -0.18089 0.03076 0.04027 2933 CG . LEU B 67 ? 0.71192 0.75703 0.67365 -0.21060 0.02897 0.04813 2934 CD1 . LEU B 67 ? 0.79461 0.79320 0.71899 -0.22418 0.01968 0.06020 2935 CD2 . LEU B 67 ? 0.68046 0.72539 0.65487 -0.21402 0.01961 0.04586 2936 N . VAL B 68 ? 0.41732 0.36930 0.35233 -0.14036 0.00577 0.04139 2937 CA . VAL B 68 ? 0.41421 0.34982 0.34109 -0.12412 0.00371 0.04053 2938 C . VAL B 68 ? 0.50909 0.42135 0.40950 -0.13746 -0.00041 0.05056 2939 O . VAL B 68 ? 0.50666 0.39379 0.38867 -0.15429 -0.00943 0.05852 2940 CB . VAL B 68 ? 0.46555 0.37554 0.39186 -0.10668 -0.00726 0.03541 2941 CG1 . VAL B 68 ? 0.38097 0.28491 0.30640 -0.08906 -0.00743 0.03266 2942 CG2 . VAL B 68 ? 0.38718 0.31594 0.33297 -0.09894 -0.00491 0.02745 2943 N . GLN B 69 ? 0.44653 0.36459 0.34283 -0.13093 0.00484 0.05066 2944 CA . GLN B 69 ? 0.56030 0.45840 0.42915 -0.14407 0.00116 0.06058 2945 C . GLN B 69 ? 0.49508 0.38057 0.35915 -0.12658 -0.00341 0.05885 2946 O . GLN B 69 ? 0.44684 0.35787 0.32502 -0.11545 0.00680 0.05192 2947 CB . GLN B 69 ? 0.57032 0.49992 0.43683 -0.16291 0.01634 0.06283 2948 CG . GLN B 69 ? 0.62538 0.53515 0.46100 -0.19013 0.01221 0.07596 2949 CD . GLN B 69 ? 0.74622 0.69623 0.58596 -0.21109 0.02970 0.07560 2950 OE1 . GLN B 69 ? 0.70556 0.69768 0.57321 -0.20224 0.04387 0.06435 2951 NE2 . GLN B 69 ? 0.87668 0.81726 0.69500 -0.22952 0.02595 0.08275 2952 N . ALA B 70 ? 0.53659 0.38221 0.38154 -0.12410 -0.02003 0.06477 2953 CA . ALA B 70 ? 0.59104 0.42329 0.43072 -0.10920 -0.02727 0.06408 2954 C . ALA B 70 ? 0.59460 0.41247 0.40408 -0.12623 -0.03039 0.07556 2955 O . ALA B 70 ? 0.66307 0.44306 0.44745 -0.13563 -0.04618 0.08581 2956 CB . ALA B 70 ? 0.53801 0.33832 0.37879 -0.09321 -0.04469 0.06146 2957 N . GLY B 71 ? 0.67799 0.52448 0.48804 -0.13034 -0.01605 0.07355 2958 CA . GLY B 71 ? 0.61794 0.45767 0.39738 -0.15045 -0.01494 0.08350 2959 C . GLY B 71 ? 0.71845 0.55977 0.48409 -0.17727 -0.01003 0.09152 2960 O . GLY B 71 ? 0.76668 0.64543 0.54981 -0.18413 0.00697 0.08540 2961 N . ASN B 72 ? 0.73831 0.53942 0.47387 -0.19248 -0.02599 0.10485 2962 CA . ASN B 72 ? 0.77805 0.58334 0.50840 -0.21210 -0.02495 0.10787 2963 C . ASN B 72 ? 0.88144 0.65888 0.61656 -0.20957 -0.03918 0.10941 2964 O . ASN B 72 ? 0.77869 0.56345 0.51438 -0.22493 -0.03718 0.11063 2965 CB . ASN B 72 ? 0.83314 0.62187 0.53165 -0.22835 -0.03275 0.11623 2966 CG . ASN B 72 ? 0.98255 0.81144 0.67882 -0.24154 -0.01301 0.11242 2967 OD1 . ASN B 72 ? 0.97084 0.81196 0.66497 -0.23439 -0.00605 0.10875 2968 ND2 . ASN B 72 ? 1.00097 0.85145 0.69844 -0.26029 -0.00411 0.11209 2969 N . VAL B 73 ? 0.81019 0.55705 0.54942 -0.18991 -0.05361 0.10803 2970 CA . VAL B 73 ? 0.81656 0.53664 0.56134 -0.18430 -0.06723 0.10618 2971 C . VAL B 73 ? 0.79827 0.55106 0.57145 -0.18340 -0.05302 0.09725 2972 O . VAL B 73 ? 0.68507 0.47470 0.48503 -0.16672 -0.03946 0.08599 2973 CB . VAL B 73 ? 0.85332 0.53822 0.59959 -0.15941 -0.08539 0.10281 2974 CG1 . VAL B 73 ? 0.88261 0.55025 0.64220 -0.14831 -0.09481 0.09482 2975 CG2 . VAL B 73 ? 0.81324 0.46573 0.53426 -0.15947 -0.10398 0.11008 2976 N . GLN B 74 ? 0.67809 0.42382 0.44956 -0.19708 -0.05695 0.09908 2977 CA . GLN B 74 ? 0.66551 0.43857 0.46228 -0.19787 -0.04724 0.09120 2978 C . GLN B 74 ? 0.71957 0.46828 0.52609 -0.17712 -0.06035 0.08225 2979 O . GLN B 74 ? 0.86586 0.56842 0.65314 -0.18006 -0.07893 0.08670 2980 CB . GLN B 74 ? 0.76867 0.55570 0.56188 -0.22151 -0.04392 0.09524 2981 CG . GLN B 74 ? 0.83915 0.67968 0.65999 -0.22837 -0.02454 0.08886 2982 CD . GLN B 74 ? 0.93002 0.80952 0.75590 -0.23101 -0.00661 0.08761 2983 OE1 . GLN B 74 ? 0.96035 0.83127 0.76393 -0.23872 -0.00749 0.09375 2984 NE2 . GLN B 74 ? 0.86263 0.78486 0.71750 -0.22390 0.00884 0.07851 2985 N . LEU B 75 ? 0.58288 0.36130 0.41762 -0.15663 -0.05113 0.06929 2986 CA . LEU B 75 ? 0.60566 0.36853 0.45031 -0.13745 -0.06007 0.05879 2987 C . LEU B 75 ? 0.69780 0.47322 0.55293 -0.14696 -0.05774 0.05491 2988 O . LEU B 75 ? 0.70777 0.52313 0.57937 -0.15486 -0.04392 0.05395 2989 CB . LEU B 75 ? 0.53572 0.32153 0.40143 -0.11135 -0.05233 0.04769 2990 CG . LEU B 75 ? 0.53625 0.31560 0.39600 -0.10063 -0.05423 0.04995 2991 CD1 . LEU B 75 ? 0.48286 0.28603 0.36482 -0.07726 -0.04674 0.03860 2992 CD2 . LEU B 75 ? 0.55014 0.28079 0.38837 -0.09839 -0.07467 0.05457 2993 N . ARG B 76 ? 0.61826 0.35902 0.46414 -0.14559 -0.07248 0.05185 2994 CA . ARG B 76 ? 0.58404 0.33148 0.43706 -0.15455 -0.07328 0.04757 2995 C . ARG B 76 ? 0.57476 0.34133 0.44782 -0.13183 -0.06839 0.03316 2996 O . ARG B 76 ? 0.59224 0.33940 0.46346 -0.11165 -0.07483 0.02472 2997 CB . ARG B 76 ? 0.55597 0.25330 0.38584 -0.16618 -0.09258 0.05095 2998 CG . ARG B 76 ? 0.68848 0.39140 0.52210 -0.18233 -0.09459 0.04906 2999 CD . ARG B 76 ? 0.70156 0.36377 0.51320 -0.19025 -0.11156 0.05269 3000 NE . ARG B 76 ? 0.79509 0.44964 0.58903 -0.20493 -0.11357 0.06665 3001 CZ . ARG B 76 ? 0.89078 0.55782 0.67869 -0.22884 -0.11130 0.07555 3002 NH1 . ARG B 76 ? 0.77701 0.46598 0.57760 -0.24047 -0.10740 0.07252 3003 NH2 . ARG B 76 ? 0.77643 0.43438 0.54471 -0.24158 -0.11366 0.08728 3004 N . VAL B 77 ? 0.52139 0.32693 0.41351 -0.13532 -0.05735 0.03015 3005 CA . VAL B 77 ? 0.44901 0.27212 0.35650 -0.11713 -0.05327 0.01842 3006 C . VAL B 77 ? 0.45235 0.25402 0.35235 -0.12026 -0.06453 0.01202 3007 O . VAL B 77 ? 0.45447 0.25928 0.35380 -0.13930 -0.06784 0.01587 3008 CB . VAL B 77 ? 0.47795 0.34856 0.40801 -0.11785 -0.03937 0.01818 3009 CG1 . VAL B 77 ? 0.37645 0.26058 0.31772 -0.10000 -0.03670 0.00802 3010 CG2 . VAL B 77 ? 0.46141 0.35127 0.39678 -0.11670 -0.02859 0.02357 3011 N . ILE B 78 ? 0.51792 0.29963 0.41276 -0.10199 -0.07019 0.00115 3012 CA . ILE B 78 ? 0.47815 0.23674 0.36328 -0.10205 -0.08095 -0.00792 3013 C . ILE B 78 ? 0.47997 0.26161 0.37495 -0.08927 -0.07459 -0.01917 3014 O . ILE B 78 ? 0.52037 0.28648 0.40635 -0.08882 -0.08224 -0.02834 3015 CB . ILE B 78 ? 0.52325 0.23489 0.39081 -0.09225 -0.09491 -0.01371 3016 CG1 . ILE B 78 ? 0.53795 0.25573 0.41310 -0.06668 -0.08962 -0.02319 3017 CG2 . ILE B 78 ? 0.53651 0.21949 0.38945 -0.10715 -0.10410 -0.00040 3018 CD1 . ILE B 78 ? 0.54882 0.22494 0.41197 -0.05330 -0.10371 -0.03044 3019 N . GLY B 79 ? 0.47669 0.29267 0.38732 -0.07997 -0.06164 -0.01862 3020 CA . GLY B 79 ? 0.46623 0.30319 0.38327 -0.07037 -0.05606 -0.02683 3021 C . GLY B 79 ? 0.44981 0.32217 0.38371 -0.06473 -0.04349 -0.02234 3022 O . GLY B 79 ? 0.48634 0.36381 0.42573 -0.06149 -0.03803 -0.01697 3023 N . HIS B 80 ? 0.39769 0.29215 0.33825 -0.06371 -0.04027 -0.02436 3024 CA . HIS B 80 ? 0.40627 0.33012 0.36177 -0.05820 -0.03069 -0.02022 3025 C . HIS B 80 ? 0.41872 0.35247 0.37169 -0.05130 -0.02948 -0.02570 3026 O . HIS B 80 ? 0.40592 0.33487 0.35070 -0.05645 -0.03629 -0.02954 3027 CB . HIS B 80 ? 0.32610 0.27279 0.29714 -0.06957 -0.02914 -0.01192 3028 CG . HIS B 80 ? 0.43704 0.39199 0.41114 -0.07982 -0.03646 -0.01227 3029 ND1 . HIS B 80 ? 0.44791 0.39063 0.41659 -0.09478 -0.04454 -0.01112 3030 CD2 . HIS B 80 ? 0.43426 0.40757 0.41582 -0.07800 -0.03853 -0.01315 3031 CE1 . HIS B 80 ? 0.48394 0.43985 0.45845 -0.10160 -0.05075 -0.01203 3032 NE2 . HIS B 80 ? 0.48192 0.45612 0.46409 -0.09098 -0.04778 -0.01316 3033 N . SER B 81 ? 0.38088 0.32710 0.33867 -0.04119 -0.02146 -0.02561 3034 CA . SER B 81 ? 0.34249 0.29747 0.29496 -0.03676 -0.01980 -0.02887 3035 C . SER B 81 ? 0.41105 0.38455 0.37513 -0.03177 -0.01301 -0.02293 3036 O . SER B 81 ? 0.36883 0.34605 0.34240 -0.02843 -0.00783 -0.01967 3037 CB . SER B 81 ? 0.29824 0.24061 0.23587 -0.02920 -0.01761 -0.03967 3038 OG . SER B 81 ? 0.49194 0.43753 0.43521 -0.01982 -0.00987 -0.04094 3039 N . MET B 82 ? 0.31619 0.29862 0.27715 -0.03187 -0.01439 -0.02143 3040 CA . MET B 82 ? 0.27110 0.26645 0.24044 -0.02775 -0.01065 -0.01569 3041 C . MET B 82 ? 0.33136 0.32477 0.28687 -0.02432 -0.00577 -0.01868 3042 O . MET B 82 ? 0.35298 0.34273 0.29253 -0.02783 -0.00885 -0.02156 3043 CB . MET B 82 ? 0.31486 0.32096 0.29250 -0.03125 -0.01856 -0.01002 3044 CG . MET B 82 ? 0.28319 0.29783 0.26852 -0.02606 -0.01753 -0.00453 3045 SD . MET B 82 ? 0.36186 0.39126 0.36618 -0.02652 -0.02816 0.00023 3046 CE . MET B 82 ? 0.38481 0.40629 0.36970 -0.03166 -0.04032 0.00168 3047 N . GLN B 83 ? 0.31107 0.30813 0.27178 -0.01891 0.00198 -0.01824 3048 CA . GLN B 83 ? 0.34933 0.34951 0.30015 -0.01771 0.00791 -0.02000 3049 C . GLN B 83 ? 0.31147 0.31787 0.26970 -0.01726 0.00833 -0.01152 3050 O . GLN B 83 ? 0.29232 0.30178 0.26358 -0.01305 0.01177 -0.00981 3051 CB . GLN B 83 ? 0.30957 0.30949 0.26128 -0.01199 0.01559 -0.02830 3052 CG . GLN B 83 ? 0.41766 0.42599 0.36003 -0.01266 0.02313 -0.03223 3053 CD . GLN B 83 ? 0.55803 0.57092 0.50634 -0.00534 0.03009 -0.04231 3054 OE1 . GLN B 83 ? 0.58572 0.59188 0.54420 0.00096 0.02775 -0.04476 3055 NE2 . GLN B 83 ? 0.59140 0.61659 0.53338 -0.00665 0.03814 -0.04823 3056 N . ASN B 84 ? 0.33172 0.33739 0.27968 -0.02186 0.00348 -0.00624 3057 CA . ASN B 84 ? 0.31516 0.32131 0.26815 -0.02134 0.00038 0.00207 3058 C . ASN B 84 ? 0.34700 0.35722 0.32131 -0.01581 -0.00317 0.00423 3059 O . ASN B 84 ? 0.34878 0.36186 0.32996 -0.01629 -0.00968 0.00417 3060 CB . ASN B 84 ? 0.29568 0.30387 0.24605 -0.02159 0.00894 0.00216 3061 CG . ASN B 84 ? 0.36135 0.37144 0.29229 -0.02820 0.01465 -0.00148 3062 OD1 . ASN B 84 ? 0.39455 0.40001 0.30740 -0.03536 0.00977 0.00188 3063 ND2 . ASN B 84 ? 0.40868 0.42697 0.34313 -0.02591 0.02476 -0.00909 3064 N . CYS B 85 ? 0.21187 0.22433 0.19686 -0.01135 0.00144 0.00521 3065 CA . CYS B 85 ? 0.31509 0.33364 0.31888 -0.00625 -0.00022 0.00568 3066 C . CYS B 85 ? 0.30480 0.32776 0.31667 -0.00491 0.00700 0.00135 3067 O . CYS B 85 ? 0.28739 0.31657 0.31205 -0.00173 0.00885 0.00100 3068 CB . CYS B 85 ? 0.28289 0.29846 0.29123 -0.00224 -0.00180 0.00914 3069 SG . CYS B 85 ? 0.34965 0.35461 0.34799 -0.00392 -0.01473 0.01647 3070 N . VAL B 86 ? 0.25653 0.27525 0.25993 -0.00723 0.01034 -0.00236 3071 CA . VAL B 86 ? 0.30866 0.32621 0.31611 -0.00678 0.01411 -0.00516 3072 C . VAL B 86 ? 0.35656 0.36928 0.35941 -0.01151 0.01014 -0.00745 3073 O . VAL B 86 ? 0.28446 0.29224 0.27665 -0.01342 0.00724 -0.00996 3074 CB . VAL B 86 ? 0.33190 0.34529 0.33506 -0.00337 0.01954 -0.00825 3075 CG1 . VAL B 86 ? 0.31369 0.32376 0.30572 -0.00360 0.02038 -0.01311 3076 CG2 . VAL B 86 ? 0.42405 0.43258 0.42974 -0.00269 0.02044 -0.00951 3077 N . LEU B 87 ? 0.32855 0.34224 0.33772 -0.01484 0.00990 -0.00659 3078 CA . LEU B 87 ? 0.30765 0.31274 0.31124 -0.02116 0.00564 -0.00818 3079 C . LEU B 87 ? 0.36764 0.35685 0.36218 -0.01880 0.00654 -0.01138 3080 O . LEU B 87 ? 0.34203 0.33051 0.33898 -0.01540 0.01020 -0.01012 3081 CB . LEU B 87 ? 0.31153 0.32613 0.32552 -0.02869 0.00487 -0.00489 3082 CG . LEU B 87 ? 0.46645 0.48566 0.48302 -0.03661 -0.00196 -0.00482 3083 CD1 . LEU B 87 ? 0.46022 0.49219 0.48434 -0.03246 -0.00546 -0.00430 3084 CD2 . LEU B 87 ? 0.40806 0.43804 0.43459 -0.04652 -0.00089 -0.00222 3085 N . LYS B 88 ? 0.41836 0.39386 0.40236 -0.01993 0.00188 -0.01624 3086 CA . LYS B 88 ? 0.34761 0.30498 0.32404 -0.01617 -0.00031 -0.02069 3087 C . LYS B 88 ? 0.38484 0.32595 0.35482 -0.02528 -0.00797 -0.01928 3088 O . LYS B 88 ? 0.42095 0.35560 0.38433 -0.02961 -0.01317 -0.02279 3089 CB . LYS B 88 ? 0.41709 0.37073 0.38651 -0.00815 0.00067 -0.03023 3090 CG . LYS B 88 ? 0.39711 0.36755 0.37144 -0.00260 0.00849 -0.03074 3091 CD . LYS B 88 ? 0.41109 0.38084 0.38300 0.00620 0.01154 -0.04085 3092 CE . LYS B 88 ? 0.46765 0.43111 0.42766 0.00645 0.00968 -0.05061 3093 NZ . LYS B 88 ? 0.43692 0.41045 0.38922 -0.00050 0.01169 -0.04799 3094 N . LEU B 89 ? 0.37710 0.31075 0.34696 -0.02990 -0.00919 -0.01365 3095 CA . LEU B 89 ? 0.42359 0.33943 0.38503 -0.04163 -0.01679 -0.01025 3096 C . LEU B 89 ? 0.43480 0.32035 0.38388 -0.03592 -0.02488 -0.01426 3097 O . LEU B 89 ? 0.37297 0.25275 0.32165 -0.02965 -0.02468 -0.01260 3098 CB . LEU B 89 ? 0.35495 0.28079 0.32069 -0.05287 -0.01331 -0.00097 3099 CG . LEU B 89 ? 0.41220 0.37005 0.39405 -0.05590 -0.00554 0.00124 3100 CD1 . LEU B 89 ? 0.45888 0.42798 0.44411 -0.06629 -0.00046 0.00777 3101 CD2 . LEU B 89 ? 0.35500 0.32040 0.34111 -0.06237 -0.00983 -0.00059 3102 N . LYS B 90 ? 0.44795 0.31318 0.38704 -0.03742 -0.03336 -0.02016 3103 CA . LYS B 90 ? 0.43930 0.27152 0.36678 -0.03147 -0.04382 -0.02492 3104 C . LYS B 90 ? 0.48546 0.29534 0.40228 -0.04602 -0.05218 -0.01414 3105 O . LYS B 90 ? 0.46238 0.27404 0.37633 -0.06310 -0.05351 -0.00784 3106 CB . LYS B 90 ? 0.38522 0.20127 0.30419 -0.02738 -0.05043 -0.03691 3107 CG . LYS B 90 ? 0.47568 0.26938 0.39036 -0.01073 -0.05711 -0.04859 3108 CD . LYS B 90 ? 0.70026 0.45800 0.59968 -0.01257 -0.07102 -0.05603 3109 CE . LYS B 90 ? 0.74777 0.48244 0.64565 0.00664 -0.07929 -0.06896 3110 NZ . LYS B 90 ? 0.87225 0.56287 0.75352 0.00504 -0.09643 -0.07494 3111 N . VAL B 91 ? 0.45065 0.24056 0.36134 -0.04041 -0.05828 -0.01156 3112 CA . VAL B 91 ? 0.53639 0.30038 0.43191 -0.05515 -0.06762 0.00002 3113 C . VAL B 91 ? 0.55897 0.27837 0.44012 -0.04742 -0.08514 -0.00487 3114 O . VAL B 91 ? 0.54677 0.26135 0.43383 -0.02719 -0.08795 -0.01753 3115 CB . VAL B 91 ? 0.50329 0.27972 0.40004 -0.05796 -0.06165 0.00996 3116 CG1 . VAL B 91 ? 0.46490 0.28272 0.37574 -0.06555 -0.04563 0.01346 3117 CG2 . VAL B 91 ? 0.48777 0.26390 0.39111 -0.03719 -0.06265 0.00362 3118 N . ASP B 92 ? 0.56504 0.25176 0.42728 -0.06421 -0.09739 0.00494 3119 CA . ASP B 92 ? 0.69251 0.32958 0.53834 -0.05888 -0.11745 0.00127 3120 C . ASP B 92 ? 0.65244 0.26813 0.49316 -0.04662 -0.12761 0.00418 3121 O . ASP B 92 ? 0.82701 0.39923 0.65490 -0.03982 -0.14670 0.00136 3122 CB . ASP B 92 ? 0.68621 0.29276 0.51116 -0.08452 -0.12850 0.01208 3123 CG . ASP B 92 ? 0.70444 0.31004 0.51682 -0.10637 -0.12740 0.03114 3124 OD1 . ASP B 92 ? 0.87689 0.51392 0.69919 -0.10345 -0.11451 0.03536 3125 OD2 . ASP B 92 ? 0.82899 0.41501 0.62416 -0.12377 -0.13637 0.04071 3126 N . THR B 93 ? 0.65144 0.29540 0.50175 -0.04321 -0.11691 0.00937 3127 CA . THR B 93 ? 0.58910 0.21593 0.43501 -0.03252 -0.12713 0.01288 3128 C . THR B 93 ? 0.59430 0.25797 0.46446 -0.01161 -0.11533 0.00248 3129 O . THR B 93 ? 0.47452 0.17789 0.35686 -0.01586 -0.09736 0.00403 3130 CB . THR B 93 ? 0.66495 0.28545 0.49245 -0.05399 -0.12786 0.03207 3131 OG1 . THR B 93 ? 0.76881 0.35206 0.57161 -0.07559 -0.14033 0.04254 3132 CG2 . THR B 93 ? 0.63784 0.24300 0.46023 -0.04262 -0.13889 0.03592 3133 N . ALA B 94 ? 0.59947 0.25028 0.47757 0.01078 -0.12602 -0.00875 3134 CA . ALA B 94 ? 0.55329 0.23816 0.45406 0.02865 -0.11662 -0.01752 3135 C . ALA B 94 ? 0.53092 0.21802 0.42693 0.02435 -0.11887 -0.00491 3136 O . ALA B 94 ? 0.52811 0.17927 0.40521 0.01934 -0.13605 0.00509 3137 CB . ALA B 94 ? 0.54483 0.22012 0.45883 0.05407 -0.12695 -0.03555 3138 N . ASN B 95 ? 0.45468 0.18171 0.36538 0.02526 -0.10247 -0.00505 3139 CA . ASN B 95 ? 0.48004 0.21254 0.38639 0.02141 -0.10318 0.00504 3140 C . ASN B 95 ? 0.54482 0.26044 0.45624 0.03968 -0.12071 0.00032 3141 O . ASN B 95 ? 0.47647 0.21320 0.41169 0.05861 -0.11815 -0.01384 3142 CB . ASN B 95 ? 0.46704 0.24403 0.38957 0.02060 -0.08307 0.00327 3143 CG . ASN B 95 ? 0.55762 0.34011 0.47282 0.01431 -0.08269 0.01317 3144 OD1 . ASN B 95 ? 0.54060 0.29476 0.43600 0.00810 -0.09655 0.02303 3145 ND2 . ASN B 95 ? 0.45225 0.26907 0.38100 0.01505 -0.06765 0.01072 3146 N . PRO B 96 ? 0.50644 0.18500 0.39607 0.03406 -0.13935 0.01185 3147 CA . PRO B 96 ? 0.54213 0.20306 0.43743 0.05273 -0.15937 0.00772 3148 C . PRO B 96 ? 0.63091 0.32461 0.54268 0.06033 -0.15337 0.00599 3149 O . PRO B 96 ? 0.61118 0.30344 0.53806 0.07942 -0.16695 -0.00188 3150 CB . PRO B 96 ? 0.58036 0.19328 0.44208 0.03878 -0.17981 0.02429 3151 CG . PRO B 96 ? 0.59673 0.21646 0.43755 0.01105 -0.16508 0.03916 3152 CD . PRO B 96 ? 0.53310 0.18633 0.39156 0.00914 -0.14307 0.02974 3153 N . LYS B 97 ? 0.55116 0.27427 0.46154 0.04642 -0.13451 0.01223 3154 CA . LYS B 97 ? 0.58761 0.34085 0.51195 0.05145 -0.12827 0.01051 3155 C . LYS B 97 ? 0.55926 0.35531 0.51374 0.06143 -0.11015 -0.00363 3156 O . LYS B 97 ? 0.51009 0.33432 0.47448 0.06023 -0.10018 -0.00395 3157 CB . LYS B 97 ? 0.50234 0.25980 0.40552 0.03092 -0.11972 0.02452 3158 CG . LYS B 97 ? 0.55838 0.27612 0.42792 0.01794 -0.13687 0.03994 3159 CD . LYS B 97 ? 0.70121 0.42677 0.54863 -0.00585 -0.12280 0.05150 3160 CE . LYS B 97 ? 0.81304 0.50337 0.62400 -0.02100 -0.13856 0.06745 3161 NZ . LYS B 97 ? 0.79974 0.50610 0.60100 -0.02779 -0.13320 0.07182 3162 N . THR B 98 ? 0.53682 0.33662 0.50344 0.06976 -0.10613 -0.01503 3163 CA . THR B 98 ? 0.51326 0.35201 0.50438 0.07700 -0.08919 -0.02767 3164 C . THR B 98 ? 0.43640 0.29657 0.45172 0.09322 -0.09358 -0.03761 3165 O . THR B 98 ? 0.42309 0.26950 0.44693 0.10901 -0.10973 -0.04543 3166 CB . THR B 98 ? 0.45583 0.29137 0.45111 0.08234 -0.08576 -0.03856 3167 OG1 . THR B 98 ? 0.43031 0.24436 0.40370 0.06649 -0.08462 -0.02892 3168 CG2 . THR B 98 ? 0.35151 0.22675 0.36581 0.08510 -0.06675 -0.04911 3169 N . PRO B 99 ? 0.39804 0.29092 0.42558 0.08999 -0.08115 -0.03794 3170 CA . PRO B 99 ? 0.36876 0.28771 0.42222 0.10322 -0.08378 -0.04814 3171 C . PRO B 99 ? 0.33146 0.28026 0.40769 0.11217 -0.07136 -0.06443 3172 O . PRO B 99 ? 0.41895 0.36906 0.48868 0.10658 -0.05971 -0.06638 3173 CB . PRO B 99 ? 0.33445 0.27201 0.38604 0.09137 -0.07496 -0.03985 3174 CG . PRO B 99 ? 0.35217 0.29027 0.38888 0.07631 -0.05901 -0.03310 3175 CD . PRO B 99 ? 0.44044 0.34734 0.45891 0.07357 -0.06505 -0.02916 3176 N . LYS B 100 ? 0.31028 0.28477 0.41322 0.12547 -0.07426 -0.07649 3177 CA . LYS B 100 ? 0.31723 0.32945 0.44200 0.12991 -0.05867 -0.09143 3178 C . LYS B 100 ? 0.36176 0.39422 0.48024 0.11214 -0.03969 -0.08375 3179 O . LYS B 100 ? 0.34220 0.38172 0.45982 0.10378 -0.03909 -0.07495 3180 CB . LYS B 100 ? 0.41891 0.46128 0.57595 0.14478 -0.06431 -0.10501 3181 CG . LYS B 100 ? 0.56817 0.65035 0.74815 0.15049 -0.04891 -0.12332 3182 CD . LYS B 100 ? 0.68707 0.80673 0.89394 0.15326 -0.04836 -0.13067 3183 CE . LYS B 100 ? 0.74554 0.85295 0.96225 0.16834 -0.06800 -0.13634 3184 NZ . LYS B 100 ? 0.49522 0.64162 0.74017 0.17132 -0.06714 -0.14503 3185 N . TYR B 101 ? 0.33486 0.37338 0.44689 0.10630 -0.02587 -0.08685 3186 CA . TYR B 101 ? 0.36062 0.41041 0.46302 0.08980 -0.01112 -0.07798 3187 C . TYR B 101 ? 