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  1. affinity_crossrep_check_100/1b8d_K/affinity.float16.npy +3 -0
  2. affinity_crossrep_check_100/1b8d_K/full_affinity_heatmap.png +3 -0
  3. affinity_crossrep_check_100/1b8d_K/q.npy +3 -0
  4. affinity_crossrep_check_100/1b8d_K/q_by_replicate.png +3 -0
  5. affinity_crossrep_check_100/1coj_A/affinity.float16.npy +3 -0
  6. affinity_crossrep_check_100/1coj_A/full_affinity_heatmap.png +3 -0
  7. affinity_crossrep_check_100/1coj_A/q.npy +3 -0
  8. affinity_crossrep_check_100/1coj_A/q_by_replicate.png +3 -0
  9. affinity_crossrep_check_100/1cpq_A/affinity.float16.npy +3 -0
  10. affinity_crossrep_check_100/1cpq_A/full_affinity_heatmap.png +3 -0
  11. affinity_crossrep_check_100/1cpq_A/q.npy +3 -0
  12. affinity_crossrep_check_100/1cpq_A/q_by_replicate.png +3 -0
  13. affinity_crossrep_check_100/1ctf_A/affinity.float16.npy +3 -0
  14. affinity_crossrep_check_100/1ctf_A/full_affinity_heatmap.png +3 -0
  15. affinity_crossrep_check_100/1ctf_A/q.npy +3 -0
  16. affinity_crossrep_check_100/1ctf_A/q_by_replicate.png +3 -0
  17. affinity_crossrep_check_100/1d4t_A/affinity.float16.npy +3 -0
  18. affinity_crossrep_check_100/1d4t_A/full_affinity_heatmap.png +3 -0
  19. affinity_crossrep_check_100/1d4t_A/q.npy +3 -0
  20. affinity_crossrep_check_100/1d4t_A/q_by_replicate.png +3 -0
  21. affinity_crossrep_check_100/1feh_A/affinity.float16.npy +3 -0
  22. affinity_crossrep_check_100/1feh_A/full_affinity_heatmap.png +3 -0
  23. affinity_crossrep_check_100/1feh_A/q.npy +3 -0
  24. affinity_crossrep_check_100/1feh_A/q_by_replicate.png +3 -0
  25. affinity_crossrep_check_100/1gpj_A/affinity.float16.npy +3 -0
  26. affinity_crossrep_check_100/1gpj_A/full_affinity_heatmap.png +3 -0
  27. affinity_crossrep_check_100/1gpj_A/q.npy +3 -0
  28. affinity_crossrep_check_100/1gpj_A/q_by_replicate.png +3 -0
  29. affinity_crossrep_check_100/1h2e_A/affinity.float16.npy +3 -0
  30. affinity_crossrep_check_100/1h2e_A/full_affinity_heatmap.png +3 -0
  31. affinity_crossrep_check_100/1h2e_A/q.npy +3 -0
  32. affinity_crossrep_check_100/1h2e_A/q_by_replicate.png +3 -0
  33. affinity_crossrep_check_100/1ix9_A/affinity.float16.npy +3 -0
  34. affinity_crossrep_check_100/1ix9_A/full_affinity_heatmap.png +3 -0
  35. affinity_crossrep_check_100/1ix9_A/q.npy +3 -0
  36. affinity_crossrep_check_100/1ix9_A/q_by_replicate.png +3 -0
  37. atlas_h5_fp16/16pk_A/heavy_chain.pdb +0 -0
  38. atlas_h5_fp16/16pk_A/meta.json +37 -0
  39. atlas_h5_fp16/1ab1_A/coords.h5 +3 -0
  40. atlas_h5_fp16/1b2s_E/heavy_chain.pdb +732 -0
  41. atlas_h5_fp16/1b2s_E/meta.json +37 -0
  42. atlas_h5_fp16/1bgf_A/heavy_chain.pdb +1025 -0
  43. atlas_h5_fp16/1bgf_A/meta.json +37 -0
  44. atlas_h5_fp16/1bkp_A/heavy_chain.pdb +0 -0
  45. atlas_h5_fp16/1bkp_A/meta.json +37 -0
  46. atlas_h5_fp16/1btk_A/heavy_chain.pdb +0 -0
  47. atlas_h5_fp16/1btk_A/meta.json +37 -0
  48. atlas_h5_fp16/1bxy_A/heavy_chain.pdb +483 -0
  49. atlas_h5_fp16/1bxy_A/meta.json +37 -0
  50. atlas_h5_fp16/1c52_A/heavy_chain.pdb +1004 -0
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+ ATOM 63 O LYS A 3 26.540 15.560 27.270 1.00 0.00 O
30
+ ATOM 64 N ALA A 4 25.480 17.270 26.400 1.00 0.00 N
31
+ ATOM 66 CA ALA A 4 26.480 18.218 26.840 1.00 0.00 C
32
+ ATOM 68 CB ALA A 4 26.600 19.450 25.830 1.00 0.00 C
33
+ ATOM 72 C ALA A 4 26.390 18.608 28.350 1.00 0.00 C
34
+ ATOM 73 O ALA A 4 25.290 18.750 28.870 1.00 0.00 O
35
+ ATOM 74 N VAL A 5 27.460 18.608 29.050 1.00 0.00 N
36
+ ATOM 76 CA VAL A 5 27.420 18.820 30.420 1.00 0.00 C
37
+ ATOM 78 CB VAL A 5 27.710 17.540 31.170 1.00 0.00 C
38
+ ATOM 80 CG1 VAL A 5 27.630 17.630 32.660 1.00 0.00 C
39
+ ATOM 84 CG2 VAL A 5 26.660 16.530 30.730 1.00 0.00 C
40
+ ATOM 88 C VAL A 5 28.430 19.870 30.860 1.00 0.00 C
41
+ ATOM 89 O VAL A 5 29.540 19.810 30.390 1.00 0.00 O
42
+ ATOM 90 N ILE A 6 27.990 20.900 31.660 1.00 0.00 N
43
+ ATOM 92 CA ILE A 6 28.900 21.840 32.360 1.00 0.00 C
44
+ ATOM 94 CB ILE A 6 28.370 23.290 32.230 1.00 0.00 C
45
+ ATOM 96 CG2 ILE A 6 29.260 24.350 32.910 1.00 0.00 C
46
+ ATOM 100 CG1 ILE A 6 28.240 23.730 30.730 1.00 0.00 C
47
+ ATOM 103 CD1 ILE A 6 27.450 25.060 30.400 1.00 0.00 C
48
+ ATOM 107 C ILE A 6 29.050 21.530 33.780 1.00 0.00 C
49
+ ATOM 108 O ILE A 6 28.030 21.550 34.480 1.00 0.00 O
50
+ ATOM 109 N ASN A 7 30.270 21.360 34.360 1.00 0.00 N
51
+ ATOM 111 CA ASN A 7 30.420 21.560 35.810 1.00 0.00 C
52
+ ATOM 113 CB ASN A 7 31.540 20.630 36.320 1.00 0.00 C
53
+ ATOM 116 CG ASN A 7 31.350 19.268 35.740 1.00 0.00 C
54
+ ATOM 117 OD1 ASN A 7 32.140 18.830 34.860 1.00 0.00 O
55
+ ATOM 118 ND2 ASN A 7 30.270 18.490 36.160 1.00 0.00 N
56
+ ATOM 121 C ASN A 7 30.700 23.060 36.150 1.00 0.00 C
57
+ ATOM 122 O ASN A 7 31.780 23.570 35.840 1.00 0.00 O
58
+ ATOM 123 N GLY A 8 29.680 23.770 36.720 1.00 0.00 N
59
+ ATOM 125 CA GLY A 8 29.670 25.160 36.840 1.00 0.00 C
60
+ ATOM 128 C GLY A 8 30.570 25.670 37.900 1.00 0.00 C
61
+ ATOM 129 O GLY A 8 31.130 26.750 37.850 1.00 0.00 O
62
+ ATOM 130 N GLU A 9 30.810 24.880 38.990 1.00 0.00 N
63
+ ATOM 132 CA GLU A 9 31.620 25.218 40.100 1.00 0.00 C
64
+ ATOM 134 CB GLU A 9 31.180 24.390 41.330 1.00 0.00 C
65
+ ATOM 137 CG GLU A 9 31.800 22.900 41.330 1.00 0.00 C
66
+ ATOM 140 CD GLU A 9 31.220 21.840 40.460 1.00 0.00 C
67
+ ATOM 141 OE1 GLU A 9 30.920 22.160 39.270 1.00 0.00 O
68
+ ATOM 142 OE2 GLU A 9 31.120 20.660 40.880 1.00 0.00 O
69
+ ATOM 143 C GLU A 9 33.100 25.210 39.900 1.00 0.00 C
70
+ ATOM 144 O GLU A 9 33.990 25.750 40.550 1.00 0.00 O
71
+ ATOM 145 N GLN A 10 33.420 24.460 38.830 1.00 0.00 N
72
+ ATOM 147 CA GLN A 10 34.710 24.250 38.320 1.00 0.00 C
73
+ ATOM 149 CB GLN A 10 34.840 22.818 37.820 1.00 0.00 C
74
+ ATOM 152 CG GLN A 10 34.730 21.810 39.010 1.00 0.00 C
75
+ ATOM 155 CD GLN A 10 35.630 22.170 40.220 1.00 0.00 C
76
+ ATOM 156 OE1 GLN A 10 35.110 22.340 41.310 1.00 0.00 O
77
+ ATOM 157 NE2 GLN A 10 36.980 22.060 40.060 1.00 0.00 N
78
+ ATOM 160 C GLN A 10 35.050 25.170 37.180 1.00 0.00 C
79
+ ATOM 161 O GLN A 10 36.120 25.110 36.570 1.00 0.00 O
80
+ ATOM 162 N ILE A 11 34.190 26.200 36.820 1.00 0.00 N
81
+ ATOM 164 CA ILE A 11 34.440 27.160 35.790 1.00 0.00 C
82
+ ATOM 166 CB ILE A 11 33.120 27.790 35.340 1.00 0.00 C
83
+ ATOM 168 CG2 ILE A 11 33.320 29.100 34.570 1.00 0.00 C
84
+ ATOM 172 CG1 ILE A 11 32.310 26.820 34.550 1.00 0.00 C
85
+ ATOM 175 CD1 ILE A 11 33.010 26.360 33.240 1.00 0.00 C
86
+ ATOM 179 C ILE A 11 35.470 28.160 36.230 1.00 0.00 C
87
+ ATOM 180 O ILE A 11 35.360 28.810 37.300 1.00 0.00 O
88
+ ATOM 181 N ARG A 12 36.540 28.370 35.420 1.00 0.00 N
89
+ ATOM 183 CA ARG A 12 37.620 29.280 35.810 1.00 0.00 C
90
+ ATOM 185 CB ARG A 12 38.900 28.680 35.220 1.00 0.00 C
91
+ ATOM 188 CG ARG A 12 39.310 27.258 35.770 1.00 0.00 C
92
+ ATOM 191 CD ARG A 12 40.840 26.980 35.280 1.00 0.00 C
93
+ ATOM 194 NE ARG A 12 41.860 27.830 36.050 1.00 0.00 N
94
+ ATOM 196 CZ ARG A 12 43.160 27.660 35.860 1.00 0.00 C
95
+ ATOM 197 NH1 ARG A 12 43.630 26.740 35.120 1.00 0.00 N
96
+ ATOM 200 NH2 ARG A 12 43.970 28.508 36.480 1.00 0.00 N
97
+ ATOM 203 C ARG A 12 37.490 30.710 35.360 1.00 0.00 C
98
+ ATOM 204 O ARG A 12 38.080 31.590 35.990 1.00 0.00 O
99
+ ATOM 205 N SER A 13 36.770 31.100 34.290 1.00 0.00 N
100
+ ATOM 207 CA SER A 13 36.730 32.440 33.630 1.00 0.00 C
101
+ ATOM 209 CB SER A 13 37.920 32.870 32.790 1.00 0.00 C
102
+ ATOM 212 OG SER A 13 38.200 31.930 31.740 1.00 0.00 O
103
+ ATOM 214 C SER A 13 35.590 32.350 32.710 1.00 0.00 C
104
+ ATOM 215 O SER A 13 35.070 31.240 32.350 1.00 0.00 O
105
+ ATOM 216 N ILE A 14 35.140 33.430 32.150 1.00 0.00 N
106
+ ATOM 218 CA ILE A 14 34.070 33.450 31.130 1.00 0.00 C
107
+ ATOM 220 CB ILE A 14 33.350 34.790 30.990 1.00 0.00 C
108
+ ATOM 222 CG2 ILE A 14 34.310 35.890 30.470 1.00 0.00 C
109
+ ATOM 226 CG1 ILE A 14 32.040 34.810 30.210 1.00 0.00 C
110
+ ATOM 229 CD1 ILE A 14 31.150 33.610 30.430 1.00 0.00 C
111
+ ATOM 233 C ILE A 14 34.510 32.810 29.790 1.00 0.00 C
112
+ ATOM 234 O ILE A 14 33.880 32.110 28.990 1.00 0.00 O
113
+ ATOM 235 N SER A 15 35.860 32.890 29.550 1.00 0.00 N
114
+ ATOM 237 CA SER A 15 36.320 32.130 28.330 1.00 0.00 C
115
+ ATOM 239 CB SER A 15 37.620 32.690 27.710 1.00 0.00 C
116
+ ATOM 242 OG SER A 15 38.820 32.510 28.480 1.00 0.00 O
117
+ ATOM 244 C SER A 15 36.520 30.730 28.530 1.00 0.00 C
118
+ ATOM 245 O SER A 15 36.450 29.988 27.590 1.00 0.00 O
119
+ ATOM 246 N ASP A 16 36.750 30.290 29.790 1.00 0.00 N
120
+ ATOM 248 CA ASP A 16 36.750 28.890 30.190 1.00 0.00 C
121
+ ATOM 250 CB ASP A 16 37.240 28.850 31.670 1.00 0.00 C
122
+ ATOM 253 CG ASP A 16 37.420 27.390 32.080 1.00 0.00 C
123
+ ATOM 254 OD1 ASP A 16 38.250 26.710 31.420 1.00 0.00 O
124
+ ATOM 255 OD2 ASP A 16 36.720 26.950 33.030 1.00 0.00 O
125
+ ATOM 256 C ASP A 16 35.370 28.210 30.020 1.00 0.00 C
126
+ ATOM 257 O ASP A 16 35.300 27.060 29.480 1.00 0.00 O
127
+ ATOM 258 N LEU A 17 34.310 28.990 30.230 1.00 0.00 N
128
+ ATOM 260 CA LEU A 17 32.950 28.560 29.890 1.00 0.00 C
129
+ ATOM 262 CB LEU A 17 31.970 29.580 30.530 1.00 0.00 C
130
+ ATOM 265 CG LEU A 17 30.550 29.230 30.300 1.00 0.00 C
131
+ ATOM 267 CD1 LEU A 17 30.090 27.700 30.620 1.00 0.00 C
132
+ ATOM 271 CD2 LEU A 17 29.880 30.270 31.190 1.00 0.00 C
133
+ ATOM 275 C LEU A 17 32.740 28.520 28.360 1.00 0.00 C
134
+ ATOM 276 O LEU A 17 32.240 27.510 27.870 1.00 0.00 O
135
+ ATOM 277 N HIS A 18 33.320 29.490 27.580 1.00 0.00 N
136
+ ATOM 279 CA HIS A 18 33.310 29.420 26.120 1.00 0.00 C
137
+ ATOM 281 CB HIS A 18 33.810 30.740 25.480 1.00 0.00 C
138
+ ATOM 284 ND1 HIS A 18 31.510 31.490 24.640 1.00 0.00 N
139
+ ATOM 286 CG HIS A 18 32.670 31.720 25.420 1.00 0.00 C
140
+ ATOM 287 CE1 HIS A 18 30.670 32.600 24.820 1.00 0.00 C
141
+ ATOM 289 NE2 HIS A 18 31.200 33.430 25.720 1.00 0.00 N
142
+ ATOM 290 CD2 HIS A 18 32.420 32.880 26.080 1.00 0.00 C
143
+ ATOM 292 C HIS A 18 34.050 28.148 25.530 1.00 0.00 C
144
+ ATOM 293 O HIS A 18 33.430 27.380 24.800 1.00 0.00 O
145
+ ATOM 294 N GLN A 19 35.320 27.870 26.020 1.00 0.00 N
146
+ ATOM 296 CA GLN A 19 36.080 26.740 25.680 1.00 0.00 C
147
+ ATOM 298 CB GLN A 19 37.410 27.028 26.270 1.00 0.00 C
148
+ ATOM 301 CG GLN A 19 38.150 28.180 25.590 1.00 0.00 C
149
+ ATOM 304 CD GLN A 19 39.400 28.620 26.270 1.00 0.00 C
150
+ ATOM 305 OE1 GLN A 19 40.030 27.800 26.950 1.00 0.00 O
151
+ ATOM 306 NE2 GLN A 19 39.770 29.890 26.030 1.00 0.00 N
152
+ ATOM 309 C GLN A 19 35.500 25.370 26.140 1.00 0.00 C
153
+ ATOM 310 O GLN A 19 35.560 24.330 25.510 1.00 0.00 O
154
+ ATOM 311 N THR A 20 34.760 25.350 27.320 1.00 0.00 N
155
+ ATOM 313 CA THR A 20 34.070 24.150 27.770 1.00 0.00 C
156
+ ATOM 315 CB THR A 20 33.490 24.298 29.150 1.00 0.00 C
157
+ ATOM 317 OG1 THR A 20 34.590 24.540 30.060 1.00 0.00 O
158
+ ATOM 319 CG2 THR A 20 32.750 23.080 29.710 1.00 0.00 C
159
+ ATOM 323 C THR A 20 32.920 23.810 26.850 1.00 0.00 C
160
+ ATOM 324 O THR A 20 32.730 22.710 26.390 1.00 0.00 O
161
+ ATOM 325 N LEU A 21 32.150 24.880 26.430 1.00 0.00 N
162
+ ATOM 327 CA LEU A 21 31.000 24.758 25.510 1.00 0.00 C
163
+ ATOM 329 CB LEU A 21 30.300 26.108 25.410 1.00 0.00 C
164
+ ATOM 332 CG LEU A 21 29.440 26.430 26.590 1.00 0.00 C
165
+ ATOM 334 CD1 LEU A 21 29.070 27.910 26.620 1.00 0.00 C
166
+ ATOM 338 CD2 LEU A 21 28.180 25.560 26.550 1.00 0.00 C
167
+ ATOM 342 C LEU A 21 31.500 24.210 24.100 1.00 0.00 C
168
+ ATOM 343 O LEU A 21 30.820 23.490 23.380 1.00 0.00 O
169
+ ATOM 344 N LYS A 22 32.630 24.758 23.580 1.00 0.00 N
170
+ ATOM 346 CA LYS A 22 33.360 24.470 22.400 1.00 0.00 C
171
+ ATOM 348 CB LYS A 22 34.680 25.350 22.370 1.00 0.00 C
172
+ ATOM 351 CG LYS A 22 35.480 25.000 21.110 1.00 0.00 C
173
+ ATOM 354 CD LYS A 22 36.700 25.970 20.910 1.00 0.00 C
174
+ ATOM 357 CE LYS A 22 37.640 25.390 19.850 1.00 0.00 C
175
+ ATOM 360 NZ LYS A 22 38.900 26.220 19.770 1.00 0.00 N
176
+ ATOM 364 C LYS A 22 33.620 22.970 22.280 1.00 0.00 C
177
+ ATOM 365 O LYS A 22 33.210 22.320 21.310 1.00 0.00 O
178
+ ATOM 366 N LYS A 23 34.280 22.360 23.300 1.00 0.00 N
179
+ ATOM 368 CA LYS A 23 34.500 20.910 23.390 1.00 0.00 C
180
+ ATOM 370 CB LYS A 23 35.410 20.660 24.600 1.00 0.00 C
181
+ ATOM 373 CG LYS A 23 35.720 19.120 24.710 1.00 0.00 C
182
+ ATOM 376 CD LYS A 23 36.300 18.580 23.470 1.00 0.00 C
183
+ ATOM 379 CE LYS A 23 37.000 17.250 23.740 1.00 0.00 C
184
+ ATOM 382 NZ LYS A 23 36.060 16.160 23.960 1.00 0.00 N
185
+ ATOM 386 C LYS A 23 33.210 20.100 23.490 1.00 0.00 C
186
+ ATOM 387 O LYS A 23 33.010 19.120 22.760 1.00 0.00 O
187
+ ATOM 388 N GLU A 24 32.260 20.470 24.450 1.00 0.00 N
188
+ ATOM 390 CA GLU A 24 31.060 19.660 24.610 1.00 0.00 C
189
+ ATOM 392 CB GLU A 24 30.470 20.080 26.060 1.00 0.00 C
190
+ ATOM 395 CG GLU A 24 31.380 19.570 27.180 1.00 0.00 C
191
+ ATOM 398 CD GLU A 24 31.250 18.060 27.440 1.00 0.00 C
192
+ ATOM 399 OE1 GLU A 24 30.110 17.590 27.790 1.00 0.00 O
193
+ ATOM 400 OE2 GLU A 24 32.280 17.400 27.160 1.00 0.00 O
194
+ ATOM 401 C GLU A 24 30.010 19.750 23.490 1.00 0.00 C
195
+ ATOM 402 O GLU A 24 29.450 18.840 22.890 1.00 0.00 O
196
+ ATOM 403 N LEU A 25 29.680 20.960 22.920 1.00 0.00 N
197
+ ATOM 405 CA LEU A 25 28.690 21.140 21.840 1.00 0.00 C
198
+ ATOM 407 CB LEU A 25 27.930 22.500 21.880 1.00 0.00 C
199
+ ATOM 410 CG LEU A 25 27.080 22.810 23.180 1.00 0.00 C
200
+ ATOM 412 CD1 LEU A 25 26.620 24.280 23.200 1.00 0.00 C
201
+ ATOM 416 CD2 LEU A 25 25.780 21.960 23.190 1.00 0.00 C
202
+ ATOM 420 C LEU A 25 29.310 21.008 20.480 1.00 0.00 C
203
+ ATOM 421 O LEU A 25 28.600 21.210 19.470 1.00 0.00 O
204
+ ATOM 422 N ALA A 26 30.660 20.690 20.340 1.00 0.00 N
205
+ ATOM 424 CA ALA A 26 31.250 20.130 19.190 1.00 0.00 C
206
+ ATOM 426 CB ALA A 26 30.480 18.890 18.630 1.00 0.00 C
207
+ ATOM 430 C ALA A 26 31.440 21.260 18.160 1.00 0.00 C
208
+ ATOM 431 O ALA A 26 31.550 21.008 16.930 1.00 0.00 O
209
+ ATOM 432 N LEU A 27 31.430 22.540 18.640 1.00 0.00 N
210
+ ATOM 434 CA LEU A 27 31.630 23.780 17.960 1.00 0.00 C
211
+ ATOM 436 CB LEU A 27 31.660 24.858 19.020 1.00 0.00 C
212
+ ATOM 439 CG LEU A 27 30.480 24.910 20.060 1.00 0.00 C
213
+ ATOM 441 CD1 LEU A 27 30.520 26.130 21.000 1.00 0.00 C
214
+ ATOM 445 CD2 LEU A 27 29.130 24.950 19.280 1.00 0.00 C
215
+ ATOM 449 C LEU A 27 32.750 23.870 16.930 1.00 0.00 C
216
+ ATOM 450 O LEU A 27 33.730 23.100 17.050 1.00 0.00 O
217
+ ATOM 451 N PRO A 28 32.800 24.640 15.900 1.00 0.00 N
218
+ ATOM 452 CD PRO A 28 31.720 25.648 15.650 1.00 0.00 C
219
+ ATOM 455 CA PRO A 28 34.040 25.060 15.170 1.00 0.00 C
220
+ ATOM 457 CB PRO A 28 33.610 26.330 14.420 1.00 0.00 C
221
+ ATOM 460 CG PRO A 28 32.060 26.210 14.290 1.00 0.00 C
222
+ ATOM 463 C PRO A 28 35.350 25.240 16.010 1.00 0.00 C
223
+ ATOM 464 O PRO A 28 35.360 25.770 17.150 1.00 0.00 O
224
+ ATOM 465 N GLU A 29 36.450 24.988 15.310 1.00 0.00 N
225
+ ATOM 467 CA GLU A 29 37.750 25.310 15.850 1.00 0.00 C
226
+ ATOM 469 CB GLU A 29 38.860 24.570 15.060 1.00 0.00 C
227
+ ATOM 472 CG GLU A 29 40.330 24.820 15.590 1.00 0.00 C
228
+ ATOM 475 CD GLU A 29 40.520 24.450 17.010 1.00 0.00 C
229
+ ATOM 476 OE1 GLU A 29 40.680 23.290 17.300 1.00 0.00 O
230
+ ATOM 477 OE2 GLU A 29 40.530 25.380 17.870 1.00 0.00 O
231
+ ATOM 478 C GLU A 29 38.000 26.840 15.690 1.00 0.00 C
232
+ ATOM 479 O GLU A 29 38.770 27.470 16.370 1.00 0.00 O
233
+ ATOM 480 N TYR A 30 37.260 27.488 14.850 1.00 0.00 N
234
+ ATOM 482 CA TYR A 30 37.460 28.920 14.560 1.00 0.00 C
235
+ ATOM 484 CB TYR A 30 37.110 29.320 13.070 1.00 0.00 C
236
+ ATOM 487 CG TYR A 30 35.680 28.960 12.610 1.00 0.00 C
237
+ ATOM 488 CD1 TYR A 30 34.500 29.590 13.130 1.00 0.00 C
238
+ ATOM 490 CE1 TYR A 30 33.230 29.240 12.610 1.00 0.00 C
239
+ ATOM 492 CZ TYR A 30 33.150 28.370 11.480 1.00 0.00 C
240
+ ATOM 493 OH TYR A 30 31.910 28.010 10.950 1.00 0.00 O
241
+ ATOM 495 CD2 TYR A 30 35.530 28.130 11.530 1.00 0.00 C
242
+ ATOM 497 CE2 TYR A 30 34.290 27.930 10.930 1.00 0.00 C
243
+ ATOM 499 C TYR A 30 36.700 29.770 15.530 1.00 0.00 C
244
+ ATOM 500 O TYR A 30 36.700 30.980 15.410 1.00 0.00 O
245
+ ATOM 501 N TYR A 31 35.950 29.010 16.440 1.00 0.00 N
246
+ ATOM 503 CA TYR A 31 34.820 29.620 17.190 1.00 0.00 C
247
+ ATOM 505 CB TYR A 31 34.180 28.550 18.080 1.00 0.00 C
248
+ ATOM 508 CG TYR A 31 33.300 28.950 19.220 1.00 0.00 C
249
+ ATOM 509 CD1 TYR A 31 32.050 29.510 18.940 1.00 0.00 C
250
+ ATOM 511 CE1 TYR A 31 31.120 29.810 20.030 1.00 0.00 C
251
+ ATOM 513 CZ TYR A 31 31.440 29.410 21.330 1.00 0.00 C
252
+ ATOM 514 OH TYR A 31 30.470 29.720 22.400 1.00 0.00 O
253
+ ATOM 516 CD2 TYR A 31 33.630 28.620 20.530 1.00 0.00 C
254
+ ATOM 518 CE2 TYR A 31 32.680 28.910 21.620 1.00 0.00 C
255
+ ATOM 520 C TYR A 31 35.230 30.860 17.930 1.00 0.00 C
256
+ ATOM 521 O TYR A 31 36.320 30.860 18.620 1.00 0.00 O
257
+ ATOM 522 N GLY A 32 34.450 32.010 17.910 1.00 0.00 N
258
+ ATOM 524 CA GLY A 32 34.790 33.290 18.460 1.00 0.00 C
259
+ ATOM 527 C GLY A 32 34.990 33.420 20.000 1.00 0.00 C
260
+ ATOM 528 O GLY A 32 35.790 34.280 20.450 1.00 0.00 O
261
+ ATOM 529 N GLU A 33 34.240 32.620 20.840 1.00 0.00 N
262
+ ATOM 531 CA GLU A 33 34.310 32.610 22.290 1.00 0.00 C
263
+ ATOM 533 CB GLU A 33 35.690 32.360 22.830 1.00 0.00 C
264
+ ATOM 536 CG GLU A 33 36.130 30.910 22.420 1.00 0.00 C
265
+ ATOM 539 CD GLU A 33 37.550 30.550 22.900 1.00 0.00 C
266
+ ATOM 540 OE1 GLU A 33 38.040 31.070 23.920 1.00 0.00 O
267
+ ATOM 541 OE2 GLU A 33 38.210 29.728 22.190 1.00 0.00 O
268
+ ATOM 542 C GLU A 33 33.560 33.780 22.890 1.00 0.00 C
269
+ ATOM 543 O GLU A 33 34.140 34.460 23.760 1.00 0.00 O
270
+ ATOM 544 N ASN A 34 32.330 34.100 22.450 1.00 0.00 N
271
+ ATOM 546 CA ASN A 34 31.590 35.260 22.870 1.00 0.00 C
272
+ ATOM 548 CB ASN A 34 32.000 36.590 22.160 1.00 0.00 C
273
+ ATOM 551 CG ASN A 34 32.090 36.440 20.650 1.00 0.00 C
274
+ ATOM 552 OD1 ASN A 34 31.190 36.210 19.920 1.00 0.00 O
275
+ ATOM 553 ND2 ASN A 34 33.340 36.600 20.130 1.00 0.00 N
276
+ ATOM 556 C ASN A 34 30.150 34.890 22.550 1.00 0.00 C
277
+ ATOM 557 O ASN A 34 29.830 33.830 21.970 1.00 0.00 O
278
+ ATOM 558 N LEU A 35 29.270 35.740 23.120 1.00 0.00 N
279
+ ATOM 560 CA LEU A 35 27.870 35.550 22.930 1.00 0.00 C
280
+ ATOM 562 CB LEU A 35 26.980 36.610 23.570 1.00 0.00 C
281
+ ATOM 565 CG LEU A 35 27.060 36.850 25.050 1.00 0.00 C
282
+ ATOM 567 CD1 LEU A 35 25.960 37.848 25.470 1.00 0.00 C
283
+ ATOM 571 CD2 LEU A 35 26.960 35.600 25.880 1.00 0.00 C
284
+ ATOM 575 C LEU A 35 27.430 35.550 21.460 1.00 0.00 C
285
+ ATOM 576 O LEU A 35 26.600 34.690 21.140 1.00 0.00 O
286
+ ATOM 577 N ASP A 36 27.910 36.470 20.580 1.00 0.00 N
287
+ ATOM 579 CA ASP A 36 27.440 36.560 19.210 1.00 0.00 C
288
+ ATOM 581 CB ASP A 36 27.990 37.870 18.510 1.00 0.00 C
289
+ ATOM 584 CG ASP A 36 27.490 39.098 19.260 1.00 0.00 C
290
+ ATOM 585 OD1 ASP A 36 26.280 39.130 19.650 1.00 0.00 O
291
+ ATOM 586 OD2 ASP A 36 28.280 40.088 19.400 1.00 0.00 O
292
+ ATOM 587 C ASP A 36 27.830 35.340 18.360 1.00 0.00 C
293
+ ATOM 588 O ASP A 36 26.960 34.860 17.600 1.00 0.00 O
294
+ ATOM 589 N ALA A 37 29.030 34.780 18.630 1.00 0.00 N
295
+ ATOM 591 CA ALA A 37 29.450 33.520 18.190 1.00 0.00 C
296
+ ATOM 593 CB ALA A 37 30.940 33.240 18.600 1.00 0.00 C
297
+ ATOM 597 C ALA A 37 28.550 32.320 18.550 1.00 0.00 C
298
+ ATOM 598 O ALA A 37 28.190 31.420 17.800 1.00 0.00 O
299
+ ATOM 599 N LEU A 38 28.100 32.320 19.840 1.00 0.00 N
300
+ ATOM 601 CA LEU A 38 27.440 31.180 20.300 1.00 0.00 C
301
+ ATOM 603 CB LEU A 38 27.460 31.310 21.820 1.00 0.00 C
302
+ ATOM 606 CG LEU A 38 26.670 30.280 22.670 1.00 0.00 C
303
+ ATOM 608 CD1 LEU A 38 27.160 28.920 22.390 1.00 0.00 C
304
+ ATOM 612 CD2 LEU A 38 26.800 30.600 24.140 1.00 0.00 C
305
+ ATOM 616 C LEU A 38 26.010 31.200 19.800 1.00 0.00 C
306
+ ATOM 617 O LEU A 38 25.420 30.150 19.480 1.00 0.00 O
307
+ ATOM 618 N TRP A 39 25.390 32.400 19.610 1.00 0.00 N
308
+ ATOM 620 CA TRP A 39 24.140 32.520 18.800 1.00 0.00 C
309
+ ATOM 622 CB TRP A 39 23.570 33.910 18.900 1.00 0.00 C
310
+ ATOM 625 CG TRP A 39 22.360 34.210 18.190 1.00 0.00 C