0.29951 0.37409 0.40747 0.08739 0.00400 -0.08766 3188 O . TYR B 101 ? 0.34340 0.42581 0.46037 0.09796 0.00471 -0.10198 3189 CB . TYR B 101 ? 0.34368 0.36426 0.42092 0.07910 -0.01220 -0.06428 3190 CG . TYR B 101 ? 0.42091 0.42603 0.48679 0.07945 -0.01091 -0.06756 3191 CD1 . TYR B 101 ? 0.35733 0.33472 0.41681 0.08756 -0.02414 -0.07005 3192 CD2 . TYR B 101 ? 0.31047 0.32600 0.37026 0.07088 0.00175 -0.06765 3193 CE1 . TYR B 101 ? 0.36941 0.33097 0.41763 0.08676 -0.02399 -0.07348 3194 CE2 . TYR B 101 ? 0.32674 0.32828 0.37544 0.07049 0.00177 -0.07095 3195 CZ . TYR B 101 ? 0.36350 0.33854 0.40682 0.07820 -0.01071 -0.07427 3196 OH . TYR B 101 ? 0.50420 0.46364 0.53558 0.07671 -0.01162 -0.07797 3197 N . LYS B 102 ? 0.36820 0.45361 0.46890 0.07304 0.01550 -0.07986 3198 CA . LYS B 102 ? 0.28995 0.39460 0.38846 0.06591 0.02949 -0.08465 3199 C . LYS B 102 ? 0.25087 0.34831 0.33321 0.05055 0.03506 -0.07055 3200 O . LYS B 102 ? 0.29308 0.37974 0.37182 0.04636 0.03047 -0.06026 3201 CB . LYS B 102 ? 0.34070 0.48329 0.46021 0.06701 0.03754 -0.09580 3202 CG . LYS B 102 ? 0.41603 0.57156 0.54695 0.06162 0.03558 -0.08959 3203 CD . LYS B 102 ? 0.55164 0.74546 0.69628 0.05281 0.04784 -0.09560 3204 CE . LYS B 102 ? 0.51564 0.74117 0.68930 0.06544 0.04739 -0.11293 3205 NZ . LYS B 102 ? 0.59088 0.85662 0.77913 0.05340 0.05917 -0.11702 3206 N . PHE B 103 ? 0.22584 0.32852 0.29772 0.04278 0.04411 -0.07091 3207 CA . PHE B 103 ? 0.26635 0.36197 0.32377 0.02969 0.04780 -0.05868 3208 C . PHE B 103 ? 0.30346 0.42231 0.36300 0.01919 0.05735 -0.05892 3209 O . PHE B 103 ? 0.22998 0.36702 0.29021 0.01776 0.06526 -0.06801 3210 CB . PHE B 103 ? 0.23289 0.31274 0.27368 0.02711 0.04779 -0.05657 3211 CG . PHE B 103 ? 0.24965 0.30533 0.28565 0.03256 0.03861 -0.05347 3212 CD1 . PHE B 103 ? 0.24975 0.29554 0.29048 0.03585 0.03162 -0.04846 3213 CD2 . PHE B 103 ? 0.27320 0.31581 0.29791 0.03238 0.03673 -0.05520 3214 CE1 . PHE B 103 ? 0.26097 0.28478 0.29441 0.03766 0.02377 -0.04452 3215 CE2 . PHE B 103 ? 0.28168 0.30252 0.30130 0.03440 0.02834 -0.05160 3216 CZ . PHE B 103 ? 0.25622 0.26787 0.27976 0.03642 0.02229 -0.04588 3217 N . VAL B 104 ? 0.23491 0.35256 0.29391 0.01083 0.05664 -0.04938 3218 CA . VAL B 104 ? 0.26491 0.39972 0.32301 -0.00226 0.06395 -0.04706 3219 C . VAL B 104 ? 0.27447 0.39005 0.31592 -0.01261 0.06166 -0.03384 3220 O . VAL B 104 ? 0.27988 0.37501 0.31743 -0.00857 0.05477 -0.02768 3221 CB . VAL B 104 ? 0.26543 0.41960 0.34204 -0.00318 0.06377 -0.05007 3222 CG1 . VAL B 104 ? 0.19525 0.36617 0.29183 0.01093 0.06234 -0.06363 3223 CG2 . VAL B 104 ? 0.25295 0.38910 0.32833 -0.00395 0.05541 -0.04083 3224 N . ARG B 105 ? 0.25072 0.37319 0.28195 -0.02621 0.06714 -0.02995 3225 CA . ARG B 105 ? 0.30814 0.41144 0.32424 -0.03629 0.06289 -0.01746 3226 C . ARG B 105 ? 0.23098 0.34217 0.25137 -0.04754 0.06374 -0.01378 3227 O . ARG B 105 ? 0.33123 0.46220 0.35059 -0.05945 0.07127 -0.01556 3228 CB . ARG B 105 ? 0.23727 0.33541 0.23325 -0.04504 0.06514 -0.01344 3229 CG . ARG B 105 ? 0.25696 0.33119 0.23753 -0.05297 0.05729 -0.00041 3230 CD . ARG B 105 ? 0.41340 0.48002 0.37277 -0.06039 0.05664 0.00415 3231 NE . ARG B 105 ? 0.41667 0.45851 0.36212 -0.06670 0.04637 0.01673 3232 CZ . ARG B 105 ? 0.39125 0.41417 0.33735 -0.05748 0.03656 0.02044 3233 NH1 . ARG B 105 ? 0.31826 0.34392 0.27605 -0.04427 0.03644 0.01399 3234 NH2 . ARG B 105 ? 0.43717 0.43808 0.37239 -0.06197 0.02599 0.03060 3235 N . ILE B 106 ? 0.24120 0.33809 0.26584 -0.04489 0.05642 -0.00938 3236 CA . ILE B 106 ? 0.24270 0.34499 0.27196 -0.05540 0.05556 -0.00671 3237 C . ILE B 106 ? 0.28566 0.37256 0.29605 -0.07151 0.05345 0.00402 3238 O . ILE B 106 ? 0.34436 0.41227 0.33908 -0.07168 0.04994 0.01010 3239 CB . ILE B 106 ? 0.30428 0.39504 0.34196 -0.04740 0.04783 -0.00688 3240 CG1 . ILE B 106 ? 0.27723 0.33873 0.30314 -0.04216 0.04080 -0.00088 3241 CG2 . ILE B 106 ? 0.20585 0.30997 0.25961 -0.03372 0.04790 -0.01588 3242 CD1 . ILE B 106 ? 0.34933 0.39909 0.37910 -0.03728 0.03437 -0.00141 3243 N . GLN B 107 ? 0.31247 0.40681 0.32428 -0.08581 0.05416 0.00671 3244 CA . GLN B 107 ? 0.40722 0.48534 0.40160 -0.10440 0.05026 0.01761 3245 C . GLN B 107 ? 0.42481 0.47380 0.41704 -0.10170 0.03831 0.02231 3246 O . GLN B 107 ? 0.38010 0.43130 0.38666 -0.09024 0.03585 0.01610 3247 CB . GLN B 107 ? 0.38356 0.48980 0.38288 -0.12328 0.05837 0.01654 3248 CG . GLN B 107 ? 0.49655 0.63831 0.50149 -0.12524 0.07218 0.00809 3249 CD . GLN B 107 ? 0.62554 0.76548 0.60515 -0.14497 0.07722 0.01612 3250 OE1 . GLN B 107 ? 0.64196 0.74780 0.59792 -0.15178 0.06807 0.02865 3251 NE2 . GLN B 107 ? 0.74327 0.92031 0.72723 -0.15420 0.09131 0.00841 3252 N . PRO B 108 ? 0.35808 0.37780 0.33104 -0.11176 0.02984 0.03275 3253 CA . PRO B 108 ? 0.38404 0.37563 0.35477 -0.11002 0.01819 0.03532 3254 C . PRO B 108 ? 0.33834 0.34334 0.32003 -0.11974 0.01906 0.03221 3255 O . PRO B 108 ? 0.37782 0.40573 0.36182 -0.13655 0.02585 0.03339 3256 CB . PRO B 108 ? 0.43989 0.39891 0.38658 -0.12220 0.00838 0.04760 3257 CG . PRO B 108 ? 0.46962 0.44481 0.40445 -0.13652 0.01662 0.05274 3258 CD . PRO B 108 ? 0.40027 0.40751 0.35088 -0.12328 0.02862 0.04226 3259 N . GLY B 109 ? 0.31340 0.30626 0.30220 -0.10951 0.01235 0.02739 3260 CA . GLY B 109 ? 0.40128 0.40636 0.40150 -0.11610 0.01130 0.02319 3261 C . GLY B 109 ? 0.41524 0.45070 0.43666 -0.10371 0.01728 0.01303 3262 O . GLY B 109 ? 0.39039 0.43211 0.42147 -0.10469 0.01343 0.00864 3263 N . GLN B 110 ? 0.34379 0.39585 0.37152 -0.09233 0.02487 0.00931 3264 CA . GLN B 110 ? 0.34224 0.41776 0.38830 -0.07938 0.02805 0.00024 3265 C . GLN B 110 ? 0.29233 0.34868 0.33578 -0.06308 0.02225 -0.00246 3266 O . GLN B 110 ? 0.29469 0.32848 0.32616 -0.05717 0.02011 0.00049 3267 CB . GLN B 110 ? 0.35105 0.44963 0.40373 -0.07425 0.03759 -0.00360 3268 CG . GLN B 110 ? 0.40589 0.52886 0.46035 -0.09082 0.04609 -0.00280 3269 CD . GLN B 110 ? 0.47120 0.62569 0.53937 -0.08330 0.05577 -0.01214 3270 OE1 . GLN B 110 ? 0.39911 0.55288 0.45698 -0.08248 0.06153 -0.01163 3271 NE2 . GLN B 110 ? 0.57433 0.75595 0.66586 -0.07719 0.05637 -0.02155 3272 N . THR B 111 ? 0.29095 0.35809 0.34583 -0.05636 0.01946 -0.00835 3273 CA . THR B 111 ? 0.24924 0.30028 0.29914 -0.04427 0.01431 -0.01084 3274 C . THR B 111 ? 0.28228 0.34374 0.33872 -0.03113 0.01680 -0.01453 3275 O . THR B 111 ? 0.29658 0.37924 0.36498 -0.02956 0.02084 -0.01736 3276 CB . THR B 111 ? 0.26387 0.31278 0.31572 -0.04791 0.00656 -0.01356 3277 OG1 . THR B 111 ? 0.26367 0.34055 0.33347 -0.05021 0.00608 -0.01721 3278 CG2 . THR B 111 ? 0.29120 0.32295 0.33366 -0.06105 0.00228 -0.01006 3279 N . PHE B 112 ? 0.23310 0.27893 0.28087 -0.02214 0.01421 -0.01510 3280 CA . PHE B 112 ? 0.24467 0.29389 0.29427 -0.01167 0.01489 -0.01694 3281 C . PHE B 112 ? 0.28219 0.31489 0.31967 -0.00684 0.01144 -0.01712 3282 O . PHE B 112 ? 0.28663 0.30566 0.31476 -0.00902 0.01105 -0.01701 3283 CB . PHE B 112 ? 0.17126 0.22197 0.22001 -0.00869 0.02127 -0.01550 3284 CG . PHE B 112 ? 0.29487 0.32962 0.33266 -0.00996 0.02322 -0.01180 3285 CD1 . PHE B 112 ? 0.28156 0.31169 0.31586 -0.01827 0.02367 -0.00839 3286 CD2 . PHE B 112 ? 0.28051 0.30530 0.31193 -0.00332 0.02368 -0.01165 3287 CE1 . PHE B 112 ? 0.28502 0.29896 0.31062 -0.01743 0.02271 -0.00530 3288 CE2 . PHE B 112 ? 0.31113 0.32503 0.33680 -0.00280 0.02455 -0.00974 3289 CZ . PHE B 112 ? 0.26174 0.26932 0.28502 -0.00860 0.02315 -0.00676 3290 N . SER B 113 ? 0.19857 0.23225 0.23545 -0.00053 0.00856 -0.01792 3291 CA . SER B 113 ? 0.24570 0.26581 0.26830 0.00188 0.00642 -0.01746 3292 C . SER B 113 ? 0.27751 0.29193 0.29427 0.00485 0.01246 -0.01563 3293 O . SER B 113 ? 0.32245 0.34184 0.34515 0.00755 0.01469 -0.01455 3294 CB . SER B 113 ? 0.26297 0.28355 0.28429 0.00501 -0.00189 -0.01742 3295 OG . SER B 113 ? 0.29794 0.32539 0.32577 0.00212 -0.00889 -0.01958 3296 N . VAL B 114 ? 0.28855 0.29420 0.29449 0.00422 0.01514 -0.01648 3297 CA . VAL B 114 ? 0.27748 0.28135 0.27954 0.00598 0.02071 -0.01554 3298 C . VAL B 114 ? 0.30300 0.30202 0.29155 0.00448 0.01978 -0.01477 3299 O . VAL B 114 ? 0.25262 0.24725 0.23081 0.00219 0.01776 -0.01707 3300 CB . VAL B 114 ? 0.32775 0.32929 0.33065 0.00679 0.02500 -0.01840 3301 CG1 . VAL B 114 ? 0.26176 0.26632 0.26340 0.00844 0.03046 -0.01871 3302 CG2 . VAL B 114 ? 0.20108 0.20338 0.21294 0.00620 0.02437 -0.01675 3303 N . LEU B 115 ? 0.25499 0.25328 0.24125 0.00431 0.02061 -0.01129 3304 CA . LEU B 115 ? 0.25253 0.24473 0.22292 -0.00023 0.02030 -0.00876 3305 C . LEU B 115 ? 0.31420 0.31271 0.28402 -0.00267 0.02950 -0.01037 3306 O . LEU B 115 ? 0.30576 0.30693 0.28130 -0.00293 0.03156 -0.00803 3307 CB . LEU B 115 ? 0.31407 0.29821 0.28112 -0.00012 0.01296 -0.00344 3308 CG . LEU B 115 ? 0.33819 0.31143 0.28467 -0.00765 0.01065 0.00169 3309 CD1 . LEU B 115 ? 0.35719 0.32575 0.28752 -0.01176 0.00744 0.00132 3310 CD2 . LEU B 115 ? 0.31861 0.27836 0.26190 -0.00648 0.00069 0.00711 3311 N . ALA B 116 ? 0.26805 0.27039 0.23227 -0.00404 0.03473 -0.01567 3312 CA . ALA B 116 ? 0.38405 0.39753 0.35160 -0.00505 0.04380 -0.01966 3313 C . ALA B 116 ? 0.35189 0.36695 0.30725 -0.01425 0.04673 -0.01502 3314 O . ALA B 116 ? 0.40930 0.41587 0.34571 -0.02100 0.04380 -0.01153 3315 CB . ALA B 116 ? 0.35801 0.37581 0.32281 -0.00284 0.04856 -0.02905 3316 N . CYS B 117 ? 0.33093 0.35573 0.29581 -0.01588 0.05135 -0.01428 3317 CA . CYS B 117 ? 0.32116 0.34662 0.27531 -0.02701 0.05339 -0.00868 3318 C . CYS B 117 ? 0.35591 0.40338 0.32082 -0.03019 0.06367 -0.01386 3319 O . CYS B 117 ? 0.31606 0.37506 0.30057 -0.02134 0.06593 -0.02000 3320 CB . CYS B 117 ? 0.30938 0.32151 0.26437 -0.02770 0.04511 -0.00081 3321 SG . CYS B 117 ? 0.40937 0.39952 0.35487 -0.02329 0.03215 0.00396 3322 N . TYR B 118 ? 0.39081 0.44425 0.34249 -0.04370 0.06902 -0.01107 3323 CA . TYR B 118 ? 0.39925 0.47859 0.36147 -0.04985 0.07970 -0.01605 3324 C . TYR B 118 ? 0.48305 0.55841 0.43033 -0.06761 0.07955 -0.00633 3325 O . TYR B 118 ? 0.45763 0.51764 0.37876 -0.07853 0.07706 0.00055 3326 CB . TYR B 118 ? 0.32901 0.42800 0.28942 -0.04976 0.09104 -0.02745 3327 CG . TYR B 118 ? 0.39541 0.49417 0.36912 -0.03269 0.08960 -0.03751 3328 CD1 . TYR B 118 ? 0.24516 0.36087 0.24540 -0.02118 0.09200 -0.04659 3329 CD2 . TYR B 118 ? 0.46217 0.54176 0.42158 -0.02861 0.08390 -0.03738 3330 CE1 . TYR B 118 ? 0.31447 0.42457 0.32435 -0.00654 0.08848 -0.05466 3331 CE2 . TYR B 118 ? 0.39840 0.47481 0.36837 -0.01519 0.08146 -0.04581 3332 CZ . TYR B 118 ? 0.30965 0.39954 0.30373 -0.00441 0.08359 -0.05410 3333 OH . TYR B 118 ? 0.40827 0.49002 0.41046 0.00805 0.07917 -0.06153 3334 N . ASN B 119 ? 0.38882 0.47574 0.35123 -0.07130 0.08059 -0.00517 3335 CA . ASN B 119 ? 0.45176 0.53333 0.40138 -0.08960 0.07921 0.00431 3336 C . ASN B 119 ? 0.41131 0.45512 0.33940 -0.09215 0.06527 0.01576 3337 O . ASN B 119 ? 0.42939 0.45855 0.33460 -0.10868 0.06207 0.02508 3338 CB . ASN B 119 ? 0.41120 0.51179 0.34676 -0.10774 0.09127 0.00352 3339 CG . ASN B 119 ? 0.54678 0.68991 0.50836 -0.10627 0.10517 -0.00915 3340 OD1 . ASN B 119 ? 0.57530 0.73356 0.56026 -0.10435 0.10461 -0.01108 3341 ND2 . ASN B 119 ? 0.48397 0.64715 0.44227 -0.10626 0.11696 -0.01902 3342 N . GLY B 120 ? 0.38551 0.41354 0.32082 -0.07604 0.05638 0.01483 3343 CA . GLY B 120 ? 0.43175 0.42774 0.35271 -0.07434 0.04269 0.02259 3344 C . GLY B 120 ? 0.48843 0.46774 0.38870 -0.07453 0.03734 0.02597 3345 O . GLY B 120 ? 0.47060 0.42454 0.36237 -0.07004 0.02429 0.03103 3346 N . SER B 121 ? 0.43277 0.42588 0.32503 -0.07891 0.04620 0.02231 3347 CA . SER B 121 ? 0.48308 0.46029 0.35340 -0.08013 0.04019 0.02543 3348 C . SER B 121 ? 0.51831 0.50334 0.40129 -0.06485 0.04149 0.01635 3349 O . SER B 121 ? 0.44696 0.45409 0.34732 -0.05881 0.05189 0.00677 3350 CB . SER B 121 ? 0.50525 0.48900 0.35055 -0.09850 0.04834 0.02795 3351 OG . SER B 121 ? 0.60061 0.57407 0.43032 -0.11613 0.04594 0.03824 3352 N . PRO B 122 ? 0.49198 0.45865 0.36694 -0.05875 0.02983 0.01907 3353 CA . PRO B 122 ? 0.47116 0.44403 0.35677 -0.04685 0.02993 0.01120 3354 C . PRO B 122 ? 0.51611 0.49744 0.38648 -0.05260 0.03754 0.00581 3355 O . PRO B 122 ? 0.68163 0.65443 0.52510 -0.06500 0.03611 0.01105 3356 CB . PRO B 122 ? 0.52467 0.47723 0.40649 -0.04076 0.01397 0.01625 3357 CG . PRO B 122 ? 0.66909 0.60245 0.53960 -0.04698 0.00478 0.02601 3358 CD . PRO B 122 ? 0.47957 0.41837 0.33590 -0.06261 0.01443 0.02936 3359 N . SER B 123 ? 0.42756 0.42368 0.31310 -0.04387 0.04484 -0.00497 3360 CA . SER B 123 ? 0.47406 0.47801 0.34685 -0.04674 0.05211 -0.01339 3361 C . SER B 123 ? 0.42983 0.42535 0.30260 -0.03867 0.04498 -0.01820 3362 O . SER B 123 ? 0.56887 0.56483 0.42467 -0.04230 0.04781 -0.02433 3363 CB . SER B 123 ? 0.42414 0.45254 0.31294 -0.04367 0.06673 -0.02479 3364 OG . SER B 123 ? 0.58081 0.61314 0.49689 -0.03015 0.06527 -0.02916 3365 N . GLY B 124 ? 0.40008 0.38911 0.29028 -0.02923 0.03627 -0.01619 3366 CA . GLY B 124 ? 0.35054 0.33381 0.24277 -0.02367 0.02957 -0.02060 3367 C . GLY B 124 ? 0.38740 0.36986 0.30264 -0.01518 0.02328 -0.01855 3368 O . GLY B 124 ? 0.38897 0.37659 0.31928 -0.01193 0.02610 -0.01617 3369 N . VAL B 125 ? 0.30796 0.28520 0.22495 -0.01287 0.01478 -0.01985 3370 CA . VAL B 125 ? 0.30283 0.28267 0.24069 -0.00711 0.00952 -0.01860 3371 C . VAL B 125 ? 0.29696 0.27627 0.23917 -0.00622 0.00773 -0.02492 3372 O . VAL B 125 ? 0.29712 0.27049 0.22451 -0.00962 0.00468 -0.02878 3373 CB . VAL B 125 ? 0.34788 0.32365 0.28717 -0.00626 -0.00198 -0.01226 3374 CG1 . VAL B 125 ? 0.29218 0.25944 0.21433 -0.01027 -0.01204 -0.01155 3375 CG2 . VAL B 125 ? 0.32486 0.30942 0.28765 -0.00081 -0.00489 -0.01300 3376 N . TYR B 126 ? 0.32873 0.31248 0.28885 -0.00297 0.00916 -0.02580 3377 CA . TYR B 126 ? 0.31159 0.29191 0.27581 -0.00410 0.00600 -0.03023 3378 C . TYR B 126 ? 0.27475 0.26167 0.25746 -0.00394 0.00476 -0.02688 3379 O . TYR B 126 ? 0.29816 0.29194 0.28983 -0.00136 0.00828 -0.02307 3380 CB . TYR B 126 ? 0.29436 0.26830 0.25323 -0.00207 0.01168 -0.03780 3381 CG . TYR B 126 ? 0.36275 0.34182 0.32981 0.00281 0.01978 -0.03779 3382 CD1 . TYR B 126 ? 0.33696 0.31583 0.31784 0.00509 0.01961 -0.03551 3383 CD2 . TYR B 126 ? 0.36288 0.34785 0.32305 0.00367 0.02703 -0.03971 3384 CE1 . TYR B 126 ? 0.34557 0.32902 0.33388 0.00963 0.02492 -0.03533 3385 CE2 . TYR B 126 ? 0.40198 0.39454 0.37224 0.00766 0.03346 -0.04013 3386 CZ . TYR B 126 ? 0.32812 0.31942 0.31282 0.01141 0.03160 -0.03804 3387 OH . TYR B 126 ? 0.35691 0.35556 0.35164 0.01552 0.03597 -0.03832 3388 N . GLN B 127 ? 0.30851 0.29330 0.29521 -0.00821 -0.00019 -0.02861 3389 CA . GLN B 127 ? 0.31906 0.31195 0.32096 -0.01161 -0.00082 -0.02548 3390 C . GLN B 127 ? 0.32316 0.30634 0.32516 -0.01264 0.00235 -0.02564 3391 O . GLN B 127 ? 0.34973 0.31824 0.34295 -0.01272 0.00030 -0.03016 3392 CB . GLN B 127 ? 0.35895 0.35699 0.36586 -0.01843 -0.00888 -0.02635 3393 CG . GLN B 127 ? 0.34560 0.35821 0.36915 -0.02448 -0.00838 -0.02363 3394 CD . GLN B 127 ? 0.36577 0.39914 0.40401 -0.02036 -0.00791 -0.02266 3395 OE1 . GLN B 127 ? 0.30171 0.33407 0.33687 -0.01223 -0.00711 -0.02215 3396 NE2 . GLN B 127 ? 0.42149 0.47403 0.47606 -0.02633 -0.00864 -0.02309 3397 N . CYS B 128 ? 0.40124 0.39097 0.41191 -0.01300 0.00623 -0.02120 3398 CA . CYS B 128 ? 0.37380 0.35265 0.38330 -0.01426 0.00704 -0.01939 3399 C . CYS B 128 ? 0.35436 0.33943 0.37002 -0.02405 0.00628 -0.01420 3400 O . CYS B 128 ? 0.39087 0.39407 0.41552 -0.02777 0.00753 -0.01338 3401 CB . CYS B 128 ? 0.32417 0.30391 0.33448 -0.00682 0.01231 -0.01827 3402 SG . CYS B 128 ? 0.51444 0.48745 0.51821 0.00225 0.01469 -0.02518 3403 N . ALA B 129 ? 0.34381 0.31413 0.35445 -0.02828 0.00394 -0.01098 3404 CA . ALA B 129 ? 0.40137 0.37495 0.41300 -0.04064 0.00364 -0.00467 3405 C . ALA B 129 ? 0.35648 0.31946 0.36218 -0.03973 0.00401 0.00063 3406 O . ALA B 129 ? 0.35765 0.30138 0.35777 -0.03238 -0.00039 -0.00058 3407 CB . ALA B 129 ? 0.37404 0.33401 0.38047 -0.05246 -0.00380 -0.00380 3408 N . MET B 130 ? 0.28649 0.26345 0.29381 -0.04665 0.00890 0.00550 3409 CA . MET B 130 ? 0.28061 0.24722 0.27914 -0.04885 0.00787 0.01191 3410 C . MET B 130 ? 0.33921 0.28318 0.32534 -0.06189 -0.00040 0.01878 3411 O . MET B 130 ? 0.32914 0.28059 0.31396 -0.07729 0.00072 0.02204 3412 CB . MET B 130 ? 0.28006 0.26932 0.28134 -0.05315 0.01631 0.01365 3413 CG . MET B 130 ? 0.34680 0.32635 0.33656 -0.05553 0.01499 0.02015 3414 SD . MET B 130 ? 0.34727 0.31479 0.33874 -0.03792 0.01107 0.01766 3415 CE . MET B 130 ? 0.34240 0.33598 0.34522 -0.02969 0.02100 0.01100 3416 N . ARG B 131 ? 0.35091 0.26734 0.32864 -0.05607 -0.00949 0.02071 3417 CA . ARG B 131 ? 0.38439 0.27137 0.34838 -0.06696 -0.02074 0.02720 3418 C . ARG B 131 ? 0.43374 0.31703 0.38394 -0.08239 -0.02173 0.03898 3419 O . ARG B 131 ? 0.33182 0.23424 0.28304 -0.08216 -0.01392 0.04070 3420 CB . ARG B 131 ? 0.37126 0.22886 0.33246 -0.05282 -0.03191 0.02352 3421 CG . ARG B 131 ? 0.43496 0.30019 0.40809 -0.03637 -0.02842 0.01075 3422 CD . ARG B 131 ? 0.42179 0.27824 0.39296 -0.04091 -0.03173 0.00545 3423 NE . ARG B 131 ? 0.46535 0.28482 0.42613 -0.04060 -0.04576 0.00506 3424 CZ . ARG B 131 ? 0.52194 0.32384 0.47579 -0.04895 -0.05269 0.00289 3425 NH1 . ARG B 131 ? 0.57779 0.39815 0.53517 -0.05864 -0.04705 0.00122 3426 NH2 . ARG B 131 ? 0.68205 0.44582 0.62547 -0.04729 -0.06714 0.00204 3427 N . HIS B 132 ? 0.46245 0.31864 0.39704 -0.09716 -0.03213 0.04722 3428 CA . HIS B 132 ? 0.42537 0.27267 0.34108 -0.11469 -0.03486 0.06019 3429 C . HIS B 132 ? 0.48098 0.31648 0.39008 -0.10363 -0.04030 0.06382 3430 O . HIS B 132 ? 0.41086 0.25411 0.30809 -0.11400 -0.03674 0.07148 3431 CB . HIS B 132 ? 0.44340 0.25554 0.34070 -0.13233 -0.04843 0.06938 3432 CG . HIS B 132 ? 0.56807 0.36764 0.44098 -0.15415 -0.05229 0.08463 3433 ND1 . HIS B 132 ? 0.58396 0.40639 0.45031 -0.17930 -0.04203 0.09055 3434 CD2 . HIS B 132 ? 0.60165 0.36886 0.45408 -0.15542 -0.06570 0.09521 3435 CE1 . HIS B 132 ? 0.63021 0.43440 0.47022 -0.19683 -0.04775 0.10462 3436 NE2 . HIS B 132 ? 0.74360 0.51214 0.57378 -0.18263 -0.06327 0.10839 3437 N . ASN B 133 ? 0.46304 0.28217 0.38006 -0.08298 -0.04875 0.05754 3438 CA . ASN B 133 ? 0.47864 0.28922 0.39399 -0.07079 -0.05545 0.05958 3439 C . ASN B 133 ? 0.42036 0.26370 0.35387 -0.05597 -0.04306 0.05055 3440 O . ASN B 133 ? 0.43247 0.27235 0.37163 -0.04190 -0.04849 0.04845 3441 CB . ASN B 133 ? 0.42878 0.20401 0.34440 -0.05668 -0.07314 0.05714 3442 CG . ASN B 133 ? 0.47528 0.25855 0.41106 -0.03841 -0.06932 0.04160 3443 OD1 . ASN B 133 ? 0.41679 0.22759 0.36344 -0.03837 -0.05526 0.03457 3444 ND2 . ASN B 133 ? 0.49731 0.25605 0.43731 -0.02270 -0.08260 0.03569 3445 N . PHE B 134 ? 0.40476 0.27895 0.34804 -0.05907 -0.02793 0.04514 3446 CA . PHE B 134 ? 0.41056 0.31314 0.36742 -0.04849 -0.01678 0.03814 3447 C . PHE B 134 ? 0.43130 0.33405 0.40327 -0.02910 -0.01837 0.02882 3448 O . PHE B 134 ? 0.36484 0.28016 0.34438 -0.01994 -0.01518 0.02582 3449 CB . PHE B 134 ? 0.34208 0.25018 0.28942 -0.05265 -0.01579 0.04409 3450 CG . PHE B 134 ? 0.38284 0.30301 0.31752 -0.07142 -0.00828 0.04969 3451 CD1 . PHE B 134 ? 0.37515 0.32602 0.32027 -0.07321 0.00586 0.04276 3452 CD2 . PHE B 134 ? 0.42371 0.32504 0.33579 -0.08751 -0.01570 0.06144 3453 CE1 . PHE B 134 ? 0.37793 0.34524 0.31447 -0.08963 0.01424 0.04533 3454 CE2 . PHE B 134 ? 0.54511 0.46171 0.44477 -0.10684 -0.00668 0.06574 3455 CZ . PHE B 134 ? 0.44619 0.39829 0.35976 -0.10734 0.00923 0.05661 3456 N . THR B 135 ? 0.35870 0.24853 0.33445 -0.02400 -0.02292 0.02357 3457 CA . THR B 135 ? 0.29163 0.18770 0.28121 -0.00796 -0.02073 0.01256 3458 C . THR B 135 ? 0.36270 0.27159 0.35670 -0.00993 -0.01265 0.00636 3459 O . THR B 135 ? 0.38855 0.30066 0.37780 -0.02231 -0.01052 0.00998 3460 CB . THR B 135 ? 0.34795 0.21868 0.33816 0.00236 -0.03322 0.00857 3461 OG1 . THR B 135 ? 0.38268 0.22901 0.36163 -0.00652 -0.04120 0.01125 3462 CG2 . THR B 135 ? 0.36048 0.21936 0.34871 0.00683 -0.04362 0.01427 3463 N . ILE B 136 ? 0.33464 0.25277 0.33775 0.00157 -0.00827 -0.00309 3464 CA . ILE B 136 ? 0.26412 0.18966 0.26840 0.00072 -0.00343 -0.00922 3465 C . ILE B 136 ? 0.28923 0.20656 0.29571 0.01199 -0.00547 -0.01976 3466 O . ILE B 136 ? 0.33066 0.24701 0.34334 0.02258 -0.00700 -0.02398 3467 CB . ILE B 136 ? 0.28425 0.23438 0.29387 0.00055 0.00647 -0.00999 3468 CG1 . ILE B 136 ? 0.26748 0.22800 0.28347 0.01049 0.01102 -0.01399 3469 CG2 . ILE B 136 ? 0.30000 0.26079 0.30915 -0.00864 0.00938 -0.00278 3470 CD1 . ILE B 136 ? 0.22442 0.20227 0.24247 0.01004 0.01839 -0.01482 3471 N . LYS B 137 ? 0.31409 0.22738 0.31601 0.00957 -0.00559 -0.02510 3472 CA . LYS B 137 ? 0.34165 0.24920 0.34281 0.01904 -0.00578 -0.03725 3473 C . LYS B 137 ? 0.35776 0.28674 0.35928 0.01994 0.00419 -0.04137 3474 O . LYS B 137 ? 0.42950 0.35975 0.42428 0.01403 0.00460 -0.04246 3475 CB . LYS B 137 ? 0.30986 0.19436 0.30162 0.01456 -0.01434 -0.04072 3476 CG . LYS B 137 ? 0.36305 0.22049 0.35061 0.01140 -0.02640 -0.03521 3477 CD . LYS B 137 ? 0.47788 0.31195 0.45455 0.00319 -0.03519 -0.03740 3478 CE . LYS B 137 ? 0.47200 0.27151 0.44148 0.00116 -0.04972 -0.03315 3479 NZ . LYS B 137 ? 0.57332 0.34739 0.53099 -0.00835 -0.05927 -0.03547 3480 N . GLY B 138 ? 0.38661 0.33166 0.39520 0.02628 0.01104 -0.04295 3481 CA . GLY B 138 ? 0.33867 0.30126 0.34503 0.02524 0.01959 -0.04488 3482 C . GLY B 138 ? 0.37607 0.34528 0.38195 0.03261 0.02518 -0.05678 3483 O . GLY B 138 ? 0.41469 0.37501 0.42336 0.04055 0.02221 -0.06601 3484 N . SER B 139 ? 0.37118 0.35604 0.37268 0.02941 0.03316 -0.05693 3485 CA . SER B 139 ? 0.37150 0.36960 0.37195 0.03329 0.04159 -0.06747 3486 C . SER B 139 ? 0.34831 0.36536 0.35550 0.03068 0.04841 -0.06249 3487 O . SER B 139 ? 0.29093 0.31128 0.28928 0.02228 0.05032 -0.05471 3488 CB . SER B 139 ? 0.38762 0.38400 0.36955 0.02785 0.04437 -0.07233 3489 OG . SER B 139 ? 0.45456 0.46649 0.43340 0.02969 0.05440 -0.08303 3490 N . PHE B 140 ? 0.28660 0.36965 0.28993 -0.02982 0.06520 -0.04738 3491 CA . PHE B 140 ? 0.32083 0.40815 0.32701 -0.03346 0.06618 -0.04721 3492 C . PHE B 140 ? 0.42271 0.53141 0.44123 -0.03719 0.07288 -0.06190 3493 O . PHE B 140 ? 0.37112 0.48837 0.40543 -0.02846 0.07255 -0.07285 3494 CB . PHE B 140 ? 0.31946 0.39792 0.33316 -0.02264 0.05995 -0.04301 3495 CG . PHE B 140 ? 0.30085 0.36245 0.30572 -0.01942 0.05480 -0.03150 3496 CD1 . PHE B 140 ? 0.35071 0.40382 0.34595 -0.02576 0.05303 -0.02337 3497 CD2 . PHE B 140 ? 0.34015 0.39467 0.34749 -0.01057 0.05097 -0.02975 3498 CE1 . PHE B 140 ? 0.38065 0.42089 0.37273 -0.02160 0.04800 -0.01573 3499 CE2 . PHE B 140 ? 0.33791 0.38117 0.33977 -0.00844 0.04767 -0.02165 3500 CZ . PHE B 140 ? 0.29708 0.33440 0.29329 -0.01307 0.04642 -0.01566 3501 N . LEU B 141 ? 0.32119 0.43849 0.33356 -0.05050 0.07806 -0.06282 3502 CA . LEU B 141 ? 0.32901 0.47031 0.35457 -0.05618 0.08568 -0.07790 3503 C . LEU B 141 ? 0.28725 0.43040 0.32057 -0.05546 0.08335 -0.07650 3504 O . LEU B 141 ? 0.27895 0.40431 0.30661 -0.05034 0.07615 -0.06455 3505 CB . LEU B 141 ? 0.41162 0.56440 0.42204 -0.07596 0.09493 -0.08154 3506 CG . LEU B 141 ? 0.48388 0.64151 0.48900 -0.07881 0.09955 -0.08818 3507 CD1 . LEU B 141 ? 0.41778 0.58112 0.39975 -0.10213 0.10707 -0.08738 3508 CD2 . LEU B 141 ? 0.37254 0.55155 0.40393 -0.06898 0.10397 -0.10887 3509 N . ASN B 142 ? 0.31101 0.47738 0.35861 -0.06091 0.08978 -0.09026 3510 CA . ASN B 142 ? 0.36603 0.53581 0.41989 -0.06298 0.08810 -0.08927 3511 C . ASN B 142 ? 0.33186 0.48685 0.36130 -0.07705 0.08710 -0.07444 3512 O . ASN B 142 ? 0.31102 0.46570 0.32191 -0.09250 0.09161 -0.07120 3513 CB . ASN B 142 ? 0.43062 0.63153 0.50485 -0.06898 0.09630 -0.10811 3514 CG . ASN B 142 ? 0.55915 0.77382 0.66202 -0.05346 0.09443 -0.12467 3515 OD1 . ASN B 142 ? 0.53223 0.73076 0.64122 -0.03732 0.08412 -0.12008 3516 ND2 . ASN B 142 ? 0.57428 0.81878 0.69492 -0.05916 0.10377 -0.14481 3517 N . GLY B 143 ? 0.26281 0.40350 0.29136 -0.07200 0.07975 -0.06536 3518 CA . GLY B 143 ? 0.39186 0.51475 0.40003 -0.08251 0.07566 -0.05163 3519 C . GLY B 143 ? 0.28572 0.38360 0.27969 -0.07728 0.06827 -0.03849 3520 O . GLY B 143 ? 0.34546 0.42680 0.32357 -0.08573 0.06285 -0.02771 3521 N . SER B 144 ? 0.25813 0.35250 0.25836 -0.06394 0.06680 -0.03948 3522 CA . SER B 144 ? 0.25850 0.33259 0.24880 -0.05858 0.06036 -0.02885 3523 C . SER B 144 ? 0.27796 0.33896 0.27346 -0.04666 0.05371 -0.02406 3524 O . SER B 144 ? 0.25426 0.30029 0.24422 -0.04251 0.04849 -0.01677 3525 CB . SER B 144 ? 0.29728 0.37432 0.29016 -0.05208 0.06237 -0.03221 3526 OG . SER B 144 ? 0.23957 0.32233 0.24844 -0.03862 0.06193 -0.03905 3527 N . CYS B 145 ? 0.26973 0.33704 0.27640 -0.04147 0.05373 -0.02907 3528 CA . CYS B 145 ? 0.23920 0.29484 0.24837 -0.03216 0.04826 -0.02556 3529 C . CYS B 145 ? 0.25474 0.29515 0.25419 -0.03687 0.04336 -0.01772 3530 O . CYS B 145 ? 0.26036 0.29963 0.25227 -0.04847 0.04289 -0.01509 3531 CB . CYS B 145 ? 0.23419 0.29841 0.25488 -0.02829 0.04789 -0.03191 3532 SG . CYS B 145 ? 0.27018 0.34535 0.30507 -0.01859 0.04798 -0.04074 3533 N . GLY B 146 ? 0.26907 0.29758 0.26886 -0.02855 0.03912 -0.01471 3534 CA . GLY B 146 ? 0.31569 0.32882 0.31024 -0.03009 0.03282 -0.00925 3535 C . GLY B 146 ? 0.30415 0.30878 0.29488 -0.02951 0.02934 -0.00463 3536 O . GLY B 146 ? 0.28967 0.28160 0.28151 -0.02650 0.02259 -0.00216 3537 N . SER B 147 ? 0.30952 0.32105 0.29724 -0.03213 0.03302 -0.00444 3538 CA . SER B 147 ? 0.26039 0.26488 0.24529 -0.03090 0.02951 -0.00036 3539 C . SER B 147 ? 0.25101 0.25367 0.24530 -0.01901 0.02870 -0.00257 3540 O . SER B 147 ? 0.24080 0.25095 0.24032 -0.01295 0.03336 -0.00723 3541 CB . SER B 147 ? 0.26072 0.27485 0.24114 -0.03518 0.03492 -0.00163 3542 OG . SER B 147 ? 0.29156 0.30867 0.26145 -0.04897 0.03651 -0.00047 3543 N . VAL B 148 ? 0.25660 0.24949 0.25299 -0.01676 0.02207 0.00040 3544 CA . VAL B 148 ? 0.25025 0.24345 0.25750 -0.00709 0.02166 -0.00368 3545 C . VAL B 148 ? 0.25386 0.24924 0.26347 -0.00472 0.02138 -0.00253 3546 O . VAL B 148 ? 0.25338 0.24478 0.25635 -0.01017 0.01799 0.00262 3547 CB . VAL B 148 ? 0.25967 0.24186 0.27399 -0.00436 0.01346 -0.00484 3548 CG1 . VAL B 148 ? 0.26357 0.24299 0.27479 -0.00712 0.01358 -0.00598 3549 CG2 . VAL B 148 ? 0.27430 0.24292 0.28617 -0.00876 0.00213 0.00157 3550 N . GLY B 149 ? 0.23873 0.24070 0.25644 0.00196 0.02510 -0.00750 3551 CA . GLY B 149 ? 0.23590 0.24100 0.25837 0.00442 0.02468 -0.00752 3552 C . GLY B 149 ? 0.26918 0.27384 0.30663 0.01015 0.02052 -0.01281 3553 O . GLY B 149 ? 0.25018 0.25601 0.29369 0.01324 0.02183 -0.01885 3554 N . PHE B 150 ? 0.24601 0.24977 0.29079 0.01159 0.01519 -0.01179 3555 CA . PHE B 150 ? 0.27051 0.27407 0.33423 0.01775 0.00881 -0.01842 3556 C . PHE B 150 ? 0.27269 0.28228 0.34665 0.01976 0.00651 -0.01950 3557 O . PHE B 150 ? 0.24247 0.25087 0.30639 0.01551 0.00650 -0.01255 3558 CB . PHE B 150 ? 0.25992 0.24682 0.32582 0.01741 -0.00451 -0.01497 3559 CG . PHE B 150 ? 0.27837 0.25277 0.33363 0.01092 -0.01421 -0.00421 3560 CD1 . PHE B 150 ? 0.27266 0.24329 0.30672 0.00150 -0.01080 0.00391 3561 CD2 . PHE B 150 ? 0.31698 0.28421 0.38379 0.01341 -0.02700 -0.00320 3562 CE1 . PHE B 150 ? 0.37182 0.33185 0.39311 -0.00698 -0.01859 0.01295 3563 CE2 . PHE B 150 ? 0.37956 0.33344 0.43307 0.00541 -0.03695 0.00754 3564 CZ . PHE B 150 ? 0.33334 0.28363 0.36241 -0.00565 -0.03205 0.01569 3565 N . ASN B 151 ? 0.24401 0.26137 0.33955 0.02619 0.00470 -0.02977 3566 CA . ASN B 151 ? 0.28437 0.30709 0.39681 0.02942 -0.00115 -0.03282 3567 C . ASN B 151 ? 0.32892 0.34290 0.46273 0.03627 -0.01606 -0.03803 3568 O . ASN B 151 ? 0.30536 0.31188 0.44210 0.03892 -0.01945 -0.04155 3569 CB . ASN B 151 ? 0.23571 0.28015 0.35869 0.03032 0.01073 -0.04330 3570 CG . ASN B 151 ? 0.31046 0.35957 0.41306 0.02325 0.02093 -0.03674 3571 OD1 . ASN B 151 ? 0.32391 0.37298 0.42310 0.02071 0.01887 -0.03114 3572 ND2 . ASN B 151 ? 0.31129 0.36290 0.40039 0.02002 0.03041 -0.03749 3573 N . ILE B 152 ? 0.31642 0.32995 0.46599 0.03929 -0.02672 -0.03865 3574 CA . ILE B 152 ? 0.43045 0.43425 0.60412 0.04689 -0.04456 -0.04420 3575 C . ILE B 152 ? 0.36116 0.38452 0.56662 0.05418 -0.04499 -0.05808 3576 O . ILE B 152 ? 0.42437 0.45673 0.62843 0.05100 -0.04176 -0.05491 3577 CB . ILE B 152 ? 0.43834 0.41574 0.59924 0.04200 -0.06383 -0.02908 3578 CG1 . ILE B 152 ? 0.31387 0.27550 0.44385 0.03272 -0.06171 -0.01704 3579 CG2 . ILE B 152 ? 0.34451 0.30830 0.53129 0.05014 -0.08605 -0.03448 3580 CD1 . ILE B 152 ? 0.46409 0.39956 0.57731 0.02431 -0.07987 -0.00248 3581 N . ASP B 153 ? 0.51001 0.54108 0.74524 0.06368 -0.04877 -0.07472 3582 CA . ASP B 153 ? 0.51783 0.57001 0.79041 0.07172 -0.05048 -0.09208 3583 C . ASP B 153 ? 0.55833 0.59362 0.85824 0.08187 -0.07560 -0.09686 3584 O . ASP B 153 ? 0.57852 0.61311 0.89709 0.08967 -0.07948 -0.11006 3585 CB . ASP B 153 ? 0.59835 0.67890 0.88429 0.07326 -0.03086 -0.11160 3586 CG . ASP B 153 ? 0.84059 0.92922 1.09363 0.06210 -0.00990 -0.10429 3587 OD1 . ASP B 153 ? 0.72281 0.79570 0.94973 0.05808 -0.00775 -0.09387 3588 OD2 . ASP B 153 ? 0.93478 1.04485 1.18854 0.05688 0.00317 -0.10899 3589 N . TYR B 154 ? 0.59790 0.61798 0.89941 0.08133 -0.09399 -0.08607 3590 CA . TYR B 154 ? 0.58845 0.58347 0.90789 0.08821 -0.12315 -0.08462 3591 C . TYR B 154 ? 0.61358 0.57835 0.90878 0.08415 -0.13269 -0.07296 3592 O . TYR B 154 ? 0.63303 0.57513 0.89353 0.07268 -0.13856 -0.05231 3593 CB . TYR B 154 ? 0.53465 0.54635 0.90569 0.10349 -0.13112 -0.10986 3594 CG . TYR B 154 ? 0.61360 0.59992 1.00837 0.11150 -0.16518 -0.10856 3595 CD1 . TYR B 154 ? 0.75578 0.71426 1.12793 0.10332 -0.18411 -0.08645 3596 CD2 . TYR B 154 ? 0.72805 0.71681 1.16604 0.12601 -0.17935 -0.12964 3597 CE1 . TYR B 154 ? 0.75001 0.68158 1.14091 0.10898 -0.21808 -0.08357 3598 CE2 . TYR B 154 ? 0.60350 0.56604 1.05105 0.12694 -0.20926 -0.12635 3599 CZ . TYR B 154 ? 0.68568 0.61899 1.11208 0.11965 -0.22994 -0.10327 3600 OH . TYR B 154 ? 0.72350 0.62951 1.15661 0.11828 -0.26017 -0.09982 3601 N . ASP B 155 ? 0.48404 0.44909 0.79694 0.09236 -0.13393 -0.08688 3602 CA . ASP B 155 ? 0.60968 0.54547 0.90292 0.08876 -0.14500 -0.07720 3603 C . ASP B 155 ? 0.43552 0.38247 0.71322 0.08602 -0.12285 -0.08189 3604 O . ASP B 155 ? 0.49481 0.42074 0.75924 0.08356 -0.13031 -0.07655 3605 CB . ASP B 155 ? 0.56452 0.48076 0.89027 0.10050 -0.17328 -0.08695 3606 CG . ASP B 155 ? 0.53125 0.47466 0.90230 0.11604 -0.16655 -0.11650 3607 OD1 . ASP B 155 ? 0.57179 0.54990 0.94784 0.11603 -0.13997 -0.12876 3608 OD2 . ASP B 155 ? 0.51935 0.44951 0.91880 0.12626 -0.18786 -0.12773 3609 N . CYS B 156 ? 0.44031 0.41810 0.71773 0.08510 -0.09720 -0.09092 3610 CA . CYS B 156 ? 0.49797 0.48671 0.76131 0.08213 -0.07727 -0.09608 3611 C . CYS B 156 ? 0.39053 0.38160 0.61574 0.06946 -0.06103 -0.07966 3612 O . CYS B 156 ? 0.39458 0.40096 0.61577 0.06594 -0.05101 -0.07735 3613 CB . CYS B 156 ? 0.45976 0.48079 0.75087 0.08916 -0.06147 -0.12051 3614 SG . CYS B 156 ? 0.45650 0.48943 0.73008 0.08452 -0.03911 -0.12812 3615 N . VAL B 157 ? 0.33943 0.31573 0.53861 0.06283 -0.05913 -0.06941 3616 CA . VAL B 157 ? 0.36068 0.33852 0.52682 0.05185 -0.04550 -0.05568 3617 C . VAL B 157 ? 0.39805 0.39562 0.55981 0.05120 -0.02509 -0.06491 3618 O . VAL B 157 ? 0.29292 0.28877 0.45750 0.05356 -0.02343 -0.07246 3619 CB . VAL B 157 ? 0.31781 0.27096 0.45920 0.04355 -0.05478 -0.04030 3620 CG1 . VAL B 157 ? 0.29515 0.25334 0.40738 0.03320 -0.04055 -0.02918 3621 CG2 . VAL B 157 ? 0.32713 0.25731 0.46966 0.04170 -0.07734 -0.03063 3622 N . SER B 158 ? 0.26525 0.27958 0.41836 0.04698 -0.01086 -0.06378 3623 CA . SER B 158 ? 0.25523 0.28520 0.39893 0.04358 0.00669 -0.06982 3624 C . SER B 158 ? 0.25201 0.27357 0.36636 0.03552 0.01156 -0.05562 3625 O . SER B 158 ? 0.28035 0.30311 0.38223 0.03086 0.01443 -0.04657 3626 CB . SER B 158 ? 0.27105 0.32335 0.42309 0.04250 0.01774 -0.07793 3627 OG . SER B 158 ? 0.37599 0.44195 0.55822 0.04961 0.01648 -0.09566 3628 N . PHE B 159 ? 0.30823 0.32187 0.41341 0.03414 0.01199 -0.05489 3629 CA . PHE B 159 ? 0.25031 0.25943 0.33210 0.02718 0.01706 -0.04453 3630 C . PHE B 159 ? 0.25709 0.28009 0.33030 0.02405 0.03037 -0.04820 3631 O . PHE B 159 ? 0.28964 0.32171 0.36886 0.02512 0.03641 -0.05914 3632 CB . PHE B 159 ? 0.25844 0.25484 0.33462 0.02606 0.01199 -0.04270 3633 CG . PHE B 159 ? 0.27712 0.25571 0.35499 0.02550 -0.00277 -0.03585 3634 CD1 . PHE B 159 ? 0.27364 0.24438 0.33631 0.01815 -0.00633 -0.02320 3635 CD2 . PHE B 159 ? 0.28370 0.25264 0.37778 0.03135 -0.01399 -0.04262 3636 CE1 . PHE B 159 ? 0.28993 0.24246 0.34967 0.01441 -0.02079 -0.01570 3637 CE2 . PHE B 159 ? 0.30008 0.24858 0.39327 0.02930 -0.03060 -0.03478 3638 CZ . PHE B 159 ? 0.30404 0.24381 0.37812 0.01969 -0.03399 -0.02044 3639 N . CYS B 160 ? 0.23953 0.26340 0.29805 0.01930 0.03411 -0.03958 3640 CA . CYS B 160 ? 0.23134 0.26439 0.28004 0.01533 0.04334 -0.04121 3641 C . CYS B 160 ? 0.24577 0.27380 0.27782 0.01128 0.04445 -0.03347 3642 O . CYS B 160 ? 0.27383 0.30527 0.29650 0.00771 0.04914 -0.03453 3643 CB . CYS B 160 ? 0.22774 0.26967 0.27956 0.01414 0.04623 -0.04151 3644 SG . CYS B 160 ? 0.33363 0.36873 0.38180 0.01386 0.04014 -0.03051 3645 N . TYR B 161 ? 0.22862 0.24901 0.25694 0.01083 0.03974 -0.02656 3646 CA . TYR B 161 ? 0.22597 0.24521 0.24337 0.00775 0.04091 -0.02172 3647 C . TYR B 161 ? 0.22898 0.24244 0.24471 0.00603 0.03741 -0.01894 3648 O . TYR B 161 ? 0.23402 0.24149 0.25298 0.00550 0.03246 -0.01677 3649 CB . TYR B 161 ? 0.23705 0.25802 0.25097 0.00658 0.04110 -0.01728 3650 CG . TYR B 161 ? 0.26024 0.28152 0.26723 0.00475 0.04161 -0.01509 3651 CD1 . TYR B 161 ? 0.31773 0.33997 0.31980 0.00450 0.04250 -0.01611 3652 CD2 . TYR B 161 ? 0.22084 0.24158 0.22668 0.00246 0.04040 -0.01288 3653 CE1 . TYR B 161 ? 0.22008 0.24231 0.22008 0.00447 0.04072 -0.01585 3654 CE2 . TYR B 161 ? 0.21921 0.24367 0.22329 0.00156 0.04132 -0.01410 3655 CZ . TYR B 161 ? 0.21826 0.24326 0.22137 0.00381 0.04077 -0.01602 3656 OH . TYR B 161 ? 0.21793 0.24623 0.22337 0.00452 0.03947 -0.01886 3657 N . MET B 162 ? 0.22803 0.24270 0.23857 0.00421 0.03883 -0.01895 3658 CA . MET B 162 ? 0.27939 0.29240 0.28800 0.00060 0.03697 -0.01666 3659 C . MET B 162 ? 0.23736 0.25688 0.24390 -0.00045 0.03908 -0.01715 3660 O . MET B 162 ? 0.22448 0.24538 0.22997 0.00170 0.03945 -0.01921 3661 CB . MET B 162 ? 0.23569 0.24417 0.24516 0.00003 0.03495 -0.01882 3662 CG . MET B 162 ? 0.23900 0.24750 0.24596 -0.00553 0.03359 -0.01680 3663 SD . MET B 162 ? 0.32450 0.32514 0.33177 -0.00691 0.02974 -0.01862 3664 CE . MET B 162 ? 0.25856 0.24615 0.26736 -0.00782 0.02235 -0.01550 3665 N . HIS B 163 ? 0.25812 0.28142 0.26416 -0.00448 0.03968 -0.01601 3666 CA . HIS B 163 ? 0.27458 0.30617 0.28302 -0.00423 0.04150 -0.01918 3667 C . HIS B 163 ? 0.27250 0.30913 0.28555 -0.00490 0.04088 -0.02311 3668 O . HIS B 163 ? 0.22662 0.26300 0.23919 -0.00929 0.04075 -0.02265 3669 CB . HIS B 163 ? 0.22435 0.26102 0.23110 -0.00926 0.04388 -0.01900 3670 CG . HIS B 163 ? 0.23626 0.28322 0.24885 -0.00807 0.04596 -0.02527 3671 ND1 . HIS B 163 ? 0.23033 0.27614 0.24613 -0.00157 0.04373 -0.02724 3672 CD2 . HIS B 163 ? 0.24163 0.30060 0.25883 -0.01277 0.04944 -0.03136 3673 CE1 . HIS B 163 ? 0.23125 0.28640 0.25510 -0.00061 0.04436 -0.03452 3674 NE2 . HIS B 163 ? 0.26158 0.32682 0.28762 -0.00715 0.04883 -0.03820 3675 N . HIS B 164 ? 0.24027 0.28037 0.25820 -0.00081 0.03892 -0.02688 3676 CA . HIS B 164 ? 0.22137 0.26586 0.24623 -0.00005 0.03596 -0.03121 3677 C . HIS B 164 ? 0.23211 0.28669 0.26876 0.00259 0.03436 -0.03834 3678 O . HIS B 164 ? 0.28028 0.34530 0.32725 0.00104 0.03440 -0.04427 3679 CB . HIS B 164 ? 0.22506 0.25994 0.24486 0.00272 0.03095 -0.02930 3680 CG . HIS B 164 ? 0.23628 0.26519 0.24983 0.00024 0.03210 -0.02687 3681 ND1 . HIS B 164 ? 0.29174 0.31551 0.29992 -0.00020 0.03501 -0.02409 3682 CD2 . HIS B 164 ? 0.23215 0.25925 0.24551 -0.00144 0.02985 -0.02795 3683 CE1 . HIS B 164 ? 0.23297 0.25199 0.23883 -0.00148 0.03453 -0.02449 3684 NE2 . HIS B 164 ? 0.29275 0.31320 0.30025 -0.00271 0.03175 -0.02633 3685 N . MET B 165 ? 0.21937 0.27162 0.25654 0.00665 0.03233 -0.03911 3686 CA . MET B 165 ? 0.22009 0.27979 0.27143 0.01114 0.02798 -0.04766 3687 C . MET B 165 ? 0.25978 0.31838 0.31114 0.01385 0.02796 -0.04928 3688 O . MET B 165 ? 0.25320 0.30295 0.29241 0.01279 0.02950 -0.04232 3689 CB . MET B 165 ? 0.25820 0.30939 0.31273 0.01570 0.01701 -0.04777 3690 CG . MET B 165 ? 0.30854 0.34317 0.35011 0.01719 0.01086 -0.04084 3691 SD . MET B 165 ? 