311
+ ATOM 626 CD1 TRP A 39 22.290 34.740 16.950 1.00 0.00 C
312
+ ATOM 628 NE1 TRP A 39 21.020 34.700 16.480 1.00 0.00 N
313
+ ATOM 630 CE2 TRP A 39 20.270 34.090 17.410 1.00 0.00 C
314
+ ATOM 631 CD2 TRP A 39 21.060 33.840 18.530 1.00 0.00 C
315
+ ATOM 632 CE3 TRP A 39 20.450 33.240 19.700 1.00 0.00 C
316
+ ATOM 634 CZ3 TRP A 39 19.100 32.910 19.590 1.00 0.00 C
317
+ ATOM 636 CZ2 TRP A 39 18.930 33.890 17.380 1.00 0.00 C
318
+ ATOM 638 CH2 TRP A 39 18.390 33.200 18.440 1.00 0.00 C
319
+ ATOM 640 C TRP A 39 24.240 32.080 17.420 1.00 0.00 C
320
+ ATOM 641 O TRP A 39 23.420 31.250 17.030 1.00 0.00 O
321
+ ATOM 642 N ASP A 40 25.350 32.380 16.750 1.00 0.00 N
322
+ ATOM 644 CA ASP A 40 25.700 31.940 15.370 1.00 0.00 C
323
+ ATOM 646 CB ASP A 40 27.040 32.640 14.990 1.00 0.00 C
324
+ ATOM 649 CG ASP A 40 27.390 32.520 13.450 1.00 0.00 C
325
+ ATOM 650 OD1 ASP A 40 26.470 32.250 12.680 1.00 0.00 O
326
+ ATOM 651 OD2 ASP A 40 28.590 32.680 13.070 1.00 0.00 O
327
+ ATOM 652 C ASP A 40 25.700 30.370 15.310 1.00 0.00 C
328
+ ATOM 653 O ASP A 40 25.080 29.820 14.400 1.00 0.00 O
329
+ ATOM 654 N CYS A 41 26.420 29.720 16.300 1.00 0.00 N
330
+ ATOM 656 CA CYS A 41 26.520 28.260 16.490 1.00 0.00 C
331
+ ATOM 658 CB CYS A 41 27.630 28.148 17.510 1.00 0.00 C
332
+ ATOM 661 SG CYS A 41 29.350 28.700 17.050 1.00 0.00 S
333
+ ATOM 663 C CYS A 41 25.290 27.480 16.850 1.00 0.00 C
334
+ ATOM 664 O CYS A 41 25.090 26.468 16.230 1.00 0.00 O
335
+ ATOM 665 N LEU A 42 24.410 27.970 17.780 1.00 0.00 N
336
+ ATOM 667 CA LEU A 42 23.100 27.400 17.940 1.00 0.00 C
337
+ ATOM 669 CB LEU A 42 22.330 28.080 19.090 1.00 0.00 C
338
+ ATOM 672 CG LEU A 42 22.930 27.890 20.510 1.00 0.00 C
339
+ ATOM 674 CD1 LEU A 42 22.160 28.680 21.550 1.00 0.00 C
340
+ ATOM 678 CD2 LEU A 42 22.940 26.438 20.870 1.00 0.00 C
341
+ ATOM 682 C LEU A 42 22.250 27.550 16.650 1.00 0.00 C
342
+ ATOM 683 O LEU A 42 21.460 26.660 16.310 1.00 0.00 O
343
+ ATOM 684 N ALA A 43 22.270 28.738 15.900 1.00 0.00 N
344
+ ATOM 686 CA ALA A 43 21.420 28.880 14.710 1.00 0.00 C
345
+ ATOM 688 CB ALA A 43 21.140 30.400 14.450 1.00 0.00 C
346
+ ATOM 692 C ALA A 43 21.860 28.200 13.430 1.00 0.00 C
347
+ ATOM 693 O ALA A 43 21.120 27.890 12.520 1.00 0.00 O
348
+ ATOM 694 N GLY A 44 23.160 27.870 13.310 1.00 0.00 N
349
+ ATOM 696 CA GLY A 44 23.640 27.170 12.120 1.00 0.00 C
350
+ ATOM 699 C GLY A 44 24.870 26.400 12.280 1.00 0.00 C
351
+ ATOM 700 O GLY A 44 25.840 26.710 11.570 1.00 0.00 O
352
+ ATOM 701 N TRP A 45 24.960 25.390 13.110 1.00 0.00 N
353
+ ATOM 703 CA TRP A 45 26.140 24.520 13.170 1.00 0.00 C
354
+ ATOM 705 CB TRP A 45 27.330 25.230 13.840 1.00 0.00 C
355
+ ATOM 708 CG TRP A 45 28.540 24.360 14.200 1.00 0.00 C
356
+ ATOM 709 CD1 TRP A 45 28.820 23.660 15.340 1.00 0.00 C
357
+ ATOM 711 NE1 TRP A 45 29.800 22.670 15.030 1.00 0.00 N
358
+ ATOM 713 CE2 TRP A 45 30.320 22.870 13.780 1.00 0.00 C
359
+ ATOM 714 CD2 TRP A 45 29.500 23.920 13.170 1.00 0.00 C
360
+ ATOM 715 CE3 TRP A 45 29.850 24.430 11.880 1.00 0.00 C
361
+ ATOM 717 CZ3 TRP A 45 31.000 23.950 11.260 1.00 0.00 C
362
+ ATOM 719 CZ2 TRP A 45 31.290 22.270 13.040 1.00 0.00 C
363
+ ATOM 721 CH2 TRP A 45 31.630 22.790 11.730 1.00 0.00 C
364
+ ATOM 723 C TRP A 45 25.820 23.240 13.900 1.00 0.00 C
365
+ ATOM 724 O TRP A 45 25.980 22.190 13.290 1.00 0.00 O
366
+ ATOM 725 N VAL A 46 25.290 23.350 15.220 1.00 0.00 N
367
+ ATOM 727 CA VAL A 46 25.070 22.250 16.150 1.00 0.00 C
368
+ ATOM 729 CB VAL A 46 24.810 22.800 17.590 1.00 0.00 C
369
+ ATOM 731 CG1 VAL A 46 26.050 23.490 18.060 1.00 0.00 C
370
+ ATOM 735 CG2 VAL A 46 23.510 23.600 17.550 1.00 0.00 C
371
+ ATOM 739 C VAL A 46 24.100 21.100 15.680 1.00 0.00 C
372
+ ATOM 740 O VAL A 46 23.150 21.350 14.970 1.00 0.00 O
373
+ ATOM 741 N GLU A 47 24.310 19.910 16.200 1.00 0.00 N
374
+ ATOM 743 CA GLU A 47 23.310 18.890 16.030 1.00 0.00 C
375
+ ATOM 745 CB GLU A 47 23.930 17.460 16.160 1.00 0.00 C
376
+ ATOM 748 CG GLU A 47 23.050 16.330 16.430 1.00 0.00 C
377
+ ATOM 751 CD GLU A 47 23.740 14.970 16.380 1.00 0.00 C
378
+ ATOM 752 OE1 GLU A 47 24.510 14.780 15.420 1.00 0.00 O
379
+ ATOM 753 OE2 GLU A 47 23.540 14.040 17.240 1.00 0.00 O
380
+ ATOM 754 C GLU A 47 22.100 19.040 16.970 1.00 0.00 C
381
+ ATOM 755 O GLU A 47 22.340 19.440 18.170 1.00 0.00 O
382
+ ATOM 756 N TYR A 48 20.890 18.760 16.470 1.00 0.00 N
383
+ ATOM 758 CA TYR A 48 19.680 18.870 17.280 1.00 0.00 C
384
+ ATOM 760 CB TYR A 48 18.660 19.900 16.640 1.00 0.00 C
385
+ ATOM 763 CG TYR A 48 19.090 21.330 17.080 1.00 0.00 C
386
+ ATOM 764 CD1 TYR A 48 19.280 21.660 18.410 1.00 0.00 C
387
+ ATOM 766 CE1 TYR A 48 19.620 22.930 18.760 1.00 0.00 C
388
+ ATOM 768 CZ TYR A 48 19.800 23.950 17.750 1.00 0.00 C
389
+ ATOM 769 OH TYR A 48 20.130 25.280 18.120 1.00 0.00 O
390
+ ATOM 771 CD2 TYR A 48 19.370 22.250 16.070 1.00 0.00 C
391
+ ATOM 773 CE2 TYR A 48 19.730 23.590 16.400 1.00 0.00 C
392
+ ATOM 775 C TYR A 48 19.080 17.510 17.430 1.00 0.00 C
393
+ ATOM 776 O TYR A 48 19.420 16.580 16.680 1.00 0.00 O
394
+ ATOM 777 N PRO A 49 18.120 17.250 18.420 1.00 0.00 N
395
+ ATOM 778 CD PRO A 49 17.340 16.030 18.270 1.00 0.00 C
396
+ ATOM 781 CA PRO A 49 18.050 17.730 19.760 1.00 0.00 C
397
+ ATOM 783 CB PRO A 49 17.320 16.730 20.630 1.00 0.00 C
398
+ ATOM 786 CG PRO A 49 16.430 16.100 19.470 1.00 0.00 C
399
+ ATOM 789 C PRO A 49 19.410 18.010 20.480 1.00 0.00 C
400
+ ATOM 790 O PRO A 49 20.420 17.250 20.320 1.00 0.00 O
401
+ ATOM 791 N LEU A 50 19.480 19.100 21.280 1.00 0.00 N
402
+ ATOM 793 CA LEU A 50 20.570 19.560 22.110 1.00 0.00 C
403
+ ATOM 795 CB LEU A 50 20.830 21.140 21.750 1.00 0.00 C
404
+ ATOM 798 CG LEU A 50 22.130 21.740 22.260 1.00 0.00 C
405
+ ATOM 800 CD1 LEU A 50 22.780 22.600 21.240 1.00 0.00 C
406
+ ATOM 804 CD2 LEU A 50 22.050 22.420 23.600 1.00 0.00 C
407
+ ATOM 808 C LEU A 50 20.060 19.420 23.580 1.00 0.00 C
408
+ ATOM 809 O LEU A 50 18.860 19.680 23.800 1.00 0.00 O
409
+ ATOM 810 N VAL A 51 20.850 18.730 24.460 1.00 0.00 N
410
+ ATOM 812 CA VAL A 51 20.400 18.540 25.780 1.00 0.00 C
411
+ ATOM 814 CB VAL A 51 19.990 17.040 26.040 1.00 0.00 C
412
+ ATOM 816 CG1 VAL A 51 19.790 16.860 27.540 1.00 0.00 C
413
+ ATOM 820 CG2 VAL A 51 18.760 16.580 25.280 1.00 0.00 C
414
+ ATOM 824 C VAL A 51 21.630 18.990 26.530 1.00 0.00 C
415
+ ATOM 825 O VAL A 51 22.730 18.470 26.460 1.00 0.00 O
416
+ ATOM 826 N LEU A 52 21.450 20.100 27.310 1.00 0.00 N
417
+ ATOM 828 CA LEU A 52 22.510 20.770 28.000 1.00 0.00 C
418
+ ATOM 830 CB LEU A 52 22.690 22.190 27.520 1.00 0.00 C
419
+ ATOM 833 CG LEU A 52 23.750 23.130 28.160 1.00 0.00 C
420
+ ATOM 835 CD1 LEU A 52 25.170 22.410 28.290 1.00 0.00 C
421
+ ATOM 839 CD2 LEU A 52 23.750 24.390 27.320 1.00 0.00 C
422
+ ATOM 843 C LEU A 52 22.150 20.830 29.520 1.00 0.00 C
423
+ ATOM 844 O LEU A 52 21.200 21.490 29.920 1.00 0.00 O
424
+ ATOM 845 N GLU A 53 22.970 20.070 30.290 1.00 0.00 N
425
+ ATOM 847 CA GLU A 53 22.900 20.070 31.680 1.00 0.00 C
426
+ ATOM 849 CB GLU A 53 23.150 18.630 32.290 1.00 0.00 C
427
+ ATOM 852 CG GLU A 53 22.800 18.530 33.830 1.00 0.00 C
428
+ ATOM 855 CD GLU A 53 23.200 17.170 34.480 1.00 0.00 C
429
+ ATOM 856 OE1 GLU A 53 23.580 16.230 33.780 1.00 0.00 O
430
+ ATOM 857 OE2 GLU A 53 23.150 17.050 35.730 1.00 0.00 O
431
+ ATOM 858 C GLU A 53 23.930 20.990 32.310 1.00 0.00 C
432
+ ATOM 859 O GLU A 53 25.150 20.840 32.240 1.00 0.00 O
433
+ ATOM 860 N TRP A 54 23.480 22.060 33.000 1.00 0.00 N
434
+ ATOM 862 CA TRP A 54 24.290 22.980 33.730 1.00 0.00 C
435
+ ATOM 864 CB TRP A 54 24.030 24.470 33.270 1.00 0.00 C
436
+ ATOM 867 CG TRP A 54 25.110 25.570 33.440 1.00 0.00 C
437
+ ATOM 868 CD1 TRP A 54 25.990 25.740 34.460 1.00 0.00 C
438
+ ATOM 870 NE1 TRP A 54 26.610 26.990 34.290 1.00 0.00 N
439
+ ATOM 872 CE2 TRP A 54 26.340 27.530 33.140 1.00 0.00 C
440
+ ATOM 873 CD2 TRP A 54 25.260 26.780 32.600 1.00 0.00 C
441
+ ATOM 874 CE3 TRP A 54 24.640 27.210 31.420 1.00 0.00 C
442
+ ATOM 876 CZ3 TRP A 54 25.060 28.440 30.870 1.00 0.00 C
443
+ ATOM 878 CZ2 TRP A 54 26.790 28.700 32.560 1.00 0.00 C
444
+ ATOM 880 CH2 TRP A 54 26.120 29.090 31.400 1.00 0.00 C
445
+ ATOM 882 C TRP A 54 24.180 22.650 35.250 1.00 0.00 C
446
+ ATOM 883 O TRP A 54 23.130 22.810 35.860 1.00 0.00 O
447
+ ATOM 884 N ARG A 55 25.160 22.040 35.850 1.00 0.00 N
448
+ ATOM 886 CA ARG A 55 25.340 21.630 37.190 1.00 0.00 C
449
+ ATOM 888 CB ARG A 55 26.190 20.370 37.530 1.00 0.00 C
450
+ ATOM 891 CG ARG A 55 25.660 19.138 36.780 1.00 0.00 C
451
+ ATOM 894 CD ARG A 55 26.580 17.960 36.960 1.00 0.00 C
452
+ ATOM 897 NE ARG A 55 26.040 16.850 36.090 1.00 0.00 N
453
+ ATOM 899 CZ ARG A 55 26.740 15.880 35.570 1.00 0.00 C
454
+ ATOM 900 NH1 ARG A 55 27.940 15.540 35.910 1.00 0.00 N
455
+ ATOM 903 NH2 ARG A 55 26.100 15.140 34.640 1.00 0.00 N
456
+ ATOM 906 C ARG A 55 25.960 22.818 37.920 1.00 0.00 C
457
+ ATOM 907 O ARG A 55 27.040 23.260 37.480 1.00 0.00 O
458
+ ATOM 908 N GLN A 56 25.290 23.440 38.930 1.00 0.00 N
459
+ ATOM 910 CA GLN A 56 25.950 24.510 39.730 1.00 0.00 C
460
+ ATOM 912 CB GLN A 56 27.380 24.110 40.140 1.00 0.00 C
461
+ ATOM 915 CG GLN A 56 27.440 22.740 40.940 1.00 0.00 C
462
+ ATOM 918 CD GLN A 56 26.250 22.310 41.850 1.00 0.00 C
463
+ ATOM 919 OE1 GLN A 56 25.660 21.270 41.610 1.00 0.00 O
464
+ ATOM 920 NE2 GLN A 56 25.910 23.220 42.850 1.00 0.00 N
465
+ ATOM 923 C GLN A 56 26.040 25.790 39.010 1.00 0.00 C
466
+ ATOM 924 O GLN A 56 27.040 26.530 39.020 1.00 0.00 O
467
+ ATOM 925 N PHE A 57 24.970 26.150 38.350 1.00 0.00 N
468
+ ATOM 927 CA PHE A 57 24.920 27.458 37.760 1.00 0.00 C
469
+ ATOM 929 CB PHE A 57 23.570 27.470 36.880 1.00 0.00 C
470
+ ATOM 932 CG PHE A 57 23.270 28.860 36.350 1.00 0.00 C
471
+ ATOM 933 CD1 PHE A 57 23.810 29.298 35.190 1.00 0.00 C
472
+ ATOM 935 CE1 PHE A 57 23.620 30.570 34.700 1.00 0.00 C
473
+ ATOM 937 CZ PHE A 57 22.740 31.470 35.340 1.00 0.00 C
474
+ ATOM 939 CD2 PHE A 57 22.490 29.790 37.120 1.00 0.00 C
475
+ ATOM 941 CE2 PHE A 57 22.230 31.080 36.610 1.00 0.00 C
476
+ ATOM 943 C PHE A 57 25.110 28.690 38.590 1.00 0.00 C
477
+ ATOM 944 O PHE A 57 25.820 29.590 38.060 1.00 0.00 O
478
+ ATOM 945 N GLU A 58 24.490 28.810 39.740 1.00 0.00 N
479
+ ATOM 947 CA GLU A 58 24.670 29.930 40.670 1.00 0.00 C
480
+ ATOM 949 CB GLU A 58 23.710 29.890 41.800 1.00 0.00 C
481
+ ATOM 952 CG GLU A 58 23.410 28.508 42.460 1.00 0.00 C
482
+ ATOM 955 CD GLU A 58 22.360 27.710 41.870 1.00 0.00 C
483
+ ATOM 956 OE1 GLU A 58 21.120 27.780 42.270 1.00 0.00 O
484
+ ATOM 957 OE2 GLU A 58 22.670 26.930 40.970 1.00 0.00 O
485
+ ATOM 958 C GLU A 58 26.130 30.150 41.120 1.00 0.00 C
486
+ ATOM 959 O GLU A 58 26.610 31.280 41.200 1.00 0.00 O
487
+ ATOM 960 N GLN A 59 26.830 28.968 41.330 1.00 0.00 N
488
+ ATOM 962 CA GLN A 59 28.290 28.960 41.520 1.00 0.00 C
489
+ ATOM 964 CB GLN A 59 28.830 27.530 41.870 1.00 0.00 C
490
+ ATOM 967 CG GLN A 59 28.480 27.010 43.220 1.00 0.00 C
491
+ ATOM 970 CD GLN A 59 27.190 26.300 43.420 1.00 0.00 C
492
+ ATOM 971 OE1 GLN A 59 26.250 26.280 42.660 1.00 0.00 O
493
+ ATOM 972 NE2 GLN A 59 27.090 25.570 44.570 1.00 0.00 N
494
+ ATOM 975 C GLN A 59 29.030 29.450 40.280 1.00 0.00 C
495
+ ATOM 976 O GLN A 59 30.010 30.250 40.420 1.00 0.00 O
496
+ ATOM 977 N SER A 60 28.630 29.040 39.060 1.00 0.00 N
497
+ ATOM 979 CA SER A 60 29.220 29.600 37.820 1.00 0.00 C
498
+ ATOM 981 CB SER A 60 28.840 28.850 36.530 1.00 0.00 C
499
+ ATOM 984 OG SER A 60 27.540 29.168 35.970 1.00 0.00 O
500
+ ATOM 986 C SER A 60 29.040 31.080 37.590 1.00 0.00 C
501
+ ATOM 987 O SER A 60 29.830 31.740 36.960 1.00 0.00 O
502
+ ATOM 988 N LYS A 61 27.980 31.590 38.180 1.00 0.00 N
503
+ ATOM 990 CA LYS A 61 27.520 32.980 38.030 1.00 0.00 C
504
+ ATOM 992 CB LYS A 61 25.990 32.990 38.110 1.00 0.00 C
505
+ ATOM 995 CG LYS A 61 25.360 34.390 38.020 1.00 0.00 C
506
+ ATOM 998 CD LYS A 61 23.800 34.250 37.990 1.00 0.00 C
507
+ ATOM 1001 CE LYS A 61 23.200 35.630 38.140 1.00 0.00 C
508
+ ATOM 1004 NZ LYS A 61 21.740 35.410 38.220 1.00 0.00 N
509
+ ATOM 1008 C LYS A 61 28.220 33.930 38.950 1.00 0.00 C
510
+ ATOM 1009 O LYS A 61 28.210 35.160 38.790 1.00 0.00 O
511
+ ATOM 1010 N GLN A 62 28.980 33.390 39.950 1.00 0.00 N
512
+ ATOM 1012 CA GLN A 62 29.910 34.120 40.770 1.00 0.00 C
513
+ ATOM 1014 CB GLN A 62 29.990 33.400 42.180 1.00 0.00 C
514
+ ATOM 1017 CG GLN A 62 28.750 33.570 43.070 1.00 0.00 C
515
+ ATOM 1020 CD GLN A 62 28.680 32.710 44.350 1.00 0.00 C
516
+ ATOM 1021 OE1 GLN A 62 28.210 31.600 44.500 1.00 0.00 O
517
+ ATOM 1022 NE2 GLN A 62 29.270 33.300 45.400 1.00 0.00 N
518
+ ATOM 1025 C GLN A 62 31.330 34.050 40.220 1.00 0.00 C
519
+ ATOM 1026 O GLN A 62 32.030 35.050 40.160 1.00 0.00 O
520
+ ATOM 1027 N LEU A 63 31.710 32.880 39.700 1.00 0.00 N
521
+ ATOM 1029 CA LEU A 63 32.940 32.660 38.950 1.00 0.00 C
522
+ ATOM 1031 CB LEU A 63 33.120 31.110 38.690 1.00 0.00 C
523
+ ATOM 1034 CG LEU A 63 33.350 30.360 40.050 1.00 0.00 C
524
+ ATOM 1036 CD1 LEU A 63 33.080 28.890 39.980 1.00 0.00 C
525
+ ATOM 1040 CD2 LEU A 63 34.780 30.520 40.650 1.00 0.00 C
526
+ ATOM 1044 C LEU A 63 33.180 33.340 37.570 1.00 0.00 C
527
+ ATOM 1045 O LEU A 63 34.390 33.640 37.270 1.00 0.00 O
528
+ ATOM 1046 N THR A 64 32.150 33.740 36.890 1.00 0.00 N
529
+ ATOM 1048 CA THR A 64 32.360 34.500 35.650 1.00 0.00 C
530
+ ATOM 1050 CB THR A 64 31.630 33.760 34.480 1.00 0.00 C
531
+ ATOM 1052 OG1 THR A 64 30.280 33.550 34.790 1.00 0.00 O
532
+ ATOM 1054 CG2 THR A 64 32.190 32.330 34.210 1.00 0.00 C
533
+ ATOM 1058 C THR A 64 31.710 35.900 35.760 1.00 0.00 C
534
+ ATOM 1059 O THR A 64 31.700 36.550 34.740 1.00 0.00 O
535
+ ATOM 1060 N GLU A 65 31.210 36.400 36.940 1.00 0.00 N
536
+ ATOM 1062 CA GLU A 65 30.170 37.370 37.060 1.00 0.00 C
537
+ ATOM 1064 CB GLU A 65 30.620 38.870 37.040 1.00 0.00 C
538
+ ATOM 1067 CG GLU A 65 31.230 39.310 35.650 1.00 0.00 C
539
+ ATOM 1070 CD GLU A 65 31.500 40.818 35.560 1.00 0.00 C
540
+ ATOM 1071 OE1 GLU A 65 32.190 41.260 36.520 1.00 0.00 O
541
+ ATOM 1072 OE2 GLU A 65 31.170 41.510 34.530 1.00 0.00 O
542
+ ATOM 1073 C GLU A 65 28.890 37.030 36.350 1.00 0.00 C
543
+ ATOM 1074 O GLU A 65 28.490 35.870 36.150 1.00 0.00 O
544
+ ATOM 1075 N ASN A 66 28.270 38.010 35.730 1.00 0.00 N
545
+ ATOM 1077 CA ASN A 66 26.970 37.740 35.080 1.00 0.00 C
546
+ ATOM 1079 CB ASN A 66 26.020 38.980 35.180 1.00 0.00 C
547
+ ATOM 1082 CG ASN A 66 25.800 39.270 36.640 1.00 0.00 C
548
+ ATOM 1083 OD1 ASN A 66 25.050 38.540 37.280 1.00 0.00 O
549
+ ATOM 1084 ND2 ASN A 66 26.560 40.240 37.170 1.00 0.00 N
550
+ ATOM 1087 C ASN A 66 27.250 37.340 33.650 1.00 0.00 C
551
+ ATOM 1088 O ASN A 66 26.290 37.150 32.890 1.00 0.00 O
552
+ ATOM 1089 N GLY A 67 28.500 36.930 33.210 1.00 0.00 N
553
+ ATOM 1091 CA GLY A 67 28.770 36.240 31.960 1.00 0.00 C
554
+ ATOM 1094 C GLY A 67 28.050 34.960 31.750 1.00 0.00 C
555
+ ATOM 1095 O GLY A 67 27.490 34.710 30.680 1.00 0.00 O
556
+ ATOM 1096 N ALA A 68 28.010 34.130 32.810 1.00 0.00 N
557
+ ATOM 1098 CA ALA A 68 27.210 32.910 32.830 1.00 0.00 C
558
+ ATOM 1100 CB ALA A 68 27.580 32.130 34.110 1.00 0.00 C
559
+ ATOM 1104 C ALA A 68 25.710 33.050 32.590 1.00 0.00 C
560
+ ATOM 1105 O ALA A 68 25.180 32.290 31.780 1.00 0.00 O
561
+ ATOM 1106 N GLU A 69 25.060 34.050 33.190 1.00 0.00 N
562
+ ATOM 1108 CA GLU A 69 23.690 34.500 33.040 1.00 0.00 C
563
+ ATOM 1110 CB GLU A 69 23.380 35.670 34.070 1.00 0.00 C
564
+ ATOM 1113 CG GLU A 69 21.830 36.050 34.090 1.00 0.00 C
565
+ ATOM 1116 CD GLU A 69 20.880 35.080 34.740 1.00 0.00 C
566
+ ATOM 1117 OE1 GLU A 69 21.030 34.650 35.880 1.00 0.00 O
567
+ ATOM 1118 OE2 GLU A 69 19.860 34.720 34.050 1.00 0.00 O
568
+ ATOM 1119 C GLU A 69 23.450 34.920 31.600 1.00 0.00 C
569
+ ATOM 1120 O GLU A 69 22.600 34.330 30.990 1.00 0.00 O
570
+ ATOM 1121 N SER A 70 24.340 35.710 30.910 1.00 0.00 N
571
+ ATOM 1123 CA SER A 70 24.220 35.970 29.480 1.00 0.00 C
572
+ ATOM 1125 CB SER A 70 24.960 37.250 28.990 1.00 0.00 C
573
+ ATOM 1128 OG SER A 70 26.370 37.180 29.060 1.00 0.00 O
574
+ ATOM 1130 C SER A 70 24.350 34.820 28.590 1.00 0.00 C
575
+ ATOM 1131 O SER A 70 23.640 34.690 27.590 1.00 0.00 O
576
+ ATOM 1132 N VAL A 71 25.270 33.960 28.870 1.00 0.00 N
577
+ ATOM 1134 CA VAL A 71 25.410 32.670 28.090 1.00 0.00 C
578
+ ATOM 1136 CB VAL A 71 26.740 32.100 28.450 1.00 0.00 C
579
+ ATOM 1138 CG1 VAL A 71 26.850 30.680 27.920 1.00 0.00 C
580
+ ATOM 1142 CG2 VAL A 71 27.860 33.040 27.900 1.00 0.00 C
581
+ ATOM 1146 C VAL A 71 24.210 31.730 28.260 1.00 0.00 C
582
+ ATOM 1147 O VAL A 71 23.630 31.260 27.250 1.00 0.00 O
583
+ ATOM 1148 N LEU A 72 23.690 31.540 29.460 1.00 0.00 N
584
+ ATOM 1150 CA LEU A 72 22.410 30.960 29.610 1.00 0.00 C
585
+ ATOM 1152 CB LEU A 72 22.100 30.680 31.080 1.00 0.00 C
586
+ ATOM 1155 CG LEU A 72 20.680 30.050 31.370 1.00 0.00 C
587
+ ATOM 1157 CD1 LEU A 72 20.470 28.660 30.730 1.00 0.00 C
588
+ ATOM 1161 CD2 LEU A 72 20.250 30.050 32.880 1.00 0.00 C
589
+ ATOM 1165 C LEU A 72 21.260 31.700 28.870 1.00 0.00 C
590
+ ATOM 1166 O LEU A 72 20.430 31.090 28.270 1.00 0.00 O
591
+ ATOM 1167 N GLN A 73 21.310 33.060 28.760 1.00 0.00 N
592
+ ATOM 1169 CA GLN A 73 20.310 33.770 28.080 1.00 0.00 C
593
+ ATOM 1171 CB GLN A 73 20.450 35.330 28.290 1.00 0.00 C
594
+ ATOM 1174 CG GLN A 73 19.400 36.170 27.530 1.00 0.00 C
595
+ ATOM 1177 CD GLN A 73 18.000 35.910 28.150 1.00 0.00 C
596
+ ATOM 1178 OE1 GLN A 73 17.800 35.830 29.370 1.00 0.00 O
597
+ ATOM 1179 NE2 GLN A 73 17.000 35.810 27.220 1.00 0.00 N
598
+ ATOM 1182 C GLN A 73 20.220 33.330 26.600 1.00 0.00 C
599
+ ATOM 1183 O GLN A 73 19.120 33.230 26.090 1.00 0.00 O
600
+ ATOM 1184 N VAL A 74 21.360 33.070 25.910 1.00 0.00 N
601
+ ATOM 1186 CA VAL A 74 21.430 32.740 24.460 1.00 0.00 C
602
+ ATOM 1188 CB VAL A 74 22.930 32.590 23.990 1.00 0.00 C
603
+ ATOM 1190 CG1 VAL A 74 23.150 32.260 22.500 1.00 0.00 C
604
+ ATOM 1194 CG2 VAL A 74 23.730 33.870 24.140 1.00 0.00 C
605
+ ATOM 1198 C VAL A 74 20.750 31.440 24.210 1.00 0.00 C
606
+ ATOM 1199 O VAL A 74 19.960 31.420 23.270 1.00 0.00 O
607
+ ATOM 1200 N PHE A 75 20.960 30.390 25.050 1.00 0.00 N
608
+ ATOM 1202 CA PHE A 75 20.240 29.110 24.910 1.00 0.00 C
609
+ ATOM 1204 CB PHE A 75 20.790 28.048 25.920 1.00 0.00 C
610
+ ATOM 1207 CG PHE A 75 22.210 27.630 25.740 1.00 0.00 C
611
+ ATOM 1208 CD1 PHE A 75 22.640 26.700 24.730 1.00 0.00 C
612
+ ATOM 1210 CE1 PHE A 75 24.040 26.430 24.550 1.00 0.00 C
613
+ ATOM 1212 CZ PHE A 75 24.950 27.020 25.400 1.00 0.00 C
614
+ ATOM 1214 CD2 PHE A 75 23.180 28.140 26.610 1.00 0.00 C
615
+ ATOM 1216 CE2 PHE A 75 24.550 27.860 26.420 1.00 0.00 C
616
+ ATOM 1218 C PHE A 75 18.710 29.260 25.120 1.00 0.00 C
617
+ ATOM 1219 O PHE A 75 17.890 28.650 24.380 1.00 0.00 O
618
+ ATOM 1220 N ARG A 76 18.320 29.980 26.140 1.00 0.00 N
619
+ ATOM 1222 CA ARG A 76 16.940 30.320 26.310 1.00 0.00 C
620
+ ATOM 1224 CB ARG A 76 16.640 31.010 27.650 1.00 0.00 C
621
+ ATOM 1227 CG ARG A 76 17.060 30.190 28.920 1.00 0.00 C
622
+ ATOM 1230 CD ARG A 76 16.400 30.790 30.210 1.00 0.00 C
623
+ ATOM 1233 NE ARG A 76 14.960 30.680 30.140 1.00 0.00 N
624
+ ATOM 1235 CZ ARG A 76 14.030 31.570 30.550 1.00 0.00 C
625
+ ATOM 1236 NH1 ARG A 76 14.310 32.700 31.060 1.00 0.00 N
626
+ ATOM 1239 NH2 ARG A 76 12.830 31.290 30.210 1.00 0.00 N
627
+ ATOM 1242 C ARG A 76 16.320 31.100 25.150 1.00 0.00 C
628
+ ATOM 1243 O ARG A 76 15.260 30.680 24.650 1.00 0.00 O
629
+ ATOM 1244 N GLU A 77 16.970 32.150 24.710 1.00 0.00 N
630
+ ATOM 1246 CA GLU A 77 16.470 32.950 23.640 1.00 0.00 C
631
+ ATOM 1248 CB GLU A 77 17.440 34.100 23.400 1.00 0.00 C
632
+ ATOM 1251 CG GLU A 77 17.030 35.040 22.180 1.00 0.00 C
633
+ ATOM 1254 CD GLU A 77 18.060 36.140 21.880 1.00 0.00 C
634
+ ATOM 1255 OE1 GLU A 77 18.990 36.430 22.700 1.00 0.00 O
635
+ ATOM 1256 OE2 GLU A 77 17.960 36.740 20.810 1.00 0.00 O
636
+ ATOM 1257 C GLU A 77 16.280 32.140 22.370 1.00 0.00 C
637
+ ATOM 1258 O GLU A 77 15.180 32.120 21.780 1.00 0.00 O
638
+ ATOM 1259 N ALA A 78 17.300 31.350 22.100 1.00 0.00 N
639