0.61157 0.63219 0.65078 0.01885 -0.00418 -0.03898 3692 CE . MET B 165 ? 0.36835 0.39044 0.40132 0.01393 0.00028 -0.03621 3693 N . VAL B 166 ? 0.26447 0.33309 0.33166 0.01763 0.02575 -0.05993 3694 CA . VAL B 166 ? 0.31715 0.38340 0.38757 0.02190 0.02278 -0.06383 3695 C . VAL B 166 ? 0.30620 0.36373 0.38705 0.02977 0.00851 -0.06756 3696 O . VAL B 166 ? 0.27386 0.33538 0.36721 0.03242 0.00260 -0.07254 3697 CB . VAL B 166 ? 0.24941 0.33424 0.33038 0.01953 0.03131 -0.07543 3698 CG1 . VAL B 166 ? 0.25603 0.35915 0.35892 0.02099 0.03144 -0.08920 3699 CG2 . VAL B 166 ? 0.26289 0.34402 0.34601 0.02388 0.02837 -0.07982 3700 N . LEU B 167 ? 0.33383 0.37770 0.40877 0.03275 0.00138 -0.06445 3701 CA . LEU B 167 ? 0.30324 0.33267 0.38366 0.03876 -0.01538 -0.06559 3702 C . LEU B 167 ? 0.36427 0.40051 0.46588 0.04631 -0.02068 -0.07985 3703 O . LEU B 167 ? 0.37603 0.42712 0.48327 0.04545 -0.00969 -0.08763 3704 CB . LEU B 167 ? 0.42722 0.43520 0.48513 0.03503 -0.02106 -0.05249 3705 CG . LEU B 167 ? 0.36482 0.36734 0.40306 0.02751 -0.01547 -0.04092 3706 CD1 . LEU B 167 ? 0.46948 0.45279 0.48807 0.02271 -0.02273 -0.03097 3707 CD2 . LEU B 167 ? 0.33367 0.33814 0.37624 0.02732 -0.01877 -0.04175 3708 N . PRO B 168 ? 0.31469 0.33995 0.42904 0.05355 -0.03855 -0.08461 3709 CA . PRO B 168 ? 0.38223 0.41365 0.52081 0.06247 -0.04539 -0.10080 3710 C . PRO B 168 ? 0.38449 0.41067 0.51400 0.06177 -0.04168 -0.10025 3711 O . PRO B 168 ? 0.38086 0.42184 0.52812 0.06611 -0.03727 -0.11570 3712 CB . PRO B 168 ? 0.35108 0.36232 0.49870 0.06936 -0.06990 -0.10093 3713 CG . PRO B 168 ? 0.30942 0.31713 0.44752 0.06446 -0.07137 -0.09136 3714 CD . PRO B 168 ? 0.34150 0.34991 0.45161 0.05389 -0.05413 -0.07756 3715 N . THR B 169 ? 0.37300 0.38016 0.47575 0.05562 -0.04266 -0.08403 3716 CA . THR B 169 ? 0.42203 0.42417 0.51478 0.05382 -0.03895 -0.08220 3717 C . THR B 169 ? 0.42072 0.44274 0.50947 0.04842 -0.01864 -0.08445 3718 O . THR B 169 ? 0.38100 0.40081 0.46215 0.04649 -0.01480 -0.08386 3719 CB . THR B 169 ? 0.35269 0.33133 0.41864 0.04709 -0.04519 -0.06461 3720 OG1 . THR B 169 ? 0.48061 0.45967 0.53204 0.04020 -0.03885 -0.05364 3721 CG2 . THR B 169 ? 0.31054 0.26440 0.37663 0.05050 -0.06813 -0.06277 3722 N . GLY B 170 ? 0.41636 0.45572 0.50838 0.04483 -0.00697 -0.08627 3723 CA . GLY B 170 ? 0.33081 0.38519 0.41536 0.03741 0.00976 -0.08626 3724 C . GLY B 170 ? 0.39251 0.43849 0.45407 0.02991 0.01573 -0.06980 3725 O . GLY B 170 ? 0.47371 0.52892 0.52794 0.02322 0.02702 -0.06806 3726 N . VAL B 171 ? 0.35017 0.37902 0.40033 0.03000 0.00785 -0.05848 3727 CA . VAL B 171 ? 0.31827 0.34185 0.35091 0.02369 0.01347 -0.04570 3728 C . VAL B 171 ? 0.30776 0.33757 0.34122 0.02155 0.01773 -0.04389 3729 O . VAL B 171 ? 0.33055 0.36808 0.37691 0.02435 0.01591 -0.05140 3730 CB . VAL B 171 ? 0.35321 0.35891 0.37285 0.02237 0.00499 -0.03637 3731 CG1 . VAL B 171 ? 0.30618 0.30460 0.32386 0.02345 0.00043 -0.03748 3732 CG2 . VAL B 171 ? 0.41143 0.40686 0.43282 0.02461 -0.00690 -0.03593 3733 N . HIS B 172 ? 0.35283 0.37985 0.37440 0.01685 0.02283 -0.03504 3734 CA . HIS B 172 ? 0.32615 0.35839 0.34781 0.01436 0.02735 -0.03359 3735 C . HIS B 172 ? 0.30595 0.32852 0.31786 0.01278 0.02480 -0.02654 3736 O . HIS B 172 ? 0.26908 0.28362 0.27182 0.01116 0.02299 -0.02163 3737 CB . HIS B 172 ? 0.24722 0.28653 0.26563 0.00946 0.03601 -0.03195 3738 CG . HIS B 172 ? 0.30738 0.35778 0.33191 0.00764 0.04018 -0.03953 3739 ND1 . HIS B 172 ? 0.28347 0.33382 0.30459 0.00652 0.04171 -0.04042 3740 CD2 . HIS B 172 ? 0.29554 0.35904 0.32927 0.00555 0.04378 -0.04787 3741 CE1 . HIS B 172 ? 0.27419 0.33699 0.30098 0.00347 0.04658 -0.04938 3742 NE2 . HIS B 172 ? 0.41053 0.48257 0.44556 0.00250 0.04838 -0.05440 3743 N . ALA B 173 ? 0.22618 0.25076 0.23980 0.01206 0.02523 -0.02698 3744 CA . ALA B 173 ? 0.23070 0.24765 0.23509 0.00970 0.02348 -0.02253 3745 C . ALA B 173 ? 0.26563 0.28723 0.27109 0.00785 0.02873 -0.02259 3746 O . ALA B 173 ? 0.22302 0.25206 0.23644 0.00798 0.03052 -0.02599 3747 CB . ALA B 173 ? 0.27064 0.27945 0.27398 0.01065 0.01327 -0.02312 3748 N . GLY B 174 ? 0.23074 0.24842 0.22856 0.00540 0.03111 -0.01982 3749 CA . GLY B 174 ? 0.25390 0.27345 0.25308 0.00424 0.03451 -0.02048 3750 C . GLY B 174 ? 0.25617 0.27160 0.24794 0.00198 0.03571 -0.02055 3751 O . GLY B 174 ? 0.29341 0.30470 0.27664 -0.00061 0.03375 -0.01966 3752 N . THR B 175 ? 0.23198 0.24828 0.22647 0.00192 0.03860 -0.02226 3753 CA . THR B 175 ? 0.27215 0.28692 0.26225 -0.00005 0.04079 -0.02554 3754 C . THR B 175 ? 0.23609 0.25386 0.23290 0.00174 0.04451 -0.02828 3755 O . THR B 175 ? 0.23124 0.24948 0.23483 0.00412 0.04365 -0.02605 3756 CB . THR B 175 ? 0.24204 0.25413 0.23182 -0.00083 0.03898 -0.02762 3757 OG1 . THR B 175 ? 0.23867 0.25083 0.23651 0.00102 0.03889 -0.02761 3758 CG2 . THR B 175 ? 0.24364 0.25403 0.23135 -0.00159 0.03365 -0.02566 3759 N . ASP B 176 ? 0.26469 0.28483 0.25994 -0.00006 0.04809 -0.03406 3760 CA . ASP B 176 ? 0.27613 0.29976 0.28300 0.00319 0.05011 -0.03996 3761 C . ASP B 176 ? 0.30342 0.32129 0.31570 0.00576 0.04662 -0.04194 3762 O . ASP B 176 ? 0.27688 0.29014 0.28307 0.00396 0.04428 -0.03917 3763 CB . ASP B 176 ? 0.28947 0.32126 0.29556 -0.00012 0.05643 -0.04862 3764 CG . ASP B 176 ? 0.35883 0.38927 0.35232 -0.00607 0.05868 -0.05246 3765 OD1 . ASP B 176 ? 0.34663 0.37118 0.33996 -0.00459 0.05573 -0.05309 3766 OD2 . ASP B 176 ? 0.38660 0.42147 0.36884 -0.01373 0.06311 -0.05480 3767 N . LEU B 177 ? 0.24639 0.26395 0.27131 0.00990 0.04499 -0.04718 3768 CA . LEU B 177 ? 0.26931 0.27798 0.29849 0.01173 0.03932 -0.04790 3769 C . LEU B 177 ? 0.31279 0.32099 0.33854 0.01032 0.04160 -0.05545 3770 O . LEU B 177 ? 0.32550 0.32542 0.35438 0.01152 0.03654 -0.05682 3771 CB . LEU B 177 ? 0.27395 0.27832 0.31827 0.01692 0.03309 -0.05078 3772 CG . LEU B 177 ? 0.28388 0.27973 0.32679 0.01571 0.02575 -0.04023 3773 CD1 . LEU B 177 ? 0.25962 0.24676 0.29302 0.01081 0.02207 -0.03389 3774 CD2 . LEU B 177 ? 0.27900 0.28165 0.31614 0.01364 0.02978 -0.03420 3775 N . GLU B 178 ? 0.30629 0.32173 0.32364 0.00636 0.04831 -0.05995 3776 CA . GLU B 178 ? 0.34762 0.36153 0.35659 0.00258 0.05020 -0.06557 3777 C . GLU B 178 ? 0.28777 0.29679 0.28185 -0.00238 0.04774 -0.05716 3778 O . GLU B 178 ? 0.37613 0.38232 0.36100 -0.00655 0.04779 -0.06017 3779 CB . GLU B 178 ? 0.32762 0.35197 0.33374 -0.00157 0.05858 -0.07667 3780 CG . GLU B 178 ? 0.43114 0.46391 0.45699 0.00413 0.06117 -0.08860 3781 CD . GLU B 178 ? 0.60344 0.64932 0.62827 -0.00118 0.07091 -0.10387 3782 OE1 . GLU B 178 ? 0.67436 0.72766 0.68466 -0.01036 0.07753 -0.10282 3783 OE2 . GLU B 178 ? 0.74884 0.79730 0.78679 0.00287 0.07164 -0.11756 3784 N . GLY B 179 ? 0.30048 0.30878 0.29329 -0.00192 0.04497 -0.04786 3785 CA . GLY B 179 ? 0.29523 0.30019 0.27997 -0.00474 0.04093 -0.04168 3786 C . GLY B 179 ? 0.29188 0.29702 0.26460 -0.00929 0.04063 -0.03907 3787 O . GLY B 179 ? 0.28187 0.28330 0.25023 -0.01070 0.03492 -0.03473 3788 N . ASN B 180 ? 0.29957 0.30857 0.26731 -0.01229 0.04546 -0.04188 3789 CA . ASN B 180 ? 0.30332 0.30966 0.25632 -0.01901 0.04369 -0.03821 3790 C . ASN B 180 ? 0.29364 0.30031 0.25117 -0.01567 0.04104 -0.03192 3791 O . ASN B 180 ? 0.26160 0.27425 0.22798 -0.01232 0.04529 -0.03290 3792 CB . ASN B 180 ? 0.35452 0.36612 0.29781 -0.02685 0.05094 -0.04469 3793 CG . ASN B 180 ? 0.38090 0.39312 0.31885 -0.03103 0.05438 -0.05306 3794 OD1 . ASN B 180 ? 0.42645 0.44752 0.37336 -0.02960 0.06178 -0.06336 3795 ND2 . ASN B 180 ? 0.31105 0.31391 0.23582 -0.03588 0.04818 -0.04972 3796 N . PHE B 181 ? 0.27292 0.27282 0.22554 -0.01632 0.03303 -0.02635 3797 CA . PHE B 181 ? 0.30553 0.30499 0.26230 -0.01322 0.02977 -0.02199 3798 C . PHE B 181 ? 0.29500 0.29485 0.24283 -0.01849 0.03282 -0.02092 3799 O . PHE B 181 ? 0.31194 0.30957 0.24507 -0.02744 0.03431 -0.02195 3800 CB . PHE B 181 ? 0.27321 0.26464 0.22817 -0.01270 0.01871 -0.01852 3801 CG . PHE B 181 ? 0.31537 0.31200 0.28668 -0.00559 0.01664 -0.02012 3802 CD1 . PHE B 181 ? 0.25287 0.25457 0.23514 -0.00057 0.01689 -0.02030 3803 CD2 . PHE B 181 ? 0.28615 0.28375 0.26128 -0.00531 0.01503 -0.02227 3804 CE1 . PHE B 181 ? 0.33054 0.34002 0.32708 0.00358 0.01673 -0.02349 3805 CE2 . PHE B 181 ? 0.28497 0.28990 0.27502 -0.00095 0.01422 -0.02459 3806 CZ . PHE B 181 ? 0.28694 0.29873 0.28760 0.00297 0.01563 -0.02565 3807 N . TYR B 182 ? 0.33121 0.33462 0.28699 -0.01437 0.03415 -0.01921 3808 CA . TYR B 182 ? 0.30009 0.30164 0.24727 -0.01950 0.03388 -0.01647 3809 C . TYR B 182 ? 0.35995 0.34891 0.29890 -0.02113 0.02230 -0.01112 3810 O . TYR B 182 ? 0.39605 0.38353 0.34574 -0.01376 0.01685 -0.01077 3811 CB . TYR B 182 ? 0.33403 0.34280 0.29279 -0.01448 0.03817 -0.01656 3812 CG . TYR B 182 ? 0.27698 0.29618 0.24586 -0.01246 0.04642 -0.02189 3813 CD1 . TYR B 182 ? 0.29489 0.32157 0.26211 -0.01770 0.05244 -0.02577 3814 CD2 . TYR B 182 ? 0.27921 0.30071 0.26030 -0.00586 0.04709 -0.02367 3815 CE1 . TYR B 182 ? 0.32105 0.35783 0.30217 -0.01428 0.05817 -0.03266 3816 CE2 . TYR B 182 ? 0.24073 0.26853 0.23247 -0.00327 0.05124 -0.02856 3817 CZ . TYR B 182 ? 0.32825 0.36398 0.32183 -0.00639 0.05638 -0.03373 3818 OH . TYR B 182 ? 0.29019 0.33281 0.29886 -0.00229 0.05883 -0.04058 3819 N . GLY B 183 ? 0.37925 0.35906 0.29945 -0.03153 0.01779 -0.00777 3820 CA . GLY B 183 ? 0.39512 0.35884 0.30641 -0.03381 0.00331 -0.00214 3821 C . GLY B 183 ? 0.38654 0.34078 0.29273 -0.03508 -0.00622 -0.00133 3822 O . GLY B 183 ? 0.39370 0.35337 0.29896 -0.03652 -0.00049 -0.00471 3823 N . PRO B 184 ? 0.44930 0.38839 0.35345 -0.03414 -0.02240 0.00262 3824 CA . PRO B 184 ? 0.41218 0.33945 0.30991 -0.03680 -0.03487 0.00431 3825 C . PRO B 184 ? 0.39087 0.32575 0.31272 -0.02418 -0.03748 -0.00115 3826 O . PRO B 184 ? 0.48645 0.41111 0.40967 -0.02338 -0.05181 -0.00037 3827 CB . PRO B 184 ? 0.40025 0.30534 0.28489 -0.04235 -0.05391 0.01126 3828 CG . PRO B 184 ? 0.43764 0.34707 0.33818 -0.03310 -0.05306 0.00939 3829 CD . PRO B 184 ? 0.37643 0.30603 0.28238 -0.03182 -0.03209 0.00575 3830 N . PHE B 185 ? 0.35684 0.30937 0.29729 -0.01556 -0.02467 -0.00670 3831 CA . PHE B 185 ? 0.38121 0.34329 0.34485 -0.00536 -0.02610 -0.01257 3832 C . PHE B 185 ? 0.33089 0.29824 0.29609 -0.00641 -0.02261 -0.01482 3833 O . PHE B 185 ? 0.29826 0.26735 0.25178 -0.01213 -0.01365 -0.01401 3834 CB . PHE B 185 ? 0.29118 0.26810 0.27009 0.00133 -0.01489 -0.01667 3835 CG . PHE B 185 ? 0.34477 0.31700 0.32056 0.00159 -0.01661 -0.01454 3836 CD1 . PHE B 185 ? 0.33192 0.29550 0.31437 0.00573 -0.02997 -0.01577 3837 CD2 . PHE B 185 ? 0.32672 0.30255 0.29415 -0.00216 -0.00623 -0.01198 3838 CE1 . PHE B 185 ? 0.38780 0.34519 0.36649 0.00559 -0.03259 -0.01379 3839 CE2 . PHE B 185 ? 0.38764 0.35893 0.35172 -0.00269 -0.00824 -0.00976 3840 CZ . PHE B 185 ? 0.37639 0.33777 0.34493 0.00087 -0.02127 -0.01029 3841 N . VAL B 186 ? 0.29580 0.26648 0.27726 -0.00076 -0.03014 -0.01893 3842 CA . VAL B 186 ? 0.29301 0.26929 0.27879 -0.00135 -0.02820 -0.02149 3843 C . VAL B 186 ? 0.34451 0.33836 0.35470 0.00582 -0.02294 -0.02866 3844 O . VAL B 186 ? 0.29334 0.29332 0.31897 0.01172 -0.02562 -0.03313 3845 CB . VAL B 186 ? 0.34887 0.31163 0.32854 -0.00460 -0.04447 -0.01938 3846 CG1 . VAL B 186 ? 0.37416 0.31919 0.32461 -0.01557 -0.04899 -0.01194 3847 CG2 . VAL B 186 ? 0.31637 0.27690 0.31494 0.00290 -0.05993 -0.02288 3848 N . ASP B 187 ? 0.28485 0.28694 0.29780 0.00412 -0.01538 -0.03049 3849 CA . ASP B 187 ? 0.26970 0.28889 0.30190 0.00714 -0.00924 -0.03672 3850 C . ASP B 187 ? 0.33676 0.36128 0.38589 0.00978 -0.01946 -0.04248 3851 O . ASP B 187 ? 0.32140 0.35014 0.37378 0.00710 -0.01937 -0.04394 3852 CB . ASP B 187 ? 0.32308 0.34660 0.34988 0.00295 0.00180 -0.03542 3853 CG . ASP B 187 ? 0.37855 0.39179 0.39144 -0.00146 -0.00016 -0.03243 3854 OD1 . ASP B 187 ? 0.42349 0.42571 0.42678 -0.00308 -0.00896 -0.03020 3855 OD2 . ASP B 187 ? 0.34815 0.36320 0.35863 -0.00416 0.00639 -0.03246 3856 N . ARG B 188 ? 0.33734 0.36167 0.39925 0.01550 -0.02943 -0.04662 3857 CA . ARG B 188 ? 0.28391 0.31460 0.36803 0.02019 -0.04149 -0.05449 3858 C . ARG B 188 ? 0.43813 0.47933 0.54380 0.02773 -0.04356 -0.06388 3859 O . ARG B 188 ? 0.40810 0.44043 0.50549 0.02943 -0.04398 -0.06079 3860 CB . ARG B 188 ? 0.37725 0.38728 0.45135 0.01919 -0.05980 -0.04901 3861 CG . ARG B 188 ? 0.53582 0.54914 0.63563 0.02588 -0.07695 -0.05732 3862 CD . ARG B 188 ? 0.50089 0.49077 0.58733 0.02274 -0.09711 -0.05014 3863 NE . ARG B 188 ? 0.59740 0.56686 0.67730 0.02484 -0.11346 -0.04614 3864 CZ . ARG B 188 ? 0.72566 0.67163 0.77310 0.01630 -0.11804 -0.03409 3865 NH1 . ARG B 188 ? 0.62396 0.56522 0.64430 0.00602 -0.10724 -0.02648 3866 NH2 . ARG B 188 ? 0.74511 0.67217 0.78742 0.01733 -0.13407 -0.03052 3867 N . GLN B 189 ? 0.35552 0.41693 0.48960 0.03173 -0.04434 -0.07658 3868 CA . GLN B 189 ? 0.35794 0.43363 0.51550 0.03869 -0.04412 -0.08913 3869 C . GLN B 189 ? 0.40183 0.46234 0.56988 0.04743 -0.06528 -0.09174 3870 O . GLN B 189 ? 0.51824 0.58506 0.71242 0.05372 -0.07863 -0.10196 3871 CB . GLN B 189 ? 0.32966 0.43567 0.51581 0.03866 -0.03659 -0.10447 3872 CG . GLN B 189 ? 0.44577 0.57115 0.65789 0.04480 -0.03371 -0.12092 3873 CD . GLN B 189 ? 0.54787 0.70695 0.78786 0.04217 -0.02425 -0.13788 3874 OE1 . GLN B 189 ? 0.55047 0.72018 0.78136 0.03178 -0.01153 -0.13471 3875 NE2 . GLN B 189 ? 0.41072 0.58709 0.68567 0.05097 -0.03094 -0.15693 3876 N . THR B 190 ? 0.42689 0.46639 0.57501 0.04735 -0.06991 -0.08248 3877 CA . THR B 190 ? 0.45545 0.47788 0.61105 0.05455 -0.09031 -0.08430 3878 C . THR B 190 ? 0.44688 0.46359 0.59158 0.05492 -0.08418 -0.08180 3879 O . THR B 190 ? 0.45571 0.47650 0.58185 0.04856 -0.06666 -0.07527 3880 CB . THR B 190 ? 0.46002 0.45234 0.59436 0.05041 -0.10987 -0.07118 3881 OG1 . THR B 190 ? 0.51775 0.49642 0.61561 0.03990 -0.10009 -0.05621 3882 CG2 . THR B 190 ? 0.52886 0.52455 0.67276 0.04968 -0.11803 -0.07304 3883 N . ALA B 191 ? 0.46261 0.46878 0.62013 0.06270 -0.10038 -0.08740 3884 CA . ALA B 191 ? 0.45253 0.44860 0.59849 0.06289 -0.09862 -0.08416 3885 C . ALA B 191 ? 0.45810 0.42460 0.56786 0.05376 -0.10626 -0.06530 3886 O . ALA B 191 ? 0.52306 0.46583 0.62663 0.05321 -0.12824 -0.05969 3887 CB . ALA B 191 ? 0.40377 0.39803 0.57756 0.07454 -0.11467 -0.09812 3888 N . GLN B 192 ? 0.37997 0.34800 0.46584 0.04557 -0.08890 -0.05602 3889 CA . GLN B 192 ? 0.34381 0.29049 0.39585 0.03473 -0.09129 -0.04023 3890 C . GLN B 192 ? 0.35373 0.29028 0.39293 0.03249 -0.09047 -0.03559 3891 O . GLN B 192 ? 0.33557 0.28716 0.38238 0.03555 -0.07649 -0.04076 3892 CB . GLN B 192 ? 0.32768 0.28479 0.36457 0.02698 -0.07297 -0.03463 3893 CG . GLN B 192 ? 0.42901 0.39628 0.47778 0.02836 -0.07307 -0.03906 3894 CD . GLN B 192 ? 0.37372 0.35071 0.40992 0.02174 -0.05574 -0.03502 3895 OE1 . GLN B 192 ? 0.41115 0.37837 0.42321 0.01357 -0.05127 -0.02619 3896 NE2 . GLN B 192 ? 0.34572 0.34239 0.39897 0.02463 -0.04626 -0.04244 3897 N . ALA B 193 ? 0.37668 0.28701 0.39485 0.02567 -0.10614 -0.02548 3898 CA . ALA B 193 ? 0.40665 0.30490 0.41051 0.02165 -0.10753 -0.01999 3899 C . ALA B 193 ? 0.48157 0.38520 0.46120 0.01049 -0.08897 -0.01121 3900 O . ALA B 193 ? 0.42335 0.32871 0.38854 0.00264 -0.08242 -0.00609 3901 CB . ALA B 193 ? 0.39491 0.26104 0.38440 0.01666 -0.13369 -0.01223 3902 N . ALA B 194 ? 0.38801 0.29495 0.36495 0.01012 -0.08094 -0.01077 3903 CA . ALA B 194 ? 0.38649 0.29997 0.34517 0.00073 -0.06466 -0.00425 3904 C . ALA B 194 ? 0.47136 0.36561 0.40471 -0.01146 -0.07235 0.00571 3905 O . ALA B 194 ? 0.48656 0.38655 0.40405 -0.02130 -0.05997 0.01051 3906 CB . ALA B 194 ? 0.44890 0.38202 0.42140 0.00701 -0.04857 -0.01027 3907 N . GLY B 195 ? 0.40708 0.27888 0.33685 -0.01176 -0.09301 0.00830 3908 CA . GLY B 195 ? 0.49174 0.34286 0.39494 -0.02564 -0.10214 0.01870 3909 C . GLY B 195 ? 0.48540 0.34026 0.39043 -0.02468 -0.09586 0.01809 3910 O . GLY B 195 ? 0.44200 0.31593 0.36688 -0.01408 -0.08317 0.01001 3911 N . THR B 196 ? 0.57334 0.40849 0.45490 -0.03786 -0.10568 0.02738 3912 CA . THR B 196 ? 0.53854 0.37374 0.41903 -0.03891 -0.10243 0.02806 3913 C . THR B 196 ? 0.50120 0.36449 0.38716 -0.03872 -0.07715 0.02497 3914 O . THR B 196 ? 0.43211 0.30697 0.30751 -0.04769 -0.06444 0.02746 3915 CB . THR B 196 ? 0.54627 0.35641 0.39614 -0.05732 -0.11588 0.04002 3916 OG1 . THR B 196 ? 0.58980 0.37017 0.43236 -0.05881 -0.14241 0.04430 3917 CG2 . THR B 196 ? 0.51306 0.31981 0.36333 -0.05752 -0.11631 0.04051 3918 N . ASP B 197 ? 0.53647 0.41030 0.43964 -0.02849 -0.07088 0.01866 3919 CA . ASP B 197 ? 0.52692 0.42465 0.43687 -0.02737 -0.05030 0.01594 3920 C . ASP B 197 ? 0.49601 0.38988 0.39339 -0.03694 -0.04915 0.02132 3921 O . ASP B 197 ? 0.58418 0.47638 0.48890 -0.03169 -0.05125 0.01874 3922 CB . ASP B 197 ? 0.54361 0.45627 0.47791 -0.01244 -0.04350 0.00590 3923 CG . ASP B 197 ? 0.62170 0.55698 0.56220 -0.01167 -0.02454 0.00402 3924 OD1 . ASP B 197 ? 0.47993 0.42087 0.41004 -0.02048 -0.01677 0.00867 3925 OD2 . ASP B 197 ? 0.68020 0.62734 0.63591 -0.00305 -0.01816 -0.00273 3926 N . THR B 198 ? 0.55272 0.44662 0.43087 -0.05220 -0.04510 0.02796 3927 CA . THR B 198 ? 0.52065 0.41398 0.38677 -0.06371 -0.04271 0.03273 3928 C . THR B 198 ? 0.50484 0.42346 0.38578 -0.05915 -0.02489 0.02783 3929 O . THR B 198 ? 0.50600 0.44244 0.39825 -0.05385 -0.01281 0.02307 3930 CB . THR B 198 ? 0.59874 0.48564 0.43873 -0.08408 -0.04390 0.04001 3931 OG1 . THR B 198 ? 0.73863 0.64897 0.58166 -0.08756 -0.02623 0.03587 3932 CG2 . THR B 198 ? 0.58006 0.44167 0.40510 -0.08842 -0.06225 0.04520 3933 N . THR B 199 ? 0.49641 0.41467 0.37738 -0.06121 -0.02511 0.02919 3934 CA . THR B 199 ? 0.50341 0.44250 0.39888 -0.05657 -0.01174 0.02514 3935 C . THR B 199 ? 0.43829 0.39511 0.33069 -0.06758 0.00048 0.02512 3936 O . THR B 199 ? 0.41598 0.36824 0.29077 -0.08306 -0.00126 0.02937 3937 CB . THR B 199 ? 0.53246 0.46475 0.42852 -0.05581 -0.01701 0.02636 3938 OG1 . THR B 199 ? 0.47981 0.39494 0.37867 -0.04667 -0.02949 0.02427 3939 CG2 . THR B 199 ? 0.39821 0.34917 0.31014 -0.04910 -0.00602 0.02216 3940 N . ILE B 200 ? 0.34634 0.32342 0.25615 -0.06029 0.01229 0.01947 3941 CA . ILE B 200 ? 0.36207 0.35955 0.27672 -0.06766 0.02398 0.01597 3942 C . ILE B 200 ? 