+ ATOM 1261 CA ALA A 78 17.310 30.380 21.000 1.00 0.00 C
640
+ ATOM 1263 CB ALA A 78 18.730 29.728 20.720 1.00 0.00 C
641
+ ATOM 1267 C ALA A 78 16.250 29.190 21.180 1.00 0.00 C
642
+ ATOM 1268 O ALA A 78 15.500 28.850 20.280 1.00 0.00 O
643
+ ATOM 1269 N LYS A 79 16.130 28.590 22.360 1.00 0.00 N
644
+ ATOM 1271 CA LYS A 79 15.040 27.700 22.770 1.00 0.00 C
645
+ ATOM 1273 CB LYS A 79 15.140 27.140 24.320 1.00 0.00 C
646
+ ATOM 1276 CG LYS A 79 13.950 26.310 24.710 1.00 0.00 C
647
+ ATOM 1279 CD LYS A 79 14.130 25.820 26.110 1.00 0.00 C
648
+ ATOM 1282 CE LYS A 79 13.180 24.750 26.580 1.00 0.00 C
649
+ ATOM 1285 NZ LYS A 79 11.820 25.280 26.200 1.00 0.00 N
650
+ ATOM 1289 C LYS A 79 13.640 28.240 22.380 1.00 0.00 C
651
+ ATOM 1290 O LYS A 79 12.800 27.550 21.830 1.00 0.00 O
652
+ ATOM 1291 N ALA A 80 13.420 29.560 22.540 1.00 0.00 N
653
+ ATOM 1293 CA ALA A 80 12.170 30.220 22.390 1.00 0.00 C
654
+ ATOM 1295 CB ALA A 80 11.990 31.440 23.300 1.00 0.00 C
655
+ ATOM 1299 C ALA A 80 11.900 30.510 20.940 1.00 0.00 C
656
+ ATOM 1300 O ALA A 80 10.780 30.760 20.550 1.00 0.00 O
657
+ ATOM 1301 N GLU A 81 12.920 30.430 20.060 1.00 0.00 N
658
+ ATOM 1303 CA GLU A 81 12.650 30.820 18.700 1.00 0.00 C
659
+ ATOM 1305 CB GLU A 81 13.870 31.510 17.970 1.00 0.00 C
660
+ ATOM 1308 CG GLU A 81 14.170 32.960 18.360 1.00 0.00 C
661
+ ATOM 1311 CD GLU A 81 12.950 33.810 18.180 1.00 0.00 C
662
+ ATOM 1312 OE1 GLU A 81 12.280 33.640 17.100 1.00 0.00 O
663
+ ATOM 1313 OE2 GLU A 81 12.570 34.630 19.050 1.00 0.00 O
664
+ ATOM 1314 C GLU A 81 12.490 29.480 17.950 1.00 0.00 C
665
+ ATOM 1315 O GLU A 81 12.600 29.540 16.720 1.00 0.00 O
666
+ ATOM 1316 N GLY A 82 12.440 28.310 18.600 1.00 0.00 N
667
+ ATOM 1318 CA GLY A 82 12.200 27.028 17.910 1.00 0.00 C
668
+ ATOM 1321 C GLY A 82 13.310 26.070 17.800 1.00 0.00 C
669
+ ATOM 1322 O GLY A 82 13.230 24.970 17.250 1.00 0.00 O
670
+ ATOM 1323 N CYS A 83 14.390 26.400 18.380 1.00 0.00 N
671
+ ATOM 1325 CA CYS A 83 15.540 25.500 18.570 1.00 0.00 C
672
+ ATOM 1327 CB CYS A 83 16.810 26.290 19.000 1.00 0.00 C
673
+ ATOM 1330 SG CYS A 83 17.300 27.440 17.690 1.00 0.00 S
674
+ ATOM 1332 C CYS A 83 15.090 24.450 19.550 1.00 0.00 C
675
+ ATOM 1333 O CYS A 83 14.460 24.730 20.520 1.00 0.00 O
676
+ ATOM 1334 N ASP A 84 15.450 23.240 19.210 1.00 0.00 N
677
+ ATOM 1336 CA ASP A 84 15.110 22.070 20.090 1.00 0.00 C
678
+ ATOM 1338 CB ASP A 84 14.840 20.830 19.160 1.00 0.00 C
679
+ ATOM 1341 CG ASP A 84 14.100 19.720 19.900 1.00 0.00 C
680
+ ATOM 1342 OD1 ASP A 84 13.600 20.020 21.020 1.00 0.00 O
681
+ ATOM 1343 OD2 ASP A 84 13.890 18.670 19.320 1.00 0.00 O
682
+ ATOM 1344 C ASP A 84 16.160 21.798 21.120 1.00 0.00 C
683
+ ATOM 1345 O ASP A 84 17.090 21.060 20.790 1.00 0.00 O
684
+ ATOM 1346 N ILE A 85 16.020 22.370 22.320 1.00 0.00 N
685
+ ATOM 1348 CA ILE A 85 17.030 22.450 23.370 1.00 0.00 C
686
+ ATOM 1350 CB ILE A 85 17.680 23.900 23.410 1.00 0.00 C
687
+ ATOM 1352 CG2 ILE A 85 18.770 24.040 24.570 1.00 0.00 C
688
+ ATOM 1356 CG1 ILE A 85 18.270 24.340 22.080 1.00 0.00 C
689
+ ATOM 1359 CD1 ILE A 85 18.840 25.740 22.080 1.00 0.00 C
690
+ ATOM 1363 C ILE A 85 16.410 22.080 24.690 1.00 0.00 C
691
+ ATOM 1364 O ILE A 85 15.450 22.730 25.180 1.00 0.00 O
692
+ ATOM 1365 N THR A 86 16.960 21.020 25.350 1.00 0.00 N
693
+ ATOM 1367 CA THR A 86 16.670 20.760 26.740 1.00 0.00 C
694
+ ATOM 1369 CB THR A 86 16.560 19.260 27.090 1.00 0.00 C
695
+ ATOM 1371 OG1 THR A 86 15.790 18.630 26.050 1.00 0.00 O
696
+ ATOM 1373 CG2 THR A 86 15.840 19.000 28.360 1.00 0.00 C
697
+ ATOM 1377 C THR A 86 17.550 21.490 27.640 1.00 0.00 C
698
+ ATOM 1378 O THR A 86 18.780 21.320 27.600 1.00 0.00 O
699
+ ATOM 1379 N ILE A 87 16.980 22.440 28.500 1.00 0.00 N
700
+ ATOM 1381 CA ILE A 87 17.820 23.150 29.460 1.00 0.00 C
701
+ ATOM 1383 CB ILE A 87 17.450 24.660 29.420 1.00 0.00 C
702
+ ATOM 1385 CG2 ILE A 87 18.310 25.410 30.460 1.00 0.00 C
703
+ ATOM 1389 CG1 ILE A 87 17.780 25.110 27.970 1.00 0.00 C
704
+ ATOM 1392 CD1 ILE A 87 17.570 26.620 27.710 1.00 0.00 C
705
+ ATOM 1396 C ILE A 87 17.700 22.550 30.910 1.00 0.00 C
706
+ ATOM 1397 O ILE A 87 16.820 22.990 31.670 1.00 0.00 O
707
+ ATOM 1398 N ILE A 88 18.620 21.630 31.340 1.00 0.00 N
708
+ ATOM 1400 CA ILE A 88 18.570 21.110 32.710 1.00 0.00 C
709
+ ATOM 1402 CB ILE A 88 19.030 19.590 32.830 1.00 0.00 C
710
+ ATOM 1404 CG2 ILE A 88 18.920 19.150 34.290 1.00 0.00 C
711
+ ATOM 1408 CG1 ILE A 88 18.260 18.650 31.900 1.00 0.00 C
712
+ ATOM 1411 CD1 ILE A 88 18.980 17.340 31.590 1.00 0.00 C
713
+ ATOM 1415 C ILE A 88 19.460 21.940 33.560 1.00 0.00 C
714
+ ATOM 1416 O ILE A 88 20.640 22.180 33.210 1.00 0.00 O
715
+ ATOM 1417 N LEU A 89 18.870 22.640 34.610 1.00 0.00 N
716
+ ATOM 1419 CA LEU A 89 19.660 23.290 35.550 1.00 0.00 C
717
+ ATOM 1421 CB LEU A 89 19.050 24.758 35.800 1.00 0.00 C
718
+ ATOM 1424 CG LEU A 89 18.960 25.620 34.560 1.00 0.00 C
719
+ ATOM 1426 CD1 LEU A 89 18.480 27.020 34.960 1.00 0.00 C
720
+ ATOM 1430 CD2 LEU A 89 20.360 25.830 33.950 1.00 0.00 C
721
+ ATOM 1434 C LEU A 89 19.620 22.530 36.830 1.00 0.00 C
722
+ ATOM 1435 O LEU A 89 18.610 21.880 37.040 1.00 0.00 O
723
+ ATOM 1436 N SER A 90 20.700 22.430 37.580 1.00 0.00 N
724
+ ATOM 1438 CA SER A 90 20.700 21.710 38.850 1.00 0.00 C
725
+ ATOM 1440 CB SER A 90 20.980 20.180 38.680 1.00 0.00 C
726
+ ATOM 1443 OG SER A 90 22.300 19.910 38.090 1.00 0.00 O
727
+ ATOM 1445 C SER A 90 21.740 22.370 39.780 1.00 0.00 C
728
+ ATOM 1446 O SER A 90 21.720 22.000 41.010 1.00 0.00 O
729
+ ATOM 1447 OXT SER A 90 22.560 23.240 39.340 1.00 0.00 O
730
+ TER 1448 SER A 90
731
+ ENDMDL
732
+ END
atlas_h5_fp16/1b2s_E/meta.json ADDED
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1
+ {
2
+ "entry": "1b2s_E",
3
+ "source_dir": "/raid_zoe/home/lr/wangyi/p/atlas_1000_analysis/1b2s_E",
4
+ "source_pdb": "/raid_zoe/home/lr/wangyi/p/atlas_1000_analysis/1b2s_E/1b2s_E.pdb",
5
+ "source_xtc": [
6
+ "/raid_zoe/home/lr/wangyi/p/atlas_1000_analysis/1b2s_E/1b2s_E_R1.xtc",
7
+ "/raid_zoe/home/lr/wangyi/p/atlas_1000_analysis/1b2s_E/1b2s_E_R2.xtc",
8
+ "/raid_zoe/home/lr/wangyi/p/atlas_1000_analysis/1b2s_E/1b2s_E_R3.xtc"
9
+ ],
10
+ "heavy_chain_pdb": "/raid_zoe/home/lr/wangyi/p/atlas_h5_fp16/1b2s_E/heavy_chain.pdb",
11
+ "coords_h5": "/raid_zoe/home/lr/wangyi/p/atlas_h5_fp16/1b2s_E/coords.h5",
12
+ "n_frames": 3003,
13
+ "n_heavy_atoms": 726,
14
+ "n_replicates": 3,
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+ "rep_names": [
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+ "R1",
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+ "R2",
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+ "R3"
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+ ],
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+ "rep_lengths": [
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+ 1001,
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+ "frame_order": "R1_then_R2_then_R3",
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+ "unit": "angstrom",
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+ "dtype": "float16",
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+ "compression": "gzip",
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+ "gzip_level": 4,
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+ "stride": 1,
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+ "xtc_chunk": 100,
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+ "frame_chunk": 64,
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+ "max_frames_per_rep": null,
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+ "center": false,
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+ "h5_size_MB": 7.428421974182129,
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+ "pdb_size_MB": 0.05624866485595703
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+ }
atlas_h5_fp16/1bgf_A/heavy_chain.pdb ADDED
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1
+ REMARK 1 CREATED WITH MDTraj 1.10.3, 2026-05-22
2
+ CRYST1 67.280 59.131 62.169 90.00 90.00 90.00 P 1 1
3
+ MODEL 0
4
+ ATOM 1 N GLY A 1 16.860 21.560 39.620 1.00 0.00 N
5
+ ATOM 5 CA GLY A 1 17.210 23.040 39.480 1.00 0.00 C
6
+ ATOM 8 C GLY A 1 18.440 23.250 38.760 1.00 0.00 C
7
+ ATOM 9 O GLY A 1 19.310 22.390 38.810 1.00 0.00 O
8
+ ATOM 10 N GLY A 2 18.460 24.370 38.000 1.00 0.00 N
9
+ ATOM 12 CA GLY A 2 19.600 24.680 37.130 1.00 0.00 C
10
+ ATOM 15 C GLY A 2 20.850 25.150 37.850 1.00 0.00 C
11
+ ATOM 16 O GLY A 2 20.870 25.530 39.030 1.00 0.00 O
12
+ ATOM 17 N SER A 3 21.960 25.220 37.060 1.00 0.00 N
13
+ ATOM 19 CA SER A 3 23.220 25.910 37.240 1.00 0.00 C
14
+ ATOM 21 CB SER A 3 24.040 25.810 35.900 1.00 0.00 C
15
+ ATOM 24 OG SER A 3 23.280 26.420 34.830 1.00 0.00 O
16
+ ATOM 26 C SER A 3 22.940 27.420 37.650 1.00 0.00 C
17
+ ATOM 27 O SER A 3 21.870 27.980 37.630 1.00 0.00 O
18
+ ATOM 28 N GLN A 4 24.060 28.150 38.010 1.00 0.00 N
19
+ ATOM 30 CA GLN A 4 23.960 29.610 38.220 1.00 0.00 C
20
+ ATOM 32 CB GLN A 4 25.030 30.020 39.200 1.00 0.00 C
21
+ ATOM 35 CG GLN A 4 25.500 31.480 39.160 1.00 0.00 C
22
+ ATOM 38 CD GLN A 4 26.830 31.550 39.980 1.00 0.00 C
23
+ ATOM 39 OE1 GLN A 4 26.730 31.150 41.150 1.00 0.00 O
24
+ ATOM 40 NE2 GLN A 4 27.890 32.010 39.350 1.00 0.00 N
25
+ ATOM 43 C GLN A 4 23.960 30.350 36.910 1.00 0.00 C
26
+ ATOM 44 O GLN A 4 23.140 31.260 36.750 1.00 0.00 O
27
+ ATOM 45 N TRP A 5 24.600 29.770 35.830 1.00 0.00 N
28
+ ATOM 47 CA TRP A 5 24.360 30.110 34.450 1.00 0.00 C
29
+ ATOM 49 CB TRP A 5 25.340 29.330 33.510 1.00 0.00 C
30
+ ATOM 52 CG TRP A 5 25.330 29.760 32.090 1.00 0.00 C
31
+ ATOM 53 CD1 TRP A 5 24.700 29.100 31.130 1.00 0.00 C
32
+ ATOM 55 NE1 TRP A 5 24.790 29.750 29.880 1.00 0.00 N
33
+ ATOM 57 CE2 TRP A 5 25.460 30.890 30.150 1.00 0.00 C
34
+ ATOM 58 CD2 TRP A 5 25.830 30.920 31.540 1.00 0.00 C
35
+ ATOM 59 CE3 TRP A 5 26.430 32.000 32.080 1.00 0.00 C
36
+ ATOM 61 CZ3 TRP A 5 26.750 33.080 31.250 1.00 0.00 C
37
+ ATOM 63 CZ2 TRP A 5 25.810 31.900 29.380 1.00 0.00 C
38
+ ATOM 65 CH2 TRP A 5 26.520 32.990 29.900 1.00 0.00 C
39
+ ATOM 67 C TRP A 5 22.860 29.960 34.090 1.00 0.00 C
40
+ ATOM 68 O TRP A 5 22.310 30.730 33.300 1.00 0.00 O
41
+ ATOM 69 N ASN A 6 22.050 28.950 34.530 1.00 0.00 N
42
+ ATOM 71 CA ASN A 6 20.560 28.900 34.290 1.00 0.00 C
43
+ ATOM 73 CB ASN A 6 19.860 27.620 34.930 1.00 0.00 C
44
+ ATOM 76 CG ASN A 6 18.490 27.460 34.310 1.00 0.00 C
45
+ ATOM 77 OD1 ASN A 6 18.340 27.190 33.100 1.00 0.00 O
46
+ ATOM 78 ND2 ASN A 6 17.390 27.610 35.100 1.00 0.00 N
47
+ ATOM 81 C ASN A 6 19.880 30.070 34.860 1.00 0.00 C
48
+ ATOM 82 O ASN A 6 19.020 30.670 34.190 1.00 0.00 O
49
+ ATOM 83 N GLN A 7 20.180 30.550 36.100 1.00 0.00 N
50
+ ATOM 85 CA GLN A 7 19.510 31.750 36.660 1.00 0.00 C
51
+ ATOM 87 CB GLN A 7 20.090 31.950 38.090 1.00 0.00 C
52
+ ATOM 90 CG GLN A 7 19.770 30.840 39.050 1.00 0.00 C
53
+ ATOM 93 CD GLN A 7 20.340 31.050 40.470 1.00 0.00 C
54
+ ATOM 94 OE1 GLN A 7 21.340 30.410 40.840 1.00 0.00 O
55
+ ATOM 95 NE2 GLN A 7 19.700 31.940 41.190 1.00 0.00 N
56
+ ATOM 98 C GLN A 7 19.780 33.020 35.920 1.00 0.00 C
57
+ ATOM 99 O GLN A 7 18.930 33.850 35.610 1.00 0.00 O
58
+ ATOM 100 N VAL A 8 21.080 33.090 35.450 1.00 0.00 N
59
+ ATOM 102 CA VAL A 8 21.650 34.210 34.690 1.00 0.00 C
60
+ ATOM 104 CB VAL A 8 23.200 34.000 34.470 1.00 0.00 C
61
+ ATOM 106 CG1 VAL A 8 23.740 34.800 33.300 1.00 0.00 C
62
+ ATOM 110 CG2 VAL A 8 23.930 34.530 35.810 1.00 0.00 C
63
+ ATOM 114 C VAL A 8 20.900 34.350 33.400 1.00 0.00 C
64
+ ATOM 115 O VAL A 8 20.490 35.400 33.030 1.00 0.00 O
65
+ ATOM 116 N GLN A 9 20.640 33.200 32.740 1.00 0.00 N
66
+ ATOM 118 CA GLN A 9 19.760 33.120 31.560 1.00 0.00 C
67
+ ATOM 120 CB GLN A 9 19.920 31.650 30.970 1.00 0.00 C
68
+ ATOM 123 CG GLN A 9 21.110 31.570 30.040 1.00 0.00 C
69
+ ATOM 126 CD GLN A 9 21.510 30.150 29.630 1.00 0.00 C
70
+ ATOM 127 OE1 GLN A 9 22.020 30.070 28.520 1.00 0.00 O
71
+ ATOM 128 NE2 GLN A 9 21.370 29.020 30.400 1.00 0.00 N
72
+ ATOM 131 C GLN A 9 18.360 33.580 31.730 1.00 0.00 C
73
+ ATOM 132 O GLN A 9 17.660 33.680 30.730 1.00 0.00 O
74
+ ATOM 133 N GLN A 10 17.940 33.760 33.030 1.00 0.00 N
75
+ ATOM 135 CA GLN A 10 16.620 34.270 33.270 1.00 0.00 C
76
+ ATOM 137 CB GLN A 10 15.870 33.590 34.530 1.00 0.00 C
77
+ ATOM 140 CG GLN A 10 15.840 32.040 34.520 1.00 0.00 C
78
+ ATOM 143 CD GLN A 10 15.520 31.510 33.120 1.00 0.00 C
79
+ ATOM 144 OE1 GLN A 10 14.400 31.670 32.650 1.00 0.00 O
80
+ ATOM 145 NE2 GLN A 10 16.440 30.680 32.540 1.00 0.00 N
81
+ ATOM 148 C GLN A 10 16.530 35.810 33.520 1.00 0.00 C
82
+ ATOM 149 O GLN A 10 15.510 36.480 33.500 1.00 0.00 O
83
+ ATOM 150 N LEU A 11 17.730 36.400 33.750 1.00 0.00 N
84
+ ATOM 152 CA LEU A 11 17.820 37.810 33.940 1.00 0.00 C
85
+ ATOM 154 CB LEU A 11 19.210 38.310 34.250 1.00 0.00 C
86
+ ATOM 157 CG LEU A 11 19.660 37.700 35.570 1.00 0.00 C
87
+ ATOM 159 CD1 LEU A 11 21.180 38.050 35.750 1.00 0.00 C
88
+ ATOM 163 CD2 LEU A 11 18.960 38.110 36.840 1.00 0.00 C
89
+ ATOM 167 C LEU A 11 17.270 38.680 32.730 1.00 0.00 C
90
+ ATOM 168 O LEU A 11 17.380 38.310 31.510 1.00 0.00 O
91
+ ATOM 169 N GLU A 12 16.800 39.980 32.890 1.00 0.00 N
92
+ ATOM 171 CA GLU A 12 16.630 40.950 31.780 1.00 0.00 C
93
+ ATOM 173 CB GLU A 12 15.810 42.150 32.320 1.00 0.00 C
94
+ ATOM 176 CG GLU A 12 14.440 41.860 33.040 1.00 0.00 C
95
+ ATOM 179 CD GLU A 12 13.430 42.950 33.160 1.00 0.00 C
96
+ ATOM 180 OE1 GLU A 12 12.290 42.770 32.700 1.00 0.00 O
97
+ ATOM 181 OE2 GLU A 12 13.710 44.020 33.760 1.00 0.00 O
98
+ ATOM 182 C GLU A 12 17.900 41.370 31.120 1.00 0.00 C
99
+ ATOM 183 O GLU A 12 18.960 41.360 31.780 1.00 0.00 O
100
+ ATOM 184 N ILE A 13 17.920 41.590 29.820 1.00 0.00 N
101
+ ATOM 186 CA ILE A 13 19.070 41.370 29.020 1.00 0.00 C
102
+ ATOM 188 CB ILE A 13 18.670 41.120 27.530 1.00 0.00 C
103
+ ATOM 190 CG2 ILE A 13 18.170 42.280 26.690 1.00 0.00 C
104
+ ATOM 194 CG1 ILE A 13 19.740 40.410 26.690 1.00 0.00 C
105
+ ATOM 197 CD1 ILE A 13 20.290 39.040 27.170 1.00 0.00 C
106
+ ATOM 201 C ILE A 13 20.210 42.450 29.200 1.00 0.00 C
107
+ ATOM 202 O ILE A 13 21.340 42.200 28.870 1.00 0.00 O
108
+ ATOM 203 N LYS A 14 19.900 43.620 29.730 1.00 0.00 N
109
+ ATOM 205 CA LYS A 14 20.760 44.710 30.080 1.00 0.00 C
110
+ ATOM 207 CB LYS A 14 19.860 45.910 30.590 1.00 0.00 C
111
+ ATOM 210 CG LYS A 14 19.130 45.520 31.910 1.00 0.00 C
112
+ ATOM 213 CD LYS A 14 17.990 46.580 32.170 1.00 0.00 C
113
+ ATOM 216 CE LYS A 14 17.090 46.180 33.470 1.00 0.00 C
114
+ ATOM 219 NZ LYS A 14 17.970 46.300 34.690 1.00 0.00 N
115
+ ATOM 223 C LYS A 14 21.830 44.450 31.170 1.00 0.00 C
116
+ ATOM 224 O LYS A 14 22.720 45.240 31.410 1.00 0.00 O
117
+ ATOM 225 N PHE A 15 21.760 43.310 31.940 1.00 0.00 N
118
+ ATOM 227 CA PHE A 15 22.870 42.780 32.680 1.00 0.00 C
119
+ ATOM 229 CB PHE A 15 22.420 41.460 33.490 1.00 0.00 C
120
+ ATOM 232 CG PHE A 15 22.760 40.030 32.920 1.00 0.00 C
121
+ ATOM 233 CD1 PHE A 15 22.120 39.600 31.790 1.00 0.00 C
122
+ ATOM 235 CE1 PHE A 15 22.540 38.530 31.100 1.00 0.00 C
123
+ ATOM 237 CZ PHE A 15 23.600 37.800 31.550 1.00 0.00 C
124
+ ATOM 239 CD2 PHE A 15 23.920 39.330 33.410 1.00 0.00 C
125
+ ATOM 241 CE2 PHE A 15 24.340 38.250 32.690 1.00 0.00 C
126
+ ATOM 243 C PHE A 15 24.090 42.560 31.720 1.00 0.00 C
127
+ ATOM 244 O PHE A 15 25.220 42.740 32.040 1.00 0.00 O
128
+ ATOM 245 N LEU A 16 23.820 42.090 30.490 1.00 0.00 N
129
+ ATOM 247 CA LEU A 16 24.760 41.400 29.590 1.00 0.00 C
130
+ ATOM 249 CB LEU A 16 23.960 40.620 28.480 1.00 0.00 C
131
+ ATOM 252 CG LEU A 16 24.710 39.830 27.410 1.00 0.00 C
132
+ ATOM 254 CD1 LEU A 16 25.630 38.760 28.060 1.00 0.00 C
133
+ ATOM 258 CD2 LEU A 16 23.710 39.060 26.420 1.00 0.00 C
134
+ ATOM 262 C LEU A 16 25.890 42.190 29.110 1.00 0.00 C
135
+ ATOM 263 O LEU A 16 26.930 41.640 28.800 1.00 0.00 O
136
+ ATOM 264 N GLU A 17 25.650 43.540 29.000 1.00 0.00 N
137
+ ATOM 266 CA GLU A 17 26.710 44.460 28.780 1.00 0.00 C
138
+ ATOM 268 CB GLU A 17 26.110 45.760 28.280 1.00 0.00 C
139
+ ATOM 271 CG GLU A 17 25.240 46.470 29.380 1.00 0.00 C
140
+ ATOM 274 CD GLU A 17 24.650 47.790 29.060 1.00 0.00 C
141
+ ATOM 275 OE1 GLU A 17 24.220 48.040 27.920 1.00 0.00 O
142
+ ATOM 276 OE2 GLU A 17 24.740 48.740 29.880 1.00 0.00 O
143
+ ATOM 277 C GLU A 17 27.740 44.650 29.830 1.00 0.00 C
144
+ ATOM 278 O GLU A 17 28.940 44.910 29.510 1.00 0.00 O
145
+ ATOM 279 N GLN A 18 27.390 44.490 31.120 1.00 0.00 N
146
+ ATOM 281 CA GLN A 18 28.160 44.620 32.260 1.00 0.00 C
147
+ ATOM 283 CB GLN A 18 27.280 44.700 33.570 1.00 0.00 C
148
+ ATOM 286 CG GLN A 18 26.140 45.780 33.640 1.00 0.00 C
149
+ ATOM 289 CD GLN A 18 25.240 45.540 34.880 1.00 0.00 C
150
+ ATOM 290 OE1 GLN A 18 25.480 44.680 35.720 1.00 0.00 O
151
+ ATOM 291 NE2 GLN A 18 24.090 46.210 34.900 1.00 0.00 N
152
+ ATOM 294 C GLN A 18 29.280 43.500 32.440 1.00 0.00 C
153
+ ATOM 295 O GLN A 18 30.290 43.640 33.170 1.00 0.00 O
154
+ ATOM 296 N VAL A 19 28.950 42.290 31.970 1.00 0.00 N
155
+ ATOM 298 CA VAL A 19 29.860 41.160 32.140 1.00 0.00 C
156
+ ATOM 300 CB VAL A 19 29.060 39.760 32.050 1.00 0.00 C
157
+ ATOM 302 CG1 VAL A 19 27.890 39.620 33.020 1.00 0.00 C
158
+ ATOM 306 CG2 VAL A 19 28.360 39.520 30.720 1.00 0.00 C
159
+ ATOM 310 C VAL A 19 30.950 41.060 31.120 1.00 0.00 C
160
+ ATOM 311 O VAL A 19 31.930 40.300 31.220 1.00 0.00 O
161
+ ATOM 312 N ASP A 20 30.830 41.880 30.000 1.00 0.00 N
162
+ ATOM 314 CA ASP A 20 31.580 41.760 28.780 1.00 0.00 C
163
+ ATOM 316 CB ASP A 20 31.150 42.870 27.790 1.00 0.00 C
164
+ ATOM 319 CG ASP A 20 31.750 42.900 26.400 1.00 0.00 C
165
+ ATOM 320 OD1 ASP A 20 32.300 41.870 25.980 1.00 0.00 O
166
+ ATOM 321 OD2 ASP A 20 31.620 43.980 25.710 1.00 0.00 O
167
+ ATOM 322 C ASP A 20 33.140 41.860 29.030 1.00 0.00 C
168
+ ATOM 323 O ASP A 20 33.950 41.180 28.450 1.00 0.00 O
169
+ ATOM 324 N GLN A 21 33.560 42.690 29.910 1.00 0.00 N
170
+ ATOM 326 CA GLN A 21 35.000 42.970 30.060 1.00 0.00 C
171
+ ATOM 328 CB GLN A 21 35.100 44.550 30.260 1.00 0.00 C
172
+ ATOM 331 CG GLN A 21 34.650 45.300 31.550 1.00 0.00 C
173
+ ATOM 334 CD GLN A 21 33.450 44.750 32.250 1.00 0.00 C
174
+ ATOM 335 OE1 GLN A 21 33.520 44.100 33.310 1.00 0.00 O
175
+ ATOM 336 NE2 GLN A 21 32.210 44.850 31.640 1.00 0.00 N
176
+ ATOM 339 C GLN A 21 35.590 42.060 31.170 1.00 0.00 C
177
+ ATOM 340 O GLN A 21 36.780 42.070 31.430 1.00 0.00 O
178
+ ATOM 341 N PHE A 22 34.740 41.180 31.740 1.00 0.00 N
179
+ ATOM 343 CA PHE A 22 35.300 39.950 32.400 1.00 0.00 C
180
+ ATOM 345 CB PHE A 22 34.310 39.240 33.330 1.00 0.00 C
181
+ ATOM 348 CG PHE A 22 33.920 40.100 34.540 1.00 0.00 C
182
+ ATOM 349 CD1 PHE A 22 32.880 40.960 34.490 1.00 0.00 C
183
+ ATOM 351 CE1 PHE A 22 32.720 41.840 35.560 1.00 0.00 C
184
+ ATOM 353 CZ PHE A 22 33.550 41.720 36.740 1.00 0.00 C
185
+ ATOM 355 CD2 PHE A 22 34.750 39.970 35.680 1.00 0.00 C
186
+ ATOM 357 CE2 PHE A 22 34.630 40.800 36.740 1.00 0.00 C
187
+ ATOM 359 C PHE A 22 35.970 38.900 31.480 1.00 0.00 C
188
+ ATOM 360 O PHE A 22 37.050 38.350 31.680 1.00 0.00 O
189
+ ATOM 361 N TYR A 23 35.250 38.800 30.290 1.00 0.00 N
190
+ ATOM 363 CA TYR A 23 35.510 37.740 29.320 1.00 0.00 C
191
+ ATOM 365 CB TYR A 23 34.240 37.320 28.420 1.00 0.00 C
192
+ ATOM 368 CG TYR A 23 33.160 36.620 29.260 1.00 0.00 C
193
+ ATOM 369 CD1 TYR A 23 33.270 35.270 29.650 1.00 0.00 C
194
+ ATOM 371 CE1 TYR A 23 32.290 34.650 30.340 1.00 0.00 C
195
+ ATOM 373 CZ TYR A 23 31.060 35.310 30.630 1.00 0.00 C
196
+ ATOM 374 OH TYR A 23 30.060 34.610 31.270 1.00 0.00 O
197
+ ATOM 376 CD2 TYR A 23 31.910 37.300 29.560 1.00 0.00 C
198
+ ATOM 378 CE2 TYR A 23 30.930 36.670 30.320 1.00 0.00 C
199
+ ATOM 380 C TYR A 23 36.670 38.090 28.360 1.00 0.00 C
200
+ ATOM 381 O TYR A 23 36.700 39.220 27.810 1.00 0.00 O
201
+ ATOM 382 N ASP A 24 37.620 37.220 28.060 1.00 0.00 N
202
+ ATOM 384 CA ASP A 24 38.700 37.590 27.250 1.00 0.00 C
203
+ ATOM 386 CB ASP A 24 39.720 38.610 27.890 1.00 0.00 C
204
+ ATOM 389 CG ASP A 24 40.580 38.120 29.100 1.00 0.00 C