0.30916 0.31135 0.22464 -0.07398 0.02436 0.01761 3943 O . ILE B 200 ? 0.32024 0.32893 0.25013 -0.06569 0.02576 0.01585 3944 CB . ILE B 200 ? 0.37108 0.38514 0.30600 -0.05654 0.03286 0.00919 3945 CG1 . ILE B 200 ? 0.37394 0.38100 0.30840 -0.04913 0.03082 0.00827 3946 CG2 . ILE B 200 ? 0.34007 0.37514 0.28255 -0.06336 0.04369 0.00281 3947 CD1 . ILE B 200 ? 0.43348 0.43600 0.35241 -0.05911 0.03041 0.00910 3948 N . THR B 201 ? 0.32911 0.32717 0.22737 -0.09030 0.02236 0.02147 3949 CA . THR B 201 ? 0.33454 0.33513 0.23130 -0.09824 0.02132 0.02383 3950 C . THR B 201 ? 0.33165 0.35892 0.25086 -0.09536 0.03245 0.01656 3951 O . THR B 201 ? 0.31098 0.34032 0.23912 -0.09181 0.03032 0.01735 3952 CB . THR B 201 ? 0.36237 0.35572 0.23480 -0.11961 0.01833 0.02900 3953 OG1 . THR B 201 ? 0.39817 0.36439 0.25046 -0.12183 0.00530 0.03585 3954 CG2 . THR B 201 ? 0.37044 0.36168 0.23874 -0.12833 0.01455 0.03290 3955 N . VAL B 202 ? 0.31011 0.35744 0.23971 -0.09660 0.04321 0.00868 3956 CA . VAL B 202 ? 0.29602 0.36901 0.25054 -0.09347 0.05184 -0.00003 3957 C . VAL B 202 ? 0.29759 0.36879 0.27077 -0.07576 0.04803 -0.00031 3958 O . VAL B 202 ? 0.30872 0.39181 0.29911 -0.07286 0.04848 -0.00321 3959 CB . VAL B 202 ? 0.29432 0.38864 0.25783 -0.09748 0.06343 -0.01079 3960 CG1 . VAL B 202 ? 0.28514 0.37297 0.25205 -0.08504 0.06324 -0.01241 3961 CG2 . VAL B 202 ? 0.31389 0.43633 0.30610 -0.09556 0.07098 -0.02199 3962 N . ASN B 203 ? 0.27243 0.32853 0.24156 -0.06515 0.04348 0.00281 3963 CA . ASN B 203 ? 0.25924 0.31208 0.24093 -0.05168 0.03982 0.00327 3964 C . ASN B 203 ? 0.29797 0.33993 0.27414 -0.05181 0.03261 0.00889 3965 O . ASN B 203 ? 0.27048 0.31618 0.25823 -0.04640 0.03065 0.00855 3966 CB . ASN B 203 ? 0.25499 0.29679 0.23272 -0.04291 0.03804 0.00410 3967 CG . ASN B 203 ? 0.33994 0.39309 0.32869 -0.03913 0.04432 -0.00222 3968 OD1 . ASN B 203 ? 0.25580 0.32551 0.25522 -0.04308 0.05044 -0.00861 3969 ND2 . ASN B 203 ? 0.28226 0.32758 0.26975 -0.03162 0.04290 -0.00175 3970 N . VAL B 204 ? 0.27630 0.30288 0.23415 -0.05821 0.02714 0.01407 3971 CA . VAL B 204 ? 0.30376 0.31906 0.25609 -0.05849 0.01991 0.01820 3972 C . VAL B 204 ? 0.28915 0.31708 0.24864 -0.06595 0.02157 0.01798 3973 O . VAL B 204 ? 0.31869 0.34567 0.28373 -0.06261 0.01795 0.01907 3974 CB . VAL B 204 ? 0.30601 0.30007 0.23868 -0.06340 0.01144 0.02290 3975 CG1 . VAL B 204 ? 0.30783 0.29008 0.23539 -0.06406 0.00368 0.02578 3976 CG2 . VAL B 204 ? 0.31854 0.30180 0.24890 -0.05438 0.00857 0.02154 3977 N . LEU B 205 ? 0.28815 0.32946 0.24785 -0.07712 0.02731 0.01576 3978 CA . LEU B 205 ? 0.28920 0.34649 0.25877 -0.08514 0.02971 0.01374 3979 C . LEU B 205 ? 0.33209 0.40607 0.32800 -0.07511 0.03190 0.00787 3980 O . LEU B 205 ? 0.31036 0.38867 0.31525 -0.07545 0.02815 0.00853 3981 CB . LEU B 205 ? 0.29982 0.37159 0.26463 -0.10090 0.03731 0.01029 3982 CG . LEU B 205 ? 0.34013 0.39341 0.27570 -0.11579 0.03221 0.01800 3983 CD1 . LEU B 205 ? 0.33532 0.40341 0.26299 -0.13296 0.04114 0.01399 3984 CD2 . LEU B 205 ? 0.33391 0.37667 0.26096 -0.12282 0.02415 0.02430 3985 N . ALA B 206 ? 0.27694 0.35847 0.28517 -0.06636 0.03618 0.00243 3986 CA . ALA B 206 ? 0.25071 0.34366 0.28348 -0.05650 0.03491 -0.00249 3987 C . ALA B 206 ? 0.27645 0.35330 0.30546 -0.04914 0.02576 0.00410 3988 O . ALA B 206 ? 0.30169 0.38370 0.34503 -0.04634 0.02062 0.00355 3989 CB . ALA B 206 ? 0.24291 0.34259 0.28668 -0.04889 0.03954 -0.00894 3990 N . TRP B 207 ? 0.28407 0.34187 0.29416 -0.04665 0.02325 0.00949 3991 CA . TRP B 207 ? 0.33100 0.37500 0.33479 -0.04207 0.01633 0.01404 3992 C . TRP B 207 ? 0.26123 0.30134 0.25948 -0.04851 0.01131 0.01757 3993 O . TRP B 207 ? 0.27265 0.30924 0.27336 -0.04663 0.00554 0.01966 3994 CB . TRP B 207 ? 0.30269 0.33148 0.29097 -0.03828 0.01625 0.01568 3995 CG . TRP B 207 ? 0.31625 0.33235 0.29533 -0.03590 0.01118 0.01801 3996 CD1 . TRP B 207 ? 0.31229 0.32644 0.29338 -0.03195 0.00915 0.01832 3997 CD2 . TRP B 207 ? 0.31778 0.32099 0.28294 -0.03858 0.00732 0.01939 3998 NE1 . TRP B 207 ? 0.34207 0.34526 0.31063 -0.03302 0.00606 0.01896 3999 CE2 . TRP B 207 ? 0.35158 0.34820 0.31202 -0.03587 0.00482 0.01882 4000 CE3 . TRP B 207 ? 0.29906 0.29446 0.25446 -0.04394 0.00478 0.02081 4001 CZ2 . TRP B 207 ? 0.40772 0.39262 0.35677 -0.03694 0.00114 0.01753 4002 CZ3 . TRP B 207 ? 0.30536 0.28628 0.24986 -0.04416 -0.00102 0.02078 4003 CH2 . TRP B 207 ? 0.35293 0.32985 0.29567 -0.03996 -0.00217 0.01813 4004 N . LEU B 208 ? 0.33746 0.37717 0.32680 -0.05754 0.01254 0.01873 4005 CA . LEU B 208 ? 0.31276 0.34989 0.29788 -0.06497 0.00759 0.02193 4006 C . LEU B 208 ? 0.30824 0.36440 0.31446 -0.06676 0.00751 0.01893 4007 O . LEU B 208 ? 0.27739 0.33083 0.28448 -0.06888 0.00122 0.02164 4008 CB . LEU B 208 ? 0.29142 0.32276 0.26099 -0.07637 0.00782 0.02447 4009 CG . LEU B 208 ? 0.33425 0.34262 0.28383 -0.07465 0.00313 0.02769 4010 CD1 . LEU B 208 ? 0.42277 0.42320 0.35614 -0.08762 0.00081 0.03131 4011 CD2 . LEU B 208 ? 0.34212 0.33480 0.28518 -0.06953 -0.00429 0.02925 4012 N . TYR B 209 ? 0.29181 0.36766 0.31660 -0.06577 0.01374 0.01224 4013 CA . TYR B 209 ? 0.26041 0.35554 0.31131 -0.06476 0.01208 0.00692 4014 C . TYR B 209 ? 0.25633 0.34372 0.31586 -0.05434 0.00323 0.00895 4015 O . TYR B 209 ? 0.27172 0.36366 0.34437 -0.05430 -0.00433 0.00916 4016 CB . TYR B 209 ? 0.25447 0.37369 0.32549 -0.06553 0.02107 -0.00364 4017 CG . TYR B 209 ? 0.30682 0.44162 0.37526 -0.08032 0.02900 -0.00742 4018 CD1 . TYR B 209 ? 0.31256 0.46147 0.39254 -0.08841 0.02738 -0.00951 4019 CD2 . TYR B 209 ? 0.26743 0.40279 0.32062 -0.08796 0.03763 -0.00875 4020 CE1 . TYR B 209 ? 0.31568 0.47990 0.39149 -0.10474 0.03520 -0.01303 4021 CE2 . TYR B 209 ? 0.38776 0.53639 0.43443 -0.10491 0.04463 -0.01153 4022 CZ . TYR B 209 ? 0.34705 0.51071 0.40487 -0.11376 0.04394 -0.01383 4023 OH . TYR B 209 ? 0.41268 0.59056 0.46226 -0.13330 0.05149 -0.01667 4024 N . ALA B 210 ? 0.25323 0.32827 0.30441 -0.04686 0.00319 0.01082 4025 CA . ALA B 210 ? 0.26173 0.32603 0.31445 -0.04029 -0.00567 0.01427 4026 C . ALA B 210 ? 0.31258 0.36241 0.34940 -0.04447 -0.01298 0.02111 4027 O . ALA B 210 ? 0.31966 0.36539 0.36154 -0.04354 -0.02264 0.02386 4028 CB . ALA B 210 ? 0.25111 0.30507 0.29378 -0.03447 -0.00289 0.01511 4029 N . ALA B 211 ? 0.27467 0.31512 0.29167 -0.04943 -0.00980 0.02365 4030 CA . ALA B 211 ? 0.32763 0.35479 0.32972 -0.05366 -0.01620 0.02829 4031 C . ALA B 211 ? 0.35501 0.39084 0.36876 -0.05913 -0.02208 0.02913 4032 O . ALA B 211 ? 0.33015 0.35842 0.34047 -0.06069 -0.03074 0.03272 4033 CB . ALA B 211 ? 0.35542 0.37049 0.33745 -0.05678 -0.01302 0.02903 4034 N . VAL B 212 ? 0.32321 0.37580 0.35037 -0.06338 -0.01743 0.02539 4035 CA . VAL B 212 ? 0.36009 0.42484 0.40163 -0.06933 -0.02219 0.02465 4036 C . VAL B 212 ? 0.31838 0.39107 0.38332 -0.06323 -0.03078 0.02272 4037 O . VAL B 212 ? 0.35951 0.43072 0.42930 -0.06588 -0.04065 0.02546 4038 CB . VAL B 212 ? 0.29980 0.38428 0.35109 -0.07719 -0.01356 0.01928 4039 CG1 . VAL B 212 ? 0.29125 0.39413 0.36368 -0.08305 -0.01750 0.01605 4040 CG2 . VAL B 212 ? 0.31911 0.39004 0.34380 -0.08562 -0.00983 0.02361 4041 N . ILE B 213 ? 0.29895 0.37811 0.37842 -0.05507 -0.02900 0.01821 4042 CA . ILE B 213 ? 0.32532 0.40873 0.42809 -0.04853 -0.04012 0.01627 4043 C . ILE B 213 ? 0.38225 0.44259 0.46755 -0.04867 -0.05262 0.02555 4044 O . ILE B 213 ? 0.42705 0.48628 0.52563 -0.04800 -0.06636 0.02721 4045 CB . ILE B 213 ? 0.38155 0.47282 0.50041 -0.03982 -0.03624 0.00953 4046 CG1 . ILE B 213 ? 0.25404 0.37076 0.39047 -0.04179 -0.02350 -0.00136 4047 CG2 . ILE B 213 ? 0.38135 0.47161 0.52319 -0.03237 -0.05113 0.00815 4048 CD1 . ILE B 213 ? 0.24654 0.37190 0.39823 -0.03378 -0.01847 -0.00961 4049 N . ASN B 214 ? 0.36742 0.42746 0.27301 -0.03475 -0.02412 0.03644 4050 CA . ASN B 214 ? 0.35754 0.40127 0.22621 -0.03650 -0.02477 0.04311 4051 C . ASN B 214 ? 0.42201 0.46524 0.26316 -0.04600 -0.03147 0.03421 4052 O . ASN B 214 ? 0.53671 0.56538 0.34187 -0.04865 -0.02750 0.03472 4053 CB . ASN B 214 ? 0.40358 0.42876 0.26333 -0.03657 -0.00609 0.04469 4054 CG . ASN B 214 ? 0.47553 0.49347 0.35255 -0.02935 -0.00263 0.05615 4055 OD1 . ASN B 214 ? 0.58618 0.59209 0.44623 -0.02716 -0.00488 0.07062 4056 ND2 . ASN B 214 ? 0.50387 0.52676 0.41246 -0.02640 0.00208 0.04989 4057 N . GLY B 215 ? 0.41766 0.47566 0.27373 -0.05222 -0.04079 0.02546 4058 CA . GLY B 215 ? 0.48632 0.54137 0.31787 -0.06277 -0.05112 0.01637 4059 C . GLY B 215 ? 0.46716 0.50284 0.28449 -0.06909 -0.03981 0.00201 4060 O . GLY B 215 ? 0.66688 0.69091 0.45484 -0.07627 -0.04606 -0.00758 4061 N . ASP B 216 ? 0.46149 0.49236 0.29848 -0.06602 -0.02477 -0.00054 4062 CA . ASP B 216 ? 0.49081 0.50394 0.32159 -0.06937 -0.01563 -0.01288 4063 C . ASP B 216 ? 0.49961 0.52019 0.35638 -0.07717 -0.02167 -0.01590 4064 O . ASP B 216 ? 0.52522 0.55603 0.40832 -0.07459 -0.01566 -0.01113 4065 CB . ASP B 216 ? 0.55351 0.55851 0.38930 -0.06107 0.00338 -0.01168 4066 CG . ASP B 216 ? 0.62904 0.61502 0.44047 -0.05934 0.01408 -0.02312 4067 OD1 . ASP B 216 ? 0.68723 0.66031 0.48257 -0.06456 0.00720 -0.03524 4068 OD2 . ASP B 216 ? 0.60295 0.58727 0.41298 -0.05293 0.02987 -0.02086 4069 N . ARG B 217 ? 0.41138 0.42596 0.25849 -0.08836 -0.03375 -0.02369 4070 CA . ARG B 217 ? 0.52523 0.54803 0.39516 -0.09976 -0.04087 -0.02367 4071 C . ARG B 217 ? 0.48964 0.48396 0.35056 -0.10758 -0.04141 -0.03387 4072 O . ARG B 217 ? 0.41262 0.40976 0.28998 -0.11966 -0.04756 -0.03167 4073 CB . ARG B 217 ? 0.46023 0.50655 0.33743 -0.11003 -0.05847 -0.02070 4074 CG . ARG B 217 ? 0.45334 0.53292 0.35529 -0.10242 -0.05957 -0.00947 4075 CD . ARG B 217 ? 0.39675 0.50455 0.31291 -0.11234 -0.07770 -0.00700 4076 NE . ARG B 217 ? 0.43397 0.57769 0.38599 -0.10495 -0.07624 0.00179 4077 CZ . ARG B 217 ? 0.47392 0.64408 0.45733 -0.11294 -0.07418 0.00333 4078 NH1 . ARG B 217 ? 0.47558 0.63932 0.45934 -0.13085 -0.07536 -0.00018 4079 NH2 . ARG B 217 ? 0.50329 0.70642 0.51804 -0.10284 -0.07044 0.00858 4080 N . TRP B 218 ? 0.44857 0.41536 0.28477 -0.10085 -0.03450 -0.04461 4081 CA . TRP B 218 ? 0.50569 0.44024 0.33150 -0.10641 -0.03751 -0.05705 4082 C . TRP B 218 ? 0.47979 0.40708 0.33052 -0.10822 -0.03450 -0.05135 4083 O . TRP B 218 ? 0.57199 0.47435 0.42109 -0.11763 -0.04244 -0.05658 4084 CB . TRP B 218 ? 0.54251 0.45261 0.34092 -0.09430 -0.02631 -0.07114 4085 CG . TRP B 218 ? 0.43628 0.34884 0.24815 -0.07860 -0.00758 -0.06764 4086 CD1 . TRP B 218 ? 0.48897 0.41916 0.29958 -0.06905 0.00478 -0.06098 4087 CD2 . TRP B 218 ? 0.46300 0.36017 0.29330 -0.07179 -0.00094 -0.06970 4088 NE1 . TRP B 218 ? 0.50905 0.43887 0.33812 -0.05824 0.01904 -0.05983 4089 CE2 . TRP B 218 ? 0.51321 0.42435 0.35509 -0.05855 0.01517 -0.06508 4090 CE3 . TRP B 218 ? 0.52486 0.39701 0.36402 -0.07617 -0.00859 -0.07341 4091 CZ2 . TRP B 218 ? 0.49773 0.40324 0.36175 -0.04876 0.02284 -0.06493 4092 CZ3 . TRP B 218 ? 0.47766 0.34050 0.33642 -0.06494 -0.00122 -0.07190 4093 CH2 . TRP B 218 ? 0.56769 0.44943 0.43970 -0.05096 0.01389 -0.06814 4094 N . PHE B 219 ? 0.46606 0.41181 0.33757 -0.10029 -0.02462 -0.04049 4095 CA . PHE B 219 ? 0.49776 0.43827 0.38856 -0.10163 -0.02274 -0.03357 4096 C . PHE B 219 ? 0.44762 0.40711 0.35459 -0.11736 -0.03080 -0.02257 4097 O . PHE B 219 ? 0.44750 0.40271 0.36571 -0.12154 -0.03060 -0.01470 4098 CB . PHE B 219 ? 0.40140 0.35406 0.30521 -0.08763 -0.00975 -0.02827 4099 CG . PHE B 219 ? 0.40804 0.38975 0.31753 -0.08404 -0.00521 -0.02231 4100 CD1 . PHE B 219 ? 0.38507 0.36830 0.28081 -0.07574 0.00063 -0.02577 4101 CD2 . PHE B 219 ? 0.38301 0.38876 0.31021 -0.08869 -0.00638 -0.01327 4102 CE1 . PHE B 219 ? 0.37113 0.37509 0.27254 -0.07199 0.00307 -0.01862 4103 CE2 . PHE B 219 ? 0.35336 0.38104 0.28744 -0.08307 -0.00272 -0.00957 4104 CZ . PHE B 219 ? 0.29938 0.32406 0.22151 -0.07463 0.00092 -0.01138 4105 N . LEU B 220 ? 0.35791 0.34104 0.26709 -0.12598 -0.03762 -0.02091 4106 CA . LEU B 220 ? 0.37169 0.38070 0.30028 -0.14077 -0.04241 -0.01106 4107 C . LEU B 220 ? 0.51649 0.50387 0.44182 -0.16013 -0.05382 -0.01141 4108 O . LEU B 220 ? 0.54099 0.51377 0.45326 -0.16778 -0.06465 -0.02052 4109 CB . LEU B 220 ? 0.40596 0.45125 0.34442 -0.14137 -0.04634 -0.00938 4110 CG . LEU B 220 ? 0.40489 0.46718 0.34749 -0.12296 -0.03688 -0.00771 4111 CD1 . LEU B 220 ? 0.35233 0.44526 0.30505 -0.12211 -0.04446 -0.00556 4112 CD2 . LEU B 220 ? 0.33305 0.40770 0.29147 -0.11779 -0.02526 -0.00168 4113 N . ASN B 221 ? 0.46369 0.44650 0.39844 -0.16926 -0.05249 -0.00122 4114 CA . ASN B 221 ? 0.60913 0.56336 0.54030 -0.18826 -0.06337 0.00105 4115 C . ASN B 221 ? 0.56678 0.55305 0.51547 -0.21190 -0.06835 0.01180 4116 O . ASN B 221 ? 0.55027 0.58232 0.51486 -0.21105 -0.06362 0.01477 4117 CB . ASN B 221 ? 0.62923 0.55109 0.55724 -0.18409 -0.06101 0.00786 4118 CG . ASN B 221 ? 0.74240 0.69158 0.68223 -0.18492 -0.05259 0.02354 4119 OD1 . ASN B 221 ? 0.72137 0.71256 0.67305 -0.19154 -0.04750 0.02899 4120 ND2 . ASN B 221 ? 0.75707 0.68311 0.69354 -0.17736 -0.05156 0.03000 4121 N . ARG B 222 ? 0.69750 0.65950 0.64557 -0.23310 -0.07749 0.01814 4122 CA . ARG B 222 ? 0.73638 0.72608 0.70154 -0.25147 -0.08000 0.02844 4123 C . ARG B 222 ? 0.66228 0.67257 0.63663 -0.25568 -0.06910 0.04636 4124 O . ARG B 222 ? 0.68548 0.72859 0.67504 -0.26674 -0.06614 0.05466 4125 CB . ARG B 222 ? 0.73003 0.68013 0.68785 -0.26476 -0.09358 0.02482 4126 CG . ARG B 222 ? 0.68292 0.66162 0.65838 -0.28143 -0.09908 0.02863 4127 CD . ARG B 222 ? 0.91233 0.85177 0.87692 -0.29049 -0.11488 0.01610 4128 NE . ARG B 222 ? 0.99632 0.94594 0.95398 -0.28359 -0.12238 -0.00078 4129 CZ . ARG B 222 ? 1.08263 0.99660 1.02162 -0.28507 -0.13495 -0.01768 4130 NH1 . ARG B 222 ? 1.15289 1.01555 1.08079 -0.29176 -0.14112 -0.02205 4131 NH2 . ARG B 222 ? 1.14027 1.06974 1.07017 -0.27875 -0.14170 -0.03078 4132 N . PHE B 223 ? 0.59720 0.59047 0.56165 -0.24719 -0.06328 0.05199 4133 CA . PHE B 223 ? 0.61529 0.61933 0.57971 -0.25190 -0.05587 0.06900 4134 C . PHE B 223 ? 0.50024 0.55092 0.47173 -0.24173 -0.04114 0.06970 4135 O . PHE B 223 ? 0.52806 0.59724 0.50554 -0.22948 -0.03684 0.05840 4136 CB . PHE B 223 ? 0.72432 0.67906 0.67293 -0.24891 -0.06157 0.07658 4137 CG . PHE B 223 ? 0.72104 0.62113 0.66148 -0.24885 -0.07501 0.06742 4138 CD1 . PHE B 223 ? 0.81709 0.69878 0.75881 -0.26342 -0.08440 0.06816 4139 CD2 . PHE B 223 ? 0.77484 0.64263 0.70666 -0.23060 -0.07677 0.05589 4140 CE1 . PHE B 223 ? 0.86661 0.69567 0.79920 -0.26157 -0.09618 0.05637 4141 CE2 . PHE B 223 ? 0.81032 0.62723 0.73319 -0.22654 -0.08702 0.04358 4142 CZ . PHE B 223 ? 0.93743 0.73229 0.85936 -0.24369 -0.09759 0.04333 4143 N . THR B 224 ? 0.43935 0.50747 0.40827 -0.24713 -0.03370 0.08253 4144 CA . THR B 224 ? 0.43768 0.54018 0.40639 -0.23717 -0.02011 0.08245 4145 C . THR B 224 ? 0.46762 0.54939 0.41671 -0.23939 -0.02098 0.09603 4146 O . THR B 224 ? 0.47273 0.51413 0.41174 -0.24705 -0.03226 0.10627 4147 CB . THR B 224 ? 0.36804 0.52176 0.35250 -0.24087 -0.00917 0.08145 4148 OG1 . THR B 224 ? 0.37258 0.55640 0.35731 -0.22733 0.00405 0.07529 4149 CG2 . THR B 224 ? 0.40301 0.55958 0.38292 -0.25903 -0.00880 0.09614 4150 N . THR B 225 ? 0.49963 0.60735 0.44277 -0.23194 -0.01046 0.09564 4151 CA . THR B 225 ? 0.44601 0.53804 0.36839 -0.23336 -0.01303 0.10813 4152 C . THR B 225 ? 0.43305 0.56627 0.34907 -0.23148 0.00054 0.10575 4153 O . THR B 225 ? 0.42017 0.59056 0.35057 -0.22730 0.01217 0.09410 4154 CB . THR B 225 ? 0.45440 0.51566 0.37122 -0.22135 -0.01990 0.10642 4155 OG1 . THR B 225 ? 0.62228 0.66410 0.52006 -0.22398 -0.02734 0.12214 4156 CG2 . THR B 225 ? 0.36445 0.45155 0.28850 -0.20311 -0.00972 0.08932 4157 N . THR B 226 ? 0.51275 0.63799 0.40696 -0.23416 -0.00206 0.11651 4158 CA . THR B 226 ? 0.47159 0.62907 0.35329 -0.23145 0.00917 0.11195 4159 C . THR B 226 ? 0.43700 0.58532 0.30777 -0.21873 0.00642 0.10655 4160 O . THR B 226 ? 0.49559 0.61166 0.36667 -0.21423 -0.00505 0.11163 4161 CB . THR B 226 ? 0.46189 0.62111 0.32316 -0.24701 0.00777 0.12873 4162 OG1 . THR B 226 ? 0.54157 0.66184 0.38526 -0.24974 -0.00864 0.14536 4163 CG2 . THR B 226 ? 0.47849 0.64393 0.35134 -0.26228 0.00947 0.13657 4164 N . LEU B 227 ? 0.39782 0.57474 0.25950 -0.21302 0.01717 0.09536 4165 CA . LEU B 227 ? 0.50846 0.67963 0.35816 -0.20258 0.01428 0.08883 4166 C . LEU B 227 ? 0.51838 0.66165 0.34544 -0.20844 -0.00257 0.10793 4167 O . LEU B 227 ? 0.46743 0.58835 0.29768 -0.19764 -0.01421 0.10782 4168 CB . LEU B 227 ? 0.47800 0.68194 0.31981 -0.19648 0.02816 0.07118 4169 CG . LEU B 227 ? 0.55332 0.75898 0.39574 -0.18188 0.03061 0.05338 4170 CD1 . LEU B 227 ? 0.42835 0.62058 0.30323 -0.16759 0.02883 0.04436 4171 CD2 . LEU B 227 ? 0.55259 0.78761 0.39151 -0.17518 0.04559 0.03287 4172 N . ASN B 228 ? 0.49540 0.63868 0.30567 -0.22137 -0.00593 0.12252 4173 CA . ASN B 228 ? 0.55984 0.67631 0.34982 -0.22578 -0.02413 0.14242 4174 C . ASN B 228 ? 0.57054 0.64520 0.37334 -0.22423 -0.04002 0.15679 4175 O . ASN B 228 ? 0.62474 0.67517 0.42362 -0.21650 -0.05607 0.16570 4176 CB . ASN B 228 ? 0.55564 0.68119 0.32483 -0.24097 -0.02290 0.15574 4177 CG . ASN B 228 ? 0.63740 0.79704 0.38705 -0.24087 -0.01050 0.14281 4178 OD1 . ASN B 228 ? 0.69271 0.86299 0.44105 -0.22914 -0.00735 0.12530 4179 ND2 . ASN B 228 ? 0.57981 0.75510 0.31317 -0.25425 -0.00326 0.15084 4180 N . ASP B 229 ? 0.51305 0.57825 0.33268 -0.23030 -0.03696 0.15806 4181 CA . ASP B 229 ? 0.61172 0.63289 0.44369 -0.22792 -0.05124 0.16757 4182 C . ASP B 229 ? 0.58213 0.59278 0.43305 -0.20800 -0.05293 0.15211 4183 O . ASP B 229 ? 0.51028 0.48768 0.37000 -0.19513 -0.06739 0.15559 4184 CB . ASP B 229 ? 0.68176 0.69719 0.52721 -0.23860 -0.04761 0.16712 4185 CG . ASP B 229 ? 0.84498 0.85009 0.67721 -0.25476 -0.05379 0.18623 4186 OD1 . ASP B 229 ? 0.88890 0.86689 0.70724 -0.25456 -0.06848 0.20314 4187 OD2 . ASP B 229 ? 0.92167 0.94655 0.75858 -0.26752 -0.04454 0.18532 4188 N . PHE B 230 ? 0.43825 0.47842 0.30196 -0.19905 -0.03827 0.12995 4189 CA . PHE B 230 ? 0.45729 0.49036 0.34210 -0.17627 -0.03877 0.11117 4190 C . PHE B 230 ? 0.46295 0.49401 0.34471 -0.16379 -0.04769 0.11107 4191 O . PHE B 230 ? 0.45213 0.46438 0.35127 -0.14781 -0.05526 0.10634 4192 CB . PHE B 230 ? 0.38681 0.45007 0.28369 -0.17058 -0.02275 0.09096 4193 CG . PHE B 230 ? 