205
+ ATOM 390 OD1 ASP A 24 40.690 36.840 29.190 1.00 0.00 O
206
+ ATOM 391 OD2 ASP A 24 41.280 38.990 29.740 1.00 0.00 O
207
+ ATOM 392 C ASP A 24 39.320 36.320 26.600 1.00 0.00 C
208
+ ATOM 393 O ASP A 24 38.560 35.410 26.330 1.00 0.00 O
209
+ ATOM 394 N ASP A 25 40.640 36.180 26.370 1.00 0.00 N
210
+ ATOM 396 CA ASP A 25 41.230 35.030 25.790 1.00 0.00 C
211
+ ATOM 398 CB ASP A 25 42.480 35.610 25.040 1.00 0.00 C
212
+ ATOM 401 CG ASP A 25 42.020 36.300 23.770 1.00 0.00 C
213
+ ATOM 402 OD1 ASP A 25 40.940 35.970 23.250 1.00 0.00 O
214
+ ATOM 403 OD2 ASP A 25 42.870 37.000 23.210 1.00 0.00 O
215
+ ATOM 404 C ASP A 25 41.790 34.070 26.830 1.00 0.00 C
216
+ ATOM 405 O ASP A 25 42.260 32.980 26.520 1.00 0.00 O
217
+ ATOM 406 N ASN A 26 41.630 34.460 28.110 1.00 0.00 N
218
+ ATOM 408 CA ASN A 26 41.790 33.590 29.270 1.00 0.00 C
219
+ ATOM 410 CB ASN A 26 42.290 34.280 30.550 1.00 0.00 C
220
+ ATOM 413 CG ASN A 26 43.660 34.750 30.370 1.00 0.00 C
221
+ ATOM 414 OD1 ASN A 26 44.710 34.170 30.650 1.00 0.00 O
222
+ ATOM 415 ND2 ASN A 26 43.780 36.020 29.950 1.00 0.00 N
223
+ ATOM 418 C ASN A 26 40.540 32.760 29.470 1.00 0.00 C
224
+ ATOM 419 O ASN A 26 40.610 31.630 29.990 1.00 0.00 O
225
+ ATOM 420 N PHE A 27 39.320 33.270 29.050 1.00 0.00 N
226
+ ATOM 422 CA PHE A 27 38.050 32.540 29.260 1.00 0.00 C
227
+ ATOM 424 CB PHE A 27 37.630 32.740 30.810 1.00 0.00 C
228
+ ATOM 427 CG PHE A 27 36.500 31.800 31.130 1.00 0.00 C
229
+ ATOM 428 CD1 PHE A 27 36.750 30.480 31.200 1.00 0.00 C
230
+ ATOM 430 CE1 PHE A 27 35.800 29.490 31.610 1.00 0.00 C
231
+ ATOM 432 CZ PHE A 27 34.560 29.980 31.950 1.00 0.00 C
232
+ ATOM 434 CD2 PHE A 27 35.310 32.320 31.680 1.00 0.00 C
233
+ ATOM 436 CE2 PHE A 27 34.350 31.370 32.070 1.00 0.00 C
234
+ ATOM 438 C PHE A 27 37.010 33.160 28.360 1.00 0.00 C
235
+ ATOM 439 O PHE A 27 36.680 34.390 28.530 1.00 0.00 O
236
+ ATOM 440 N PRO A 28 36.540 32.600 27.290 1.00 0.00 N
237
+ ATOM 441 CD PRO A 28 37.180 31.430 26.670 1.00 0.00 C
238
+ ATOM 444 CA PRO A 28 35.500 33.090 26.470 1.00 0.00 C
239
+ ATOM 446 CB PRO A 28 35.920 32.590 25.110 1.00 0.00 C
240
+ ATOM 449 CG PRO A 28 36.450 31.150 25.420 1.00 0.00 C
241
+ ATOM 452 C PRO A 28 34.150 32.520 26.920 1.00 0.00 C
242
+ ATOM 453 O PRO A 28 34.040 31.540 27.610 1.00 0.00 O
243
+ ATOM 454 N MET A 29 33.080 33.160 26.490 1.00 0.00 N
244
+ ATOM 456 CA MET A 29 31.710 32.840 26.920 1.00 0.00 C
245
+ ATOM 458 CB MET A 29 30.740 34.080 26.650 1.00 0.00 C
246
+ ATOM 461 CG MET A 29 29.230 33.810 26.700 1.00 0.00 C
247
+ ATOM 464 SD MET A 29 28.270 35.170 26.140 1.00 0.00 S
248
+ ATOM 465 CE MET A 29 28.600 36.300 27.570 1.00 0.00 C
249
+ ATOM 469 C MET A 29 31.140 31.510 26.510 1.00 0.00 C
250
+ ATOM 470 O MET A 29 30.410 30.930 27.270 1.00 0.00 O
251
+ ATOM 471 N GLU A 30 31.500 30.990 25.330 1.00 0.00 N
252
+ ATOM 473 CA GLU A 30 31.240 29.570 24.820 1.00 0.00 C
253
+ ATOM 475 CB GLU A 30 32.140 29.260 23.550 1.00 0.00 C
254
+ ATOM 478 CG GLU A 30 31.720 29.970 22.220 1.00 0.00 C
255
+ ATOM 481 CD GLU A 30 32.430 31.270 21.950 1.00 0.00 C
256
+ ATOM 482 OE1 GLU A 30 32.350 32.160 22.840 1.00 0.00 O
257
+ ATOM 483 OE2 GLU A 30 33.010 31.430 20.830 1.00 0.00 O
258
+ ATOM 484 C GLU A 30 31.600 28.490 25.800 1.00 0.00 C
259
+ ATOM 485 O GLU A 30 30.750 27.650 26.180 1.00 0.00 O
260
+ ATOM 486 N ILE A 31 32.790 28.630 26.430 1.00 0.00 N
261
+ ATOM 488 CA ILE A 31 33.300 27.700 27.520 1.00 0.00 C
262
+ ATOM 490 CB ILE A 31 34.780 28.020 27.910 1.00 0.00 C
263
+ ATOM 492 CG2 ILE A 31 35.370 27.080 28.980 1.00 0.00 C
264
+ ATOM 496 CG1 ILE A 31 35.620 27.780 26.550 1.00 0.00 C
265
+ ATOM 499 CD1 ILE A 31 35.470 26.350 25.950 1.00 0.00 C
266
+ ATOM 503 C ILE A 31 32.500 27.910 28.810 1.00 0.00 C
267
+ ATOM 504 O ILE A 31 32.300 26.950 29.580 1.00 0.00 O
268
+ ATOM 505 N ARG A 32 32.010 29.100 29.160 1.00 0.00 N
269
+ ATOM 507 CA ARG A 32 31.130 29.310 30.280 1.00 0.00 C
270
+ ATOM 509 CB ARG A 32 31.040 30.800 30.640 1.00 0.00 C
271
+ ATOM 512 CG ARG A 32 30.190 31.170 31.770 1.00 0.00 C
272
+ ATOM 515 CD ARG A 32 30.740 30.660 33.120 1.00 0.00 C
273
+ ATOM 518 NE ARG A 32 29.650 30.920 34.100 1.00 0.00 N
274
+ ATOM 520 CZ ARG A 32 29.050 29.870 34.720 1.00 0.00 C
275
+ ATOM 521 NH1 ARG A 32 29.070 28.620 34.270 1.00 0.00 N
276
+ ATOM 524 NH2 ARG A 32 28.370 30.130 35.800 1.00 0.00 N
277
+ ATOM 527 C ARG A 32 29.780 28.770 30.110 1.00 0.00 C
278
+ ATOM 528 O ARG A 32 29.200 28.260 31.080 1.00 0.00 O
279
+ ATOM 529 N HIS A 33 29.170 28.790 28.900 1.00 0.00 N
280
+ ATOM 531 CA HIS A 33 27.930 28.210 28.520 1.00 0.00 C
281
+ ATOM 533 CB HIS A 33 27.530 28.670 27.130 1.00 0.00 C
282
+ ATOM 536 ND1 HIS A 33 25.830 27.100 26.110 1.00 0.00 N
283
+ ATOM 537 CG HIS A 33 26.160 28.370 26.580 1.00 0.00 C
284
+ ATOM 538 CE1 HIS A 33 24.620 27.180 25.570 1.00 0.00 C
285
+ ATOM 540 NE2 HIS A 33 24.150 28.450 25.640 1.00 0.00 N
286
+ ATOM 542 CD2 HIS A 33 25.030 29.220 26.300 1.00 0.00 C
287
+ ATOM 544 C HIS A 33 27.900 26.680 28.470 1.00 0.00 C
288
+ ATOM 545 O HIS A 33 27.200 25.950 29.200 1.00 0.00 O
289
+ ATOM 546 N LEU A 34 28.740 26.160 27.470 1.00 0.00 N
290
+ ATOM 548 CA LEU A 34 28.660 24.760 27.010 1.00 0.00 C
291
+ ATOM 550 CB LEU A 34 29.440 24.530 25.790 1.00 0.00 C
292
+ ATOM 553 CG LEU A 34 28.860 25.320 24.600 1.00 0.00 C
293
+ ATOM 555 CD1 LEU A 34 29.980 25.460 23.590 1.00 0.00 C
294
+ ATOM 559 CD2 LEU A 34 27.610 24.540 24.020 1.00 0.00 C
295
+ ATOM 563 C LEU A 34 28.980 23.720 28.030 1.00 0.00 C
296
+ ATOM 564 O LEU A 34 28.640 22.520 27.930 1.00 0.00 O
297
+ ATOM 565 N LEU A 35 29.750 24.200 29.020 1.00 0.00 N
298
+ ATOM 567 CA LEU A 35 30.230 23.420 30.100 1.00 0.00 C
299
+ ATOM 569 CB LEU A 35 31.730 23.150 29.880 1.00 0.00 C
300
+ ATOM 572 CG LEU A 35 32.020 21.900 28.980 1.00 0.00 C
301
+ ATOM 574 CD1 LEU A 35 33.430 22.040 28.440 1.00 0.00 C
302
+ ATOM 578 CD2 LEU A 35 31.860 20.630 29.790 1.00 0.00 C
303
+ ATOM 582 C LEU A 35 30.000 24.220 31.340 1.00 0.00 C
304
+ ATOM 583 O LEU A 35 30.790 24.220 32.330 1.00 0.00 O
305
+ ATOM 584 N ALA A 36 28.790 24.790 31.440 1.00 0.00 N
306
+ ATOM 586 CA ALA A 36 28.470 25.540 32.630 1.00 0.00 C
307
+ ATOM 588 CB ALA A 36 27.080 26.290 32.620 1.00 0.00 C
308
+ ATOM 592 C ALA A 36 28.440 24.830 34.000 1.00 0.00 C
309
+ ATOM 593 O ALA A 36 29.150 25.240 34.970 1.00 0.00 O
310
+ ATOM 594 N GLN A 37 27.840 23.680 34.220 1.00 0.00 N
311
+ ATOM 596 CA GLN A 37 27.890 22.890 35.390 1.00 0.00 C
312
+ ATOM 598 CB GLN A 37 27.110 21.550 35.020 1.00 0.00 C
313
+ ATOM 601 CG GLN A 37 25.620 21.760 34.570 1.00 0.00 C
314
+ ATOM 604 CD GLN A 37 24.870 20.400 34.680 1.00 0.00 C
315
+ ATOM 605 OE1 GLN A 37 24.350 19.760 33.760 1.00 0.00 O
316
+ ATOM 606 NE2 GLN A 37 24.650 20.020 35.960 1.00 0.00 N
317
+ ATOM 609 C GLN A 37 29.320 22.530 35.940 1.00 0.00 C
318
+ ATOM 610 O GLN A 37 29.530 22.600 37.110 1.00 0.00 O
319
+ ATOM 611 N TRP A 38 30.260 22.140 35.080 1.00 0.00 N
320
+ ATOM 613 CA TRP A 38 31.660 21.880 35.500 1.00 0.00 C
321
+ ATOM 615 CB TRP A 38 32.350 21.150 34.250 1.00 0.00 C
322
+ ATOM 618 CG TRP A 38 33.720 20.580 34.490 1.00 0.00 C
323
+ ATOM 619 CD1 TRP A 38 34.100 19.330 34.860 1.00 0.00 C
324
+ ATOM 621 NE1 TRP A 38 35.460 19.310 35.030 1.00 0.00 N
325
+ ATOM 623 CE2 TRP A 38 36.000 20.520 34.740 1.00 0.00 C
326
+ ATOM 624 CD2 TRP A 38 34.910 21.410 34.420 1.00 0.00 C
327
+ ATOM 625 CE3 TRP A 38 35.100 22.740 34.050 1.00 0.00 C
328
+ ATOM 627 CZ3 TRP A 38 36.430 23.160 34.030 1.00 0.00 C
329
+ ATOM 629 CZ2 TRP A 38 37.280 20.990 34.750 1.00 0.00 C
330
+ ATOM 631 CH2 TRP A 38 37.460 22.300 34.430 1.00 0.00 C
331
+ ATOM 633 C TRP A 38 32.510 23.110 35.910 1.00 0.00 C
332
+ ATOM 634 O TRP A 38 33.260 23.180 36.900 1.00 0.00 O
333
+ ATOM 635 N ILE A 39 32.240 24.250 35.220 1.00 0.00 N
334
+ ATOM 637 CA ILE A 39 32.880 25.490 35.730 1.00 0.00 C
335
+ ATOM 639 CB ILE A 39 32.560 26.700 34.840 1.00 0.00 C
336
+ ATOM 641 CG2 ILE A 39 32.780 28.040 35.500 1.00 0.00 C
337
+ ATOM 645 CG1 ILE A 39 33.180 26.570 33.430 1.00 0.00 C
338
+ ATOM 648 CD1 ILE A 39 34.680 26.630 33.410 1.00 0.00 C
339
+ ATOM 652 C ILE A 39 32.400 25.850 37.130 1.00 0.00 C
340
+ ATOM 653 O ILE A 39 33.120 26.250 38.090 1.00 0.00 O
341
+ ATOM 654 N GLU A 40 31.090 25.640 37.410 1.00 0.00 N
342
+ ATOM 656 CA GLU A 40 30.510 25.960 38.710 1.00 0.00 C
343
+ ATOM 658 CB GLU A 40 28.950 26.050 38.550 1.00 0.00 C
344
+ ATOM 661 CG GLU A 40 28.620 27.200 37.680 1.00 0.00 C
345
+ ATOM 664 CD GLU A 40 27.100 27.330 37.480 1.00 0.00 C
346
+ ATOM 665 OE1 GLU A 40 26.370 26.710 38.220 1.00 0.00 O
347
+ ATOM 666 OE2 GLU A 40 26.680 28.100 36.630 1.00 0.00 O
348
+ ATOM 667 C GLU A 40 30.910 24.940 39.750 1.00 0.00 C
349
+ ATOM 668 O GLU A 40 30.780 25.130 40.900 1.00 0.00 O
350
+ ATOM 669 N THR A 41 31.350 23.690 39.340 1.00 0.00 N
351
+ ATOM 671 CA THR A 41 31.900 22.620 40.090 1.00 0.00 C
352
+ ATOM 673 CB THR A 41 31.750 21.230 39.390 1.00 0.00 C
353
+ ATOM 675 OG1 THR A 41 30.430 20.880 39.010 1.00 0.00 O
354
+ ATOM 677 CG2 THR A 41 32.170 20.060 40.290 1.00 0.00 C
355
+ ATOM 681 C THR A 41 33.240 22.850 40.670 1.00 0.00 C
356
+ ATOM 682 O THR A 41 33.450 22.840 41.890 1.00 0.00 O
357
+ ATOM 683 N GLN A 42 34.210 23.400 39.870 1.00 0.00 N
358
+ ATOM 685 CA GLN A 42 35.550 23.430 40.240 1.00 0.00 C
359
+ ATOM 687 CB GLN A 42 36.610 23.610 39.130 1.00 0.00 C
360
+ ATOM 690 CG GLN A 42 36.500 22.620 37.920 1.00 0.00 C
361
+ ATOM 693 CD GLN A 42 36.260 21.100 38.340 1.00 0.00 C
362
+ ATOM 694 OE1 GLN A 42 37.140 20.440 38.870 1.00 0.00 O
363
+ ATOM 695 NE2 GLN A 42 35.100 20.560 37.860 1.00 0.00 N
364
+ ATOM 698 C GLN A 42 35.840 24.560 41.290 1.00 0.00 C
365
+ ATOM 699 O GLN A 42 35.090 25.480 41.470 1.00 0.00 O
366
+ ATOM 700 N ASP A 43 36.930 24.390 42.150 1.00 0.00 N
367
+ ATOM 702 CA ASP A 43 37.510 25.370 43.020 1.00 0.00 C
368
+ ATOM 704 CB ASP A 43 38.050 24.560 44.220 1.00 0.00 C
369
+ ATOM 707 CG ASP A 43 38.140 25.450 45.480 1.00 0.00 C
370
+ ATOM 708 OD1 ASP A 43 37.730 26.610 45.490 1.00 0.00 O
371
+ ATOM 709 OD2 ASP A 43 38.700 24.910 46.510 1.00 0.00 O
372
+ ATOM 710 C ASP A 43 38.590 26.270 42.340 1.00 0.00 C
373
+ ATOM 711 O ASP A 43 39.810 26.060 42.360 1.00 0.00 O
374
+ ATOM 712 N TRP A 44 38.140 27.340 41.590 1.00 0.00 N
375
+ ATOM 714 CA TRP A 44 38.870 28.380 40.900 1.00 0.00 C
376
+ ATOM 716 CB TRP A 44 37.960 29.170 39.920 1.00 0.00 C
377
+ ATOM 719 CG TRP A 44 37.410 28.310 38.910 1.00 0.00 C
378
+ ATOM 720 CD1 TRP A 44 36.060 27.930 38.880 1.00 0.00 C
379
+ ATOM 722 NE1 TRP A 44 35.930 26.890 38.000 1.00 0.00 N
380
+ ATOM 724 CE2 TRP A 44 37.090 26.680 37.350 1.00 0.00 C
381
+ ATOM 725 CD2 TRP A 44 38.100 27.480 37.920 1.00 0.00 C
382
+ ATOM 726 CE3 TRP A 44 39.350 27.420 37.470 1.00 0.00 C
383
+ ATOM 728 CZ3 TRP A 44 39.650 26.620 36.410 1.00 0.00 C
384
+ ATOM 730 CZ2 TRP A 44 37.390 25.770 36.320 1.00 0.00 C
385
+ ATOM 732 CH2 TRP A 44 38.680 25.840 35.900 1.00 0.00 C
386
+ ATOM 734 C TRP A 44 39.530 29.310 41.870 1.00 0.00 C
387
+ ATOM 735 O TRP A 44 40.720 29.550 41.650 1.00 0.00 O
388
+ ATOM 736 N GLU A 45 38.840 29.580 42.990 1.00 0.00 N
389
+ ATOM 738 CA GLU A 45 39.270 30.540 44.020 1.00 0.00 C
390
+ ATOM 740 CB GLU A 45 38.180 30.960 44.960 1.00 0.00 C
391
+ ATOM 743 CG GLU A 45 37.020 31.890 44.450 1.00 0.00 C
392
+ ATOM 746 CD GLU A 45 35.870 31.130 43.960 1.00 0.00 C
393
+ ATOM 747 OE1 GLU A 45 35.160 30.520 44.820 1.00 0.00 O
394
+ ATOM 748 OE2 GLU A 45 35.590 31.160 42.720 1.00 0.00 O
395
+ ATOM 749 C GLU A 45 40.540 30.130 44.800 1.00 0.00 C
396
+ ATOM 750 O GLU A 45 41.440 30.970 44.970 1.00 0.00 O
397
+ ATOM 751 N VAL A 46 40.560 28.890 45.270 1.00 0.00 N
398
+ ATOM 753 CA VAL A 46 41.880 28.370 45.790 1.00 0.00 C
399
+ ATOM 755 CB VAL A 46 41.760 27.280 46.870 1.00 0.00 C
400
+ ATOM 757 CG1 VAL A 46 43.110 26.880 47.560 1.00 0.00 C
401
+ ATOM 761 CG2 VAL A 46 40.750 27.710 47.930 1.00 0.00 C
402
+ ATOM 765 C VAL A 46 42.840 28.030 44.660 1.00 0.00 C
403
+ ATOM 766 O VAL A 46 44.040 28.060 44.890 1.00 0.00 O
404
+ ATOM 767 N ALA A 47 42.460 27.710 43.430 1.00 0.00 N
405
+ ATOM 769 CA ALA A 47 43.350 27.430 42.360 1.00 0.00 C
406
+ ATOM 771 CB ALA A 47 42.660 26.850 41.080 1.00 0.00 C
407
+ ATOM 775 C ALA A 47 44.150 28.600 41.900 1.00 0.00 C
408
+ ATOM 776 O ALA A 47 45.360 28.580 41.640 1.00 0.00 O
409
+ ATOM 777 N SER A 48 43.550 29.830 42.020 1.00 0.00 N
410
+ ATOM 779 CA SER A 48 44.150 31.080 41.730 1.00 0.00 C
411
+ ATOM 781 CB SER A 48 43.120 32.200 41.640 1.00 0.00 C
412
+ ATOM 784 OG SER A 48 42.520 32.360 42.940 1.00 0.00 O
413
+ ATOM 786 C SER A 48 45.350 31.470 42.520 1.00 0.00 C
414
+ ATOM 787 O SER A 48 46.170 32.280 42.090 1.00 0.00 O
415
+ ATOM 788 N ASN A 49 45.470 30.910 43.740 1.00 0.00 N
416
+ ATOM 790 CA ASN A 49 46.720 31.040 44.620 1.00 0.00 C
417
+ ATOM 792 CB ASN A 49 46.230 31.190 46.130 1.00 0.00 C
418
+ ATOM 795 CG ASN A 49 45.360 32.420 46.240 1.00 0.00 C
419
+ ATOM 796 OD1 ASN A 49 45.580 33.510 45.600 1.00 0.00 O
420
+ ATOM 797 ND2 ASN A 49 44.320 32.400 47.070 1.00 0.00 N
421
+ ATOM 800 C ASN A 49 47.660 29.810 44.610 1.00 0.00 C
422
+ ATOM 801 O ASN A 49 48.730 29.800 45.190 1.00 0.00 O
423
+ ATOM 802 N ASN A 50 47.280 28.800 43.940 1.00 0.00 N
424
+ ATOM 804 CA ASN A 50 47.890 27.480 43.910 1.00 0.00 C
425
+ ATOM 806 CB ASN A 50 47.010 26.440 44.540 1.00 0.00 C
426
+ ATOM 809 CG ASN A 50 47.680 25.070 44.710 1.00 0.00 C
427
+ ATOM 810 OD1 ASN A 50 48.450 24.560 43.920 1.00 0.00 O
428
+ ATOM 811 ND2 ASN A 50 47.340 24.320 45.820 1.00 0.00 N
429
+ ATOM 814 C ASN A 50 48.150 27.120 42.430 1.00 0.00 C
430
+ ATOM 815 O ASN A 50 47.280 26.630 41.740 1.00 0.00 O
431
+ ATOM 816 N GLU A 51 49.460 27.140 41.980 1.00 0.00 N
432
+ ATOM 818 CA GLU A 51 49.970 26.800 40.710 1.00 0.00 C
433
+ ATOM 820 CB GLU A 51 51.470 27.140 40.600 1.00 0.00 C
434
+ ATOM 823 CG GLU A 51 52.300 26.580 39.440 1.00 0.00 C
435
+ ATOM 826 CD GLU A 51 53.650 27.310 39.370 1.00 0.00 C
436
+ ATOM 827 OE1 GLU A 51 53.850 28.050 38.350 1.00 0.00 O
437
+ ATOM 828 OE2 GLU A 51 54.350 27.430 40.460 1.00 0.00 O
438
+ ATOM 829 C GLU A 51 49.710 25.360 40.200 1.00 0.00 C
439
+ ATOM 830 O GLU A 51 49.270 25.100 39.060 1.00 0.00 O
440
+ ATOM 831 N THR A 52 49.900 24.400 41.090 1.00 0.00 N
441
+ ATOM 833 CA THR A 52 49.420 23.070 40.810 1.00 0.00 C
442
+ ATOM 835 CB THR A 52 49.910 22.070 41.800 1.00 0.00 C
443
+ ATOM 837 OG1 THR A 52 51.340 22.110 41.860 1.00 0.00 O
444
+ ATOM 839 CG2 THR A 52 49.450 20.570 41.490 1.00 0.00 C
445
+ ATOM 843 C THR A 52 47.920 22.880 40.570 1.00 0.00 C
446
+ ATOM 844 O THR A 52 47.560 22.380 39.500 1.00 0.00 O
447
+ ATOM 845 N MET A 53 47.020 23.420 41.460 1.00 0.00 N
448
+ ATOM 847 CA MET A 53 45.620 23.370 41.200 1.00 0.00 C
449
+ ATOM 849 CB MET A 53 44.730 23.900 42.260 1.00 0.00 C
450
+ ATOM 852 CG MET A 53 44.790 23.140 43.630 1.00 0.00 C
451
+ ATOM 855 SD MET A 53 43.910 23.990 44.900 1.00 0.00 S
452
+ ATOM 856 CE MET A 53 42.220 23.790 44.170 1.00 0.00 C
453
+ ATOM 860 C MET A 53 45.250 24.080 39.880 1.00 0.00 C
454
+ ATOM 861 O MET A 53 44.510 23.510 39.060 1.00 0.00 O
455
+ ATOM 862 N ALA A 54 45.820 25.280 39.580 1.00 0.00 N
456
+ ATOM 864 CA ALA A 54 45.550 26.030 38.350 1.00 0.00 C
457
+ ATOM 866 CB ALA A 54 46.130 27.400 38.400 1.00 0.00 C
458
+ ATOM 870 C ALA A 54 45.940 25.240 37.110 1.00 0.00 C
459
+ ATOM 871 O ALA A 54 45.170 25.110 36.140 1.00 0.00 O
460
+ ATOM 872 N THR A 55 47.150 24.540 37.180 1.00 0.00 N
461
+ ATOM 874 CA THR A 55 47.810 23.700 36.130 1.00 0.00 C
462
+ ATOM 876 CB THR A 55 49.170 23.110 36.450 1.00 0.00 C
463
+ ATOM 878 OG1 THR A 55 50.090 24.190 36.710 1.00 0.00 O
464
+ ATOM 880 CG2 THR A 55 49.860 22.390 35.280 1.00 0.00 C
465
+ ATOM 884 C THR A 55 46.940 22.550 35.820 1.00 0.00 C
466
+ ATOM 885 O THR A 55 46.680 22.300 34.630 1.00 0.00 O
467
+ ATOM 886 N ILE A 56 46.440 21.830 36.900 1.00 0.00 N
468
+ ATOM 888 CA ILE A 56 45.560 20.710 36.840 1.00 0.00 C
469
+ ATOM 890 CB ILE A 56 45.240 20.110 38.200 1.00 0.00 C
470
+ ATOM 892 CG2 ILE A 56 43.990 19.140 38.150 1.00 0.00 C
471
+ ATOM 896 CG1 ILE A 56 46.430 19.250 38.570 1.00 0.00 C
472
+ ATOM 899 CD1 ILE A 56 46.240 18.490 39.920 1.00 0.00 C
473
+ ATOM 903 C ILE A 56 44.150 21.240 36.300 1.00 0.00 C
474
+ ATOM 904 O ILE A 56 43.570 20.630 35.390 1.00 0.00 O
475
+ ATOM 905 N LEU A 57 43.580 22.380 36.800 1.00 0.00 N
476
+ ATOM 907 CA LEU A 57 42.220 22.800 36.410 1.00 0.00 C
477
+ ATOM 909 CB LEU A 57 41.570 23.790 37.390 1.00 0.00 C
478
+ ATOM 912 CG LEU A 57 41.200 23.320 38.800 1.00 0.00 C
479
+ ATOM 914 CD1 LEU A 57 40.380 24.350 39.490 1.00 0.00 C
480
+ ATOM 918 CD2 LEU A 57 40.470 21.910 38.660 1.00 0.00 C
481
+ ATOM 922 C LEU A 57 42.090 23.210 34.950 1.00 0.00 C
482
+ ATOM 923 O LEU A 57 41.060 22.960 34.290 1.00 0.00 O
483
+ ATOM 924 N LEU A 58 43.120 23.790 34.400 1.00 0.00 N
484
+ ATOM 926 CA LEU A 58 43.300 24.150 33.020 1.00 0.00 C
485
+ ATOM 928 CB LEU A 58 44.410 25.180 32.900 1.00 0.00 C
486
+ ATOM 931 CG LEU A 58 44.740 25.690 31.530 1.00 0.00 C
487
+ ATOM 933 CD1 LEU A 58 43.520 26.110 30.710 1.00 0.00 C
488
+ ATOM 937 CD2 LEU A 58 45.670 26.920 31.710 1.00 0.00 C
489
+ ATOM 941 C LEU A 58 43.610 22.990 32.170 1.00 0.00 C
490
+ ATOM 942 O LEU A 58 43.180 22.880 31.000 1.00 0.00 O
491
+ ATOM 943 N GLN A 59 44.340 21.910 32.690 1.00 0.00 N
492
+ ATOM 945 CA GLN A 59 44.390 20.660 31.890 1.00 0.00 C
493
+ ATOM 947 CB GLN A 59 45.350 19.660 32.590 1.00 0.00 C
494
+ ATOM 950 CG GLN A 59 46.850 19.980 32.350 1.00 0.00 C
495
+ ATOM 953 CD GLN A 59 47.710 18.970 33.120 1.00 0.00 C
496
+ ATOM 954 OE1 GLN A 59 47.160 17.920 33.500 1.00 0.00 O
497
+ ATOM 955 NE2 GLN A 59 48.960 19.320 33.480 1.00 0.00 N
498
+ ATOM 958 C GLN A 59 43.040 19.870 31.660 1.00 0.00 C
499
+ ATOM 959 O GLN A 59 42.720 19.370 30.570 1.00 0.00 O
500
+ ATOM 960 N ASN A 60 42.230 19.860 32.740 1.00 0.00 N
501
+ ATOM 962 CA ASN A 60 40.920 19.280 32.730 1.00 0.00 C
502
+ ATOM 964 CB ASN A 60 40.440 18.940 34.190 1.00 0.00 C
503
+ ATOM 967 CG ASN A 60 41.530 18.140 34.970 1.00 0.00 C
504
+ ATOM 968 OD1 ASN A 60 42.400 17.500 34.390 1.00 0.00 O
505
+ ATOM 969 ND2 ASN A 60 41.380 17.950 36.300 1.00 0.00 N
506
+ ATOM 972 C ASN A 60 39.900 20.110 32.040 1.00 0.00 C
507
+ ATOM 973 O ASN A 60 38.900 19.540 31.500 1.00 0.00 O
508
+ ATOM 974 N LEU A 61 40.100 21.460 32.010 1.00 0.00 N
509
+ ATOM 976 CA LEU A 61 39.440 22.390 31.130 1.00 0.00 C
510
+ ATOM 978 CB LEU A 61 39.940 23.870 31.340 1.00 0.00 C
511
+ ATOM 981 CG LEU A 61 39.080 24.990 30.720 1.00 0.00 C
512
+ ATOM 983 CD1 LEU A 61 37.810 25.340 31.470 1.00 0.00 C
513
+ ATOM 987 CD2 LEU A 61 39.990 26.180 30.690 1.00 0.00 C
514
+ ATOM 991 C LEU A 61 39.690 22.020 29.670 1.00 0.00 C
515
+ ATOM 992 O LEU A 61 38.760 22.080 28.830 1.00 0.00 O
516
+ ATOM 993 N LEU A 62 40.930 21.660 29.330 1.00 0.00 N
517
+ ATOM 995 CA LEU A 62 41.270 21.200 28.010 1.00 0.00 C
518
+ ATOM 997 CB LEU A 62 42.820 21.290 27.630 1.00 0.00 C
519
+ ATOM 1000 CG LEU A 62 43.360 22.700 27.510 1.00 0.00 C
520
+ ATOM 1002 CD1 LEU A 62 44.870 22.830 27.790 1.00 0.00 C
521
+ ATOM 1006 CD2 LEU A 62 43.250 23.190 26.080 1.00 0.00 C
522
+ ATOM 1010 C LEU A 62 40.730 19.870 27.660 1.00 0.00 C
523
+ ATOM 1011 O LEU A 62 40.180 19.690 26.560 1.00 0.00 O
524
+ ATOM 1012 N ILE A 63 40.710 18.810 28.530 1.00 0.00 N
525
+ ATOM 1014 CA ILE A 63 40.100 17.450 28.390 1.00 0.00 C
526
+ ATOM 1016 CB ILE A 63 40.220 16.480 29.550 1.00 0.00 C
527
+ ATOM 1018 CG2 ILE A 63 39.420 15.080 29.420 1.00 0.00 C
528
+ ATOM 1022 CG1 ILE A 63 41.770 16.120 29.800 1.00 0.00 C
529
+ ATOM 1025 CD1 ILE A 63 42.020 15.620 31.180 1.00 0.00 C
530
+ ATOM 1029 C ILE A 63 38.540 17.550 28.050 1.00 0.00 C
531
+ ATOM 1030 O ILE A 63 38.040 16.970 27.110 1.00 0.00 O
532
+ ATOM 1031 N GLN A 64 37.830 18.370 28.800 1.00 0.00 N
533
+ ATOM 1033 CA GLN A 64 36.400 18.660 28.570 1.00 0.00 C
534
+ ATOM 1035 CB GLN A 64 35.750 19.320 29.800 1.00 0.00 C
535
+ ATOM 1038 CG GLN A 64 35.620 18.400 31.080 1.00 0.00 C
536
+ ATOM 1041 CD GLN A 64 34.710 17.180 30.880 1.00 0.00 C
537
+ ATOM 1042 OE1 GLN A 64 33.540 17.380 30.620 1.00 0.00 O
538
+ ATOM 1043 NE2 GLN A 64 35.200 15.920 30.990 1.00 0.00 N
539
+ ATOM 1046 C GLN A 64 36.150 19.390 27.240 1.00 0.00 C
540
+ ATOM 1047 O GLN A 64 35.200 19.080 26.560 1.00 0.00 O
541
+ ATOM 1048 N LEU A 65 36.980 20.340 26.790 1.00 0.00 N
542
+ ATOM 1050 CA LEU A 65 36.880 20.940 25.510 1.00 0.00 C
543
+ ATOM 1052 CB LEU A 65 38.000 21.990 25.440 1.00 0.00 C
544
+ ATOM 1055 CG LEU A 65 38.100 22.780 24.070 1.00 0.00 C
545
+ ATOM 1057 CD1 LEU A 65 36.720 23.480 23.860 1.00 0.00 C
546
+ ATOM 1061 CD2 LEU A 65 39.210 23.830 24.150 1.00 0.00 C
547
+ ATOM 1065 C LEU A 65 37.010 20.020 24.320 1.00 0.00 C
548
+ ATOM 1066 O LEU A 65 36.230 20.140 23.360 1.00 0.00 O
549
+ ATOM 1067 N ASP A 66 37.890 19.050 24.410 1.00 0.00 N
550
+ ATOM 1069 CA ASP A 66 37.930 18.010 23.410 1.00 0.00 C
551
+ ATOM 1071 CB ASP A 66 39.220 17.190 23.570 1.00 0.00 C
552
+ ATOM 1074 CG ASP A 66 40.330 17.820 22.770 1.00 0.00 C
553
+ ATOM 1075 OD1 ASP A 66 40.260 19.000 22.360 1.00 0.00 O
554
+ ATOM 1076 OD2 ASP A 66 41.400 17.140 22.620 1.00 0.00 O
555
+ ATOM 1077 C ASP A 66 36.610 17.170 23.260 1.00 0.00 C
556
+ ATOM 1078 O ASP A 66 36.140 16.810 22.170 1.00 0.00 O
557
+ ATOM 1079 N GLU A 67 35.930 16.840 24.440 1.00 0.00 N
558
+ ATOM 1081 CA GLU A 67 34.650 16.240 24.530 1.00 0.00 C
559
+ ATOM 1083 CB GLU A 67 34.120 15.920 25.960 1.00 0.00 C
560
+ ATOM 1086 CG GLU A 67 35.010 14.880 26.640 1.00 0.00 C
561
+ ATOM 1089 CD GLU A 67 34.450 14.320 27.920 1.00 0.00 C
562
+ ATOM 1090 OE1 GLU A 67 33.230 14.460 28.180 1.00 0.00 O
563
+ ATOM 1091 OE2 GLU A 67 35.280 13.720 28.660 1.00 0.00 O
564
+ ATOM 1092 C GLU A 67 33.530 17.080 23.940 1.00 0.00 C
565
+ ATOM 1093 O GLU A 67 32.650 16.580 23.270 1.00 0.00 O
566
+ ATOM 1094 N GLN A 68 33.570 18.400 24.130 1.00 0.00 N
567
+ ATOM 1096 CA GLN A 68 32.720 19.430 23.520 1.00 0.00 C
568
+ ATOM 1098 CB GLN A 68 32.750 20.840 24.220 1.00 0.00 C
569
+ ATOM 1101 CG GLN A 68 32.160 20.750 25.620 1.00 0.00 C
570
+ ATOM 1104 CD GLN A 68 30.740 20.230 25.840 1.00 0.00 C
571
+ ATOM 1105 OE1 GLN A 68 29.920 20.560 25.040 1.00 0.00 O
572
+ ATOM 1106 NE2 GLN A 68 30.530 19.490 26.940 1.00 0.00 N
573
+ ATOM 1109 C GLN A 68 32.950 19.510 22.010 1.00 0.00 C
574
+ ATOM 1110 O GLN A 68 31.970 19.440 21.240 1.00 0.00 O
575
+ ATOM 1111 N LEU A 69 34.200 19.500 21.590 1.00 0.00 N
576
+ ATOM 1113 CA LEU A 69 34.620 19.380 20.190 1.00 0.00 C
577
+ ATOM 1115 CB LEU A 69 36.150 19.600 19.910 1.00 0.00 C
578
+ ATOM 1118 CG LEU A 69 36.680 21.030 20.170 1.00 0.00 C
579
+ ATOM 1120 CD1 LEU A 69 38.170 21.090 20.400 1.00 0.00 C
580
+ ATOM 1124 CD2 LEU A 69 36.200 21.800 18.910 1.00 0.00 C
581
+ ATOM 1128 C LEU A 69 34.130 18.150 19.500 1.00 0.00 C
582
+ ATOM 1129 O LEU A 69 33.570 18.280 18.420 1.00 0.00 O
583
+ ATOM 1130 N GLY A 70 34.210 16.950 20.140 1.00 0.00 N
584
+ ATOM 1132 CA GLY A 70 33.570 15.700 19.670 1.00 0.00 C
585
+ ATOM 1135 C GLY A 70 32.060 15.820 19.520 1.00 0.00 C
586
+ ATOM 1136 O GLY A 70 31.510 15.390 18.480 1.00 0.00 O
587
+ ATOM 1137 N ARG A 71 31.380 16.360 20.490 1.00 0.00 N
588
+ ATOM 1139 CA ARG A 71 29.950 16.590 20.490 1.00 0.00 C
589
+ ATOM 1141 CB ARG A 71 29.530 17.170 21.850 1.00 0.00 C
590
+ ATOM 1144 CG ARG A 71 28.080 17.770 21.850 1.00 0.00 C
591
+ ATOM 1147 CD ARG A 71 27.510 17.960 23.250 1.00 0.00 C
592
+ ATOM 1150 NE ARG A 71 26.050 18.370 23.180 1.00 0.00 N
593
+ ATOM 1152 CZ ARG A 71 25.170 18.510 24.210 1.00 0.00 C
594
+ ATOM 1153 NH1 ARG A 71 25.490 18.040 25.400 1.00 0.00 N
595
+ ATOM 1156 NH2 ARG A 71 23.980 18.860 23.930 1.00 0.00 N
596
+ ATOM 1159 C ARG A 71 29.540 17.460 19.370 1.00 0.00 C
597
+ ATOM 1160 O ARG A 71 28.690 17.140 18.520 1.00 0.00 O
598
+ ATOM 1161 N VAL A 72 30.150 18.600 19.220 1.00 0.00 N
599
+ ATOM 1163 CA VAL A 72 29.590 19.510 18.260 1.00 0.00 C
600
+ ATOM 1165 CB VAL A 72 29.960 21.060 18.510 1.00 0.00 C
601
+ ATOM 1167 CG1 VAL A 72 29.450 21.410 19.900 1.00 0.00 C
602
+ ATOM 1171 CG2 VAL A 72 31.460 21.420 18.480 1.00 0.00 C
603
+ ATOM 1175 C VAL A 72 29.900 19.120 16.830 1.00 0.00 C
604
+ ATOM 1176 O VAL A 72 29.180 19.400 15.890 1.00 0.00 O
605
+ ATOM 1177 N SER A 73 31.010 18.380 16.690 1.00 0.00 N
606
+ ATOM 1179 CA SER A 73 31.390 17.770 15.350 1.00 0.00 C
607
+ ATOM 1181 CB SER A 73 32.740 17.140 15.480 1.00 0.00 C
608
+ ATOM 1184 OG SER A 73 33.820 18.100 15.630 1.00 0.00 O
609
+ ATOM 1186 C SER A 73 30.310 16.740 14.960 1.00 0.00 C
610
+ ATOM 1187 O SER A 73 29.860 16.720 13.800 1.00 0.00 O
611
+ ATOM 1188 N LYS A 74 29.790 15.860 15.890 1.00 0.00 N
612
+ ATOM 1190 CA LYS A 74 28.690 14.920 15.650 1.00 0.00 C
613
+ ATOM 1192 CB LYS A 74 28.480 14.190 16.970 1.00 0.00 C
614
+ ATOM 1195 CG LYS A 74 27.520 12.980 16.910 1.00 0.00 C
615
+ ATOM 1198 CD LYS A 74 27.270 12.410 18.290 1.00 0.00 C
616
+ ATOM 1201 CE LYS A 74 26.380 11.210 18.360 1.00 0.00 C
617
+ ATOM 1204 NZ LYS A 74 26.630 10.200 17.290 1.00 0.00 N
618
+ ATOM 1208 C LYS A 74 27.440 15.770 15.240 1.00 0.00 C
619
+ ATOM 1209 O LYS A 74 26.910 15.560 14.140 1.00 0.00 O
620
+ ATOM 1210 N GLU A 75 27.120 16.820 16.050 1.00 0.00 N
621
+ ATOM 1212 CA GLU A 75 25.910 17.640 15.820 1.00 0.00 C
622
+ ATOM 1214 CB GLU A 75 25.600 18.570 17.030 1.00 0.00 C
623
+ ATOM 1217 CG GLU A 75 25.350 17.730 18.280 1.00 0.00 C
624
+ ATOM 1220 CD GLU A 75 25.020 18.570 19.500 1.00 0.00 C
625
+ ATOM 1221 OE1 GLU A 75 25.010 19.810 19.400 1.00 0.00 O
626
+ ATOM 1222 OE2 GLU A 75 24.610 17.970 20.510 1.00 0.00 O
627
+ ATOM 1223 C GLU A 75 26.000 18.490 14.500 1.00 0.00 C
628
+ ATOM 1224 O GLU A 75 25.000 19.030 14.010 1.00 0.00 O
629
+ ATOM 1225 N LYS A 76 27.250 18.650 13.880 1.00 0.00 N
630
+ ATOM 1227 CA LYS A 76 27.610 19.250 12.640 1.00 0.00 C
631
+ ATOM 1229 CB LYS A 76 26.870 18.630 11.390 1.00 0.00 C
632
+ ATOM 1232 CG LYS A 76 27.310 17.190 11.190 1.00 0.00 C
633
+ ATOM 1235 CD LYS A 76 26.430 16.470 10.160 1.00 0.00 C
634
+ ATOM 1238 CE LYS A 76 26.600 17.080 8.750 1.00 0.00 C
635
+ ATOM 1241 NZ LYS A 76 25.900 16.270 7.840 1.00 0.00 N
636
+ ATOM 1245 C LYS A 76 27.420 20.770 12.660 1.00 0.00 C
637
+ ATOM 1246 O LYS A 76 27.120 21.410 11.620 1.00 0.00 O
638
+ ATOM 1247 N ASN A 77 27.470 21.450 13.840 1.00 0.00 N
639
+ ATOM 1249 CA ASN A 77 27.280 22.870 14.040 1.00 0.00 C
640
+ ATOM 1251 CB ASN A 77 26.580 23.190 15.430 1.00 0.00 C
641
+ ATOM 1254 CG ASN A 77 26.250 24.700 15.610 1.00 0.00 C
642
+ ATOM 1255 OD1 ASN A 77 26.700 25.620 14.920 1.00 0.00 O
643
+ ATOM 1256 ND2 ASN A 77 25.520 25.010 16.710 1.00 0.00 N
644
+ ATOM 1259 C ASN A 77 28.590 23.610 13.910 1.00 0.00 C
645
+ ATOM 1260 O ASN A 77 29.370 23.690 14.840 1.00 0.00 O
646
+ ATOM 1261 N LEU A 78 28.800 24.070 12.670 1.00 0.00 N
647
+ ATOM 1263 CA LEU A 78 30.030 24.620 12.170 1.00 0.00 C
648
+ ATOM 1265 CB LEU A 78 29.900 25.070 10.700 1.00 0.00 C
649
+ ATOM 1268 CG LEU A 78 29.510 23.880 9.750 1.00 0.00 C
650
+ ATOM 1270 CD1 LEU A 78 29.390 24.370 8.290 1.00 0.00 C
651
+ ATOM 1274 CD2 LEU A 78 30.340 22.560 9.750 1.00 0.00 C
652
+ ATOM 1278 C LEU A 78 30.530 25.780 12.960 1.00 0.00 C
653
+ ATOM 1279 O LEU A 78 31.730 25.940 13.150 1.00 0.00 O
654
+ ATOM 1280 N LEU A 79 29.590 26.680 13.420 1.00 0.00 N
655
+ ATOM 1282 CA LEU A 79 29.980 27.820 14.300 1.00 0.00 C
656
+ ATOM 1284 CB LEU A 79 28.740 28.640 14.670 1.00 0.00 C
657
+ ATOM 1287 CG LEU A 79 28.940 29.770 15.580 1.00 0.00 C
658
+ ATOM 1289 CD1 LEU A 79 29.890 30.840 15.000 1.00 0.00 C
659
+ ATOM 1293 CD2 LEU A 79 27.580 30.420 15.850 1.00 0.00 C
660
+ ATOM 1297 C LEU A 79 30.810 27.460 15.490 1.00 0.00 C
661
+ ATOM 1298 O LEU A 79 31.960 27.930 15.640 1.00 0.00 O
662
+ ATOM 1299 N LEU A 80 30.230 26.620 16.360 1.00 0.00 N
663
+ ATOM 1301 CA LEU A 80 30.860 25.960 17.500 1.00 0.00 C
664
+ ATOM 1303 CB LEU A 80 29.840 25.090 18.210 1.00 0.00 C
665
+ ATOM 1306 CG LEU A 80 28.570 25.830 18.850 1.00 0.00 C
666
+ ATOM 1308 CD1 LEU A 80 27.690 24.900 19.760 1.00 0.00 C
667
+ ATOM 1312 CD2 LEU A 80 29.040 27.090 19.660 1.00 0.00 C
668
+ ATOM 1316 C LEU A 80 32.070 25.140 17.160 1.00 0.00 C
669
+ ATOM 1317 O LEU A 80 33.070 25.280 17.860 1.00 0.00 O
670
+ ATOM 1318 N ILE A 81 32.070 24.330 16.060 1.00 0.00 N
671
+ ATOM 1320 CA ILE A 81 33.250 23.600 15.660 1.00 0.00 C
672
+ ATOM 1322 CB ILE A 81 33.010 22.760 14.350 1.00 0.00 C
673
+ ATOM 1324 CG2 ILE A 81 34.300 22.070 13.980 1.00 0.00 C
674
+ ATOM 1328 CG1 ILE A 81 31.990 21.590 14.590 1.00 0.00 C
675
+ ATOM 1331 CD1 ILE A 81 31.300 21.180 13.350 1.00 0.00 C
676
+ ATOM 1335 C ILE A 81 34.440 24.520 15.340 1.00 0.00 C
677
+ ATOM 1336 O ILE A 81 35.540 24.280 15.820 1.00 0.00 O
678
+ ATOM 1337 N HIS A 82 34.170 25.550 14.540 1.00 0.00 N
679
+ ATOM 1339 CA HIS A 82 35.080 26.550 14.210 1.00 0.00 C
680
+ ATOM 1341 CB HIS A 82 34.500 27.370 13.070 1.00 0.00 C
681
+ ATOM 1344 ND1 HIS A 82 35.530 29.580 13.400 1.00 0.00 N
682
+ ATOM 1345 CG HIS A 82 35.520 28.420 12.650 1.00 0.00 C
683
+ ATOM 1346 CE1 HIS A 82 36.400 30.330 12.780 1.00 0.00 C
684
+ ATOM 1348 NE2 HIS A 82 36.980 29.740 11.700 1.00 0.00 N
685
+ ATOM 1350 CD2 HIS A 82 36.420 28.450 11.630 1.00 0.00 C
686
+ ATOM 1352 C HIS A 82 35.550 27.360 15.470 1.00 0.00 C
687
+ ATOM 1353 O HIS A 82 36.780 27.320 15.780 1.00 0.00 O
688
+ ATOM 1354 N ASN A 83 34.690 28.090 16.280 1.00 0.00 N
689
+ ATOM 1356 CA ASN A 83 35.070 28.910 17.420 1.00 0.00 C
690
+ ATOM 1358 CB ASN A 83 33.880 29.860 17.970 1.00 0.00 C
691
+ ATOM 1361 CG ASN A 83 33.470 30.980 17.030 1.00 0.00 C
692
+ ATOM 1362 OD1 ASN A 83 32.550 31.720 17.390 1.00 0.00 O
693
+ ATOM 1363 ND2 ASN A 83 34.090 31.070 15.830 1.00 0.00 N
694
+ ATOM 1366 C ASN A 83 35.760 28.090 18.500 1.00 0.00 C
695
+ ATOM 1367 O ASN A 83 36.700 28.630 19.110 1.00 0.00 O
696
+ ATOM 1368 N LEU A 84 35.340 26.840 18.840 1.00 0.00 N
697
+ ATOM 1370 CA LEU A 84 36.090 26.060 19.880 1.00 0.00 C
698
+ ATOM 1372 CB LEU A 84 35.140 24.810 20.210 1.00 0.00 C
699
+ ATOM 1375 CG LEU A 84 33.920 25.290 20.950 1.00 0.00 C
700
+ ATOM 1377 CD1 LEU A 84 32.940 24.160 21.220 1.00 0.00 C
701
+ ATOM 1381 CD2 LEU A 84 34.260 25.930 22.320 1.00 0.00 C
702
+ ATOM 1385 C LEU A 84 37.490 25.540 19.570 1.00 0.00 C
703
+ ATOM 1386 O LEU A 84 38.310 25.540 20.490 1.00 0.00 O
704
+ ATOM 1387 N LYS A 85 37.730 25.240 18.270 1.00 0.00 N
705
+ ATOM 1389 CA LYS A 85 39.060 24.980 17.790 1.00 0.00 C
706
+ ATOM 1391 CB LYS A 85 39.140 24.470 16.380 1.00 0.00 C
707
+ ATOM 1394 CG LYS A 85 38.780 22.900 16.410 1.00 0.00 C
708
+ ATOM 1397 CD LYS A 85 38.860 22.140 15.060 1.00 0.00 C
709
+ ATOM 1400 CE LYS A 85 38.050 20.850 15.030 1.00 0.00 C
710
+ ATOM 1403 NZ LYS A 85 38.110 20.250 13.760 1.00 0.00 N
711
+ ATOM 1407 C LYS A 85 40.050 26.110 17.800 1.00 0.00 C
712
+ ATOM 1408 O LYS A 85 41.210 26.020 18.160 1.00 0.00 O
713
+ ATOM 1409 N ARG A 86 39.570 27.380 17.490 1.00 0.00 N
714
+ ATOM 1411 CA ARG A 86 40.250 28.660 17.790 1.00 0.00 C
715
+ ATOM 1413 CB ARG A 86 39.540 29.950 17.240 1.00 0.00 C
716
+ ATOM 1416 CG ARG A 86 39.590 29.870 15.680 1.00 0.00 C
717
+ ATOM 1419 CD ARG A 86 38.890 31.060 15.040 1.00 0.00 C
718
+ ATOM 1422 NE ARG A 86 39.250 31.120 13.540 1.00 0.00 N
719
+ ATOM 1424 CZ ARG A 86 39.190 32.230 12.840 1.00 0.00 C
720
+ ATOM 1425 NH1 ARG A 86 38.410 33.240 13.230 1.00 0.00 N
721
+ ATOM 1428 NH2 ARG A 86 39.710 32.290 11.630 1.00 0.00 N
722
+ ATOM 1431 C ARG A 86 40.560 28.830 19.300 1.00 0.00 C
723
+ ATOM 1432 O ARG A 86 41.610 29.150 19.770 1.00 0.00 O
724
+ ATOM 1433 N ILE A 87 39.560 28.570 20.110 1.00 0.00 N
725
+ ATOM 1435 CA ILE A 87 39.700 28.630 21.510 1.00 0.00 C
726
+ ATOM 1437 CB ILE A 87 38.300 28.520 22.150 1.00 0.00 C
727
+ ATOM 1439 CG2 ILE A 87 38.390 28.250 23.670 1.00 0.00 C
728
+ ATOM 1443 CG1 ILE A 87 37.490 29.840 21.940 1.00 0.00 C
729
+ ATOM 1446 CD1 ILE A 87 35.970 29.640 22.080 1.00 0.00 C
730
+ ATOM 1450 C ILE A 87 40.720 27.680 22.080 1.00 0.00 C
731
+ ATOM 1451 O ILE A 87 41.560 28.010 22.980 1.00 0.00 O
732
+ ATOM 1452 N ARG A 88 40.660 26.390 21.570 1.00 0.00 N
733
+ ATOM 1454 CA ARG A 88 41.630 25.410 21.940 1.00 0.00 C
734
+ ATOM 1456 CB ARG A 88 41.360 24.030 21.260 1.00 0.00 C
735
+ ATOM 1459 CG ARG A 88 42.260 22.920 21.770 1.00 0.00 C
736
+ ATOM 1462 CD ARG A 88 41.890 21.520 21.320 1.00 0.00 C
737
+ ATOM 1465 NE ARG A 88 41.960 21.430 19.830 1.00 0.00 N
738
+ ATOM 1467 CZ ARG A 88 41.320 20.390 19.130 1.00 0.00 C
739
+ ATOM 1468 NH1 ARG A 88 40.680 19.420 19.730 1.00 0.00 N
740
+ ATOM 1471 NH2 ARG A 88 41.450 20.310 17.810 1.00 0.00 N
741
+ ATOM 1474 C ARG A 88 43.140 25.790 21.750 1.00 0.00 C
742
+ ATOM 1475 O ARG A 88 43.910 25.680 22.680 1.00 0.00 O
743
+ ATOM 1476 N LYS A 89 43.460 26.430 20.640 1.00 0.00 N
744
+ ATOM 1478 CA LYS A 89 44.780 27.040 20.420 1.00 0.00 C
745
+ ATOM 1480 CB LYS A 89 44.970 27.670 19.010 1.00 0.00 C
746
+ ATOM 1483 CG LYS A 89 44.890 26.720 17.800 1.00 0.00 C
747
+ ATOM 1486 CD LYS A 89 45.180 27.460 16.450 1.00 0.00 C
748
+ ATOM 1489 CE LYS A 89 45.000 26.500 15.350 1.00 0.00 C
749
+ ATOM 1492 NZ LYS A 89 45.180 27.290 14.050 1.00 0.00 N
750
+ ATOM 1496 C LYS A 89 45.220 28.020 21.410 1.00 0.00 C
751
+ ATOM 1497 O LYS A 89 46.380 28.100 21.810 1.00 0.00 O
752
+ ATOM 1498 N VAL A 90 44.250 28.850 21.920 1.00 0.00 N
753
+ ATOM 1500 CA VAL A 90 44.480 29.720 23.070 1.00 0.00 C
754
+ ATOM 1502 CB VAL A 90 43.350 30.800 23.200 1.00 0.00 C
755
+ ATOM 1504 CG1 VAL A 90 43.910 31.880 24.130 1.00 0.00 C
756
+ ATOM 1508 CG2 VAL A 90 43.040 31.400 21.810 1.00 0.00 C
757
+ ATOM 1512 C VAL A 90 44.640 29.060 24.470 1.00 0.00 C
758
+ ATOM 1513 O VAL A 90 45.560 29.380 25.190 1.00 0.00 O
759
+ ATOM 1514 N LEU A 91 43.760 28.160 24.830 1.00 0.00 N
760
+ ATOM 1516 CA LEU A 91 43.810 27.680 26.160 1.00 0.00 C
761
+ ATOM 1518 CB LEU A 91 42.430 27.210 26.660 1.00 0.00 C
762
+ ATOM 1521 CG LEU A 91 41.310 28.300 26.610 1.00 0.00 C
763
+ ATOM 1523 CD1 LEU A 91 39.860 27.850 26.880 1.00 0.00 C
764
+ ATOM 1527 CD2 LEU A 91 41.630 29.560 27.530 1.00 0.00 C
765
+ ATOM 1531 C LEU A 91 44.880 26.660 26.420 1.00 0.00 C
766
+ ATOM 1532 O LEU A 91 45.410 26.650 27.540 1.00 0.00 O
767
+ ATOM 1533 N GLN A 92 45.390 25.970 25.330 1.00 0.00 N
768
+ ATOM 1535 CA GLN A 92 46.680 25.340 25.280 1.00 0.00 C
769
+ ATOM 1537 CB GLN A 92 46.840 24.780 23.830 1.00 0.00 C
770
+ ATOM 1540 CG GLN A 92 45.930 23.520 23.550 1.00 0.00 C
771
+ ATOM 1543 CD GLN A 92 46.150 23.120 22.070 1.00 0.00 C
772
+ ATOM 1544 OE1 GLN A 92 45.980 23.870 21.120 1.00 0.00 O
773
+ ATOM 1545 NE2 GLN A 92 46.730 21.970 21.850 1.00 0.00 N
774
+ ATOM 1548 C GLN A 92 47.820 26.390 25.510 1.00 0.00 C
775
+ ATOM 1549 O GLN A 92 48.750 26.100 26.230 1.00 0.00 O
776
+ ATOM 1550 N GLY A 93 47.690 27.570 24.910 1.00 0.00 N
777
+ ATOM 1552 CA GLY A 93 48.660 28.650 24.950 1.00 0.00 C
778
+ ATOM 1555 C GLY A 93 48.840 29.240 26.360 1.00 0.00 C
779
+ ATOM 1556 O GLY A 93 49.940 29.600 26.720 1.00 0.00 O
780
+ ATOM 1557 N LYS A 94 47.720 29.210 27.160 1.00 0.00 N
781
+ ATOM 1559 CA LYS A 94 47.780 29.630 28.570 1.00 0.00 C
782
+ ATOM 1561 CB LYS A 94 46.350 30.050 29.020 1.00 0.00 C
783
+ ATOM 1564 CG LYS A 94 45.610 31.140 28.280 1.00 0.00 C
784
+ ATOM 1567 CD LYS A 94 46.480 32.350 27.900 1.00 0.00 C
785
+ ATOM 1570 CE LYS A 94 45.730 33.540 27.190 1.00 0.00 C
786
+ ATOM 1573 NZ LYS A 94 46.760 34.490 26.730 1.00 0.00 N
787
+ ATOM 1577 C LYS A 94 48.270 28.480 29.440 1.00 0.00 C
788
+ ATOM 1578 O LYS A 94 48.930 28.780 30.440 1.00 0.00 O
789
+ ATOM 1579 N PHE A 95 48.030 27.190 29.110 1.00 0.00 N
790
+ ATOM 1581 CA PHE A 95 48.740 26.130 29.750 1.00 0.00 C
791
+ ATOM 1583 CB PHE A 95 48.210 24.710 29.330 1.00 0.00 C
792
+ ATOM 1586 CG PHE A 95 49.130 23.500 29.580 1.00 0.00 C
793
+ ATOM 1587 CD1 PHE A 95 49.370 22.980 30.870 1.00 0.00 C
794
+ ATOM 1589 CE1 PHE A 95 50.130 21.860 31.100 1.00 0.00 C
795
+ ATOM 1591 CZ PHE A 95 50.770 21.220 30.040 1.00 0.00 C
796
+ ATOM 1593 CD2 PHE A 95 49.750 22.850 28.460 1.00 0.00 C
797
+ ATOM 1595 CE2 PHE A 95 50.580 21.690 28.710 1.00 0.00 C
798
+ ATOM 1597 C PHE A 95 50.280 26.160 29.740 1.00 0.00 C
799
+ ATOM 1598 O PHE A 95 50.950 25.940 30.740 1.00 0.00 O
800
+ ATOM 1599 N HIS A 96 50.900 26.500 28.590 1.00 0.00 N
801
+ ATOM 1601 CA HIS A 96 52.320 26.770 28.460 1.00 0.00 C
802
+ ATOM 1603 CB HIS A 96 52.750 26.520 26.940 1.00 0.00 C
803
+ ATOM 1606 ND1 HIS A 96 52.170 24.770 25.340 1.00 0.00 N
804
+ ATOM 1607 CG HIS A 96 52.720 25.090 26.570 1.00 0.00 C
805
+ ATOM 1608 CE1 HIS A 96 52.410 23.500 25.130 1.00 0.00 C
806
+ ATOM 1610 NE2 HIS A 96 53.030 22.980 26.210 1.00 0.00 N
807
+ ATOM 1612 CD2 HIS A 96 53.210 23.990 27.150 1.00 0.00 C
808
+ ATOM 1614 C HIS A 96 52.650 28.170 28.860 1.00 0.00 C
809
+ ATOM 1615 O HIS A 96 53.830 28.560 28.970 1.00 0.00 O
810
+ ATOM 1616 N GLY A 97 51.650 29.000 29.160 1.00 0.00 N
811
+ ATOM 1618 CA GLY A 97 51.930 30.340 29.710 1.00 0.00 C
812
+ ATOM 1621 C GLY A 97 52.000 30.370 31.210 1.00 0.00 C
813
+ ATOM 1622 O GLY A 97 52.890 29.800 31.850 1.00 0.00 O
814
+ ATOM 1623 N ASN A 98 50.990 31.000 31.850 1.00 0.00 N
815
+ ATOM 1625 CA ASN A 98 50.780 30.950 33.300 1.00 0.00 C
816
+ ATOM 1627 CB ASN A 98 51.000 32.420 33.930 1.00 0.00 C
817
+ ATOM 1630 CG ASN A 98 50.520 32.710 35.290 1.00 0.00 C
818
+ ATOM 1631 OD1 ASN A 98 49.370 33.100 35.570 1.00 0.00 O
819
+ ATOM 1632 ND2 ASN A 98 51.410 32.470 36.250 1.00 0.00 N
820
+ ATOM 1635 C ASN A 98 49.310 30.430 33.700 1.00 0.00 C
821
+ ATOM 1636 O ASN A 98 48.410 31.210 33.490 1.00 0.00 O
822
+ ATOM 1637 N PRO A 99 49.090 29.180 34.110 1.00 0.00 N
823
+ ATOM 1638 CD PRO A 99 50.070 28.060 33.940 1.00 0.00 C
824
+ ATOM 1641 CA PRO A 99 47.810 28.700 34.640 1.00 0.00 C
825
+ ATOM 1643 CB PRO A 99 48.070 27.270 35.090 1.00 0.00 C
826
+ ATOM 1646 CG PRO A 99 49.240 26.820 34.170 1.00 0.00 C
827
+ ATOM 1649 C PRO A 99 47.000 29.520 35.540 1.00 0.00 C
828
+ ATOM 1650 O PRO A 99 45.790 29.470 35.480 1.00 0.00 O
829
+ ATOM 1651 N MET A 100 47.570 30.270 36.500 1.00 0.00 N
830
+ ATOM 1653 CA MET A 100 46.930 31.020 37.580 1.00 0.00 C
831
+ ATOM 1655 CB MET A 100 47.950 31.540 38.770 1.00 0.00 C
832
+ ATOM 1658 CG MET A 100 48.500 30.390 39.650 1.00 0.00 C
833
+ ATOM 1661 SD MET A 100 49.960 30.670 40.610 1.00 0.00 S
834
+ ATOM 1662 CE MET A 100 49.510 31.940 41.750 1.00 0.00 C
835
+ ATOM 1666 C MET A 100 45.950 32.130 37.160 1.00 0.00 C
836
+ ATOM 1667 O MET A 100 44.810 32.250 37.580 1.00 0.00 O
837
+ ATOM 1668 N HIS A 101 46.400 32.900 36.130 1.00 0.00 N
838
+ ATOM 1670 CA HIS A 101 45.770 34.020 35.520 1.00 0.00 C
839
+ ATOM 1672 CB HIS A 101 46.580 34.510 34.280 1.00 0.00 C
840
+ ATOM 1675 ND1 HIS A 101 46.210 36.450 32.620 1.00 0.00 N
841
+ ATOM 1676 CG HIS A 101 45.990 35.870 33.860 1.00 0.00 C
842
+ ATOM 1677 CE1 HIS A 101 45.560 37.600 32.580 1.00 0.00 C
843
+ ATOM 1679 NE2 HIS A 101 44.840 37.790 33.700 1.00 0.00 N
844
+ ATOM 1681 CD2 HIS A 101 45.130 36.680 34.520 1.00 0.00 C
845
+ ATOM 1683 C HIS A 101 44.390 33.540 34.960 1.00 0.00 C
846
+ ATOM 1684 O HIS A 101 43.420 34.290 35.040 1.00 0.00 O
847
+ ATOM 1685 N VAL A 102 44.220 32.390 34.270 1.00 0.00 N
848
+ ATOM 1687 CA VAL A 102 43.020 31.790 33.750 1.00 0.00 C
849
+ ATOM 1689 CB VAL A 102 43.310 30.400 32.990 1.00 0.00 C
850
+ ATOM 1691 CG1 VAL A 102 42.030 29.760 32.550 1.00 0.00 C
851
+ ATOM 1695 CG2 VAL A 102 44.190 30.570 31.760 1.00 0.00 C
852
+ ATOM 1699 C VAL A 102 42.090 31.540 34.910 1.00 0.00 C
853
+ ATOM 1700 O VAL A 102 40.890 31.750 34.790 1.00 0.00 O
854
+ ATOM 1701 N ALA A 103 42.580 31.090 36.120 1.00 0.00 N
855
+ ATOM 1703 CA ALA A 103 41.720 30.850 37.300 1.00 0.00 C
856
+ ATOM 1705 CB ALA A 103 42.200 29.750 38.250 1.00 0.00 C
857
+ ATOM 1709 C ALA A 103 41.330 32.100 38.050 1.00 0.00 C
858
+ ATOM 1710 O ALA A 103 40.300 32.120 38.730 1.00 0.00 O
859
+ ATOM 1711 N VAL A 104 42.070 33.280 37.920 1.00 0.00 N
860
+ ATOM 1713 CA VAL A 104 41.600 34.490 38.450 1.00 0.00 C