0.44168 0.50130 0.35550 -0.14977 -0.02165 0.07407 4194 CD1 . PHE B 230 ? 0.44236 0.48225 0.37175 -0.14042 -0.02307 0.06702 4195 CD2 . PHE B 230 ? 0.49519 0.57055 0.40742 -0.14129 -0.01905 0.06520 4196 CE1 . PHE B 230 ? 0.39653 0.43517 0.33948 -0.12346 -0.02012 0.05375 4197 CE2 . PHE B 230 ? 0.44098 0.51292 0.37004 -0.12533 -0.01769 0.05205 4198 CZ . PHE B 230 ? 0.38587 0.44078 0.33029 -0.11661 -0.01731 0.04745 4199 N . ASN B 231 ? 0.46455 0.51730 0.32468 -0.17136 -0.04684 0.11540 4200 CA . ASN B 231 ? 0.48877 0.54295 0.34595 -0.16159 -0.05763 0.11415 4201 C . ASN B 231 ? 0.55318 0.57788 0.41038 -0.15901 -0.07870 0.13416 4202 O . ASN B 231 ? 0.51799 0.53978 0.38828 -0.14556 -0.09014 0.13180 4203 CB . ASN B 231 ? 0.45643 0.53931 0.28487 -0.17165 -0.05272 0.11217 4204 CG . ASN B 231 ? 0.50780 0.61729 0.34293 -0.16661 -0.03428 0.08767 4205 OD1 . ASN B 231 ? 0.38449 0.49045 0.24624 -0.15360 -0.02878 0.07325 4206 ND2 . ASN B 231 ? 0.53845 0.67374 0.34825 -0.17627 -0.02449 0.08289 4207 N . LEU B 232 ? 0.46699 0.46965 0.31268 -0.17166 -0.08490 0.15446 4208 CA . LEU B 232 ? 0.50927 0.47748 0.35822 -0.16666 -0.10630 0.17411 4209 C . LEU B 232 ? 0.60610 0.55261 0.49115 -0.14437 -0.10973 0.16171 4210 O . LEU B 232 ? 0.70131 0.63428 0.60104 -0.12981 -0.12550 0.16768 4211 CB . LEU B 232 ? 0.59072 0.53403 0.42114 -0.18628 -0.11133 0.19812 4212 CG . LEU B 232 ? 0.69495 0.61521 0.50560 -0.19183 -0.13392 0.22798 4213 CD1 . LEU B 232 ? 0.68895 0.64461 0.47229 -0.19986 -0.13213 0.22880 4214 CD2 . LEU B 232 ? 0.67120 0.56286 0.48015 -0.20402 -0.13617 0.24074 4215 N . VAL B 233 ? 0.51606 0.46186 0.41587 -0.14103 -0.09494 0.14415 4216 CA . VAL B 233 ? 0.59811 0.52632 0.52707 -0.12079 -0.09442 0.12989 4217 C . VAL B 233 ? 0.59200 0.54770 0.53886 -0.10579 -0.08696 0.11178 4218 O . VAL B 233 ? 0.65577 0.60421 0.62765 -0.08769 -0.09035 0.10525 4219 CB . VAL B 233 ? 0.59513 0.50921 0.52687 -0.12553 -0.08390 0.11974 4220 CG1 . VAL B 233 ? 0.59129 0.48712 0.54676 -0.10498 -0.08163 0.10331 4221 CG2 . VAL B 233 ? 0.60143 0.48671 0.51785 -0.14365 -0.09247 0.13836 4222 N . ALA B 234 ? 0.51075 0.49798 0.44695 -0.11312 -0.07620 0.10320 4223 CA . ALA B 234 ? 0.52080 0.53024 0.47303 -0.10192 -0.07028 0.08730 4224 C . ALA B 234 ? 0.46843 0.48278 0.42983 -0.09483 -0.08625 0.09441 4225 O . ALA B 234 ? 0.41446 0.43407 0.40376 -0.08063 -0.08671 0.08588 4226 CB . ALA B 234 ? 0.46509 0.50159 0.40254 -0.11120 -0.05744 0.07685 4227 N . MET B 235 ? 0.45127 0.46661 0.38956 -0.10555 -0.09987 0.11100 4228 CA . MET B 235 ? 0.46761 0.48956 0.41279 -0.09997 -0.11913 0.11967 4229 C . MET B 235 ? 0.47904 0.48049 0.45600 -0.08238 -0.13146 0.12693 4230 O . MET B 235 ? 0.46346 0.47804 0.46623 -0.07067 -0.14215 0.12563 4231 CB . MET B 235 ? 0.69491 0.71853 0.60228 -0.11608 -0.13251 0.13894 4232 CG . MET B 235 ? 0.83528 0.88379 0.71085 -0.13152 -0.11986 0.12925 4233 SD . MET B 235 ? 1.20561 1.25551 1.02936 -0.15290 -0.13086 0.15341 4234 CE . MET B 235 ? 0.89691 0.97776 0.69290 -0.16610 -0.10573 0.13309 4235 N . LYS B 236 ? 0.44220 0.41219 0.41995 -0.08014 -0.13038 0.13348 4236 CA . LYS B 236 ? 0.49361 0.44017 0.50212 -0.06071 -0.14022 0.13700 4237 C . LYS B 236 ? 0.46219 0.42257 0.50661 -0.04293 -0.12625 0.11499 4238 O . LYS B 236 ? 0.42861 0.38778 0.50664 -0.02399 -0.13378 0.11462 4239 CB . LYS B 236 ? 0.53932 0.44423 0.53681 -0.06450 -0.14126 0.14571 4240 CG . LYS B 236 ? 0.68695 0.55849 0.71119 -0.04442 -0.15479 0.15169 4241 CD . LYS B 236 ? 0.86745 0.69596 0.87018 -0.05508 -0.17023 0.17526 4242 CE . LYS B 236 ? 0.89758 0.71351 0.87225 -0.07730 -0.15664 0.17293 4243 NZ . LYS B 236 ? 0.90821 0.68629 0.85942 -0.09401 -0.17130 0.19927 4244 N . TYR B 237 ? 0.38220 0.35736 0.42109 -0.04843 -0.10578 0.09760 4245 CA . TYR B 237 ? 0.35044 0.33836 0.41696 -0.03504 -0.09040 0.07880 4246 C . TYR B 237 ? 0.36448 0.38802 0.44113 -0.03787 -0.08622 0.07076 4247 O . TYR B 237 ? 0.40484 0.44062 0.49487 -0.03380 -0.06997 0.05623 4248 CB . TYR B 237 ? 0.39245 0.36709 0.44594 -0.03840 -0.07239 0.06642 4249 CG . TYR B 237 ? 0.42036 0.35774 0.47291 -0.03208 -0.07527 0.06799 4250 CD1 . TYR B 237 ? 0.42956 0.34155 0.45773 -0.04574 -0.08429 0.08106 4251 CD2 . TYR B 237 ? 0.44448 0.37154 0.52036 -0.01322 -0.06831 0.05559 4252 CE1 . TYR B 237 ? 0.51930 0.39192 0.54686 -0.04160 -0.08854 0.08162 4253 CE2 . TYR B 237 ? 0.41862 0.30728 0.49217 -0.00664 -0.07130 0.05357 4254 CZ . TYR B 237 ? 0.50339 0.36254 0.55303 -0.02124 -0.08259 0.06656 4255 OH . TYR B 237 ? 0.55001 0.36581 0.59750 -0.01630 -0.08708 0.06370 4256 N . ASN B 238 ? 0.41001 0.44825 0.47842 -0.04595 -0.10156 0.08034 4257 CA . ASN B 238 ? 0.40107 0.46951 0.47751 -0.05092 -0.10147 0.07215 4258 C . ASN B 238 ? 0.34330 0.41824 0.40410 -0.06010 -0.08211 0.05731 4259 O . ASN B 238 ? 0.30832 0.39895 0.38742 -0.05859 -0.07328 0.04568 4260 CB . ASN B 238 ? 0.39523 0.48224 0.51773 -0.03680 -0.10333 0.06742 4261 CG . ASN B 238 ? 0.60166 0.69890 0.74131 -0.03186 -0.12892 0.08143 4262 OD1 . ASN B 238 ? 0.61325 0.71322 0.72690 -0.04362 -0.14557 0.09136 4263 ND2 . ASN B 238 ? 0.68779 0.79269 0.87121 -0.01380 -0.13227 0.08218 4264 N . TYR B 239 ? 0.34004 0.40320 0.36922 -0.06980 -0.07592 0.05885 4265 CA . TYR B 239 ? 0.36313 0.43398 0.37713 -0.07757 -0.06055 0.04645 4266 C . TYR B 239 ? 0.44954 0.53271 0.43610 -0.09062 -0.06624 0.04698 4267 O . TYR B 239 ? 0.37064 0.45172 0.33865 -0.09712 -0.07968 0.06030 4268 CB . TYR B 239 ? 0.30327 0.35918 0.30486 -0.07914 -0.04872 0.04564 4269 CG . TYR B 239 ? 0.31561 0.36495 0.33552 -0.06876 -0.03617 0.03618 4270 CD1 . TYR B 239 ? 0.33983 0.38118 0.38283 -0.05614 -0.03815 0.03687 4271 CD2 . TYR B 239 ? 0.34665 0.39884 0.35990 -0.07081 -0.02236 0.02665 4272 CE1 . TYR B 239 ? 0.31445 0.35133 0.36874 -0.04743 -0.02477 0.02736 4273 CE2 . TYR B 239 ? 0.35785 0.40390 0.38172 -0.06262 -0.01188 0.01961 4274 CZ . TYR B 239 ? 0.31621 0.35481 0.35815 -0.05177 -0.01219 0.01956 4275 OH . TYR B 239 ? 0.31800 0.35202 0.36524 -0.04441 0.00008 0.01172 4276 N . GLU B 240 ? 0.39386 0.48830 0.37622 -0.09414 -0.05598 0.03228 4277 CA . GLU B 240 ? 0.34312 0.44869 0.29690 -0.10519 -0.05785 0.02774 4278 C . GLU B 240 ? 0.37964 0.48331 0.30579 -0.11321 -0.05144 0.03486 4279 O . GLU B 240 ? 0.42595 0.52304 0.35762 -0.11078 -0.04011 0.03466 4280 CB . GLU B 240 ? 0.39762 0.51011 0.35490 -0.10501 -0.04684 0.00839 4281 CG . GLU B 240 ? 0.36786 0.48702 0.34004 -0.10592 -0.05660 0.00057 4282 CD . GLU B 240 ? 0.56835 0.68759 0.53885 -0.10768 -0.04681 -0.01859 4283 OE1 . GLU B 240 ? 0.50118 0.61749 0.45946 -0.10590 -0.03275 -0.02525 4284 OE2 . GLU B 240 ? 0.57441 0.69627 0.55813 -0.11082 -0.05399 -0.02688 4285 N . PRO B 241 ? 0.41542 0.52660 0.31121 -0.12429 -0.05865 0.04187 4286 CA . PRO B 241 ? 0.47951 0.59484 0.34976 -0.13467 -0.04923 0.04832 4287 C . PRO B 241 ? 0.45759 0.58665 0.32786 -0.13345 -0.02948 0.02963 4288 O . PRO B 241 ? 0.46401 0.60196 0.33203 -0.13086 -0.02579 0.01231 4289 CB . PRO B 241 ? 0.49793 0.62179 0.33264 -0.14703 -0.06065 0.05811 4290 CG . PRO B 241 ? 0.47437 0.59172 0.32152 -0.14150 -0.08215 0.06422 4291 CD . PRO B 241 ? 0.47240 0.59029 0.35479 -0.12925 -0.07673 0.04623 4292 N . LEU B 242 ? 0.41498 0.54457 0.29034 -0.13485 -0.01821 0.03283 4293 CA . LEU B 242 ? 0.46875 0.61380 0.34947 -0.13166 -0.00091 0.01712 4294 C . LEU B 242 ? 0.47076 0.63947 0.32370 -0.14190 0.00834 0.01324 4295 O . LEU B 242 ? 0.49548 0.66973 0.32730 -0.15549 0.00670 0.02908 4296 CB . LEU B 242 ? 0.35470 0.49580 0.25289 -0.13019 0.00544 0.02205 4297 CG . LEU B 242 ? 0.38224 0.53430 0.29803 -0.12089 0.01845 0.00675 4298 CD1 . LEU B 242 ? 0.32512 0.46290 0.25859 -0.10735 0.01624 -0.00369 4299 CD2 . LEU B 242 ? 0.39368 0.54720 0.32102 -0.12402 0.02177 0.01389 4300 N . THR B 243 ? 0.43384 0.61526 0.28599 -0.13550 0.01865 -0.00785 4301 CA . THR B 243 ? 0.42135 0.62700 0.24699 -0.14206 0.03039 -0.01773 4302 C . THR B 243 ? 0.46481 0.69224 0.30661 -0.13679 0.04986 -0.02781 4303 O . THR B 243 ? 0.38801 0.60988 0.25976 -0.12806 0.05157 -0.02741 4304 CB . THR B 243 ? 0.45158 0.65440 0.26344 -0.13771 0.02707 -0.03793 4305 OG1 . THR B 243 ? 0.47433 0.67153 0.31194 -0.12275 0.03487 -0.05799 4306 CG2 . THR B 243 ? 0.53522 0.71840 0.34476 -0.14024 0.00520 -0.02873 4307 N . GLN B 244 ? 0.49194 0.74641 0.31404 -0.14152 0.06430 -0.03721 4308 CA . GLN B 244 ? 0.46052 0.73795 0.30653 -0.13271 0.08125 -0.04787 4309 C . GLN B 244 ? 0.51633 0.79140 0.38086 -0.11421 0.08822 -0.07260 4310 O . GLN B 244 ? 0.42322 0.70995 0.31831 -0.10349 0.09650 -0.07712 4311 CB . GLN B 244 ? 0.47203 0.77146 0.30193 -0.13779 0.09176 -0.05070 4312 CG . GLN B 244 ? 0.53399 0.86123 0.38922 -0.12746 0.10938 -0.06278 4313 CD . GLN B 244 ? 0.57177 0.90853 0.45748 -0.13024 0.10912 -0.04794 4314 OE1 . GLN B 244 ? 0.64134 0.96718 0.52258 -0.14452 0.09859 -0.02628 4315 NE2 . GLN B 244 ? 0.51256 0.86796 0.43004 -0.11605 0.11918 -0.05987 4316 N . ASP B 245 ? 0.47002 0.72435 0.32186 -0.10898 0.08080 -0.08703 4317 CA . ASP B 245 ? 0.44570 0.68388 0.32011 -0.09095 0.08207 -0.10714 4318 C . ASP B 245 ? 0.38318 0.60093 0.29004 -0.08363 0.07301 -0.09500 4319 O . ASP B 245 ? 0.38979 0.60499 0.32257 -0.06903 0.07809 -0.10328 4320 CB . ASP B 245 ? 0.44475 0.66157 0.29877 -0.09152 0.07294 -0.12284 4321 CG . ASP B 245 ? 0.61400 0.84928 0.43419 -0.09482 0.08413 -0.14287 4322 OD1 . ASP B 245 ? 0.72123 0.96590 0.55429 -0.08084 0.09881 -0.16055 4323 OD2 . ASP B 245 ? 0.71270 0.94617 0.50258 -0.10779 0.07438 -0.13526 4324 N . HIS B 246 ? 0.45989 0.66280 0.36463 -0.09281 0.05946 -0.07533 4325 CA . HIS B 246 ? 0.35118 0.53668 0.28149 -0.08696 0.05270 -0.06431 4326 C . HIS B 246 ? 0.38472 0.58781 0.33268 -0.08442 0.06029 -0.05776 4327 O . HIS B 246 ? 0.32313 0.51858 0.29339 -0.07352 0.05984 -0.05871 4328 CB . HIS B 246 ? 0.42651 0.59592 0.35073 -0.09613 0.03869 -0.04675 4329 CG . HIS B 246 ? 0.45041 0.60371 0.36841 -0.09702 0.02806 -0.05172 4330 ND1 . HIS B 246 ? 0.51131 0.65833 0.41943 -0.10551 0.01483 -0.03883 4331 CD2 . HIS B 246 ? 0.34329 0.48570 0.26631 -0.09112 0.02724 -0.06783 4332 CE1 . HIS B 246 ? 0.38823 0.52605 0.29724 -0.10518 0.00616 -0.04692 4333 NE2 . HIS B 246 ? 0.52000 0.65352 0.43705 -0.09786 0.01365 -0.06477 4334 N . VAL B 247 ? 0.42288 0.65057 0.36084 -0.09591 0.06635 -0.04988 4335 CA . VAL B 247 ? 0.36569 0.61591 0.32365 -0.09607 0.07304 -0.04451 4336 C . VAL B 247 ? 0.34921 0.61743 0.32858 -0.07936 0.08417 -0.06217 4337 O . VAL B 247 ? 0.31163 0.58557 0.31708 -0.07093 0.08312 -0.06015 4338 CB . VAL B 247 ? 0.39965 0.67531 0.34329 -0.11467 0.07891 -0.03244 4339 CG1 . VAL B 247 ? 0.29941 0.60158 0.26859 -0.11749 0.08445 -0.02671 4340 CG2 . VAL B 247 ? 0.34676 0.59842 0.27023 -0.12906 0.06542 -0.01366 4341 N . ASP B 248 ? 0.38800 0.66416 0.35626 -0.07344 0.09379 -0.08042 4342 CA . ASP B 248 ? 0.41035 0.69938 0.40066 -0.05426 0.10429 -0.09960 4343 C . ASP B 248 ? 0.35750 0.61300 0.36633 -0.03872 0.09408 -0.10257 4344 O . ASP B 248 ? 0.40137 0.66390 0.43828 -0.02352 0.09592 -0.10601 4345 CB . ASP B 248 ? 0.46550 0.76425 0.43513 -0.05119 0.11664 -0.12164 4346 CG . ASP B 248 ? 0.59909 0.93358 0.56002 -0.06024 0.12888 -0.11866 4347 OD1 . ASP B 248 ? 0.59266 0.95381 0.58171 -0.05230 0.13710 -0.11868 4348 OD2 . ASP B 248 ? 0.65332 0.98488 0.58124 -0.07499 0.12696 -0.11320 4349 N . ILE B 249 ? 0.32794 0.54857 0.32256 -0.04296 0.08274 -0.09950 4350 CA . ILE B 249 ? 0.38991 0.57816 0.39928 -0.03175 0.07427 -0.10006 4351 C . ILE B 249 ? 0.28818 0.47483 0.31492 -0.03014 0.06766 -0.08260 4352 O . ILE B 249 ? 0.39263 0.56791 0.43773 -0.01685 0.06485 -0.08273 4353 CB . ILE B 249 ? 0.39375 0.55254 0.38626 -0.03998 0.06487 -0.09999 4354 CG1 . ILE B 249 ? 0.39676 0.55203 0.37380 -0.03864 0.06917 -0.12198 4355 CG2 . ILE B 249 ? 0.44519 0.57372 0.45236 -0.03436 0.05651 -0.09315 4356 CD1 . ILE B 249 ? 0.47665 0.61404 0.43434 -0.05113 0.05857 -0.12209 4357 N . LEU B 250 ? 0.41261 0.60881 0.43190 -0.04377 0.06413 -0.06746 4358 CA . LEU B 250 ? 0.29345 0.48838 0.32428 -0.04437 0.05732 -0.05335 4359 C . LEU B 250 ? 0.32517 0.55213 0.37726 -0.03907 0.06143 -0.05356 4360 O . LEU B 250 ? 0.35304 0.58292 0.41343 -0.04168 0.05416 -0.04263 4361 CB . LEU B 250 ? 0.30306 0.49241 0.31871 -0.06063 0.05127 -0.03949 4362 CG . LEU B 250 ? 0.36770 0.52875 0.36955 -0.06432 0.04494 -0.03662 4363 CD1 . LEU B 250 ? 0.32951 0.48727 0.31859 -0.07800 0.03934 -0.02418 4364 CD2 . LEU B 250 ? 0.31670 0.45411 0.32704 -0.05564 0.04034 -0.03432 4365 N . GLY B 251 ? 0.33818 0.59079 0.40024 -0.03142 0.07265 -0.06685 4366 CA . GLY B 251 ? 0.30519 0.59717 0.39315 -0.02646 0.07815 -0.06777 4367 C . GLY B 251 ? 0.38600 0.67547 0.49946 -0.01199 0.06853 -0.06308 4368 O . GLY B 251 ? 0.30804 0.61631 0.43427 -0.01799 0.06181 -0.05209 4369 N . PRO B 252 ? 0.42197 0.68728 0.54262 0.00648 0.06626 -0.07079 4370 CA . PRO B 252 ? 0.35680 0.61683 0.49880 0.02083 0.05497 -0.06326 4371 C . PRO B 252 ? 0.34765 0.58958 0.47639 0.00990 0.04109 -0.04538 4372 O . PRO B 252 ? 0.28805 0.54437 0.43191 0.01343 0.03123 -0.03655 4373 CB . PRO B 252 ? 0.36834 0.59360 0.51184 0.03824 0.05487 -0.07282 4374 CG . PRO B 252 ? 0.33590 0.56856 0.47272 0.03890 0.06947 -0.09257 4375 CD . PRO B 252 ? 0.41745 0.66283 0.52971 0.01566 0.07371 -0.08776 4376 N . LEU B 253 ? 0.27100 0.48330 0.37234 -0.00259 0.03968 -0.04082 4377 CA . LEU B 253 ? 0.38861 0.58515 0.47573 -0.01221 0.02925 -0.02703 4378 C . LEU B 253 ? 0.34664 0.57076 0.43677 -0.02590 0.02593 -0.02135 4379 O . LEU B 253 ? 0.30707 0.53096 0.39668 -0.02865 0.01492 -0.01286 4380 CB . LEU B 253 ? 0.29807 0.46318 0.36078 -0.02141 0.03059 -0.02523 4381 CG . LEU B 253 ? 0.40673 0.53930 0.46499 -0.01313 0.03028 -0.02572 4382 CD1 . LEU B 253 ? 0.22952 0.34072 0.26967 -0.02396 0.03141 -0.02288 4383 CD2 . LEU B 253 ? 0.27358 0.39465 0.33573 -0.00371 0.02191 -0.01593 4384 N . SER B 254 ? 0.38175 0.62896 0.47308 -0.03626 0.03478 -0.02560 4385 CA . SER B 254 ? 0.29947 0.57128 0.39482 -0.05277 0.03199 -0.01887 4386 C . SER B 254 ? 0.35083 0.65896 0.47698 -0.04688 0.02709 -0.01782 4387 O . SER B 254 ? 0.34159 0.65780 0.47103 -0.05757 0.01594 -0.00997 4388 CB . SER B 254 ? 0.35684 0.64613 0.44563 -0.06585 0.04376 -0.02127 4389 OG . SER B 254 ? 0.38679 0.70245 0.48356 -0.08346 0.04215 -0.01352 4390 N . ALA B 255 ? 0.28167 0.61218 0.43222 -0.02934 0.03427 -0.02670 4391 CA . ALA B 255 ? 0.35882 0.72926 0.54580 -0.02061 0.02913 -0.02584 4392 C . ALA B 255 ? 0.32421 0.67620 0.51296 -0.01044 0.01043 -0.01726 4393 O . ALA B 255 ? 0.29593 0.67555 0.50513 -0.01254 -0.00176 -0.01092 4394 CB . ALA B 255 ? 0.24669 0.64421 0.46096 -0.00094 0.04294 -0.03967 4395 N . GLN B 256 ? 0.30544 0.61293 0.47278 -0.00070 0.00740 -0.01610 4396 CA . GLN B 256 ? 0.31461 0.60240 0.47699 0.00757 -0.00936 -0.00569 4397 C . GLN B 256 ? 0.28478 0.56599 0.42535 -0.01109 -0.02141 0.00332 4398 O . GLN B 256 ? 0.33933 0.62920 0.48448 -0.00940 -0.03776 0.01116 4399 CB . GLN B 256 ? 0.37960 0.62111 0.52209 0.01802 -0.00720 -0.00510 4400 CG . GLN B 256 ? 0.56254 0.77783 0.68903 0.02233 -0.02240 0.00860 4401 CD . GLN B 256 ? 0.67653 0.84890 0.78772 0.03076 -0.01861 0.01091 4402 OE1 . GLN B 256 ? 0.60895 0.77089 0.72443 0.03450 -0.00653 0.00055 4403 NE2 . GLN B 256 ? 0.58198 0.72958 0.67367 0.03199 -0.02917 0.02474 4404 N . THR B 257 ? 0.29519 0.56006 0.41152 -0.02841 -0.01487 0.00167 4405 CA . THR B 257 ? 0.24677 0.49937 0.34090 -0.04541 -0.02494 0.00677 4406 C . THR B 257 ? 0.33475 0.62056 0.44442 -0.06307 -0.02853 0.00689 4407 O . THR B 257 ? 0.32103 0.59994 0.41752 -0.07686 -0.04083 0.00995 4408 CB . THR B 257 ? 0.29867 0.51308 0.36139 -0.05311 -0.01729 0.00521 4409 OG1 . THR B 257 ? 0.23314 0.45575 0.30024 -0.06064 -0.00496 0.00059 4410 CG2 . THR B 257 ? 0.27676 0.46102 0.32659 -0.03917 -0.01339 0.00622 4411 N . GLY B 258 ? 0.39030 0.71168 0.52664 -0.06417 -0.01766 0.00313 4412 CA . GLY B 258 ? 0.31700 0.67190 0.46949 -0.08423 -0.01871 0.00523 4413 C . GLY B 258 ? 0.35465 0.68742 0.48266 -0.10534 -0.01359 0.00715 4414 O . GLY B 258 ? 0.38681 0.73485 0.52130 -0.12634 -0.01847 0.01146 4415 N . ILE B 259 ? 0.34090 0.63780 0.44301 -0.10083 -0.00522 0.00498 4416 CA . ILE B 259 ? 0.28503 0.55564 0.36358 -0.11719 -0.00272 0.00815 4417 C . ILE B 259 ? 0.35484 0.63504 0.43244 -0.11706 0.01313 0.00654 4418 O . ILE B 259 ? 0.36692 0.63607 0.43884 -0.10156 0.02029 0.00057 4419 CB . ILE B 259 ? 0.33021 0.55258 0.37965 -0.11217 -0.00823 0.00731 4420 CG1 . ILE B 259 ? 0.38724 0.59960 0.42990 -0.11549 -0.02360 0.00770 4421 CG2 . ILE B 259 ? 0.38870 0.58427 0.41883 -0.12374 -0.00506 0.01021 4422 CD1 . ILE B 259 ? 0.40106 0.57376 0.41668 -0.10637 -0.02583 0.00513 4423 N . ALA B 260 ? 0.38779 0.68766 0.46885 -0.13602 0.01799 0.01222 4424 CA . ALA B 260 ? 0.29304 0.60252 0.36602 -0.13912 0.03245 0.01209 4425 C . ALA B 260 ? 0.31859 0.58494 0.36252 -0.13474 0.03146 0.01223 4426 O . ALA B 260 ? 0.32375 0.55416 0.35348 -0.13727 0.02102 0.01605 4427 CB . ALA B 260 ? 0.26386 0.58709 0.33572 -0.16027 0.03474 0.02194 4428 N . VAL B 261 ? 0.32966 0.60174 0.36596 -0.12765 0.04239 0.00661 4429 CA . VAL B 261 ? 0.31871 0.55616 0.33229 -0.12289 0.04020 0.00605 4430 C . VAL B 261 ? 0.37613 0.59095 0.37117 -0.13976 0.03307 0.01920 4431 O . VAL B 261 ? 0.34970 0.52999 0.33374 -0.13590 0.02481 0.02137 4432 CB . VAL B 261 ? 0.31958 0.57014 0.32702 -0.11517 0.05161 -0.00374 4433 CG1 . VAL B 261 ? 0.32802 0.54684 0.31455 -0.11276 0.04670 -0.00359 4434 CG2 . VAL B 261 ? 0.31271 0.57781 0.34044 -0.09592 0.05731 -0.01761 4435 N . LEU B 262 ? 0.34885 0.58291 0.34185 -0.15849 0.03642 0.02891 4436 CA . LEU B 262 ? 0.35910 0.56733 0.33479 -0.17529 0.02800 0.04400 4437 C . LEU B 262 ? 0.37556 0.55645 0.35631 -0.18017 0.01500 0.04762 4438 O . LEU B 262 ? 0.38520 0.53032 0.35241 -0.18594 0.00543 0.05604 4439 CB . LEU B 262 ? 0.29811 0.52450 0.26707 -0.18858 0.03261 0.05275 4440 CG . LEU B 262 ? 0.34755 0.58927 0.29966 -0.18563 0.04236 0.05005 4441 CD1 . LEU B 262 ? 0.35527 0.61780 0.30187 -0.19877 0.04815 0.05796 4442 CD2 . LEU B 262 ? 0.38397 0.59561 0.31230 -0.18638 0.03468 0.05697 4443 N . ASP B 263 ? 0.33760 0.53366 0.33693 -0.17718 0.01338 0.04070 4444 CA . ASP B 263 ? 