861
+ ATOM 1715 CB VAL A 104 42.770 35.480 38.380 1.00 0.00 C
862
+ ATOM 1717 CG1 VAL A 104 42.250 36.920 38.670 1.00 0.00 C
863
+ ATOM 1721 CG2 VAL A 104 43.790 34.970 39.360 1.00 0.00 C
864
+ ATOM 1725 C VAL A 104 40.480 35.040 37.610 1.00 0.00 C
865
+ ATOM 1726 O VAL A 104 39.410 35.510 38.060 1.00 0.00 O
866
+ ATOM 1727 N VAL A 105 40.680 34.990 36.290 1.00 0.00 N
867
+ ATOM 1729 CA VAL A 105 39.710 35.430 35.280 1.00 0.00 C
868
+ ATOM 1731 CB VAL A 105 40.340 35.220 33.910 1.00 0.00 C
869
+ ATOM 1733 CG1 VAL A 105 39.250 35.390 32.780 1.00 0.00 C
870
+ ATOM 1737 CG2 VAL A 105 41.370 36.380 33.760 1.00 0.00 C
871
+ ATOM 1741 C VAL A 105 38.290 34.740 35.450 1.00 0.00 C
872
+ ATOM 1742 O VAL A 105 37.270 35.500 35.540 1.00 0.00 O
873
+ ATOM 1743 N ILE A 106 38.300 33.380 35.650 1.00 0.00 N
874
+ ATOM 1745 CA ILE A 106 37.110 32.650 35.910 1.00 0.00 C
875
+ ATOM 1747 CB ILE A 106 37.300 31.130 35.790 1.00 0.00 C
876
+ ATOM 1749 CG2 ILE A 106 35.980 30.380 36.250 1.00 0.00 C
877
+ ATOM 1753 CG1 ILE A 106 37.780 30.720 34.430 1.00 0.00 C
878
+ ATOM 1756 CD1 ILE A 106 38.230 29.270 34.310 1.00 0.00 C
879
+ ATOM 1760 C ILE A 106 36.440 32.970 37.250 1.00 0.00 C
880
+ ATOM 1761 O ILE A 106 35.250 33.180 37.410 1.00 0.00 O
881
+ ATOM 1762 N SER A 107 37.250 32.990 38.330 1.00 0.00 N
882
+ ATOM 1764 CA SER A 107 36.780 33.320 39.700 1.00 0.00 C
883
+ ATOM 1766 CB SER A 107 37.980 33.390 40.690 1.00 0.00 C
884
+ ATOM 1769 OG SER A 107 38.570 32.150 40.970 1.00 0.00 O
885
+ ATOM 1771 C SER A 107 36.070 34.690 39.800 1.00 0.00 C
886
+ ATOM 1772 O SER A 107 34.960 34.760 40.280 1.00 0.00 O
887
+ ATOM 1773 N ASN A 108 36.670 35.720 39.230 1.00 0.00 N
888
+ ATOM 1775 CA ASN A 108 36.120 37.060 39.140 1.00 0.00 C
889
+ ATOM 1777 CB ASN A 108 37.090 38.040 38.320 1.00 0.00 C
890
+ ATOM 1780 CG ASN A 108 38.190 38.540 39.300 1.00 0.00 C
891
+ ATOM 1781 OD1 ASN A 108 38.180 38.290 40.510 1.00 0.00 O
892
+ ATOM 1782 ND2 ASN A 108 39.190 39.180 38.680 1.00 0.00 N
893
+ ATOM 1785 C ASN A 108 34.740 37.130 38.440 1.00 0.00 C
894
+ ATOM 1786 O ASN A 108 33.790 37.800 38.900 1.00 0.00 O
895
+ ATOM 1787 N CYS A 109 34.610 36.510 37.270 1.00 0.00 N
896
+ ATOM 1789 CA CYS A 109 33.390 36.420 36.470 1.00 0.00 C
897
+ ATOM 1791 CB CYS A 109 33.750 35.790 35.080 1.00 0.00 C
898
+ ATOM 1794 SG CYS A 109 32.520 36.040 33.780 1.00 0.00 S
899
+ ATOM 1796 C CYS A 109 32.270 35.610 37.140 1.00 0.00 C
900
+ ATOM 1797 O CYS A 109 31.060 35.890 37.020 1.00 0.00 O
901
+ ATOM 1798 N LEU A 110 32.650 34.500 37.900 1.00 0.00 N
902
+ ATOM 1800 CA LEU A 110 31.710 33.830 38.840 1.00 0.00 C
903
+ ATOM 1802 CB LEU A 110 32.250 32.430 39.370 1.00 0.00 C
904
+ ATOM 1805 CG LEU A 110 32.480 31.370 38.340 1.00 0.00 C
905
+ ATOM 1807 CD1 LEU A 110 33.360 30.300 39.020 1.00 0.00 C
906
+ ATOM 1811 CD2 LEU A 110 31.210 30.750 37.920 1.00 0.00 C
907
+ ATOM 1815 C LEU A 110 31.290 34.660 40.000 1.00 0.00 C
908
+ ATOM 1816 O LEU A 110 30.110 34.680 40.370 1.00 0.00 O
909
+ ATOM 1817 N ARG A 111 32.170 35.420 40.650 1.00 0.00 N
910
+ ATOM 1819 CA ARG A 111 31.930 36.340 41.760 1.00 0.00 C
911
+ ATOM 1821 CB ARG A 111 33.270 36.860 42.380 1.00 0.00 C
912
+ ATOM 1824 CG ARG A 111 32.960 37.570 43.690 1.00 0.00 C
913
+ ATOM 1827 CD ARG A 111 34.220 38.200 44.310 1.00 0.00 C
914
+ ATOM 1830 NE ARG A 111 33.720 38.990 45.520 1.00 0.00 N
915
+ ATOM 1832 CZ ARG A 111 34.390 40.140 45.890 1.00 0.00 C
916
+ ATOM 1833 NH1 ARG A 111 35.580 40.380 45.460 1.00 0.00 N
917
+ ATOM 1836 NH2 ARG A 111 33.760 41.030 46.640 1.00 0.00 N
918
+ ATOM 1839 C ARG A 111 30.930 37.470 41.250 1.00 0.00 C
919
+ ATOM 1840 O ARG A 111 30.020 37.850 41.960 1.00 0.00 O
920
+ ATOM 1841 N GLU A 112 31.190 37.990 40.010 1.00 0.00 N
921
+ ATOM 1843 CA GLU A 112 30.310 38.960 39.320 1.00 0.00 C
922
+ ATOM 1845 CB GLU A 112 30.940 39.340 37.910 1.00 0.00 C
923
+ ATOM 1848 CG GLU A 112 30.190 40.480 37.230 1.00 0.00 C
924
+ ATOM 1851 CD GLU A 112 30.340 41.810 37.980 1.00 0.00 C
925
+ ATOM 1852 OE1 GLU A 112 31.070 41.880 39.040 1.00 0.00 O
926
+ ATOM 1853 OE2 GLU A 112 29.820 42.850 37.510 1.00 0.00 O
927
+ ATOM 1854 C GLU A 112 28.890 38.470 39.030 1.00 0.00 C
928
+ ATOM 1855 O GLU A 112 27.940 39.140 39.260 1.00 0.00 O
929
+ ATOM 1856 N GLU A 113 28.750 37.140 38.650 1.00 0.00 N
930
+ ATOM 1858 CA GLU A 113 27.420 36.510 38.620 1.00 0.00 C
931
+ ATOM 1860 CB GLU A 113 27.310 35.110 37.970 1.00 0.00 C
932
+ ATOM 1863 CG GLU A 113 27.870 35.050 36.470 1.00 0.00 C
933
+ ATOM 1866 CD GLU A 113 27.980 33.610 35.870 1.00 0.00 C
934
+ ATOM 1867 OE1 GLU A 113 27.750 32.650 36.620 1.00 0.00 O
935
+ ATOM 1868 OE2 GLU A 113 28.470 33.500 34.750 1.00 0.00 O
936
+ ATOM 1869 C GLU A 113 26.610 36.460 39.900 1.00 0.00 C
937
+ ATOM 1870 O GLU A 113 25.440 36.910 39.870 1.00 0.00 O
938
+ ATOM 1871 N ARG A 114 27.280 36.080 41.050 1.00 0.00 N
939
+ ATOM 1873 CA ARG A 114 26.720 36.260 42.340 1.00 0.00 C
940
+ ATOM 1875 CB ARG A 114 27.650 35.640 43.380 1.00 0.00 C
941
+ ATOM 1878 CG ARG A 114 27.830 34.150 43.120 1.00 0.00 C
942
+ ATOM 1881 CD ARG A 114 28.600 33.420 44.230 1.00 0.00 C
943
+ ATOM 1884 NE ARG A 114 29.870 34.020 44.550 1.00 0.00 N
944
+ ATOM 1886 CZ ARG A 114 31.110 33.610 44.160 1.00 0.00 C
945
+ ATOM 1887 NH1 ARG A 114 31.240 32.890 43.050 1.00 0.00 N
946
+ ATOM 1890 NH2 ARG A 114 32.230 33.910 44.760 1.00 0.00 N
947
+ ATOM 1893 C ARG A 114 26.270 37.720 42.710 1.00 0.00 C
948
+ ATOM 1894 O ARG A 114 25.170 37.900 43.190 1.00 0.00 O
949
+ ATOM 1895 N ARG A 115 27.080 38.750 42.310 1.00 0.00 N
950
+ ATOM 1897 CA ARG A 115 26.880 40.140 42.640 1.00 0.00 C
951
+ ATOM 1899 CB ARG A 115 28.130 40.940 42.190 1.00 0.00 C
952
+ ATOM 1902 CG ARG A 115 28.060 42.420 42.590 1.00 0.00 C
953
+ ATOM 1905 CD ARG A 115 29.080 43.320 41.920 1.00 0.00 C
954
+ ATOM 1908 NE ARG A 115 28.750 43.480 40.480 1.00 0.00 N
955
+ ATOM 1910 CZ ARG A 115 27.890 44.360 40.010 1.00 0.00 C
956
+ ATOM 1911 NH1 ARG A 115 27.000 44.970 40.670 1.00 0.00 N
957
+ ATOM 1914 NH2 ARG A 115 27.750 44.390 38.720 1.00 0.00 N
958
+ ATOM 1917 C ARG A 115 25.740 40.560 41.890 1.00 0.00 C
959
+ ATOM 1918 O ARG A 115 24.860 41.240 42.380 1.00 0.00 O
960
+ ATOM 1919 N ILE A 116 25.650 40.130 40.570 1.00 0.00 N
961
+ ATOM 1921 CA ILE A 116 24.620 40.490 39.630 1.00 0.00 C
962
+ ATOM 1923 CB ILE A 116 24.970 40.320 38.090 1.00 0.00 C
963
+ ATOM 1925 CG2 ILE A 116 23.720 40.620 37.250 1.00 0.00 C
964
+ ATOM 1929 CG1 ILE A 116 26.140 41.290 37.750 1.00 0.00 C
965
+ ATOM 1932 CD1 ILE A 116 26.590 41.430 36.310 1.00 0.00 C
966
+ ATOM 1936 C ILE A 116 23.270 39.970 39.960 1.00 0.00 C
967
+ ATOM 1937 O ILE A 116 22.220 40.600 39.980 1.00 0.00 O
968
+ ATOM 1938 N LEU A 117 23.330 38.650 40.310 1.00 0.00 N
969
+ ATOM 1940 CA LEU A 117 22.180 37.970 40.820 1.00 0.00 C
970
+ ATOM 1942 CB LEU A 117 22.500 36.430 41.010 1.00 0.00 C
971
+ ATOM 1945 CG LEU A 117 22.440 35.530 39.750 1.00 0.00 C
972
+ ATOM 1947 CD1 LEU A 117 23.010 34.100 40.090 1.00 0.00 C
973
+ ATOM 1951 CD2 LEU A 117 20.960 35.420 39.210 1.00 0.00 C
974
+ ATOM 1955 C LEU A 117 21.630 38.540 42.140 1.00 0.00 C
975
+ ATOM 1956 O LEU A 117 20.420 38.610 42.260 1.00 0.00 O
976
+ ATOM 1957 N ALA A 118 22.460 38.950 43.090 1.00 0.00 N
977
+ ATOM 1959 CA ALA A 118 22.050 39.620 44.360 1.00 0.00 C
978
+ ATOM 1961 CB ALA A 118 23.300 39.600 45.260 1.00 0.00 C
979
+ ATOM 1965 C ALA A 118 21.460 40.980 44.120 1.00 0.00 C
980
+ ATOM 1966 O ALA A 118 20.460 41.400 44.690 1.00 0.00 O
981
+ ATOM 1967 N ALA A 119 22.000 41.750 43.160 1.00 0.00 N
982
+ ATOM 1969 CA ALA A 119 21.460 43.120 42.840 1.00 0.00 C
983
+ ATOM 1971 CB ALA A 119 22.550 43.980 42.150 1.00 0.00 C
984
+ ATOM 1975 C ALA A 119 20.170 43.110 41.950 1.00 0.00 C
985
+ ATOM 1976 O ALA A 119 19.530 44.110 41.940 1.00 0.00 O
986
+ ATOM 1977 N ALA A 120 19.800 41.990 41.270 1.00 0.00 N
987
+ ATOM 1979 CA ALA A 120 18.610 41.930 40.450 1.00 0.00 C
988
+ ATOM 1981 CB ALA A 120 18.390 40.610 39.680 1.00 0.00 C
989
+ ATOM 1985 C ALA A 120 17.310 42.210 41.210 1.00 0.00 C
990
+ ATOM 1986 O ALA A 120 17.090 41.710 42.310 1.00 0.00 O
991
+ ATOM 1987 N ASN A 121 16.380 42.990 40.630 1.00 0.00 N
992
+ ATOM 1989 CA ASN A 121 15.030 43.220 41.070 1.00 0.00 C
993
+ ATOM 1991 CB ASN A 121 14.400 44.580 40.610 1.00 0.00 C
994
+ ATOM 1994 CG ASN A 121 15.180 45.870 40.970 1.00 0.00 C
995
+ ATOM 1995 OD1 ASN A 121 16.010 45.920 41.800 1.00 0.00 O
996
+ ATOM 1996 ND2 ASN A 121 15.000 47.000 40.190 1.00 0.00 N
997
+ ATOM 1999 C ASN A 121 14.120 42.050 40.600 1.00 0.00 C
998
+ ATOM 2000 O ASN A 121 14.060 41.540 39.510 1.00 0.00 O
999
+ ATOM 2001 N MET A 122 13.360 41.600 41.570 1.00 0.00 N
1000
+ ATOM 2003 CA MET A 122 12.580 40.410 41.580 1.00 0.00 C
1001
+ ATOM 2005 CB MET A 122 13.250 39.170 42.250 1.00 0.00 C
1002
+ ATOM 2008 CG MET A 122 14.750 39.080 41.830 1.00 0.00 C
1003
+ ATOM 2011 SD MET A 122 15.480 37.480 42.390 1.00 0.00 S
1004
+ ATOM 2012 CE MET A 122 14.540 36.340 41.320 1.00 0.00 C
1005
+ ATOM 2016 C MET A 122 11.250 40.640 42.320 1.00 0.00 C
1006
+ ATOM 2017 O MET A 122 11.310 41.360 43.360 1.00 0.00 O
1007
+ ATOM 2018 N PRO A 123 10.100 40.160 41.880 1.00 0.00 N
1008
+ ATOM 2019 CD PRO A 123 9.960 39.460 40.580 1.00 0.00 C
1009
+ ATOM 2022 CA PRO A 123 8.920 40.150 42.670 1.00 0.00 C
1010
+ ATOM 2024 CB PRO A 123 7.870 40.070 41.450 1.00 0.00 C
1011
+ ATOM 2027 CG PRO A 123 8.470 39.260 40.320 1.00 0.00 C
1012
+ ATOM 2030 C PRO A 123 8.740 38.950 43.600 1.00 0.00 C
1013
+ ATOM 2031 O PRO A 123 9.370 37.900 43.300 1.00 0.00 O
1014
+ ATOM 2032 N ILE A 124 8.050 39.220 44.760 1.00 0.00 N
1015
+ ATOM 2034 CA ILE A 124 7.990 38.280 45.910 1.00 0.00 C
1016
+ ATOM 2036 CB ILE A 124 8.250 39.000 47.260 1.00 0.00 C
1017
+ ATOM 2038 CG2 ILE A 124 7.940 38.120 48.490 1.00 0.00 C
1018
+ ATOM 2042 CG1 ILE A 124 9.690 39.540 47.400 1.00 0.00 C
1019
+ ATOM 2045 CD1 ILE A 124 10.880 38.580 47.070 1.00 0.00 C
1020
+ ATOM 2049 C ILE A 124 6.590 37.510 45.910 1.00 0.00 C
1021
+ ATOM 2050 O ILE A 124 6.450 36.330 45.620 1.00 0.00 O
1022
+ ATOM 2051 OXT ILE A 124 5.580 38.250 46.230 1.00 0.00 O
1023
+ TER 2052 ILE A 124
1024
+ ENDMDL
1025
+ END
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The diff for this file is too large to render. See raw diff
 
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The diff for this file is too large to render. See raw diff
 
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+ "heavy_chain_pdb": "/raid_zoe/home/lr/wangyi/p/atlas_h5_fp16/1btk_A/heavy_chain.pdb",
11
+ "coords_h5": "/raid_zoe/home/lr/wangyi/p/atlas_h5_fp16/1btk_A/coords.h5",
12
+ "n_frames": 3003,
13
+ "n_heavy_atoms": 1401,
14
+ "n_replicates": 3,
15
+ "rep_names": [
16
+ "R1",
17
+ "R2",
18
+ "R3"
19
+ ],
20
+ "rep_lengths": [
21
+ 1001,
22
+ 1001,
23
+ 1001
24
+ ],
25
+ "frame_order": "R1_then_R2_then_R3",
26
+ "unit": "angstrom",
27
+ "dtype": "float16",
28
+ "compression": "gzip",
29
+ "gzip_level": 4,
30
+ "stride": 1,
31
+ "xtc_chunk": 100,
32
+ "frame_chunk": 64,
33
+ "max_frames_per_rep": null,
34
+ "center": false,
35
+ "h5_size_MB": 14.41393756866455,
36
+ "pdb_size_MB": 0.10839080810546875
37
+ }
atlas_h5_fp16/1bxy_A/heavy_chain.pdb ADDED
@@ -0,0 +1,483 @@
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
1
+ REMARK 1 CREATED WITH MDTraj 1.10.3, 2026-05-22
2
+ CRYST1 44.761 47.107 51.613 90.00 90.00 90.00 P 1 1
3
+ MODEL 0
4
+ ATOM 1 N MET A 1 30.540 13.800 14.380 1.00 0.00 N
5
+ ATOM 5 CA MET A 1 29.660 13.840 13.200 1.00 0.00 C
6
+ ATOM 7 CB MET A 1 29.990 12.670 12.240 1.00 0.00 C
7
+ ATOM 10 CG MET A 1 30.680 13.270 11.060 1.00 0.00 C
8
+ ATOM 13 SD MET A 1 29.680 14.240 9.890 1.00 0.00 S
9
+ ATOM 14 CE MET A 1 28.630 13.000 9.130 1.00 0.00 C
10
+ ATOM 18 C MET A 1 28.130 13.830 13.590 1.00 0.00 C
11
+ ATOM 19 O MET A 1 27.550 14.890 13.430 1.00 0.00 O
12
+ ATOM 20 N PRO A 2 27.490 12.810 14.220 1.00 0.00 N
13
+ ATOM 21 CD PRO A 2 28.080 11.510 14.530 1.00 0.00 C
14
+ ATOM 24 CA PRO A 2 26.170 12.910 14.830 1.00 0.00 C
15
+ ATOM 26 CB PRO A 2 26.060 11.560 15.580 1.00 0.00 C
16
+ ATOM 29 CG PRO A 2 27.500 11.140 15.840 1.00 0.00 C
17
+ ATOM 32 C PRO A 2 26.040 14.080 15.830 1.00 0.00 C
18
+ ATOM 33 O PRO A 2 27.100 14.480 16.340 1.00 0.00 O
19
+ ATOM 34 N ARG A 3 24.830 14.540 16.000 1.00 0.00 N
20
+ ATOM 36 CA ARG A 3 24.580 15.790 16.570 1.00 0.00 C
21
+ ATOM 38 CB ARG A 3 24.330 16.850 15.550 1.00 0.00 C
22
+ ATOM 41 CG ARG A 3 25.520 17.560 14.830 1.00 0.00 C
23
+ ATOM 44 CD ARG A 3 25.270 18.070 13.380 1.00 0.00 C
24
+ ATOM 47 NE ARG A 3 26.360 19.020 13.050 1.00 0.00 N
25
+ ATOM 49 CZ ARG A 3 27.680 18.800 12.760 1.00 0.00 C
26
+ ATOM 50 NH1 ARG A 3 28.230 17.590 12.700 1.00 0.00 N
27
+ ATOM 53 NH2 ARG A 3 28.480 19.840 12.660 1.00 0.00 N
28
+ ATOM 56 C ARG A 3 23.470 15.800 17.570 1.00 0.00 C
29
+ ATOM 57 O ARG A 3 22.570 14.950 17.710 1.00 0.00 O
30
+ ATOM 58 N LEU A 4 23.420 16.910 18.380 1.00 0.00 N
31
+ ATOM 60 CA LEU A 4 22.390 17.140 19.370 1.00 0.00 C
32
+ ATOM 62 CB LEU A 4 22.960 17.160 20.800 1.00 0.00 C
33
+ ATOM 65 CG LEU A 4 23.240 15.800 21.470 1.00 0.00 C
34
+ ATOM 67 CD1 LEU A 4 23.920 15.990 22.810 1.00 0.00 C
35
+ ATOM 71 CD2 LEU A 4 22.010 14.880 21.630 1.00 0.00 C
36
+ ATOM 75 C LEU A 4 21.920 18.540 19.070 1.00 0.00 C
37
+ ATOM 76 O LEU A 4 22.720 19.520 18.880 1.00 0.00 O
38
+ ATOM 77 N LYS A 5 20.620 18.700 18.900 1.00 0.00 N
39
+ ATOM 79 CA LYS A 5 19.980 19.980 18.770 1.00 0.00 C
40
+ ATOM 81 CB LYS A 5 18.820 19.990 17.680 1.00 0.00 C
41
+ ATOM 84 CG LYS A 5 18.160 21.390 17.420 1.00 0.00 C
42
+ ATOM 87 CD LYS A 5 16.960 21.440 16.440 1.00 0.00 C
43
+ ATOM 90 CE LYS A 5 15.770 20.570 16.710 1.00 0.00 C
44
+ ATOM 93 NZ LYS A 5 14.980 20.960 17.860 1.00 0.00 N
45
+ ATOM 97 C LYS A 5 19.410 20.310 20.160 1.00 0.00 C
46
+ ATOM 98 O LYS A 5 18.700 19.520 20.710 1.00 0.00 O
47
+ ATOM 99 N VAL A 6 19.790 21.520 20.690 1.00 0.00 N
48
+ ATOM 101 CA VAL A 6 19.450 21.870 22.070 1.00 0.00 C
49
+ ATOM 103 CB VAL A 6 20.730 21.570 22.890 1.00 0.00 C
50
+ ATOM 105 CG1 VAL A 6 20.710 22.400 24.170 1.00 0.00 C
51
+ ATOM 109 CG2 VAL A 6 20.890 19.990 23.080 1.00 0.00 C
52
+ ATOM 113 C VAL A 6 18.800 23.200 22.100 1.00 0.00 C
53
+ ATOM 114 O VAL A 6 19.280 24.150 21.450 1.00 0.00 O
54
+ ATOM 115 N LYS A 7 17.620 23.310 22.680 1.00 0.00 N
55
+ ATOM 117 CA LYS A 7 16.900 24.540 22.810 1.00 0.00 C
56
+ ATOM 119 CB LYS A 7 15.410 24.210 22.510 1.00 0.00 C
57
+ ATOM 122 CG LYS A 7 14.670 25.510 22.110 1.00 0.00 C
58
+ ATOM 125 CD LYS A 7 13.320 25.190 21.530 1.00 0.00 C
59
+ ATOM 128 CE LYS A 7 12.510 26.440 21.270 1.00 0.00 C
60
+ ATOM 131 NZ LYS A 7 11.090 26.130 20.820 1.00 0.00 N
61
+ ATOM 135 C LYS A 7 16.940 24.990 24.290 1.00 0.00 C
62
+ ATOM 136 O LYS A 7 16.600 24.260 25.260 1.00 0.00 O
63
+ ATOM 137 N LEU A 8 17.410 26.200 24.580 1.00 0.00 N
64
+ ATOM 139 CA LEU A 8 17.190 26.880 25.870 1.00 0.00 C
65
+ ATOM 141 CB LEU A 8 18.240 27.970 26.080 1.00 0.00 C
66
+ ATOM 144 CG LEU A 8 18.200 28.800 27.360 1.00 0.00 C
67
+ ATOM 146 CD1 LEU A 8 18.190 27.940 28.650 1.00 0.00 C
68
+ ATOM 150 CD2 LEU A 8 19.370 29.810 27.440 1.00 0.00 C
69
+ ATOM 154 C LEU A 8 15.760 27.230 26.020 1.00 0.00 C
70
+ ATOM 155 O LEU A 8 15.310 28.110 25.300 1.00 0.00 O
71
+ ATOM 156 N VAL A 9 14.970 26.560 26.900 1.00 0.00 N
72
+ ATOM 158 CA VAL A 9 13.540 26.650 27.150 1.00 0.00 C
73
+ ATOM 160 CB VAL A 9 12.810 25.310 27.000 1.00 0.00 C
74
+ ATOM 162 CG1 VAL A 9 13.000 24.800 25.560 1.00 0.00 C
75
+ ATOM 166 CG2 VAL A 9 13.270 24.370 28.070 1.00 0.00 C
76
+ ATOM 170 C VAL A 9 13.160 27.380 28.440 1.00 0.00 C
77
+ ATOM 171 O VAL A 9 11.970 27.660 28.600 1.00 0.00 O
78
+ ATOM 172 N LYS A 10 14.140 27.670 29.320 1.00 0.00 N
79
+ ATOM 174 CA LYS A 10 13.830 28.410 30.580 1.00 0.00 C
80
+ ATOM 176 CB LYS A 10 13.670 27.490 31.760 1.00 0.00 C
81
+ ATOM 179 CG LYS A 10 12.370 26.660 31.770 1.00 0.00 C
82
+ ATOM 182 CD LYS A 10 12.350 25.940 33.160 1.00 0.00 C
83
+ ATOM 185 CE LYS A 10 11.950 24.510 33.100 1.00 0.00 C
84
+ ATOM 188 NZ LYS A 10 10.610 24.430 32.450 1.00 0.00 N
85
+ ATOM 192 C LYS A 10 14.930 29.460 30.950 1.00 0.00 C
86
+ ATOM 193 O LYS A 10 16.050 29.480 30.400 1.00 0.00 O
87
+ ATOM 194 N SER A 11 14.630 30.360 31.930 1.00 0.00 N
88
+ ATOM 196 CA SER A 11 15.510 31.430 32.370 1.00 0.00 C
89
+ ATOM 198 CB SER A 11 14.790 32.420 33.280 1.00 0.00 C
90
+ ATOM 201 OG SER A 11 15.510 33.610 33.680 1.00 0.00 O
91
+ ATOM 203 C SER A 11 16.710 30.960 33.170 1.00 0.00 C
92
+ ATOM 204 O SER A 11 16.530 30.540 34.290 1.00 0.00 O
93
+ ATOM 205 N PRO A 12 17.900 31.310 32.700 1.00 0.00 N
94
+ ATOM 206 CD PRO A 12 18.270 31.820 31.400 1.00 0.00 C
95
+ ATOM 209 CA PRO A 12 19.160 30.930 33.470 1.00 0.00 C
96
+ ATOM 211 CB PRO A 12 20.150 30.760 32.330 1.00 0.00 C
97
+ ATOM 214 CG PRO A 12 19.850 31.880 31.380 1.00 0.00 C
98
+ ATOM 217 C PRO A 12 19.530 32.140 34.310 1.00 0.00 C
99
+ ATOM 218 O PRO A 12 20.720 32.190 34.730 1.00 0.00 O
100
+ ATOM 219 N ILE A 13 18.690 33.100 34.670 1.00 0.00 N
101
+ ATOM 221 CA ILE A 13 19.000 34.130 35.540 1.00 0.00 C
102
+ ATOM 223 CB ILE A 13 18.030 35.310 35.520 1.00 0.00 C
103
+ ATOM 225 CG2 ILE A 13 18.420 36.370 36.610 1.00 0.00 C
104
+ ATOM 229 CG1 ILE A 13 18.010 35.940 34.050 1.00 0.00 C
105
+ ATOM 232 CD1 ILE A 13 16.990 37.040 33.760 1.00 0.00 C
106
+ ATOM 236 C ILE A 13 19.280 33.680 36.940 1.00 0.00 C
107
+ ATOM 237 O ILE A 13 18.480 32.960 37.490 1.00 0.00 O
108
+ ATOM 238 N GLY A 14 20.450 33.970 37.500 1.00 0.00 N
109
+ ATOM 240 CA GLY A 14 20.850 33.700 38.920 1.00 0.00 C
110
+ ATOM 243 C GLY A 14 21.500 32.320 39.140 1.00 0.00 C
111
+ ATOM 244 O GLY A 14 21.810 31.990 40.280 1.00 0.00 O
112
+ ATOM 245 N TYR A 15 21.600 31.550 38.050 1.00 0.00 N
113
+ ATOM 247 CA TYR A 15 22.030 30.190 38.120 1.00 0.00 C
114
+ ATOM 249 CB TYR A 15 21.720 29.280 36.850 1.00 0.00 C
115
+ ATOM 252 CG TYR A 15 20.340 28.590 36.860 1.00 0.00 C
116
+ ATOM 253 CD1 TYR A 15 19.240 29.490 36.740 1.00 0.00 C
117
+ ATOM 255 CE1 TYR A 15 17.950 28.970 36.770 1.00 0.00 C
118
+ ATOM 257 CZ TYR A 15 17.770 27.590 36.660 1.00 0.00 C
119
+ ATOM 258 OH TYR A 15 16.390 27.050 36.500 1.00 0.00 O
120
+ ATOM 260 CD2 TYR A 15 20.070 27.160 36.940 1.00 0.00 C
121
+ ATOM 262 CE2 TYR A 15 18.830 26.670 36.800 1.00 0.00 C
122
+ ATOM 264 C TYR A 15 23.540 30.100 38.650 1.00 0.00 C
123
+ ATOM 265 O TYR A 15 24.310 31.040 38.420 1.00 0.00 O
124
+ ATOM 266 N PRO A 16 23.870 29.020 39.360 1.00 0.00 N
125
+ ATOM 267 CD PRO A 16 22.930 28.200 40.010 1.00 0.00 C
126
+ ATOM 270 CA PRO A 16 25.270 28.610 39.530 1.00 0.00 C
127
+ ATOM 272 CB PRO A 16 25.200 27.150 39.920 1.00 0.00 C
128
+ ATOM 275 CG PRO A 16 23.810 27.160 40.660 1.00 0.00 C
129
+ ATOM 278 C PRO A 16 26.190 28.900 38.380 1.00 0.00 C
130
+ ATOM 279 O PRO A 16 25.930 28.750 37.150 1.00 0.00 O
131
+ ATOM 280 N LYS A 17 27.400 29.390 38.690 1.00 0.00 N
132
+ ATOM 282 CA LYS A 17 28.410 29.740 37.710 1.00 0.00 C
133
+ ATOM 284 CB LYS A 17 29.680 30.120 38.530 1.00 0.00 C
134
+ ATOM 287 CG LYS A 17 29.570 31.580 38.960 1.00 0.00 C
135
+ ATOM 290 CD LYS A 17 29.590 32.560 37.760 1.00 0.00 C
136
+ ATOM 293 CE LYS A 17 30.550 33.760 37.850 1.00 0.00 C
137
+ ATOM 296 NZ LYS A 17 31.890 33.380 38.110 1.00 0.00 N
138
+ ATOM 300 C LYS A 17 28.860 28.600 36.790 1.00 0.00 C
139
+ ATOM 301 O LYS A 17 29.050 28.790 35.590 1.00 0.00 O
140
+ ATOM 302 N ASP A 18 28.950 27.320 37.240 1.00 0.00 N
141
+ ATOM 304 CA ASP A 18 29.100 26.070 36.470 1.00 0.00 C
142
+ ATOM 306 CB ASP A 18 29.350 24.900 37.470 1.00 0.00 C
143
+ ATOM 309 CG ASP A 18 30.750 24.790 37.920 1.00 0.00 C
144
+ ATOM 310 OD1 ASP A 18 31.760 24.660 37.130 1.00 0.00 O
145
+ ATOM 311 OD2 ASP A 18 30.930 24.780 39.160 1.00 0.00 O
146
+ ATOM 312 C ASP A 18 27.910 25.760 35.560 1.00 0.00 C
147
+ ATOM 313 O ASP A 18 28.100 25.400 34.380 1.00 0.00 O
148
+ ATOM 314 N GLN A 19 26.710 26.030 36.030 1.00 0.00 N
149
+ ATOM 316 CA GLN A 19 25.580 26.080 35.120 1.00 0.00 C