0.35378 0.52196 0.35285 -0.18006 0.00029 0.04008 4445 C . ASP B 263 ? 0.38529 0.51900 0.37323 -0.16127 -0.00362 0.03225 4446 O . ASP B 263 ? 0.42537 0.52295 0.40233 -0.16306 -0.01228 0.03311 4447 CB . ASP B 263 ? 0.30430 0.50189 0.32466 -0.18235 -0.00250 0.03526 4448 CG . ASP B 263 ? 0.43287 0.66077 0.46658 -0.19917 0.00018 0.04283 4449 OD1 . ASP B 263 ? 0.50681 0.73080 0.52898 -0.20691 0.00550 0.05153 4450 OD2 . ASP B 263 ? 0.34018 0.59269 0.39398 -0.20123 -0.00402 0.04008 4451 N . MET B 264 ? 0.35305 0.49723 0.34485 -0.14336 0.00343 0.02412 4452 CA . MET B 264 ? 0.40354 0.51957 0.38667 -0.12788 0.00214 0.01856 4453 C . MET B 264 ? 0.35902 0.45235 0.33068 -0.12854 0.00096 0.02382 4454 O . MET B 264 ? 0.36956 0.43530 0.33594 -0.12081 -0.00279 0.02172 4455 CB . MET B 264 ? 0.32846 0.45927 0.31965 -0.11165 0.00936 0.01074 4456 CG . MET B 264 ? 0.29880 0.40500 0.28384 -0.09818 0.00928 0.00639 4457 SD . MET B 264 ? 0.39044 0.47882 0.36796 -0.09579 0.00232 0.00379 4458 CE . MET B 264 ? 0.36692 0.48103 0.35666 -0.08785 0.00241 0.00182 4459 N . CYS B 265 ? 0.32431 0.43087 0.29202 -0.13717 0.00404 0.03082 4460 CA . CYS B 265 ? 0.32627 0.41219 0.28235 -0.13877 -0.00077 0.03872 4461 C . CYS B 265 ? 0.42401 0.47770 0.37488 -0.14686 -0.01139 0.04692 4462 O . CYS B 265 ? 0.40798 0.43445 0.35606 -0.13891 -0.01758 0.04853 4463 CB . CYS B 265 ? 0.41377 0.52119 0.36050 -0.14907 0.00371 0.04606 4464 SG . CYS B 265 ? 0.38864 0.52390 0.33691 -0.13738 0.01490 0.03297 4465 N . ALA B 266 ? 0.33977 0.39617 0.29190 -0.16257 -0.01408 0.05154 4466 CA . ALA B 266 ? 0.40872 0.42902 0.35585 -0.17149 -0.02527 0.05717 4467 C . ALA B 266 ? 0.46056 0.45413 0.40841 -0.15658 -0.02880 0.04392 4468 O . ALA B 266 ? 0.41977 0.37625 0.36272 -0.15381 -0.03654 0.04470 4469 CB . ALA B 266 ? 0.42963 0.46132 0.38067 -0.19388 -0.02775 0.06319 4470 N . SER B 267 ? 0.38721 0.39835 0.34015 -0.14633 -0.02293 0.03187 4471 CA . SER B 267 ? 0.39256 0.38167 0.34127 -0.13281 -0.02385 0.01977 4472 C . SER B 267 ? 0.38830 0.36604 0.33854 -0.11580 -0.01954 0.01770 4473 O . SER B 267 ? 0.44828 0.39923 0.39547 -0.10648 -0.02107 0.01120 4474 CB . SER B 267 ? 0.45212 0.46336 0.40306 -0.12802 -0.02009 0.01123 4475 OG . SER B 267 ? 0.42434 0.44464 0.37669 -0.14318 -0.02724 0.01170 4476 N . LEU B 268 ? 0.40997 0.40931 0.36628 -0.11172 -0.01408 0.02189 4477 CA . LEU B 268 ? 0.35714 0.35012 0.31897 -0.09849 -0.01222 0.02125 4478 C . LEU B 268 ? 0.37407 0.34231 0.33533 -0.09967 -0.02167 0.02997 4479 O . LEU B 268 ? 0.46186 0.41498 0.43088 -0.08646 -0.02267 0.02675 4480 CB . LEU B 268 ? 0.39469 0.41451 0.36122 -0.09684 -0.00690 0.02264 4481 CG . LEU B 268 ? 0.26144 0.27972 0.23641 -0.08660 -0.00738 0.02279 4482 CD1 . LEU B 268 ? 0.34650 0.35633 0.33028 -0.07334 -0.00171 0.01400 4483 CD2 . LEU B 268 ? 0.26925 0.31101 0.24549 -0.08770 -0.00375 0.02160 4484 N . LYS B 269 ? 0.32171 0.28654 0.27545 -0.11520 -0.02859 0.04219 4485 CA . LYS B 269 ? 0.44258 0.37929 0.39417 -0.11718 -0.04005 0.05408 4486 C . LYS B 269 ? 0.50000 0.39920 0.45408 -0.10927 -0.04490 0.04645 4487 O . LYS B 269 ? 0.57278 0.45038 0.53496 -0.09626 -0.05054 0.04772 4488 CB . LYS B 269 ? 0.42422 0.36270 0.36405 -0.13899 -0.04545 0.07046 4489 CG . LYS B 269 ? 0.50864 0.41491 0.44334 -0.14302 -0.05935 0.08741 4490 CD . LYS B 269 ? 0.60143 0.51161 0.52159 -0.16804 -0.06277 0.10626 4491 CE . LYS B 269 ? 0.70720 0.58253 0.62547 -0.18221 -0.07077 0.11090 4492 NZ . LYS B 269 ? 0.71911 0.55719 0.62874 -0.19030 -0.08572 0.13290 4493 N . GLU B 270 ? 0.44013 0.33208 0.38797 -0.11613 -0.04331 0.03711 4494 CA . GLU B 270 ? 0.53298 0.38717 0.47817 -0.10952 -0.04750 0.02589 4495 C . GLU B 270 ? 0.53674 0.39120 0.48924 -0.08643 -0.03834 0.01092 4496 O . GLU B 270 ? 0.48431 0.30880 0.44084 -0.07357 -0.04066 0.00371 4497 CB . GLU B 270 ? 0.47036 0.32106 0.40472 -0.12415 -0.04931 0.01802 4498 CG . GLU B 270 ? 0.66406 0.50883 0.59486 -0.14905 -0.05896 0.03248 4499 CD . GLU B 270 ? 0.80677 0.60242 0.73503 -0.15270 -0.07158 0.03983 4500 OE1 . GLU B 270 ? 1.00860 0.76702 0.93189 -0.14791 -0.07654 0.02573 4501 OE2 . GLU B 270 ? 0.76256 0.55477 0.69199 -0.15992 -0.07703 0.05953 4502 N . LEU B 271 ? 0.46823 0.35607 0.42374 -0.08089 -0.02716 0.00614 4503 CA . LEU B 271 ? 0.58339 0.47602 0.54681 -0.06200 -0.01655 -0.00534 4504 C . LEU B 271 ? 0.54141 0.43246 0.52467 -0.04902 -0.01870 0.00041 4505 O . LEU B 271 ? 0.45401 0.33507 0.44804 -0.03254 -0.01366 -0.00910 4506 CB . LEU B 271 ? 0.45280 0.37862 0.41565 -0.06169 -0.00588 -0.00777 4507 CG . LEU B 271 ? 0.41694 0.34622 0.36287 -0.06795 -0.00322 -0.01557 4508 CD1 . LEU B 271 ? 0.33939 0.29933 0.28792 -0.06778 0.00406 -0.01310 4509 CD2 . LEU B 271 ? 0.43008 0.33929 0.36417 -0.05832 0.00208 -0.03052 4510 N . LEU B 272 ? 0.39726 0.30051 0.38581 -0.05597 -0.02633 0.01557 4511 CA . LEU B 272 ? 0.44168 0.34565 0.44912 -0.04481 -0.03254 0.02300 4512 C . LEU B 272 ? 0.44440 0.31021 0.45640 -0.03783 -0.04392 0.02624 4513 O . LEU B 272 ? 0.49142 0.35212 0.52486 -0.01952 -0.04509 0.02330 4514 CB . LEU B 272 ? 0.38305 0.30802 0.38778 -0.05587 -0.03968 0.03805 4515 CG . LEU B 272 ? 0.36482 0.32443 0.36849 -0.06013 -0.02996 0.03390 4516 CD1 . LEU B 272 ? 0.47155 0.44719 0.46786 -0.07080 -0.03770 0.04612 4517 CD2 . LEU B 272 ? 0.37511 0.34957 0.39917 -0.04577 -0.02125 0.02442 4518 N . GLN B 273 ? 0.51610 0.35474 0.51099 -0.05213 -0.05264 0.03231 4519 CA . GLN B 273 ? 0.49432 0.28931 0.49210 -0.04771 -0.06595 0.03765 4520 C . GLN B 273 ? 0.59799 0.36268 0.59719 -0.03400 -0.06060 0.01659 4521 O . GLN B 273 ? 0.67083 0.40213 0.68224 -0.01939 -0.06832 0.01518 4522 CB . GLN B 273 ? 0.57584 0.35174 0.55463 -0.07193 -0.07757 0.05414 4523 CG . GLN B 273 ? 0.58494 0.38597 0.55802 -0.08515 -0.08323 0.07573 4524 CD . GLN B 273 ? 0.66296 0.45077 0.61677 -0.11144 -0.09081 0.09243 4525 OE1 . GLN B 273 ? 0.61941 0.39398 0.56523 -0.12403 -0.08876 0.08558 4526 NE2 . GLN B 273 ? 0.73614 0.52929 0.68176 -0.12146 -0.09995 0.11508 4527 N . ASN B 274 ? 0.49815 0.27243 0.48388 -0.03751 -0.04826 -0.00024 4528 CA . ASN B 274 ? 0.59500 0.34013 0.57373 -0.02705 -0.04298 -0.02226 4529 C . ASN B 274 ? 0.51979 0.29041 0.50333 -0.01015 -0.02395 -0.03994 4530 O . ASN B 274 ? 0.65249 0.40311 0.62617 -0.00054 -0.01660 -0.06038 4531 CB . ASN B 274 ? 0.55879 0.28632 0.51138 -0.04791 -0.04755 -0.02796 4532 CG . ASN B 274 ? 0.63068 0.33556 0.57874 -0.06897 -0.06451 -0.00918 4533 OD1 . ASN B 274 ? 0.74800 0.46615 0.68398 -0.09154 -0.06731 -0.00272 4534 ND2 . ASN B 274 ? 0.74282 0.41495 0.70217 -0.06184 -0.07595 0.00108 4535 N . GLY B 275 ? 0.46624 0.27886 0.46271 -0.00747 -0.01550 -0.03305 4536 CA . GLY B 275 ? 0.51022 0.34773 0.50930 0.00393 0.00323 -0.04669 4537 C . GLY B 275 ? 0.55096 0.39236 0.52010 -0.00801 0.00977 -0.05566 4538 O . GLY B 275 ? 0.58991 0.42159 0.54139 -0.02528 -0.00038 -0.05116 4539 N . MET B 276 ? 0.46220 0.32049 0.42679 0.00104 0.02676 -0.06737 4540 CA . MET B 276 ? 0.55973 0.42373 0.49445 -0.00819 0.03249 -0.07443 4541 C . MET B 276 ? 0.57764 0.41489 0.48740 -0.00172 0.03808 -0.09628 4542 O . MET B 276 ? 0.65223 0.49550 0.53398 -0.00718 0.04375 -0.10339 4543 CB . MET B 276 ? 0.51625 0.41682 0.45585 -0.00653 0.04671 -0.06914 4544 CG . MET B 276 ? 0.55016 0.47315 0.49707 -0.01914 0.03966 -0.05203 4545 SD . MET B 276 ? 0.54508 0.50307 0.50454 -0.01637 0.05454 -0.04522 4546 CE . MET B 276 ? 0.49677 0.46680 0.49578 -0.00840 0.05248 -0.03834 4547 N . ASN B 277 ? 0.63142 0.43771 0.54913 0.01032 0.03568 -0.10749 4548 CA . ASN B 277 ? 0.67545 0.44883 0.56734 0.01660 0.03930 -0.13201 4549 C . ASN B 277 ? 0.67591 0.46928 0.55008 0.02657 0.06187 -0.14700 4550 O . ASN B 277 ? 0.68809 0.46231 0.52661 0.02555 0.06527 -0.16662 4551 CB . ASN B 277 ? 0.85087 0.59859 0.71222 -0.00419 0.02226 -0.13495 4552 CG . ASN B 277 ? 0.85481 0.56283 0.72625 -0.01044 0.00310 -0.13089 4553 OD1 . ASN B 277 ? 0.80494 0.52015 0.69993 -0.01595 -0.00624 -0.10973 4554 ND2 . ASN B 277 ? 0.87428 0.53806 0.72493 -0.01106 -0.00335 -0.15104 4555 N . GLY B 278 ? 0.59399 0.42581 0.49059 0.03445 0.07722 -0.13781 4556 CA . GLY B 278 ? 0.68421 0.53937 0.56376 0.03984 0.09974 -0.14674 4557 C . GLY B 278 ? 0.61956 0.48981 0.46641 0.02249 0.09849 -0.13779 4558 O . GLY B 278 ? 0.61033 0.49757 0.43635 0.02443 0.11617 -0.14240 4559 N . ARG B 279 ? 0.59226 0.45802 0.43448 0.00600 0.07849 -0.12440 4560 CA . ARG B 279 ? 0.52345 0.40538 0.34133 -0.00793 0.07505 -0.11427 4561 C . ARG B 279 ? 0.53505 0.45030 0.37801 -0.00929 0.08141 -0.09414 4562 O . ARG B 279 ? 0.50919 0.43526 0.38816 -0.00312 0.08406 -0.08714 4563 CB . ARG B 279 ? 0.55803 0.42561 0.36491 -0.02414 0.05178 -0.10997 4564 CG . ARG B 279 ? 0.59776 0.42719 0.38739 -0.02620 0.04114 -0.12833 4565 CD . ARG B 279 ? 0.74940 0.57125 0.53069 -0.04604 0.01854 -0.12229 4566 NE . ARG B 279 ? 0.88101 0.69890 0.62225 -0.05494 0.01254 -0.13274 4567 CZ . ARG B 279 ? 0.92148 0.70675 0.63449 -0.05878 0.00510 -0.15375 4568 NH1 . ARG B 279 ? 1.00069 0.75049 0.72253 -0.05381 0.00290 -0.16667 4569 NH2 . ARG B 279 ? 0.86362 0.64969 0.53771 -0.06779 -0.00188 -0.16213 4570 N . THR B 280 ? 0.55214 0.48184 0.37520 -0.01764 0.08209 -0.08478 4571 CA . THR B 280 ? 0.48239 0.43751 0.32537 -0.02017 0.08690 -0.06670 4572 C . THR B 280 ? 0.45737 0.41663 0.30109 -0.03136 0.06923 -0.05375 4573 O . THR B 280 ? 0.43318 0.38195 0.25678 -0.03855 0.05543 -0.05717 4574 CB . THR B 280 ? 0.50369 0.47228 0.32684 -0.01916 0.10463 -0.06361 4575 OG1 . THR B 280 ? 0.51451 0.47519 0.29560 -0.02651 0.09722 -0.06374 4576 CG2 . THR B 280 ? 0.45894 0.42919 0.28212 -0.00745 0.12568 -0.07840 4577 N . ILE B 281 ? 0.45223 0.42837 0.32158 -0.03271 0.06980 -0.04008 4578 CA . ILE B 281 ? 0.45869 0.44289 0.33267 -0.04016 0.05707 -0.02864 4579 C . ILE B 281 ? 0.49014 0.48696 0.36871 -0.03976 0.06536 -0.01670 4580 O . ILE B 281 ? 0.43285 0.43811 0.33480 -0.03732 0.07445 -0.01326 4581 CB . ILE B 281 ? 0.42992 0.41735 0.33088 -0.04287 0.04752 -0.02577 4582 CG1 . ILE B 281 ? 0.38578 0.35624 0.28129 -0.04573 0.03818 -0.03452 4583 CG2 . ILE B 281 ? 0.35521 0.35532 0.26297 -0.04840 0.03844 -0.01626 4584 CD1 . ILE B 281 ? 0.43445 0.40650 0.35208 -0.04975 0.02980 -0.02935 4585 N . LEU B 282 ? 0.42949 0.42640 0.28638 -0.04277 0.06070 -0.00964 4586 CA . LEU B 282 ? 0.40603 0.40806 0.26221 -0.04310 0.06738 0.00380 4587 C . LEU B 282 ? 0.39583 0.40059 0.24931 -0.04150 0.08750 0.00357 4588 O . LEU B 282 ? 0.37973 0.39134 0.25268 -0.04308 0.09595 0.01253 4589 CB . LEU B 282 ? 0.38819 0.39685 0.27529 -0.04349 0.06231 0.01162 4590 CG . LEU B 282 ? 0.42553 0.43747 0.31703 -0.04398 0.04590 0.01419 4591 CD1 . LEU B 282 ? 0.36244 0.37999 0.28249 -0.04273 0.04438 0.01798 4592 CD2 . LEU B 282 ? 0.50039 0.50931 0.36750 -0.04374 0.03817 0.02279 4593 N . GLY B 283 ? 0.41527 0.41555 0.24567 -0.03887 0.09584 -0.00793 4594 CA . GLY B 283 ? 0.40559 0.41369 0.23365 -0.03640 0.11793 -0.01001 4595 C . GLY B 283 ? 0.45821 0.47778 0.32642 -0.03100 0.12757 -0.01594 4596 O . GLY B 283 ? 0.48433 0.51770 0.36082 -0.02920 0.14700 -0.01613 4597 N . SER B 284 ? 0.45589 0.47275 0.34982 -0.02887 0.11439 -0.01972 4598 CA . SER B 284 ? 0.37506 0.40284 0.30746 -0.02355 0.11859 -0.02334 4599 C . SER B 284 ? 0.42249 0.43740 0.35657 -0.01549 0.11217 -0.03746 4600 O . SER B 284 ? 0.39195 0.39069 0.31148 -0.01867 0.09683 -0.03997 4601 CB . SER B 284 ? 0.38660 0.42104 0.34690 -0.02901 0.10739 -0.01324 4602 OG . SER B 284 ? 0.49761 0.54133 0.49147 -0.02438 0.10580 -0.01669 4603 N . ALA B 285 ? 0.45029 0.47253 0.40471 -0.00520 0.12367 -0.04611 4604 CA . ALA B 285 ? 0.48540 0.49208 0.44829 0.00459 0.11665 -0.05812 4605 C . ALA B 285 ? 0.43535 0.44638 0.43364 0.00527 0.10279 -0.05064 4606 O . ALA B 285 ? 0.52121 0.51808 0.53031 0.01344 0.09495 -0.05673 4607 CB . ALA B 285 ? 0.38680 0.39829 0.35549 0.01902 0.13570 -0.07290 4608 N . LEU B 286 ? 0.40180 0.42966 0.41614 -0.00322 0.09884 -0.03770 4609 CA . LEU B 286 ? 0.35704 0.39033 0.39787 -0.00496 0.08459 -0.03045 4610 C . LEU B 286 ? 0.38483 0.41473 0.41225 -0.01753 0.07255 -0.02193 4611 O . LEU B 286 ? 0.38939 0.41846 0.39724 -0.02359 0.07629 -0.01948 4612 CB . LEU B 286 ? 0.38004 0.44079 0.45821 -0.00269 0.09130 -0.02609 4613 CG . LEU B 286 ? 0.48659 0.56022 0.58889 0.01166 0.10488 -0.03440 4614 CD1 . LEU B 286 ? 0.47166 0.57951 0.61081 0.00923 0.11403 -0.02858 4615 CD2 . LEU B 286 ? 0.35168 0.41238 0.46925 0.02397 0.09221 -0.03862 4616 N . LEU B 287 ? 0.32412 0.35272 0.36191 -0.02057 0.05806 -0.01718 4617 CA . LEU B 287 ? 0.29412 0.32445 0.32314 -0.03109 0.04885 -0.01099 4618 C . LEU B 287 ? 0.28953 0.33691 0.33417 -0.03527 0.05244 -0.00681 4619 O . LEU B 287 ? 0.33164 0.39173 0.40081 -0.03379 0.05127 -0.00539 4620 CB . LEU B 287 ? 0.23615 0.26045 0.26662 -0.03431 0.03411 -0.00711 4621 CG . LEU B 287 ? 0.34442 0.34686 0.35918 -0.03381 0.02847 -0.00979 4622 CD1 . LEU B 287 ? 0.30314 0.29891 0.32009 -0.03871 0.01432 -0.00210 4623 CD2 . LEU B 287 ? 0.35273 0.35002 0.34395 -0.04071 0.02952 -0.01223 4624 N . GLU B 288 ? 0.28330 0.32992 0.31542 -0.04055 0.05521 -0.00478 4625 CA . GLU B 288 ? 0.27739 0.33277 0.32197 -0.04525 0.05897 -0.00139 4626 C . GLU B 288 ? 0.29144 0.34889 0.33883 -0.05079 0.04816 -0.00152 4627 O . GLU B 288 ? 0.27854 0.33117 0.31090 -0.05188 0.04261 -0.00246 4628 CB . GLU B 288 ? 0.30583 0.35469 0.33474 -0.04655 0.06737 0.00208 4629 CG . GLU B 288 ? 0.43332 0.48450 0.47456 -0.05257 0.07069 0.00705 4630 CD . GLU B 288 ? 0.39532 0.46044 0.46096 -0.05505 0.07948 0.00861 4631 OE1 . GLU B 288 ? 0.52421 0.59537 0.58873 -0.05073 0.09091 0.00827 4632 OE2 . GLU B 288 ? 0.43304 0.50486 0.51981 -0.06147 0.07508 0.00895 4633 N . ASP B 289 ? 0.26618 0.33295 0.33308 -0.05492 0.04561 -0.00160 4634 CA . ASP B 289 ? 0.33490 0.40396 0.40149 -0.06029 0.03529 -0.00461 4635 C . ASP B 289 ? 0.28581 0.35303 0.36102 -0.06636 0.03645 -0.00688 4636 O . ASP B 289 ? 0.28716 0.35682 0.36431 -0.07147 0.02813 -0.01224 4637 CB . ASP B 289 ? 0.32048 0.39969 0.39806 -0.06106 0.02494 -0.00402 4638 CG . ASP B 289 ? 0.35935 0.45235 0.46568 -0.06278 0.02489 -0.00300 4639 OD1 . ASP B 289 ? 0.35787 0.45468 0.47706 -0.06006 0.03654 -0.00110 4640 OD2 . ASP B 289 ? 0.49532 0.59791 0.61119 -0.06780 0.01303 -0.00398 4641 N . GLU B 290 ? 0.23597 0.29647 0.31378 -0.06683 0.04606 -0.00288 4642 CA . GLU B 290 ? 0.28257 0.33539 0.36987 -0.07394 0.04679 -0.00320 4643 C . GLU B 290 ? 0.34379 0.37815 0.41549 -0.07073 0.04764 -0.00317 4644 O . GLU B 290 ? 0.28442 0.30500 0.36144 -0.07496 0.05018 0.00015 4645 CB . GLU B 290 ? 0.27069 0.32923 0.37591 -0.07931 0.05676 0.00434 4646 CG . GLU B 290 ? 0.30403 0.38499 0.43597 -0.08288 0.05453 0.00333 4647 CD . GLU B 290 ? 0.51815 0.60803 0.67544 -0.09331 0.06275 0.00922 4648 OE1 . GLU B 290 ? 0.61368 0.69824 0.76484 -0.09432 0.07652 0.01742 4649 OE2 . GLU B 290 ? 0.45320 0.55643 0.63576 -0.10210 0.05485 0.00643 4650 N . PHE B 291 ? 0.25247 0.28659 0.30771 -0.06355 0.04482 -0.00585 4651 CA . PHE B 291 ? 0.22833 0.25073 0.27429 -0.05792 0.04370 -0.00698 4652 C . PHE B 291 ? 0.26692 0.29664 0.30885 -0.05561 0.03795 -0.01805 4653 O . PHE B 291 ? 0.22570 0.26872 0.26007 -0.05515 0.03608 -0.01883 4654 CB . PHE B 291 ? 0.26607 0.28736 0.29795 -0.05179 0.04647 0.00092 4655 CG . PHE B 291 ? 0.26931 0.28251 0.29796 -0.05389 0.05377 0.01190 4656 CD1 . PHE B 291 ? 0.29088 0.28677 0.31913 -0.05410 0.05477 0.01965 4657 CD2 . PHE B 291 ? 0.30196 0.32389 0.32677 -0.05535 0.06025 0.01468 4658 CE1 . PHE B 291 ? 0.34786 0.33725 0.36910 -0.05820 0.06267 0.03223 4659 CE2 . PHE B 291 ? 0.37210 0.39008 0.39085 -0.05776 0.06988 0.02395 4660 CZ . PHE B 291 ? 0.40310 0.40581 0.41852 -0.06041 0.07137 0.03389 4661 N . THR B 292 ? 0.25206 0.27197 0.29803 -0.05477 0.03589 -0.02682 4662 CA . THR B 292 ? 0.29317 0.32113 0.33320 -0.05107 0.03373 -0.03931 4663 C . THR B 292 ? 0.27375 0.30759 0.31043 -0.04073 0.03589 -0.03742 4664 O . THR B 292 ? 0.34199 0.36774 0.37995 -0.03597 0.03652 -0.02737 4665 CB . THR B 292 ? 0.34029 0.35281 0.38524 -0.05176 0.03168 -0.05242 4666 OG1 . THR B 292 ? 0.41054 0.40287 0.46189 -0.04293 0.03331 -0.05062 4667 CG2 . THR B 292 ? 0.35037 0.35576 0.40398 -0.06387 0.02783 -0.05189 4668 N . PRO B 293 ? 0.24406 0.29503 0.27644 -0.03788 0.03684 -0.04625 4669 CA . PRO B 293 ? 0.27142 0.33286 0.30821 -0.02760 0.03855 -0.04574 4670 C . PRO B 293 ? 0.30451 0.34756 0.35276 -0.01564 0.03796 -0.04796 4671 O . PRO B 293 ? 0.27495 0.32011 0.32898 -0.00707 0.03575 -0.03987 4672 CB . PRO B 293 ? 0.23586 0.32127 0.26839 -0.02858 0.04237 -0.05700 4673 CG . PRO B 293 ? 0.28042 0.36903 0.29990 -0.04159 0.04019 -0.05558 4674 CD . PRO B 293 ? 0.26668 0.33272 0.28942 -0.04508 0.03633 -0.05443 4675 N . PHE B 294 ? 0.35054 0.37345 0.40216 -0.01517 0.03800 -0.05823 4676 C . PHE B 294 ? 0.34214 0.31930 0.40518 -0.00661 0.03257 -0.03965 4677 O . PHE B 294 ? 0.37929 0.34369 0.44842 0.00427 0.02901 -0.03120 4678 CA A PHE B 294 ? 0.33901 0.33658 0.40212 -0.00378 0.03605 -0.05931 4679 CB A PHE B 294 ? 0.37504 0.35092 0.44009 -0.00508 0.03596 -0.07666 4680 CG A PHE B 294 ? 0.42712 0.36399 0.50247 -0.00019 0.03178 -0.07293 4681 CD1 A PHE B 294 ? 0.47687 0.40103 0.56454 0.01850 0.03032 -0.07588 4682 CD2 A PHE B 294 ? 0.47176 0.38510 0.54697 -0.01455 0.02889 -0.06521 4683 CE1 A PHE B 294 ? 0.44532 0.32799 0.54171 0.02285 0.02480 -0.06996 4684 CE2 A PHE B 294 ? 0.55007 0.42477 0.63402 -0.01302 0.02495 -0.05913 4685 CZ A PHE B 294 ? 0.45707 0.31338 0.54997 0.00575 0.02227 -0.06092 4686 CA B PHE B 294 ? 0.33922 0.33690 0.40232 -0.00376 0.03606 -0.05931 4687 CB B PHE B 294 ? 0.37534 0.35187 0.44024 -0.00511 0.03603 -0.07681 4688 CG B PHE B 294 ? 0.40718 0.40437 0.46136 -0.01024 0.03953 -0.09430 4689 CD1 B PHE B 294 ? 0.41556 0.43205 0.47041 0.00099 0.04573 -0.10927 4690 CD2 B PHE B 294 ? 0.42628 0.42651 0.46981 -0.02631 0.03664 -0.09474 4691 CE1 B PHE B 294 ? 0.46071 0.49721 0.50011 -0.00540 0.05017 -0.12389 4692 CE2 B PHE B 294 ? 0.45043 0.46885 0.47935 -0.03189 0.03788 -0.10827 4693 CZ B PHE B 294 ? 0.53499 0.57070 0.55895 -0.02229 0.04525 -0.12259 4694 N . ASP B 295 ? 0.37045 0.34591 0.42672 -0.02069 0.03370 -0.03159 4695 CA . ASP B 295 ? 0.37579 0.33629 0.42905 -0.02502 0.03381 -0.01321 4696 C . ASP B 295 ? 