150
+ ATOM 318 CB GLN A 19 24.210 25.980 35.890 1.00 0.00 C
151
+ ATOM 321 CG GLN A 19 24.040 24.570 36.520 1.00 0.00 C
152
+ ATOM 324 CD GLN A 19 22.860 24.410 37.470 1.00 0.00 C
153
+ ATOM 325 OE1 GLN A 19 22.530 25.200 38.350 1.00 0.00 O
154
+ ATOM 326 NE2 GLN A 19 22.080 23.350 37.210 1.00 0.00 N
155
+ ATOM 329 C GLN A 19 25.500 27.110 33.990 1.00 0.00 C
156
+ ATOM 330 O GLN A 19 25.340 26.810 32.820 1.00 0.00 O
157
+ ATOM 331 N LYS A 20 25.770 28.440 34.300 1.00 0.00 N
158
+ ATOM 333 CA LYS A 20 26.060 29.480 33.350 1.00 0.00 C
159
+ ATOM 335 CB LYS A 20 26.290 30.800 34.100 1.00 0.00 C
160
+ ATOM 338 CG LYS A 20 24.970 31.220 34.790 1.00 0.00 C
161
+ ATOM 341 CD LYS A 20 25.190 32.540 35.500 1.00 0.00 C
162
+ ATOM 344 CE LYS A 20 23.890 33.260 36.050 1.00 0.00 C
163
+ ATOM 347 NZ LYS A 20 24.280 34.520 36.930 1.00 0.00 N
164
+ ATOM 351 C LYS A 20 27.230 29.270 32.380 1.00 0.00 C
165
+ ATOM 352 O LYS A 20 27.120 29.510 31.170 1.00 0.00 O
166
+ ATOM 353 N ALA A 21 28.420 28.680 32.790 1.00 0.00 N
167
+ ATOM 355 CA ALA A 21 29.450 28.300 31.900 1.00 0.00 C
168
+ ATOM 357 CB ALA A 21 30.610 27.770 32.730 1.00 0.00 C
169
+ ATOM 361 C ALA A 21 29.040 27.180 30.910 1.00 0.00 C
170
+ ATOM 362 O ALA A 21 29.490 27.230 29.740 1.00 0.00 O
171
+ ATOM 363 N ALA A 22 28.250 26.210 31.330 1.00 0.00 N
172
+ ATOM 365 CA ALA A 22 27.750 25.230 30.410 1.00 0.00 C
173
+ ATOM 367 CB ALA A 22 27.040 24.210 31.230 1.00 0.00 C
174
+ ATOM 371 C ALA A 22 26.840 25.810 29.330 1.00 0.00 C
175
+ ATOM 372 O ALA A 22 27.080 25.470 28.140 1.00 0.00 O
176
+ ATOM 373 N LEU A 23 25.910 26.710 29.650 1.00 0.00 N
177
+ ATOM 375 CA LEU A 23 25.260 27.560 28.670 1.00 0.00 C
178
+ ATOM 377 CB LEU A 23 24.250 28.530 29.350 1.00 0.00 C
179
+ ATOM 380 CG LEU A 23 23.220 27.860 30.280 1.00 0.00 C
180
+ ATOM 382 CD1 LEU A 23 22.390 28.960 30.950 1.00 0.00 C
181
+ ATOM 386 CD2 LEU A 23 22.340 26.910 29.400 1.00 0.00 C
182
+ ATOM 390 C LEU A 23 26.170 28.310 27.770 1.00 0.00 C
183
+ ATOM 391 O LEU A 23 25.920 28.340 26.560 1.00 0.00 O
184
+ ATOM 392 N LYS A 24 27.260 28.930 28.370 1.00 0.00 N
185
+ ATOM 394 CA LYS A 24 28.330 29.470 27.520 1.00 0.00 C
186
+ ATOM 396 CB LYS A 24 29.440 30.190 28.460 1.00 0.00 C
187
+ ATOM 399 CG LYS A 24 28.830 31.400 29.220 1.00 0.00 C
188
+ ATOM 402 CD LYS A 24 28.420 32.530 28.330 1.00 0.00 C
189
+ ATOM 405 CE LYS A 24 28.180 33.900 29.110 1.00 0.00 C
190
+ ATOM 408 NZ LYS A 24 27.170 33.860 30.160 1.00 0.00 N
191
+ ATOM 412 C LYS A 24 29.090 28.500 26.610 1.00 0.00 C
192
+ ATOM 413 O LYS A 24 29.180 28.900 25.450 1.00 0.00 O
193
+ ATOM 414 N ALA A 25 29.560 27.340 26.990 1.00 0.00 N
194
+ ATOM 416 CA ALA A 25 30.190 26.330 26.160 1.00 0.00 C
195
+ ATOM 418 CB ALA A 25 30.360 25.130 27.170 1.00 0.00 C
196
+ ATOM 422 C ALA A 25 29.450 25.940 24.870 1.00 0.00 C
197
+ ATOM 423 O ALA A 25 30.120 25.800 23.820 1.00 0.00 O
198
+ ATOM 424 N LEU A 26 28.110 25.820 24.980 1.00 0.00 N
199
+ ATOM 426 CA LEU A 26 27.160 25.480 23.880 1.00 0.00 C
200
+ ATOM 428 CB LEU A 26 25.960 24.710 24.390 1.00 0.00 C
201
+ ATOM 431 CG LEU A 26 26.250 23.560 25.270 1.00 0.00 C
202
+ ATOM 433 CD1 LEU A 26 25.050 23.280 26.140 1.00 0.00 C
203
+ ATOM 437 CD2 LEU A 26 26.610 22.400 24.350 1.00 0.00 C
204
+ ATOM 441 C LEU A 26 26.730 26.600 23.010 1.00 0.00 C
205
+ ATOM 442 O LEU A 26 26.250 26.440 21.900 1.00 0.00 O
206
+ ATOM 443 N GLY A 27 26.890 27.830 23.500 1.00 0.00 N
207
+ ATOM 445 CA GLY A 27 26.410 29.060 22.870 1.00 0.00 C
208
+ ATOM 448 C GLY A 27 25.040 29.330 23.120 1.00 0.00 C
209
+ ATOM 449 O GLY A 27 24.350 29.840 22.230 1.00 0.00 O
210
+ ATOM 450 N LEU A 28 24.520 29.020 24.330 1.00 0.00 N
211
+ ATOM 452 CA LEU A 28 23.130 29.220 24.730 1.00 0.00 C
212
+ ATOM 454 CB LEU A 28 22.430 28.100 25.430 1.00 0.00 C
213
+ ATOM 457 CG LEU A 28 22.610 26.770 24.730 1.00 0.00 C
214
+ ATOM 459 CD1 LEU A 28 22.470 25.580 25.640 1.00 0.00 C
215
+ ATOM 463 CD2 LEU A 28 21.690 26.600 23.480 1.00 0.00 C
216
+ ATOM 467 C LEU A 28 22.970 30.590 25.500 1.00 0.00 C
217
+ ATOM 468 O LEU A 28 23.190 30.710 26.700 1.00 0.00 O
218
+ ATOM 469 N ARG A 29 22.700 31.670 24.730 1.00 0.00 N
219
+ ATOM 471 CA ARG A 29 22.620 33.020 25.150 1.00 0.00 C
220
+ ATOM 473 CB ARG A 29 23.310 34.050 24.130 1.00 0.00 C
221
+ ATOM 476 CG ARG A 29 24.860 33.840 24.050 1.00 0.00 C
222
+ ATOM 479 CD ARG A 29 25.490 33.450 22.640 1.00 0.00 C
223
+ ATOM 482 NE ARG A 29 24.990 34.350 21.630 1.00 0.00 N
224
+ ATOM 484 CZ ARG A 29 24.570 33.910 20.430 1.00 0.00 C
225
+ ATOM 485 NH1 ARG A 29 25.090 32.880 19.870 1.00 0.00 N
226
+ ATOM 488 NH2 ARG A 29 23.770 34.650 19.680 1.00 0.00 N
227
+ ATOM 491 C ARG A 29 21.210 33.600 25.330 1.00 0.00 C
228
+ ATOM 492 O ARG A 29 21.030 34.700 25.880 1.00 0.00 O
229
+ ATOM 493 N ARG A 30 20.080 33.020 24.830 1.00 0.00 N
230
+ ATOM 495 CA ARG A 30 18.760 33.610 24.880 1.00 0.00 C
231
+ ATOM 497 CB ARG A 30 18.510 34.730 23.830 1.00 0.00 C
232
+ ATOM 500 CG ARG A 30 19.110 34.560 22.500 1.00 0.00 C
233
+ ATOM 503 CD ARG A 30 18.780 35.760 21.540 1.00 0.00 C
234
+ ATOM 506 NE ARG A 30 19.610 35.620 20.340 1.00 0.00 N
235
+ ATOM 508 CZ ARG A 30 19.250 34.860 19.300 1.00 0.00 C
236
+ ATOM 509 NH1 ARG A 30 18.140 34.210 19.280 1.00 0.00 N
237
+ ATOM 512 NH2 ARG A 30 19.920 34.910 18.140 1.00 0.00 N
238
+ ATOM 515 C ARG A 30 17.690 32.520 24.880 1.00 0.00 C
239
+ ATOM 516 O ARG A 30 17.910 31.510 24.240 1.00 0.00 O
240
+ ATOM 517 N LEU A 31 16.500 32.830 25.430 1.00 0.00 N
241
+ ATOM 519 CA LEU A 31 15.260 32.030 25.420 1.00 0.00 C
242
+ ATOM 521 CB LEU A 31 14.110 32.710 26.240 1.00 0.00 C
243
+ ATOM 524 CG LEU A 31 14.410 33.000 27.750 1.00 0.00 C
244
+ ATOM 526 CD1 LEU A 31 13.270 33.760 28.450 1.00 0.00 C
245
+ ATOM 530 CD2 LEU A 31 14.640 31.650 28.550 1.00 0.00 C
246
+ ATOM 534 C LEU A 31 14.790 31.710 24.020 1.00 0.00 C
247
+ ATOM 535 O LEU A 31 14.760 32.550 23.150 1.00 0.00 O
248
+ ATOM 536 N GLN A 32 14.570 30.350 23.850 1.00 0.00 N
249
+ ATOM 538 CA GLN A 32 14.050 29.640 22.760 1.00 0.00 C
250
+ ATOM 540 CB GLN A 32 12.690 30.270 22.280 1.00 0.00 C
251
+ ATOM 543 CG GLN A 32 11.630 30.390 23.470 1.00 0.00 C
252
+ ATOM 546 CD GLN A 32 10.240 30.770 22.940 1.00 0.00 C
253
+ ATOM 547 OE1 GLN A 32 9.990 31.070 21.740 1.00 0.00 O
254
+ ATOM 548 NE2 GLN A 32 9.240 30.790 23.880 1.00 0.00 N
255
+ ATOM 551 C GLN A 32 15.030 29.490 21.650 1.00 0.00 C
256
+ ATOM 552 O GLN A 32 14.730 28.940 20.540 1.00 0.00 O
257
+ ATOM 553 N GLN A 33 16.280 29.870 21.790 1.00 0.00 N
258
+ ATOM 555 CA GLN A 33 17.280 29.600 20.770 1.00 0.00 C
259
+ ATOM 557 CB GLN A 33 18.530 30.520 20.970 1.00 0.00 C
260
+ ATOM 560 CG GLN A 33 19.800 30.280 20.190 1.00 0.00 C
261
+ ATOM 563 CD GLN A 33 20.890 31.160 20.810 1.00 0.00 C
262
+ ATOM 564 OE1 GLN A 33 21.030 31.350 21.990 1.00 0.00 O
263
+ ATOM 565 NE2 GLN A 33 21.790 31.690 20.030 1.00 0.00 N
264
+ ATOM 568 C GLN A 33 17.660 28.190 20.740 1.00 0.00 C
265
+ ATOM 569 O GLN A 33 17.930 27.620 21.780 1.00 0.00 O
266
+ ATOM 570 N GLU A 34 17.820 27.640 19.470 1.00 0.00 N
267
+ ATOM 572 CA GLU A 34 18.330 26.330 19.120 1.00 0.00 C
268
+ ATOM 574 CB GLU A 34 17.370 25.410 18.180 1.00 0.00 C
269
+ ATOM 577 CG GLU A 34 16.020 25.070 18.820 1.00 0.00 C
270
+ ATOM 580 CD GLU A 34 14.970 24.720 17.700 1.00 0.00 C
271
+ ATOM 581 OE1 GLU A 34 14.480 23.590 17.740 1.00 0.00 O
272
+ ATOM 582 OE2 GLU A 34 14.670 25.670 16.820 1.00 0.00 O
273
+ ATOM 583 C GLU A 34 19.800 26.350 18.740 1.00 0.00 C
274
+ ATOM 584 O GLU A 34 20.160 27.080 17.830 1.00 0.00 O
275
+ ATOM 585 N ARG A 35 20.580 25.410 19.280 1.00 0.00 N
276
+ ATOM 587 CA ARG A 35 21.900 25.140 18.780 1.00 0.00 C
277
+ ATOM 589 CB ARG A 35 22.890 25.430 19.940 1.00 0.00 C
278
+ ATOM 592 CG ARG A 35 23.000 26.890 20.140 1.00 0.00 C
279
+ ATOM 595 CD ARG A 35 23.800 27.650 19.090 1.00 0.00 C
280
+ ATOM 598 NE ARG A 35 25.230 27.450 19.310 1.00 0.00 N
281
+ ATOM 600 CZ ARG A 35 26.160 28.210 18.750 1.00 0.00 C
282
+ ATOM 601 NH1 ARG A 35 25.970 29.080 17.750 1.00 0.00 N
283
+ ATOM 604 NH2 ARG A 35 27.400 27.930 19.090 1.00 0.00 N
284
+ ATOM 607 C ARG A 35 22.110 23.710 18.380 1.00 0.00 C
285
+ ATOM 608 O ARG A 35 21.850 22.750 19.090 1.00 0.00 O
286
+ ATOM 609 N VAL A 36 22.500 23.400 17.100 1.00 0.00 N
287
+ ATOM 611 CA VAL A 36 22.920 22.130 16.580 1.00 0.00 C
288
+ ATOM 613 CB VAL A 36 22.620 21.810 15.090 1.00 0.00 C
289
+ ATOM 615 CG1 VAL A 36 22.790 20.330 14.820 1.00 0.00 C
290
+ ATOM 619 CG2 VAL A 36 21.140 22.190 14.770 1.00 0.00 C
291
+ ATOM 623 C VAL A 36 24.420 21.970 16.790 1.00 0.00 C
292
+ ATOM 624 O VAL A 36 25.150 22.620 16.030 1.00 0.00 O
293
+ ATOM 625 N LEU A 37 24.950 21.050 17.670 1.00 0.00 N
294
+ ATOM 627 CA LEU A 37 26.350 20.810 17.930 1.00 0.00 C
295
+ ATOM 629 CB LEU A 37 26.640 21.410 19.400 1.00 0.00 C
296
+ ATOM 632 CG LEU A 37 26.100 22.850 19.590 1.00 0.00 C
297
+ ATOM 634 CD1 LEU A 37 26.220 23.170 21.080 1.00 0.00 C
298
+ ATOM 638 CD2 LEU A 37 26.890 23.870 18.790 1.00 0.00 C
299
+ ATOM 642 C LEU A 37 26.600 19.340 17.930 1.00 0.00 C
300
+ ATOM 643 O LEU A 37 25.680 18.530 18.100 1.00 0.00 O
301
+ ATOM 644 N GLU A 38 27.860 18.920 17.830 1.00 0.00 N
302
+ ATOM 646 CA GLU A 38 28.290 17.570 17.770 1.00 0.00 C
303
+ ATOM 648 CB GLU A 38 29.790 17.400 17.520 1.00 0.00 C
304
+ ATOM 651 CG GLU A 38 30.250 17.760 16.150 1.00 0.00 C
305
+ ATOM 654 CD GLU A 38 30.620 19.290 16.080 1.00 0.00 C
306
+ ATOM 655 OE1 GLU A 38 29.980 20.020 15.310 1.00 0.00 O
307
+ ATOM 656 OE2 GLU A 38 31.580 19.740 16.750 1.00 0.00 O
308
+ ATOM 657 C GLU A 38 27.910 16.780 18.990 1.00 0.00 C
309
+ ATOM 658 O GLU A 38 28.040 17.250 20.090 1.00 0.00 O
310
+ ATOM 659 N ASP A 39 27.530 15.490 18.770 1.00 0.00 N
311
+ ATOM 661 CA ASP A 39 27.310 14.610 19.940 1.00 0.00 C
312
+ ATOM 663 CB ASP A 39 26.250 13.500 19.550 1.00 0.00 C
313
+ ATOM 666 CG ASP A 39 25.710 12.580 20.640 1.00 0.00 C
314
+ ATOM 667 OD1 ASP A 39 25.750 12.900 21.850 1.00 0.00 O
315
+ ATOM 668 OD2 ASP A 39 25.180 11.490 20.250 1.00 0.00 O
316
+ ATOM 669 C ASP A 39 28.610 13.960 20.390 1.00 0.00 C
317
+ ATOM 670 O ASP A 39 29.230 13.170 19.660 1.00 0.00 O
318
+ ATOM 671 N THR A 40 29.060 14.330 21.590 1.00 0.00 N
319
+ ATOM 673 CA THR A 40 30.410 14.020 22.080 1.00 0.00 C
320
+ ATOM 675 CB THR A 40 31.590 15.030 21.650 1.00 0.00 C
321
+ ATOM 677 OG1 THR A 40 31.840 16.090 22.520 1.00 0.00 O
322
+ ATOM 679 CG2 THR A 40 31.390 15.790 20.350 1.00 0.00 C
323
+ ATOM 683 C THR A 40 30.290 13.920 23.580 1.00 0.00 C
324
+ ATOM 684 O THR A 40 29.380 14.520 24.130 1.00 0.00 O
325
+ ATOM 685 N PRO A 41 31.100 13.180 24.300 1.00 0.00 N
326
+ ATOM 686 CD PRO A 41 32.080 12.230 23.790 1.00 0.00 C
327
+ ATOM 689 CA PRO A 41 31.120 13.130 25.750 1.00 0.00 C
328
+ ATOM 691 CB PRO A 41 32.290 12.200 26.190 1.00 0.00 C
329
+ ATOM 694 CG PRO A 41 32.540 11.390 24.950 1.00 0.00 C
330
+ ATOM 697 C PRO A 41 31.150 14.510 26.460 1.00 0.00 C
331
+ ATOM 698 O PRO A 41 30.300 14.740 27.290 1.00 0.00 O
332
+ ATOM 699 N ALA A 42 32.150 15.360 26.160 1.00 0.00 N
333
+ ATOM 701 CA ALA A 42 32.320 16.670 26.700 1.00 0.00 C
334
+ ATOM 703 CB ALA A 42 33.630 17.300 26.200 1.00 0.00 C
335
+ ATOM 707 C ALA A 42 31.130 17.620 26.380 1.00 0.00 C
336
+ ATOM 708 O ALA A 42 30.690 18.330 27.280 1.00 0.00 O
337
+ ATOM 709 N ILE A 43 30.540 17.550 25.160 1.00 0.00 N
338
+ ATOM 711 CA ILE A 43 29.330 18.310 24.830 1.00 0.00 C
339
+ ATOM 713 CB ILE A 43 28.930 18.240 23.340 1.00 0.00 C
340
+ ATOM 715 CG2 ILE A 43 27.560 18.890 23.020 1.00 0.00 C
341
+ ATOM 719 CG1 ILE A 43 30.130 18.930 22.510 1.00 0.00 C
342
+ ATOM 722 CD1 ILE A 43 30.400 20.390 22.900 1.00 0.00 C
343
+ ATOM 726 C ILE A 43 28.180 17.820 25.740 1.00 0.00 C
344
+ ATOM 727 O ILE A 43 27.490 18.620 26.420 1.00 0.00 O
345
+ ATOM 728 N ARG A 44 27.950 16.460 25.890 1.00 0.00 N
346
+ ATOM 730 CA ARG A 44 26.970 15.900 26.790 1.00 0.00 C
347
+ ATOM 732 CB ARG A 44 26.860 14.340 26.560 1.00 0.00 C
348
+ ATOM 735 CG ARG A 44 26.170 13.910 25.230 1.00 0.00 C
349
+ ATOM 738 CD ARG A 44 25.750 12.440 25.180 1.00 0.00 C
350
+ ATOM 741 NE ARG A 44 27.000 11.690 25.450 1.00 0.00 N
351
+ ATOM 743 CZ ARG A 44 27.740 11.150 24.520 1.00 0.00 C
352
+ ATOM 744 NH1 ARG A 44 27.600 11.290 23.210 1.00 0.00 N
353
+ ATOM 747 NH2 ARG A 44 28.780 10.400 24.820 1.00 0.00 N
354
+ ATOM 750 C ARG A 44 27.140 16.270 28.250 1.00 0.00 C
355
+ ATOM 751 O ARG A 44 26.210 16.460 29.000 1.00 0.00 O
356
+ ATOM 752 N GLY A 45 28.470 16.410 28.650 1.00 0.00 N
357
+ ATOM 754 CA GLY A 45 28.770 16.990 29.960 1.00 0.00 C
358
+ ATOM 757 C GLY A 45 28.170 18.350 30.230 1.00 0.00 C
359
+ ATOM 758 O GLY A 45 27.600 18.510 31.310 1.00 0.00 O
360
+ ATOM 759 N ASN A 46 28.300 19.330 29.310 1.00 0.00 N
361
+ ATOM 761 CA ASN A 46 27.690 20.640 29.510 1.00 0.00 C
362
+ ATOM 763 CB ASN A 46 28.060 21.780 28.520 1.00 0.00 C
363
+ ATOM 766 CG ASN A 46 29.550 21.720 28.280 1.00 0.00 C
364
+ ATOM 767 OD1 ASN A 46 30.290 21.950 29.230 1.00 0.00 O
365
+ ATOM 768 ND2 ASN A 46 29.910 21.460 27.030 1.00 0.00 N
366
+ ATOM 771 C ASN A 46 26.200 20.440 29.540 1.00 0.00 C
367
+ ATOM 772 O ASN A 46 25.430 21.090 30.280 1.00 0.00 O
368
+ ATOM 773 N VAL A 47 25.590 19.500 28.690 1.00 0.00 N
369
+ ATOM 775 CA VAL A 47 24.190 19.320 28.510 1.00 0.00 C
370
+ ATOM 777 CB VAL A 47 23.800 18.590 27.260 1.00 0.00 C
371
+ ATOM 779 CG1 VAL A 47 22.260 18.220 27.150 1.00 0.00 C
372
+ ATOM 783 CG2 VAL A 47 24.070 19.570 26.170 1.00 0.00 C
373
+ ATOM 787 C VAL A 47 23.460 18.800 29.720 1.00 0.00 C
374
+ ATOM 788 O VAL A 47 22.360 19.210 30.060 1.00 0.00 O
375
+ ATOM 789 N GLU A 48 24.090 17.840 30.430 1.00 0.00 N
376
+ ATOM 791 CA GLU A 48 23.720 17.280 31.670 1.00 0.00 C
377
+ ATOM 793 CB GLU A 48 24.660 16.030 32.050 1.00 0.00 C
378
+ ATOM 796 CG GLU A 48 24.780 15.700 33.540 1.00 0.00 C
379
+ ATOM 799 CD GLU A 48 25.390 14.340 33.870 1.00 0.00 C
380
+ ATOM 800 OE1 GLU A 48 25.350 13.510 32.940 1.00 0.00 O
381
+ ATOM 801 OE2 GLU A 48 25.890 14.130 34.970 1.00 0.00 O
382
+ ATOM 802 C GLU A 48 23.610 18.230 32.760 1.00 0.00 C
383
+ ATOM 803 O GLU A 48 22.610 18.240 33.460 1.00 0.00 O
384
+ ATOM 804 N LYS A 49 24.550 19.210 32.850 1.00 0.00 N
385
+ ATOM 806 CA LYS A 49 24.540 20.160 33.960 1.00 0.00 C
386
+ ATOM 808 CB LYS A 49 25.900 21.040 33.840 1.00 0.00 C
387
+ ATOM 811 CG LYS A 49 27.090 20.190 34.350 1.00 0.00 C
388
+ ATOM 814 CD LYS A 49 28.390 21.000 34.290 1.00 0.00 C
389
+ ATOM 817 CE LYS A 49 29.570 20.090 34.560 1.00 0.00 C
390
+ ATOM 820 NZ LYS A 49 30.930 20.810 34.400 1.00 0.00 N
391
+ ATOM 824 C LYS A 49 23.340 21.170 33.960 1.00 0.00 C
392
+ ATOM 825 O LYS A 49 22.900 21.660 35.010 1.00 0.00 O
393
+ ATOM 826 N VAL A 50 22.780 21.380 32.720 1.00 0.00 N
394
+ ATOM 828 CA VAL A 50 21.790 22.380 32.500 1.00 0.00 C
395
+ ATOM 830 CB VAL A 50 22.260 23.380 31.500 1.00 0.00 C
396
+ ATOM 832 CG1 VAL A 50 23.390 24.290 32.050 1.00 0.00 C
397
+ ATOM 836 CG2 VAL A 50 22.580 22.800 30.070 1.00 0.00 C
398
+ ATOM 840 C VAL A 50 20.460 21.760 32.040 1.00 0.00 C
399
+ ATOM 841 O VAL A 50 19.520 22.410 31.600 1.00 0.00 O
400
+ ATOM 842 N ALA A 51 20.310 20.400 32.300 1.00 0.00 N
401
+ ATOM 844 CA ALA A 51 19.180 19.630 31.890 1.00 0.00 C
402
+ ATOM 846 CB ALA A 51 19.370 18.210 32.510 1.00 0.00 C
403
+ ATOM 850 C ALA A 51 17.780 20.160 32.210 1.00 0.00 C
404
+ ATOM 851 O ALA A 51 16.950 20.120 31.290 1.00 0.00 O
405
+ ATOM 852 N HIS A 52 17.520 20.690 33.410 1.00 0.00 N
406
+ ATOM 854 CA HIS A 52 16.300 21.400 33.650 1.00 0.00 C
407
+ ATOM 856 CB HIS A 52 16.250 21.910 35.090 1.00 0.00 C
408
+ ATOM 859 ND1 HIS A 52 15.380 24.030 36.200 1.00 0.00 N
409
+ ATOM 860 CG HIS A 52 15.120 22.790 35.570 1.00 0.00 C
410
+ ATOM 861 CE1 HIS A 52 14.260 24.460 36.620 1.00 0.00 C
411
+ ATOM 863 NE2 HIS A 52 13.280 23.560 36.370 1.00 0.00 N
412
+ ATOM 865 CD2 HIS A 52 13.790 22.480 35.690 1.00 0.00 C
413
+ ATOM 867 C HIS A 52 16.030 22.690 32.820 1.00 0.00 C
414
+ ATOM 868 O HIS A 52 14.880 23.030 32.650 1.00 0.00 O
415
+ ATOM 869 N LEU A 53 17.050 23.350 32.250 1.00 0.00 N
416
+ ATOM 871 CA LEU A 53 16.840 24.570 31.510 1.00 0.00 C
417
+ ATOM 873 CB LEU A 53 18.110 25.400 31.660 1.00 0.00 C
418
+ ATOM 876 CG LEU A 53 18.300 26.100 33.040 1.00 0.00 C
419
+ ATOM 878 CD1 LEU A 53 19.830 26.330 33.040 1.00 0.00 C
420
+ ATOM 882 CD2 LEU A 53 17.500 27.460 33.070 1.00 0.00 C
421
+ ATOM 886 C LEU A 53 16.720 24.320 30.000 1.00 0.00 C
422
+ ATOM 887 O LEU A 53 16.140 25.170 29.320 1.00 0.00 O
423
+ ATOM 888 N VAL A 54 17.030 23.120 29.570 1.00 0.00 N
424
+ ATOM 890 CA VAL A 54 17.120 22.910 28.130 1.00 0.00 C
425
+ ATOM 892 CB VAL A 54 18.540 22.540 27.680 1.00 0.00 C
426
+ ATOM 894 CG1 VAL A 54 19.620 23.620 28.140 1.00 0.00 C
427
+ ATOM 898 CG2 VAL A 54 19.020 21.170 28.290 1.00 0.00 C
428
+ ATOM 902 C VAL A 54 16.100 21.830 27.600 1.00 0.00 C
429
+ ATOM 903 O VAL A 54 15.470 20.990 28.320 1.00 0.00 O
430
+ ATOM 904 N ARG A 55 15.910 21.860 26.210 1.00 0.00 N
431
+ ATOM 906 CA ARG A 55 15.230 20.680 25.590 1.00 0.00 C
432
+ ATOM 908 CB ARG A 55 13.860 21.130 25.090 1.00 0.00 C
433
+ ATOM 911 CG ARG A 55 12.800 19.970 24.720 1.00 0.00 C
434
+ ATOM 914 CD ARG A 55 11.430 20.450 24.180 1.00 0.00 C
435
+ ATOM 917 NE ARG A 55 10.560 19.250 24.050 1.00 0.00 N
436
+ ATOM 919 CZ ARG A 55 9.600 18.950 24.950 1.00 0.00 C
437
+ ATOM 920 NH1 ARG A 55 9.220 19.860 25.870 1.00 0.00 N
438
+ ATOM 923 NH2 ARG A 55 8.690 18.010 24.780 1.00 0.00 N
439
+ ATOM 926 C ARG A 55 16.060 20.130 24.510 1.00 0.00 C
440
+ ATOM 927 O ARG A 55 16.770 20.810 23.750 1.00 0.00 O
441
+ ATOM 928 N VAL A 56 16.150 18.780 24.430 1.00 0.00 N
442
+ ATOM 930 CA VAL A 56 17.250 18.080 23.730 1.00 0.00 C
443
+ ATOM 932 CB VAL A 56 18.000 17.260 24.700 1.00 0.00 C
444
+ ATOM 934 CG1 VAL A 56 19.020 16.430 23.930 1.00 0.00 C
445
+ ATOM 938 CG2 VAL A 56 18.810 18.260 25.630 1.00 0.00 C
446
+ ATOM 942 C VAL A 56 16.620 17.120 22.640 1.00 0.00 C
447
+ ATOM 943 O VAL A 56 15.870 16.250 23.030 1.00 0.00 O
448
+ ATOM 944 N GLU A 57 16.890 17.400 21.360 1.00 0.00 N
449
+ ATOM 946 CA GLU A 57 16.500 16.480 20.310 1.00 0.00 C
450
+ ATOM 948 CB GLU A 57 15.580 17.160 19.250 1.00 0.00 C
451
+ ATOM 951 CG GLU A 57 14.230 17.580 19.870 1.00 0.00 C
452
+ ATOM 954 CD GLU A 57 13.190 18.520 19.210 1.00 0.00 C
453
+ ATOM 955 OE1 GLU A 57 13.430 18.940 18.070 1.00 0.00 O
454
+ ATOM 956 OE2 GLU A 57 12.280 18.950 19.970 1.00 0.00 O
455
+ ATOM 957 C GLU A 57 17.740 15.890 19.610 1.00 0.00 C
456
+ ATOM 958 O GLU A 57 18.810 16.510 19.530 1.00 0.00 O
457
+ ATOM 959 N VAL A 58 17.770 14.590 19.170 1.00 0.00 N
458
+ ATOM 961 CA VAL A 58 18.960 13.960 18.520 1.00 0.00 C
459
+ ATOM 963 CB VAL A 58 19.220 12.520 18.940 1.00 0.00 C
460
+ ATOM 965 CG1 VAL A 58 20.280 11.950 18.020 1.00 0.00 C
461
+ ATOM 969 CG2 VAL A 58 19.500 12.500 20.440 1.00 0.00 C
462
+ ATOM 973 C VAL A 58 18.780 14.140 17.050 1.00 0.00 C
463
+ ATOM 974 O VAL A 58 17.760 13.910 16.400 1.00 0.00 O
464
+ ATOM 975 N VAL A 59 19.790 14.680 16.470 1.00 0.00 N
465
+ ATOM 977 CA VAL A 59 19.870 15.040 15.070 1.00 0.00 C
466
+ ATOM 979 CB VAL A 59 19.530 16.480 14.770 1.00 0.00 C
467
+ ATOM 981 CG1 VAL A 59 18.040 16.710 15.180 1.00 0.00 C
468
+ ATOM 985 CG2 VAL A 59 20.520 17.410 15.520 1.00 0.00 C
469
+ ATOM 989 C VAL A 59 21.170 14.480 14.350 1.00 0.00 C
470
+ ATOM 990 O VAL A 59 22.130 14.150 15.080 1.00 0.00 O
471
+ ATOM 991 N GLU A 60 21.200 14.390 13.030 1.00 0.00 N
472
+ ATOM 993 CA GLU A 60 22.340 13.960 12.210 1.00 0.00 C
473
+ ATOM 995 CB GLU A 60 21.920 13.010 11.080 1.00 0.00 C
474
+ ATOM 998 CG GLU A 60 21.270 11.640 11.440 1.00 0.00 C
475
+ ATOM 1001 CD GLU A 60 22.260 10.690 12.160 1.00 0.00 C
476
+ ATOM 1002 OE1 GLU A 60 23.330 10.420 11.510 1.00 0.00 O
477
+ ATOM 1003 OE2 GLU A 60 21.870 10.050 13.220 1.00 0.00 O
478
+ ATOM 1004 C GLU A 60 23.260 15.140 11.720 1.00 0.00 C
479
+ ATOM 1005 O GLU A 60 22.760 16.230 11.410 1.00 0.00 O
480
+ ATOM 1006 OXT GLU A 60 24.470 14.900 11.670 1.00 0.00 O