0.33907 0.31073 0.38378 -0.01797 0.03208 -0.00120 4697 O . ASP B 295 ? 0.35017 0.30571 0.39126 -0.01410 0.02930 0.01269 4698 CB . ASP B 295 ? 0.36086 0.32746 0.41191 -0.03966 0.03774 -0.00898 4699 CG . ASP B 295 ? 0.40509 0.36098 0.46662 -0.04927 0.03662 -0.01834 4700 OD1 . ASP B 295 ? 0.43854 0.37101 0.50653 -0.04656 0.03351 -0.02483 4701 OD2 . ASP B 295 ? 0.36476 0.33497 0.42920 -0.05927 0.03751 -0.01969 4702 N . VAL B 296 ? 0.34007 0.33824 0.37992 -0.01782 0.03235 -0.00547 4703 CA . VAL B 296 ? 0.32136 0.33143 0.35286 -0.01383 0.02872 0.00390 4704 C . VAL B 296 ? 0.34592 0.35431 0.38737 0.00045 0.02206 0.00603 4705 O . VAL B 296 ? 0.36443 0.36433 0.39929 0.00471 0.01609 0.01989 4706 CB . VAL B 296 ? 0.25576 0.29174 0.28302 -0.01879 0.02935 -0.00205 4707 CG1 . VAL B 296 ? 0.25325 0.30176 0.27412 -0.01610 0.02332 0.00505 4708 CG2 . VAL B 296 ? 0.23256 0.26708 0.25176 -0.02985 0.03383 -0.00168 4709 N . VAL B 297 ? 0.35017 0.36754 0.40746 0.00891 0.02286 -0.00781 4710 CA . VAL B 297 ? 0.36055 0.37905 0.43438 0.02601 0.01711 -0.00813 4711 C . VAL B 297 ? 0.45577 0.43708 0.53080 0.03231 0.01187 0.00295 4712 O . VAL B 297 ? 0.41670 0.39338 0.49604 0.04345 0.00259 0.01525 4713 CB . VAL B 297 ? 0.31334 0.34783 0.40368 0.03429 0.02288 -0.02862 4714 CG1 . VAL B 297 ? 0.41214 0.44323 0.52523 0.05561 0.01828 -0.03166 4715 CG2 . VAL B 297 ? 0.27218 0.34619 0.36147 0.02760 0.02715 -0.03422 4716 N . ARG B 298 ? 0.41478 0.36892 0.48614 0.02383 0.01624 0.00058 4717 CA . ARG B 298 ? 0.48724 0.40199 0.56041 0.02660 0.01166 0.01211 4718 C . ARG B 298 ? 0.55614 0.46308 0.61159 0.02149 0.00740 0.03706 4719 O . ARG B 298 ? 0.59176 0.47665 0.64785 0.03056 -0.00135 0.05205 4720 CB . ARG B 298 ? 0.55354 0.44501 0.62723 0.01349 0.01710 0.00450 4721 CG . ARG B 298 ? 0.63419 0.48182 0.71829 0.01845 0.01222 0.00610 4722 CD . ARG B 298 ? 0.69344 0.51734 0.77282 -0.00200 0.01557 0.01367 4723 NE . ARG B 298 ? 0.65726 0.50579 0.73390 -0.01665 0.02254 0.00154 4724 CZ . ARG B 298 ? 0.70977 0.55772 0.78405 -0.03539 0.02715 0.00976 4725 NH1 . ARG B 298 ? 0.68297 0.50836 0.75484 -0.04437 0.02812 0.03030 4726 NH2 . ARG B 298 ? 0.54005 0.41259 0.61543 -0.04541 0.03090 -0.00168 4727 N . GLN B 299 ? 0.41308 0.33676 0.45093 0.00767 0.01327 0.04170 4728 CA . GLN B 299 ? 0.47920 0.39694 0.49466 0.00180 0.01179 0.06258 4729 C . GLN B 299 ? 0.54044 0.47501 0.54877 0.01212 0.00081 0.06974 4730 O . GLN B 299 ? 0.60701 0.53003 0.59702 0.01243 -0.00577 0.08884 4731 CB . GLN B 299 ? 0.46678 0.39746 0.46766 -0.01395 0.02293 0.06159 4732 CG . GLN B 299 ? 0.49303 0.41853 0.46716 -0.02121 0.02567 0.08005 4733 CD . GLN B 299 ? 0.52450 0.45987 0.49121 -0.03489 0.03978 0.07733 4734 OE1 . GLN B 299 ? 0.46282 0.40358 0.40597 -0.03976 0.04503 0.08539 4735 NE2 . GLN B 299 ? 0.47156 0.41046 0.45854 -0.04037 0.04561 0.06512 4736 N . CYS B 300 ? 0.54197 0.50514 0.56397 0.01917 -0.00196 0.05571 4737 CA . CYS B 300 ? 0.45857 0.44385 0.47909 0.02666 -0.01360 0.06094 4738 C . CYS B 300 ? 0.53138 0.51620 0.57662 0.04633 -0.02523 0.06315 4739 O . CYS B 300 ? 0.55719 0.56215 0.60616 0.05383 -0.03784 0.06964 4740 CB . CYS B 300 ? 0.51495 0.53444 0.53873 0.02060 -0.01018 0.04664 4741 SG . CYS B 300 ? 0.57460 0.59330 0.57196 0.00141 0.00094 0.04417 4742 N . SER B 301 ? 0.54850 0.51053 0.61222 0.05537 -0.02236 0.05717 4743 CA . SER B 301 ? 0.56575 0.52101 0.65532 0.07731 -0.03297 0.05860 4744 C . SER B 301 ? 0.58504 0.49285 0.66926 0.08219 -0.04040 0.07692 4745 O . SER B 301 ? 0.75590 0.65417 0.85782 0.10164 -0.05371 0.08499 4746 CB . SER B 301 ? 0.65704 0.62257 0.77524 0.08791 -0.02425 0.03318 4747 OG . SER B 301 ? 0.64108 0.57181 0.75612 0.08198 -0.01576 0.02483 4748 N . GLY B 302 ? 0.63150 0.51018 0.69454 0.06507 -0.03251 0.08463 4749 CA . GLY B 302 ? 0.68355 0.51574 0.73939 0.06508 -0.03860 0.10514 4750 C . GLY B 302 ? 0.67001 0.46582 0.74926 0.07330 -0.03767 0.09428 4751 O . GLY B 302 ? 0.58689 0.34473 0.67199 0.08390 -0.04899 0.10971 4752 N . VAL B 303 ? 0.61175 0.41531 0.70265 0.06849 -0.02578 0.06817 4753 CA . VAL B 303 ? 0.79616 0.56400 0.90616 0.07499 -0.02493 0.05293 4754 C . VAL B 303 ? 0.79746 0.51829 0.89571 0.05716 -0.02469 0.06955 4755 O . VAL B 303 ? 0.75882 0.48737 0.83971 0.03410 -0.01564 0.07618 4756 CB . VAL B 303 ? 0.71067 0.50227 0.82909 0.07153 -0.01296 0.02088 4757 CG1 . VAL B 303 ? 0.71063 0.46053 0.83938 0.07032 -0.01143 0.00425 4758 CG2 . VAL B 303 ? 0.66288 0.49534 0.79853 0.09114 -0.01251 0.00437 4759 N . THR B 304 ? 0.74162 0.41373 0.85186 0.06778 -0.03448 0.07665 4760 CA . THR B 304 ? 0.78613 0.40790 0.88802 0.05035 -0.03607 0.09568 4761 C . THR B 304 ? 0.86419 0.44819 0.98465 0.04864 -0.03477 0.07209 4762 O . THR B 304 ? 0.89414 0.49070 1.03057 0.06294 -0.03221 0.04074 4763 CB . THR B 304 ? 0.75831 0.34572 0.85441 0.06080 -0.05128 0.12846 4764 OG1 . THR B 304 ? 0.81504 0.38406 0.93779 0.09155 -0.06366 0.11809 4765 CG2 . THR B 304 ? 0.70413 0.32962 0.77632 0.05988 -0.05372 0.14990 4766 N . PHE B 305 ? 0.83654 0.37408 0.95324 0.02926 -0.03623 0.08713 4767 CA . PHE B 305 ? 0.90812 0.40465 1.04003 0.02219 -0.03678 0.06563 4768 C . PHE B 305 ? 0.97277 0.39848 1.10905 0.01858 -0.04828 0.08773 4769 O . PHE B 305 ? 0.98825 0.40250 1.10754 0.00137 -0.04844 0.12211 4770 CB . PHE B 305 ? 0.74127 0.25971 0.86780 -0.00799 -0.02513 0.05518 4771 CG . PHE B 305 ? 0.74293 0.32773 0.86058 -0.00878 -0.01466 0.04390 4772 CD1 . PHE B 305 ? 0.70579 0.31855 0.83026 0.00599 -0.01207 0.01190 4773 CD2 . PHE B 305 ? 0.65147 0.26914 0.75272 -0.02416 -0.00688 0.06542 4774 CE1 . PHE B 305 ? 0.68038 0.34960 0.79611 0.00388 -0.00363 0.00436 4775 CE2 . PHE B 305 ? 0.64676 0.31916 0.74065 -0.02409 0.00138 0.05497 4776 CZ . PHE B 305 ? 0.70661 0.40333 0.80805 -0.01077 0.00213 0.02584 data_comp_ZQ8 loop_ _chem_comp_atom.comp_id _chem_comp_atom.atom_id _chem_comp_atom.type_symbol _chem_comp_atom.type_energy _chem_comp_atom.charge _chem_comp_atom.partial_charge _chem_comp_atom.x _chem_comp_atom.y _chem_comp_atom.z ZQ8 H011 H HCH2 0 0.090 2.0075 0.5243 -0.8565 ZQ8 C01 C CH2 0 -0.036 1.6133 -0.0240 0.0488 ZQ8 O02 O OH1 0 -0.333 2.1224 -1.3528 -0.0075 ZQ8 C03 C CH1 0 0.058 0.0414 -0.0630 0.0095 ZQ8 C04 C CH2 0 -0.163 -0.5191 0.0462 1.4854 ZQ8 C05 C CH1 0 -0.126 -0.2075 1.3457 2.2887 ZQ8 C06 C CH2 0 -0.193 0.7947 1.0582 3.3626 ZQ8 C07 C CH2 0 -0.006 -0.0295 0.7576 4.6521 ZQ8 N08 N NH1 0 -0.422 -1.3920 1.2226 4.3739 ZQ8 C09 C C 0 0.308 -1.4199 1.8608 3.1198 ZQ8 O10 O O 0 -0.328 -2.2356 2.7342 2.8090 ZQ8 N11 N NH1 0 -0.393 -0.4773 -1.2137 -0.7713 ZQ8 C12 C C 0 0.294 -0.2344 -1.4685 -2.1429 ZQ8 C13 C CH1 0 0.089 -0.1588 -2.9610 -2.8441 ZQ8 C14 C CH2 0 -0.428 0.8224 -2.9360 -4.0733 ZQ8 SI15 SI SI 0 1.029 2.6477 -3.8815 -3.8465 ZQ8 C16 C CH3 0 -0.501 2.9720 -4.1582 -1.9422 ZQ8 C17 C CH3 0 -0.509 2.6202 -5.5788 -4.7720 ZQ8 C18 C CH3 0 -0.505 4.0658 -2.7979 -4.6068 ZQ8 N19 N NH1 0 -0.428 -1.5170 -3.4665 -3.1223 ZQ8 C20 C C 0 0.380 -2.0499 -4.7373 -2.7237 ZQ8 C21 C CR5 0 -0.067 -3.5586 -5.0097 -2.3100 ZQ8 C22 C CR15 0 -0.124 -4.1642 -6.2120 -1.8316 ZQ8 C23 C CR56 0 -0.092 -5.5756 -5.9429 -1.4740 ZQ8 C24 C CR16 0 -0.070 -6.6839 -6.7176 -0.9900 ZQ8 C25 C CR16 0 -0.160 -7.8934 -6.0982 -0.6330 ZQ8 C26 C CR16 0 -0.095 -8.0844 -4.7079 -0.8813 ZQ8 C27 C CR6 0 -0.072 -7.0770 -3.9531 -1.5089 ZQ8 CL28 CL CL 0 -0.026 -7.3854 -2.3240 -1.9701 ZQ8 C29 C CR56 0 0.025 -5.7825 -4.5416 -1.7556 ZQ8 N30 N NR15 0 -0.203 -4.5656 -4.0268 -2.2563 ZQ8 O31 O O 0 -0.318 -1.2638 -5.6940 -2.6335 ZQ8 O32 O O 0 -0.360 -0.0464 -0.5093 -2.9153 ZQ8 H031 H HCH1 0 0.108 -0.3269 0.8800 -0.4863 ZQ8 H051 H HCH1 0 0.127 0.2517 2.1589 1.6436 ZQ8 H131 H HCH1 0 0.117 0.3384 -3.6163 -2.0899 ZQ8 H012 H HCH2 0 0.065 2.0109 0.5156 0.9502 ZQ8 H021 H HOH1 0 0.201 2.8737 -1.4481 0.5960 ZQ8 H041 H HCH2 0 0.099 -1.6294 -0.0547 1.5220 ZQ8 H042 H HCH2 0 0.087 -0.1175 -0.8366 2.0631 ZQ8 H061 H HCH2 0 0.096 1.4352 0.2107 2.9890 ZQ8 H062 H HCH2 0 0.096 1.4871 1.9464 3.4670 ZQ8 H071 H HCH2 0 0.086 0.0168 -0.3393 4.8572 ZQ8 H072 H HCH2 0 0.083 0.4186 1.3022 5.5189 ZQ8 H081 H HNH1 0 0.256 -2.1558 1.2509 5.0162 ZQ8 H111 H HNH1 0 0.218 -1.0152 -1.8649 -0.2581 ZQ8 H141 H HCH2 0 0.117 1.0634 -1.8969 -4.4240 ZQ8 H142 H HCH2 0 0.090 0.3444 -3.4212 -4.9639 ZQ8 H161 H HCH3 0 0.083 3.0273 -5.2392 -1.6642 ZQ8 H162 H HCH3 0 0.079 3.9245 -3.6923 -1.5875 ZQ8 H163 H HCH3 0 0.092 2.1684 -3.7158 -1.3030 ZQ8 H171 H HCH3 0 0.082 3.0363 -5.5309 -5.8093 ZQ8 H172 H HCH3 0 0.091 1.5894 -5.9941 -4.8710 ZQ8 H173 H HCH3 0 0.084 3.2168 -6.3589 -4.2361 ZQ8 H181 H HCH3 0 0.083 4.9178 -3.4112 -4.9961 ZQ8 H182 H HCH3 0 0.083 4.5077 -2.0989 -3.8557 ZQ8 H183 H HCH3 0 0.084 3.7318 -2.1642 -5.4637 ZQ8 H191 H HNH1 0 0.224 -2.0130 -2.9356 -3.7964 ZQ8 H221 H HCR5 0 0.171 -3.6623 -7.1806 -1.7016 ZQ8 H241 H HCR6 0 0.139 -6.5887 -7.8139 -0.8353 ZQ8 H251 H HCR6 0 0.145 -8.7368 -6.7086 -0.2084 ZQ8 H261 H HCR6 0 0.153 -9.0963 -4.2693 -0.6814 ZQ8 H301 H HNR5 0 0.252 -4.4063 -3.1020 -2.5910 loop_ _chem_comp_bond.comp_id _chem_comp_bond.atom_id_1 _chem_comp_bond.atom_id_2 _chem_comp_bond.type _chem_comp_bond.value_dist _chem_comp_bond.value_dist_esd ZQ8 C01 H011 single 1.129 0.037 ZQ8 O02 C01 single 1.424 0.032 ZQ8 C03 C01 single 1.573 0.037 ZQ8 C05 C04 single 1.559 0.033 ZQ8 C06 C05 single 1.497 0.023 ZQ8 C07 C06 single 1.560 0.035 ZQ8 N08 C07 single 1.466 0.031 ZQ8 C09 N08 single 1.407 0.028 ZQ8 O10 C09 double 1.235 0.022 ZQ8 C04 C03 single 1.583 0.035 ZQ8 N11 C03 single 1.484 0.034 ZQ8 C12 N11 single 1.416 0.030 ZQ8 SI15 C14 single 2.068 0.040 ZQ8 C16 SI15 single 1.951 0.038 ZQ8 C17 SI15 single 1.934 0.034 ZQ8 C18 SI15 single 1.940 0.034 ZQ8 C14 C13 single 1.573 0.035 ZQ8 N19 C13 single 1.476 0.034 ZQ8 C20 N19 single 1.434 0.030 ZQ8 C22 C21 aromatic 1.429 0.026 ZQ8 C23 C22 aromatic 1.481 0.030 ZQ8 C25 C24 aromatic 1.405 0.024 ZQ8 C26 C25 aromatic 1.425 0.027 ZQ8 C27 C26 aromatic 1.407 0.025 ZQ8 CL28 C27 single 1.721 0.036 ZQ8 C24 C23 aromatic 1.436 0.027 ZQ8 C29 C23 aromatic 1.444 0.027 ZQ8 N30 C29 aromatic 1.413 0.031 ZQ8 C21 C20 single 1.588 0.037 ZQ8 O31 C20 double 1.241 0.023 ZQ8 C13 C12 single 1.651 0.040 ZQ8 O32 C12 double 1.246 0.022 ZQ8 C05 C09 single 1.558 0.037 ZQ8 C21 N30 aromatic 1.408 0.030 ZQ8 C27 C29 aromatic 1.443 0.028 ZQ8 H031 C03 single 1.127 0.038 ZQ8 H051 C05 single 1.135 0.032 ZQ8 H131 C13 single 1.116 0.037 ZQ8 H012 C01 single 1.123 0.037 ZQ8 H021 O02 single 0.968 0.033 ZQ8 H041 C04 single 1.115 0.036 ZQ8 H042 C04 single 1.129 0.038 ZQ8 H061 C06 single 1.126 0.033 ZQ8 H062 C06 single 1.131 0.034 ZQ8 H071 C07 single 1.117 0.037 ZQ8 H072 C07 single 1.117 0.036 ZQ8 H081 N08 single 0.998 0.035 ZQ8 H111 N11 single 0.988 0.034 ZQ8 H141 C14 single 1.123 0.036 ZQ8 H142 C14 single 1.121 0.037 ZQ8 H161 C16 single 1.118 0.036 ZQ8 H162 C16 single 1.118 0.036 ZQ8 H163 C16 single 1.118 0.036 ZQ8 H171 C17 single 1.119 0.036 ZQ8 H172 C17 single 1.116 0.036 ZQ8 H173 C17 single 1.119 0.036 ZQ8 H181 C18 single 1.120 0.036 ZQ8 H182 C18 single 1.117 0.036 ZQ8 H183 C18 single 1.117 0.036 ZQ8 H191 N19 single 0.991 0.034 ZQ8 H221 C22 single 1.099 0.036 ZQ8 H241 C24 single 1.111 0.037 ZQ8 H251 C25 single 1.124 0.038 ZQ8 H261 C26 single 1.121 0.038 ZQ8 H301 N30 single 0.996 0.032 loop_ _chem_comp_angle.comp_id _chem_comp_angle.atom_id_1 _chem_comp_angle.atom_id_2 _chem_comp_angle.atom_id_3 _chem_comp_angle.value_angle _chem_comp_angle.value_angle_esd ZQ8 H012 C01 C03 112.69 2.741 ZQ8 H012 C01 O02 110.70 2.457 ZQ8 H012 C01 H011 106.65 2.702 ZQ8 C03 C01 O02 109.46 2.379 ZQ8 C03 C01 H011 109.93 2.502 ZQ8 O02 C01 H011 107.25 2.489 ZQ8 H021 O02 C01 110.15 2.747 ZQ8 H031 C03 N11 107.64 2.371 ZQ8 H031 C03 C04 103.69 2.486 ZQ8 N11 C03 C04 114.86 2.455 ZQ8 H031 C03 C01 108.47 2.451 ZQ8 N11 C03 C01 112.44 2.505 ZQ8 C04 C03 C01 109.20 2.761 ZQ8 H042 C04 H041 105.46 2.996 ZQ8 H042 C04 C05 108.48 2.248 ZQ8 H041 C04 C05 104.92 2.411 ZQ8 H042 C04 C03 107.29 2.411 ZQ8 H041 C04 C03 112.14 2.454 ZQ8 C05 C04 C03 117.86 2.474 ZQ8 H051 C05 C09 112.41 2.485 ZQ8 H051 C05 C06 105.93 2.244 ZQ8 C09 C05 C06 101.65 2.362 ZQ8 H051 C05 C04 112.65 2.278 ZQ8 C09 C05 C04 113.26 2.346 ZQ8 C06 C05 C04 110.08 2.345 ZQ8 H062 C06 H061 105.87 2.786 ZQ8 H062 C06 C07 113.49 2.186 ZQ8 H061 C06 C07 115.46 2.742 ZQ8 H062 C06 C05 108.98 2.760 ZQ8 H061 C06 C05 106.70 2.678 ZQ8 C07 C06 C05 106.04 2.506 ZQ8 H072 C07 H071 108.63 2.905 ZQ8 H072 C07 N08 111.42 2.736 ZQ8 H071 C07 N08 112.63 2.155 ZQ8 H072 C07 C06 109.61 2.482 ZQ8 H071 C07 C06 108.61 2.385 ZQ8 N08 C07 C06 105.85 2.208 ZQ8 H081 N08 C09 123.03 2.464 ZQ8 H081 N08 C07 126.72 2.190 ZQ8 C09 N08 C07 109.35 2.212 ZQ8 O10 C09 N08 123.93 2.473 ZQ8 O10 C09 C05 127.86 2.777 ZQ8 N08 C09 C05 108.06 2.531 ZQ8 H111 N11 C12 118.54 2.369 ZQ8 H111 N11 C03 115.33 2.600 ZQ8 C12 N11 C03 126.09 2.584 ZQ8 O32 C12 C13 115.21 2.278 ZQ8 O32 C12 N11 119.20 2.263 ZQ8 C13 C12 N11 125.59 2.280 ZQ8 H131 C13 N19 109.65 2.543 ZQ8 H131 C13 C14 105.05 2.765 ZQ8 N19 C13 C14 115.61 3.000 ZQ8 H131 C13 C12 105.32 2.272 ZQ8 N19 C13 C12 110.34 2.265 ZQ8 C14 C13 C12 110.25 2.244 ZQ8 H142 C14 H141 104.11 2.992 ZQ8 H142 C14 SI15 105.40 2.281 ZQ8 H141 C14 SI15 105.54 2.305 ZQ8 H142 C14 C13 110.36 2.378 ZQ8 H141 C14 C13 113.12 2.437 ZQ8 SI15 C14 C13 117.23 2.315 ZQ8 C18 SI15 C17 108.25 2.564 ZQ8 C18 SI15 C16 109.89 2.736 ZQ8 C17 SI15 C16 110.18 2.723 ZQ8 C18 SI15 C14 110.30 2.754 ZQ8 C17 SI15 C14 109.65 2.340 ZQ8 C16 SI15 C14 108.57 2.360 ZQ8 H163 C16 H162 105.43 2.984 ZQ8 H163 C16 H161 106.03 2.984 ZQ8 H162 C16 H161 106.38 2.983 ZQ8 H163 C16 SI15 112.48 2.748 ZQ8 H162 C16 SI15 113.08 2.305 ZQ8 H161 C16 SI15 112.84 2.374 ZQ8 H173 C17 H172 106.00 2.981 ZQ8 H173 C17 H171 106.00 2.981 ZQ8 H172 C17 H171 106.10 2.980 ZQ8 H173 C17 SI15 112.04 2.618 ZQ8 H172 C17 SI15 112.48 2.714 ZQ8 H171 C17 SI15 113.64 2.740 ZQ8 H183 C18 H182 106.20 2.980 ZQ8 H183 C18 H181 105.76 2.981 ZQ8 H182 C18 H181 105.99 2.981 ZQ8 H183 C18 SI15 113.52 2.730 ZQ8 H182 C18 SI15 112.03 2.632 ZQ8 H181 C18 SI15 112.74 2.588 ZQ8 H191 N19 C20 118.53 2.727 ZQ8 H191 N19 C13 113.91 2.310 ZQ8 C20 N19 C13 126.37 2.345 ZQ8 O31 C20 C21 116.77 2.726 ZQ8 O31 C20 N19 117.88 2.676 ZQ8 C21 C20 N19 125.26 2.711 ZQ8 N30 C21 C22 105.76 2.592 ZQ8 N30 C21 C20 124.72 2.724 ZQ8 C22 C21 C20 129.37 2.770 ZQ8 H221 C22 C23 124.56 2.617 ZQ8 H221 C22 C21 126.01 2.654 ZQ8 C23 C22 C21 109.39 2.716 ZQ8 C29 C23 C24 118.59 2.556 ZQ8 C29 C23 C22 105.42 2.553 ZQ8 C24 C23 C22 135.96 2.593 ZQ8 H241 C24 C25 118.25 2.633 ZQ8 H241 C24 C23 120.86 2.623 ZQ8 C25 C24 C23 120.80 2.553 ZQ8 H251 C25 C26 119.66 2.654 ZQ8 H251 C25 C24 120.16 2.747 ZQ8 C26 C25 C24 120.08 2.557 ZQ8 H261 C26 C27 121.08 2.622 ZQ8 H261 C26 C25 118.14 2.617 ZQ8 C27 C26 C25 120.34 2.734 ZQ8 C29 C27 CL28 120.06 2.655 ZQ8 C29 C27 C26 120.00 2.592 ZQ8 CL28 C27 C26 119.94 2.612 ZQ8 N30 C29 C27 133.20 2.616 ZQ8 C27 C29 C23 119.39 2.557 ZQ8 N30 C29 C23 107.41 2.554 ZQ8 H301 N30 C29 126.51 2.713 ZQ8 H301 N30 C21 121.38 2.735 ZQ8 C29 N30 C21 112.03 2.591 loop_ _chem_comp_tor.comp_id _chem_comp_tor.id _chem_comp_tor.atom_id_1 _chem_comp_tor.atom_id_2 _chem_comp_tor.atom_id_3 _chem_comp_tor.atom_id_4 _chem_comp_tor.value_angle _chem_comp_tor.value_angle_esd _chem_comp_tor.period ZQ8 CONST_01 C29 C23 C22 C21 -0.07 0.0 0 ZQ8 CONST_02 N30 C29 C23 C22 0.36 0.0 0 ZQ8 CONST_03 C21 N30 C29 C23 -0.55 0.0 0 ZQ8 CONST_04 C22 C21 N30 C29 0.50 0.0 0 ZQ8 CONST_05 C23 C22 C21 N30 -0.25 0.0 0 ZQ8 CONST_06 C26 C25 C24 C23 6.70 0.0 0 ZQ8 CONST_07 C27 C26 C25 C24 1.31 0.0 0 ZQ8 CONST_08 C29 C27 C26 C25 -7.66 0.0 0 ZQ8 CONST_09 C23 C29 C27 C26 6.05 0.0 0 ZQ8 CONST_10 C24 C23 C29 C27 1.74 0.0 0 ZQ8 CONST_11 C25 C24 C23 C29 -8.12 0.0 0 ZQ8 CONST_12 C07 N08 C09 C05 22.35 0.0 0 ZQ8 CONST_13 C23 C22 C21 C20 175.35 0.0 0 ZQ8 CONST_14 C29 N30 C21 C20 -175.37 0.0 0 ZQ8 CONST_15 CL28 C27 C29 C23 -174.46 0.0 0 ZQ8 CONST_16 CL28 C27 C26 C25 172.85 0.0 0 ZQ8 CONST_17 N30 C29 C27 CL28 5.20 0.0 0 ZQ8 CONST_18 O10 C09 N08 C07 -153.55 0.0 0 ZQ8 CONST_19 H301 N30 C21 C22 -176.38 0.0 0 ZQ8 CONST_20 H241 C24 C23 C22 -2.45 0.0 0 ZQ8 CONST_21 H251 C25 C24 C23 -177.03 0.0 0 ZQ8 CONST_22 H261 C26 C25 C24 173.84 0.0 0 ZQ8 CONST_23 H221 C22 C23 C24 -4.62 0.0 0 ZQ8 CONST_24 H081 N08 C09 C05 -167.85 0.0 0 ZQ8 CONST_25 C21 C20 N19 C13 145.49 0.0 0 ZQ8 CONST_26 H191 N19 C20 C21 -47.78 0.0 0 ZQ8 CONST_27 C13 C12 N11 C03 149.40 0.0 0 ZQ8 CONST_28 O32 C12 N11 C03 -29.99 0.0 0 ZQ8 CONST_29 O31 C20 N19 C13 -31.04 0.0 0 ZQ8 CONST_30 H111 N11 C12 C13 -28.42 0.0 0 ZQ8 Var_01 N08 C07 C06 C05 -14.60 30.0 1 ZQ8 Var_02 C09 N08 C07 C06 -5.08 30.0 1 ZQ8 Var_03 C22 C21 C20 N19 -176.17 30.0 2 ZQ8 Var_04 C16 SI15 C14 C13 -16.79 30.0 3 ZQ8 Var_05 H161 C16 SI15 C14 116.48 30.0 3 ZQ8 Var_06 H171 C17 SI15 C14 94.80 30.0 3 ZQ8 Var_07 H181 C18 SI15 C14 -150.09 30.0 3 loop_ _chem_comp_chir.comp_id _chem_comp_chir.id _chem_comp_chir.atom_id_centre _chem_comp_chir.atom_id_1 _chem_comp_chir.atom_id_2 _chem_comp_chir.atom_id_3 _chem_comp_chir.volume_sign ZQ8 chir_01 C03 C01 C04 N11 positiv ZQ8 chir_02 C05 C04 C09 C06 negativ ZQ8 chir_03 C13 C12 C14 N19 positiv loop_ _chem_comp_plane_atom.comp_id _chem_comp_plane_atom.plane_id _chem_comp_plane_atom.atom_id _chem_comp_plane_atom.dist_esd ZQ8 plan-1 C20 0.020 ZQ8 plan-1 C21 0.020 ZQ8 plan-1 C22 0.020 ZQ8 plan-1 C23 0.020 ZQ8 plan-1 C24 0.020 ZQ8 plan-1 C25 0.020 ZQ8 plan-1 C26 0.020 ZQ8 plan-1 C27 0.020 ZQ8 plan-1 CL28 0.020 ZQ8 plan-1 C29 0.020 ZQ8 plan-1 N30 0.020 ZQ8 plan-1 H221 0.020 ZQ8 plan-1 H241 0.020 ZQ8 plan-1 H251 0.020 ZQ8 plan-1 H261 0.020 ZQ8 plan-1 H301 0.020 ZQ8 plan-2 C13 0.020 ZQ8 plan-2 N19 0.020 ZQ8 plan-2 C20 0.020 ZQ8 plan-2 C21 0.020 ZQ8 plan-2 O31 0.020 ZQ8 plan-2 H191 0.020 ZQ8 plan-3 C03 0.020 ZQ8 plan-3 N11 0.020 ZQ8 plan-3 C12 0.020 ZQ8 plan-3 C13 0.020 ZQ8 plan-3 O32 0.020 ZQ8 plan-3 H111 0.020 ZQ8 plan-4 C05 0.020 ZQ8 plan-4 C07 0.020 ZQ8 plan-4 N08 0.020 ZQ8 plan-4 C09 0.020 ZQ8 plan-4 O10 0.020 ZQ8 plan-4 H081 0.020 loop_ _chem_comp_plane.comp_id _chem_comp_plane.id ZQ8 plan-1 ZQ8 plan-2 ZQ8 plan-3 ZQ8 plan-4 loop_ _chem_comp.id _chem_comp.three_letter_code _chem_comp.name _chem_comp.group _chem_comp.number_atoms_all _chem_comp.number_atoms_nh _chem_comp.desc_level ZQ8 ZQ8 'Unknown ' ligand 63 32 .