481
+ TER 1007 GLU A 60
482
+ ENDMDL
483
+ END
atlas_h5_fp16/1bxy_A/meta.json ADDED
@@ -0,0 +1,37 @@
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
1
+ {
2
+ "entry": "1bxy_A",
3
+ "source_dir": "/raid_zoe/home/lr/wangyi/p/atlas_1000_analysis/1bxy_A",
4
+ "source_pdb": "/raid_zoe/home/lr/wangyi/p/atlas_1000_analysis/1bxy_A/1bxy_A.pdb",
5
+ "source_xtc": [
6
+ "/raid_zoe/home/lr/wangyi/p/atlas_1000_analysis/1bxy_A/1bxy_A_R1.xtc",
7
+ "/raid_zoe/home/lr/wangyi/p/atlas_1000_analysis/1bxy_A/1bxy_A_R2.xtc",
8
+ "/raid_zoe/home/lr/wangyi/p/atlas_1000_analysis/1bxy_A/1bxy_A_R3.xtc"
9
+ ],
10
+ "heavy_chain_pdb": "/raid_zoe/home/lr/wangyi/p/atlas_h5_fp16/1bxy_A/heavy_chain.pdb",
11
+ "coords_h5": "/raid_zoe/home/lr/wangyi/p/atlas_h5_fp16/1bxy_A/coords.h5",
12
+ "n_frames": 3003,
13
+ "n_heavy_atoms": 477,
14
+ "n_replicates": 3,
15
+ "rep_names": [
16
+ "R1",
17
+ "R2",
18
+ "R3"
19
+ ],
20
+ "rep_lengths": [
21
+ 1001,
22
+ 1001,
23
+ 1001
24
+ ],
25
+ "frame_order": "R1_then_R2_then_R3",
26
+ "unit": "angstrom",
27
+ "dtype": "float16",
28
+ "compression": "gzip",
29
+ "gzip_level": 4,
30
+ "stride": 1,
31
+ "xtc_chunk": 100,
32
+ "frame_chunk": 64,
33
+ "max_frames_per_rep": null,
34
+ "center": false,
35
+ "h5_size_MB": 4.9127607345581055,
36
+ "pdb_size_MB": 0.037014007568359375
37
+ }
atlas_h5_fp16/1c52_A/heavy_chain.pdb ADDED
@@ -0,0 +1,1004 @@
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
1
+ REMARK 1 CREATED WITH MDTraj 1.10.3, 2026-05-22
2
+ CRYST1 58.699 56.118 60.201 90.00 90.00 90.00 P 1 1
3
+ MODEL 0
4
+ ATOM 1 N GLN A 1 47.900 17.340 29.360 1.00 0.00 N
5
+ ATOM 5 CA GLN A 1 46.630 16.670 29.650 1.00 0.00 C
6
+ ATOM 7 CB GLN A 1 46.660 16.030 31.140 1.00 0.00 C
7
+ ATOM 10 CG GLN A 1 45.860 14.800 31.510 1.00 0.00 C
8
+ ATOM 13 CD GLN A 1 45.750 13.710 30.400 1.00 0.00 C
9
+ ATOM 14 OE1 GLN A 1 45.430 13.900 29.240 1.00 0.00 O
10
+ ATOM 15 NE2 GLN A 1 46.050 12.450 30.840 1.00 0.00 N
11
+ ATOM 18 C GLN A 1 45.350 17.420 29.370 1.00 0.00 C
12
+ ATOM 19 O GLN A 1 45.420 18.260 28.480 1.00 0.00 O
13
+ ATOM 20 N ALA A 2 44.230 17.310 30.120 1.00 0.00 N
14
+ ATOM 22 CA ALA A 2 43.000 18.060 29.920 1.00 0.00 C
15
+ ATOM 24 CB ALA A 2 43.090 19.610 30.180 1.00 0.00 C
16
+ ATOM 28 C ALA A 2 42.250 17.710 28.630 1.00 0.00 C
17
+ ATOM 29 O ALA A 2 42.280 18.380 27.580 1.00 0.00 O
18
+ ATOM 30 N ASP A 3 41.550 16.620 28.590 1.00 0.00 N
19
+ ATOM 32 CA ASP A 3 40.660 16.190 27.510 1.00 0.00 C
20
+ ATOM 34 CB ASP A 3 40.620 14.650 27.230 1.00 0.00 C
21
+ ATOM 37 CG ASP A 3 39.720 14.120 26.250 1.00 0.00 C
22
+ ATOM 38 OD1 ASP A 3 39.280 14.900 25.370 1.00 0.00 O
23
+ ATOM 39 OD2 ASP A 3 39.520 12.890 26.210 1.00 0.00 O
24
+ ATOM 40 C ASP A 3 39.320 16.750 27.870 1.00 0.00 C
25
+ ATOM 41 O ASP A 3 38.760 16.460 28.920 1.00 0.00 O
26
+ ATOM 42 N GLY A 4 38.710 17.610 27.030 1.00 0.00 N
27
+ ATOM 44 CA GLY A 4 37.340 18.180 27.370 1.00 0.00 C
28
+ ATOM 47 C GLY A 4 36.200 17.270 27.170 1.00 0.00 C
29
+ ATOM 48 O GLY A 4 35.220 17.490 27.880 1.00 0.00 O
30
+ ATOM 49 N ALA A 5 36.250 16.200 26.380 1.00 0.00 N
31
+ ATOM 51 CA ALA A 5 35.170 15.290 26.330 1.00 0.00 C
32
+ ATOM 53 CB ALA A 5 35.220 14.380 25.150 1.00 0.00 C
33
+ ATOM 57 C ALA A 5 35.070 14.350 27.500 1.00 0.00 C
34
+ ATOM 58 O ALA A 5 34.020 13.880 27.900 1.00 0.00 O
35
+ ATOM 59 N LYS A 6 36.230 14.220 28.160 1.00 0.00 N
36
+ ATOM 61 CA LYS A 6 36.300 13.450 29.440 1.00 0.00 C
37
+ ATOM 63 CB LYS A 6 37.750 12.900 29.540 1.00 0.00 C
38
+ ATOM 66 CG LYS A 6 37.870 11.790 30.590 1.00 0.00 C
39
+ ATOM 69 CD LYS A 6 37.010 10.550 30.270 1.00 0.00 C
40
+ ATOM 72 CE LYS A 6 37.250 9.430 31.330 1.00 0.00 C
41
+ ATOM 75 NZ LYS A 6 36.650 8.180 30.910 1.00 0.00 N
42
+ ATOM 79 C LYS A 6 35.940 14.300 30.660 1.00 0.00 C
43
+ ATOM 80 O LYS A 6 35.280 13.870 31.580 1.00 0.00 O
44
+ ATOM 81 N ILE A 7 36.220 15.570 30.640 1.00 0.00 N
45
+ ATOM 83 CA ILE A 7 35.750 16.510 31.650 1.00 0.00 C
46
+ ATOM 85 CB ILE A 7 36.580 17.800 31.690 1.00 0.00 C
47
+ ATOM 87 CG2 ILE A 7 36.260 18.840 32.800 1.00 0.00 C
48
+ ATOM 91 CG1 ILE A 7 38.090 17.510 31.870 1.00 0.00 C
49
+ ATOM 94 CD1 ILE A 7 38.930 18.560 31.200 1.00 0.00 C
50
+ ATOM 98 C ILE A 7 34.190 16.770 31.370 1.00 0.00 C
51
+ ATOM 99 O ILE A 7 33.390 17.050 32.230 1.00 0.00 O
52
+ ATOM 100 N TYR A 8 33.650 16.650 30.090 1.00 0.00 N
53
+ ATOM 102 CA TYR A 8 32.310 16.850 29.700 1.00 0.00 C
54
+ ATOM 104 CB TYR A 8 32.170 17.090 28.150 1.00 0.00 C
55
+ ATOM 107 CG TYR A 8 30.750 17.440 27.770 1.00 0.00 C
56
+ ATOM 108 CD1 TYR A 8 30.190 18.640 28.250 1.00 0.00 C
57
+ ATOM 110 CE1 TYR A 8 28.870 18.910 27.960 1.00 0.00 C
58
+ ATOM 112 CZ TYR A 8 28.040 18.000 27.250 1.00 0.00 C
59
+ ATOM 113 OH TYR A 8 26.650 18.370 27.080 1.00 0.00 O
60
+ ATOM 115 CD2 TYR A 8 29.940 16.530 27.010 1.00 0.00 C
61
+ ATOM 117 CE2 TYR A 8 28.570 16.850 26.730 1.00 0.00 C
62
+ ATOM 119 C TYR A 8 31.450 15.750 30.250 1.00 0.00 C
63
+ ATOM 120 O TYR A 8 30.310 16.010 30.420 1.00 0.00 O
64
+ ATOM 121 N ALA A 9 32.070 14.580 30.500 1.00 0.00 N
65
+ ATOM 123 CA ALA A 9 31.410 13.490 31.200 1.00 0.00 C
66
+ ATOM 125 CB ALA A 9 32.520 12.550 31.620 1.00 0.00 C
67
+ ATOM 129 C ALA A 9 30.680 13.880 32.410 1.00 0.00 C
68
+ ATOM 130 O ALA A 9 29.510 13.530 32.620 1.00 0.00 O
69
+ ATOM 131 N GLN A 10 31.250 14.760 33.180 1.00 0.00 N
70
+ ATOM 133 CA GLN A 10 30.720 15.290 34.400 1.00 0.00 C
71
+ ATOM 135 CB GLN A 10 31.910 15.890 35.110 1.00 0.00 C
72
+ ATOM 138 CG GLN A 10 33.380 15.370 35.130 1.00 0.00 C
73
+ ATOM 141 CD GLN A 10 34.360 16.200 35.980 1.00 0.00 C
74
+ ATOM 142 OE1 GLN A 10 33.970 16.740 37.010 1.00 0.00 O
75
+ ATOM 143 NE2 GLN A 10 35.610 16.340 35.480 1.00 0.00 N
76
+ ATOM 146 C GLN A 10 29.560 16.350 34.230 1.00 0.00 C
77
+ ATOM 147 O GLN A 10 28.940 16.710 35.220 1.00 0.00 O
78
+ ATOM 148 N CYS A 11 29.330 16.930 33.040 1.00 0.00 N
79
+ ATOM 150 CA CYS A 11 28.150 17.790 32.800 1.00 0.00 C
80
+ ATOM 152 CB CYS A 11 28.620 19.020 31.980 1.00 0.00 C
81
+ ATOM 155 SG CYS A 11 30.090 19.950 32.610 1.00 0.00 S
82
+ ATOM 157 C CYS A 11 27.150 17.060 31.950 1.00 0.00 C
83
+ ATOM 158 O CYS A 11 26.010 17.520 31.780 1.00 0.00 O
84
+ ATOM 159 N ALA A 12 27.460 15.890 31.450 1.00 0.00 N
85
+ ATOM 161 CA ALA A 12 26.740 15.150 30.450 1.00 0.00 C
86
+ ATOM 163 CB ALA A 12 27.650 14.010 29.820 1.00 0.00 C
87
+ ATOM 167 C ALA A 12 25.560 14.530 31.110 1.00 0.00 C
88
+ ATOM 168 O ALA A 12 24.580 14.140 30.460 1.00 0.00 O
89
+ ATOM 169 N GLY A 13 25.490 14.460 32.440 1.00 0.00 N
90
+ ATOM 171 CA GLY A 13 24.310 14.060 33.260 1.00 0.00 C
91
+ ATOM 174 C GLY A 13 23.190 15.040 33.280 1.00 0.00 C
92
+ ATOM 175 O GLY A 13 22.150 14.660 33.750 1.00 0.00 O
93
+ ATOM 176 N CYS A 14 23.500 16.340 32.930 1.00 0.00 N
94
+ ATOM 178 CA CYS A 14 22.510 17.380 32.900 1.00 0.00 C
95
+ ATOM 180 CB CYS A 14 22.890 18.630 33.720 1.00 0.00 C
96
+ ATOM 183 SG CYS A 14 23.200 18.230 35.430 1.00 0.00 S
97
+ ATOM 185 C CYS A 14 22.260 17.880 31.430 1.00 0.00 C
98
+ ATOM 186 O CYS A 14 21.080 18.060 31.040 1.00 0.00 O
99
+ ATOM 187 N HIS A 15 23.310 18.210 30.640 1.00 0.00 N
100
+ ATOM 189 CA HIS A 15 23.090 18.950 29.430 1.00 0.00 C
101
+ ATOM 191 CB HIS A 15 24.150 19.980 29.210 1.00 0.00 C
102
+ ATOM 194 ND1 HIS A 15 23.140 21.850 30.460 1.00 0.00 N
103
+ ATOM 196 CG HIS A 15 24.190 21.020 30.190 1.00 0.00 C
104
+ ATOM 197 CE1 HIS A 15 23.460 22.440 31.650 1.00 0.00 C
105
+ ATOM 199 NE2 HIS A 15 24.660 22.160 32.090 1.00 0.00 N
106
+ ATOM 200 CD2 HIS A 15 25.110 21.220 31.220 1.00 0.00 C
107
+ ATOM 202 C HIS A 15 23.080 17.970 28.260 1.00 0.00 C
108
+ ATOM 203 O HIS A 15 22.750 18.340 27.110 1.00 0.00 O
109
+ ATOM 204 N GLN A 16 23.500 16.760 28.570 1.00 0.00 N
110
+ ATOM 206 CA GLN A 16 23.500 15.550 27.700 1.00 0.00 C
111
+ ATOM 208 CB GLN A 16 22.110 15.280 27.070 1.00 0.00 C
112
+ ATOM 211 CG GLN A 16 20.910 15.220 28.040 1.00 0.00 C
113
+ ATOM 214 CD GLN A 16 20.840 14.080 28.990 1.00 0.00 C
114
+ ATOM 215 OE1 GLN A 16 20.830 14.250 30.250 1.00 0.00 O
115
+ ATOM 216 NE2 GLN A 16 20.840 12.810 28.510 1.00 0.00 N
116
+ ATOM 219 C GLN A 16 24.690 15.420 26.640 1.00 0.00 C
117
+ ATOM 220 O GLN A 16 25.260 16.390 26.130 1.00 0.00 O
118
+ ATOM 221 N GLN A 17 25.120 14.210 26.250 1.00 0.00 N
119
+ ATOM 223 CA GLN A 17 26.130 14.080 25.210 1.00 0.00 C
120
+ ATOM 225 CB GLN A 17 26.380 12.500 24.910 1.00 0.00 C
121
+ ATOM 228 CG GLN A 17 27.240 11.710 26.030 1.00 0.00 C
122
+ ATOM 231 CD GLN A 17 28.620 12.400 26.320 1.00 0.00 C
123
+ ATOM 232 OE1 GLN A 17 29.000 13.370 25.630 1.00 0.00 O
124
+ ATOM 233 NE2 GLN A 17 29.360 11.880 27.300 1.00 0.00 N
125
+ ATOM 236 C GLN A 17 25.910 14.730 23.900 1.00 0.00 C
126
+ ATOM 237 O GLN A 17 26.860 15.180 23.260 1.00 0.00 O
127
+ ATOM 238 N ASN A 18 24.680 14.870 23.490 1.00 0.00 N
128
+ ATOM 240 CA ASN A 18 24.260 15.530 22.250 1.00 0.00 C
129
+ ATOM 242 CB ASN A 18 22.850 14.860 21.930 1.00 0.00 C
130
+ ATOM 245 CG ASN A 18 21.840 14.840 23.070 1.00 0.00 C
131
+ ATOM 246 OD1 ASN A 18 21.770 15.740 23.890 1.00 0.00 O
132
+ ATOM 247 ND2 ASN A 18 20.960 13.830 23.120 1.00 0.00 N
133
+ ATOM 250 C ASN A 18 24.080 17.030 22.410 1.00 0.00 C
134
+ ATOM 251 O ASN A 18 23.810 17.760 21.430 1.00 0.00 O
135
+ ATOM 252 N GLY A 19 24.160 17.530 23.660 1.00 0.00 N
136
+ ATOM 254 CA GLY A 19 24.210 18.960 24.020 1.00 0.00 C
137
+ ATOM 257 C GLY A 19 22.830 19.590 23.970 1.00 0.00 C
138
+ ATOM 258 O GLY A 19 22.700 20.810 23.860 1.00 0.00 O
139
+ ATOM 259 N GLN A 20 21.750 18.830 24.040 1.00 0.00 N
140
+ ATOM 261 CA GLN A 20 20.380 19.260 23.760 1.00 0.00 C
141
+ ATOM 263 CB GLN A 20 19.520 18.310 22.810 1.00 0.00 C
142
+ ATOM 266 CG GLN A 20 20.180 18.160 21.420 1.00 0.00 C
143
+ ATOM 269 CD GLN A 20 19.230 17.520 20.360 1.00 0.00 C
144
+ ATOM 270 OE1 GLN A 20 18.050 17.500 20.600 1.00 0.00 O
145
+ ATOM 271 NE2 GLN A 20 19.810 17.120 19.260 1.00 0.00 N
146
+ ATOM 274 C GLN A 20 19.600 19.550 25.010 1.00 0.00 C
147
+ ATOM 275 O GLN A 20 18.490 19.960 24.890 1.00 0.00 O
148
+ ATOM 276 N GLY A 21 20.210 19.220 26.180 1.00 0.00 N
149
+ ATOM 278 CA GLY A 21 19.560 19.420 27.480 1.00 0.00 C
150
+ ATOM 281 C GLY A 21 18.400 18.530 27.620 1.00 0.00 C
151
+ ATOM 282 O GLY A 21 18.070 17.600 26.810 1.00 0.00 O
152
+ ATOM 283 N ILE A 22 17.620 18.880 28.680 1.00 0.00 N
153
+ ATOM 285 CA ILE A 22 16.290 18.330 28.910 1.00 0.00 C
154
+ ATOM 287 CB ILE A 22 16.310 17.400 30.070 1.00 0.00 C
155
+ ATOM 289 CG2 ILE A 22 14.910 17.070 30.560 1.00 0.00 C
156
+ ATOM 293 CG1 ILE A 22 17.130 16.110 29.630 1.00 0.00 C
157
+ ATOM 296 CD1 ILE A 22 17.150 15.040 30.710 1.00 0.00 C
158
+ ATOM 300 C ILE A 22 15.400 19.510 29.150 1.00 0.00 C
159
+ ATOM 301 O ILE A 22 15.590 20.190 30.140 1.00 0.00 O
160
+ ATOM 302 N PRO A 23 14.460 19.770 28.310 1.00 0.00 N
161
+ ATOM 303 CD PRO A 23 14.410 19.240 26.960 1.00 0.00 C
162
+ ATOM 306 CA PRO A 23 13.460 20.840 28.510 1.00 0.00 C
163
+ ATOM 308 CB PRO A 23 12.550 20.740 27.310 1.00 0.00 C
164
+ ATOM 311 CG PRO A 23 13.500 20.260 26.210 1.00 0.00 C
165
+ ATOM 314 C PRO A 23 12.730 20.840 29.830 1.00 0.00 C
166
+ ATOM 315 O PRO A 23 12.200 19.840 30.250 1.00 0.00 O
167
+ ATOM 316 N GLY A 24 12.780 21.990 30.500 1.00 0.00 N
168
+ ATOM 318 CA GLY A 24 12.180 22.310 31.750 1.00 0.00 C
169
+ ATOM 321 C GLY A 24 12.830 21.870 32.930 1.00 0.00 C
170
+ ATOM 322 O GLY A 24 12.260 21.580 33.970 1.00 0.00 O
171
+ ATOM 323 N ALA A 25 14.160 21.640 32.760 1.00 0.00 N
172
+ ATOM 325 CA ALA A 25 15.060 21.010 33.720 1.00 0.00 C
173
+ ATOM 327 CB ALA A 25 15.030 19.470 33.790 1.00 0.00 C
174
+ ATOM 331 C ALA A 25 16.410 21.570 33.430 1.00 0.00 C
175
+ ATOM 332 O ALA A 25 16.880 22.310 34.260 1.00 0.00 O
176
+ ATOM 333 N PHE A 26 17.060 21.260 32.300 1.00 0.00 N
177
+ ATOM 335 CA PHE A 26 18.490 21.650 32.070 1.00 0.00 C
178
+ ATOM 337 CB PHE A 26 19.410 20.360 32.160 1.00 0.00 C
179
+ ATOM 340 CG PHE A 26 19.330 19.420 33.300 1.00 0.00 C
180
+ ATOM 341 CD1 PHE A 26 19.520 19.940 34.620 1.00 0.00 C
181
+ ATOM 343 CE1 PHE A 26 19.300 19.100 35.730 1.00 0.00 C
182
+ ATOM 345 CZ PHE A 26 18.910 17.720 35.580 1.00 0.00 C
183
+ ATOM 347 CD2 PHE A 26 18.930 18.080 33.200 1.00 0.00 C
184
+ ATOM 349 CE2 PHE A 26 18.800 17.240 34.260 1.00 0.00 C
185
+ ATOM 351 C PHE A 26 18.660 22.310 30.670 1.00 0.00 C
186
+ ATOM 352 O PHE A 26 18.320 21.740 29.600 1.00 0.00 O
187
+ ATOM 353 N PRO A 27 19.230 23.520 30.650 1.00 0.00 N
188
+ ATOM 354 CD PRO A 27 19.448 24.370 31.890 1.00 0.00 C
189
+ ATOM 357 CA PRO A 27 19.440 24.270 29.400 1.00 0.00 C
190
+ ATOM 359 CB PRO A 27 20.380 25.390 29.950 1.00 0.00 C
191
+ ATOM 362 CG PRO A 27 19.730 25.740 31.350 1.00 0.00 C
192
+ ATOM 365 C PRO A 27 20.150 23.400 28.340 1.00 0.00 C
193
+ ATOM 366 O PRO A 27 21.200 22.780 28.680 1.00 0.00 O
194
+ ATOM 367 N PRO A 28 19.740 23.470 27.070 1.00 0.00 N
195
+ ATOM 368 CD PRO A 28 18.370 23.800 26.650 1.00 0.00 C
196
+ ATOM 371 CA PRO A 28 20.610 23.130 25.890 1.00 0.00 C
197
+ ATOM 373 CB PRO A 28 19.810 23.610 24.690 1.00 0.00 C
198
+ ATOM 376 CG PRO A 28 18.370 23.390 25.190 1.00 0.00 C
199
+ ATOM 379 C PRO A 28 21.950 23.850 25.940 1.00 0.00 C
200
+ ATOM 380 O PRO A 28 22.100 24.870 26.570 1.00 0.00 O
201
+ ATOM 381 N LEU A 29 22.950 23.270 25.230 1.00 0.00 N
202
+ ATOM 383 CA LEU A 29 24.260 23.900 24.900 1.00 0.00 C
203
+ ATOM 385 CB LEU A 29 25.430 22.990 25.310 1.00 0.00 C
204
+ ATOM 388 CG LEU A 29 25.650 22.890 26.830 1.00 0.00 C
205
+ ATOM 390 CD1 LEU A 29 26.410 21.580 27.250 1.00 0.00 C
206
+ ATOM 394 CD2 LEU A 29 26.330 24.180 27.320 1.00 0.00 C
207
+ ATOM 398 C LEU A 29 24.410 24.140 23.430 1.00 0.00 C
208
+ ATOM 399 O LEU A 29 24.750 25.150 22.980 1.00 0.00 O
209
+ ATOM 400 N ALA A 30 24.040 23.090 22.650 1.00 0.00 N
210
+ ATOM 402 CA ALA A 30 24.150 22.920 21.210 1.00 0.00 C
211
+ ATOM 404 CB ALA A 30 23.500 21.620 20.800 1.00 0.00 C
212
+ ATOM 408 C ALA A 30 23.490 24.150 20.450 1.00 0.00 C
213
+ ATOM 409 O ALA A 30 22.280 24.330 20.410 1.00 0.00 O
214
+ ATOM 410 N GLY A 31 24.260 25.040 19.870 1.00 0.00 N
215
+ ATOM 412 CA GLY A 31 23.850 26.200 19.020 1.00 0.00 C
216
+ ATOM 415 C GLY A 31 23.300 27.290 19.820 1.00 0.00 C
217
+ ATOM 416 O GLY A 31 22.660 28.240 19.340 1.00 0.00 O
218
+ ATOM 417 N HIS A 32 23.480 27.230 21.220 1.00 0.00 N
219
+ ATOM 419 CA HIS A 32 23.200 28.290 22.200 1.00 0.00 C
220
+ ATOM 421 CB HIS A 32 22.340 27.760 23.270 1.00 0.00 C
221
+ ATOM 424 ND1 HIS A 32 21.500 29.630 24.590 1.00 0.00 N
222
+ ATOM 425 CG HIS A 32 22.230 28.510 24.540 1.00 0.00 C
223
+ ATOM 426 CE1 HIS A 32 21.390 29.930 25.900 1.00 0.00 C
224
+ ATOM 428 NE2 HIS A 32 21.980 29.040 26.680 1.00 0.00 N
225
+ ATOM 430 CD2 HIS A 32 22.600 28.130 25.860 1.00 0.00 C
226
+ ATOM 432 C HIS A 32 24.460 28.880 22.750 1.00 0.00 C
227
+ ATOM 433 O HIS A 32 24.580 30.030 23.120 1.00 0.00 O
228
+ ATOM 434 N VAL A 33 25.550 28.100 22.900 1.00 0.00 N
229
+ ATOM 436 CA VAL A 33 26.940 28.580 23.280 1.00 0.00 C
230
+ ATOM 438 CB VAL A 33 27.720 27.320 23.720 1.00 0.00 C
231
+ ATOM 440 CG1 VAL A 33 29.240 27.720 23.560 1.00 0.00 C
232
+ ATOM 444 CG2 VAL A 33 27.300 27.060 25.210 1.00 0.00 C
233
+ ATOM 448 C VAL A 33 27.550 29.480 22.200 1.00 0.00 C
234
+ ATOM 449 O VAL A 33 28.110 30.470 22.450 1.00 0.00 O
235
+ ATOM 450 N ALA A 34 27.240 29.250 20.930 1.00 0.00 N
236
+ ATOM 452 CA ALA A 34 27.380 30.140 19.790 1.00 0.00 C
237
+ ATOM 454 CB ALA A 34 26.820 29.420 18.630 1.00 0.00 C
238
+ ATOM 458 C ALA A 34 26.590 31.430 19.910 1.00 0.00 C
239
+ ATOM 459 O ALA A 34 27.090 32.540 19.590 1.00 0.00 O
240
+ ATOM 460 N GLU A 35 25.370 31.290 20.380 1.00 0.00 N
241
+ ATOM 462 CA GLU A 35 24.540 32.530 20.670 1.00 0.00 C
242
+ ATOM 464 CB GLU A 35 23.160 32.140 21.160 1.00 0.00 C
243
+ ATOM 467 CG GLU A 35 22.310 31.610 20.060 1.00 0.00 C
244
+ ATOM 470 CD GLU A 35 20.840 31.720 20.320 1.00 0.00 C
245
+ ATOM 471 OE1 GLU A 35 20.120 32.410 19.530 1.00 0.00 O
246
+ ATOM 472 OE2 GLU A 35 20.200 31.120 21.180 1.00 0.00 O
247
+ ATOM 473 C GLU A 35 25.190 33.490 21.730 1.00 0.00 C
248
+ ATOM 474 O GLU A 35 25.270 34.710 21.560 1.00 0.00 O
249
+ ATOM 475 N ILE A 36 25.730 32.830 22.820 1.00 0.00 N
250
+ ATOM 477 CA ILE A 36 26.390 33.520 23.990 1.00 0.00 C
251
+ ATOM 479 CB ILE A 36 26.540 32.680 25.240 1.00 0.00 C
252
+ ATOM 481 CG2 ILE A 36 27.320 33.410 26.400 1.00 0.00 C
253
+ ATOM 485 CG1 ILE A 36 25.130 32.290 25.870 1.00 0.00 C
254
+ ATOM 488 CD1 ILE A 36 25.130 30.970 26.710 1.00 0.00 C
255
+ ATOM 492 C ILE A 36 27.690 34.150 23.530 1.00 0.00 C
256
+ ATOM 493 O ILE A 36 27.970 35.320 23.750 1.00 0.00 O
257
+ ATOM 494 N LEU A 37 28.470 33.440 22.700 1.00 0.00 N
258
+ ATOM 496 CA LEU A 37 29.780 33.980 22.290 1.00 0.00 C
259
+ ATOM 498 CB LEU A 37 30.720 32.810 21.870 1.00 0.00 C
260
+ ATOM 501 CG LEU A 37 31.070 31.830 22.910 1.00 0.00 C
261
+ ATOM 503 CD1 LEU A 37 31.640 30.490 22.350 1.00 0.00 C
262
+ ATOM 507 CD2 LEU A 37 32.170 32.440 23.830 1.00 0.00 C
263
+ ATOM 511 C LEU A 37 29.660 35.180 21.310 1.00 0.00 C
264
+ ATOM 512 O LEU A 37 30.600 36.070 21.360 1.00 0.00 O
265
+ ATOM 513 N ALA A 38 28.510 35.260 20.570 1.00 0.00 N
266
+ ATOM 515 CA ALA A 38 28.210 36.400 19.740 1.00 0.00 C
267
+ ATOM 517 CB ALA A 38 27.150 35.790 18.790 1.00 0.00 C
268
+ ATOM 521 C ALA A 38 27.780 37.580 20.520 1.00 0.00 C
269
+ ATOM 522 O ALA A 38 27.700 38.700 20.040 1.00 0.00 O
270
+ ATOM 523 N LYS A 39 27.470 37.490 21.840 1.00 0.00 N
271
+ ATOM 525 CA LYS A 39 27.430 38.700 22.670 1.00 0.00 C
272
+ ATOM 527 CB LYS A 39 26.610 38.480 23.860 1.00 0.00 C
273
+ ATOM 530 CG LYS A 39 25.210 38.090 23.460 1.00 0.00 C
274
+ ATOM 533 CD LYS A 39 24.560 39.300 22.810 1.00 0.00 C
275
+ ATOM 536 CE LYS A 39 23.070 39.400 22.720 1.00 0.00 C
276
+ ATOM 539 NZ LYS A 39 22.510 38.890 21.440 1.00 0.00 N
277
+ ATOM 543 C LYS A 39 28.830 39.060 23.170 1.00 0.00 C
278
+ ATOM 544 O LYS A 39 29.700 38.210 23.410 1.00 0.00 O
279
+ ATOM 545 N GLU A 40 29.050 40.330 23.550 1.00 0.00 N
280
+ ATOM 547 CA GLU A 40 30.300 40.810 24.010 1.00 0.00 C
281
+ ATOM 549 CB GLU A 40 30.550 42.340 23.660 1.00 0.00 C
282
+ ATOM 552 CG GLU A 40 32.040 42.820 23.530 1.00 0.00 C
283
+ ATOM 555 CD GLU A 40 32.740 42.330 22.250 1.00 0.00 C
284
+ ATOM 556 OE1 GLU A 40 33.350 41.230 22.490 1.00 0.00 O
285
+ ATOM 557 OE2 GLU A 40 32.690 42.920 21.190 1.00 0.00 O
286
+ ATOM 558 C GLU A 40 30.410 40.610 25.510 1.00 0.00 C
287
+ ATOM 559 O GLU A 40 29.610 41.130 26.280 1.00 0.00 O
288
+ ATOM 560 N GLY A 41 31.360 39.800 25.990 1.00 0.00 N
289
+ ATOM 562 CA GLY A 41 31.540 39.460 27.410 1.00 0.00 C
290
+ ATOM 565 C GLY A 41 31.060 38.050 27.660 1.00 0.00 C
291
+ ATOM 566 O GLY A 41 30.780 37.700 28.810 1.00 0.00 O
292
+ ATOM 567 N GLY A 42 30.960 37.240 26.600 1.00 0.00 N
293
+ ATOM 569 CA GLY A 42 30.250 35.980 26.610 1.00 0.00 C
294
+ ATOM 572 C GLY A 42 31.150 34.860 27.080 1.00 0.00 C
295
+ ATOM 573 O GLY A 42 30.690 34.030 27.840 1.00 0.00 O
296
+ ATOM 574 N ARG A 43 32.460 34.940 26.660 1.00 0.00 N
297
+ ATOM 576 CA ARG A 43 33.480 33.990 27.160 1.00 0.00 C
298
+ ATOM 578 CB ARG A 43 34.750 34.110 26.260 1.00 0.00 C
299
+ ATOM 581 CG ARG A 43 35.440 35.490 26.140 1.00 0.00 C
300
+ ATOM 584 CD ARG A 43 36.310 35.730 24.970 1.00 0.00 C
301
+ ATOM 587 NE ARG A 43 37.480 34.870 25.010 1.00 0.00 N
302
+ ATOM 589 CZ ARG A 43 37.680 33.710 24.370 1.00 0.00 C
303
+ ATOM 590 NH1 ARG A 43 36.960 33.410 23.300 1.00 0.00 N
304
+ ATOM 593 NH2 ARG A 43 38.650 32.950 24.840 1.00 0.00 N
305
+ ATOM 596 C ARG A 43 33.780 34.190 28.610 1.00 0.00 C
306
+ ATOM 597 O ARG A 43 33.820 33.230 29.410 1.00 0.00 O
307
+ ATOM 598 N GLU A 44 33.960 35.510 29.020 1.00 0.00 N
308
+ ATOM 600 CA GLU A 44 33.930 35.860 30.450 1.00 0.00 C
309
+ ATOM 602 CB GLU A 44 33.860 37.380 30.680 1.00 0.00 C
310
+ ATOM 605 CG GLU A 44 35.220 38.160 30.370 1.00 0.00 C
311
+ ATOM 608 CD GLU A 44 35.350 38.390 28.830 1.00 0.00 C
312
+ ATOM 609 OE1 GLU A 44 34.550 37.920 28.020 1.00 0.00 O
313
+ ATOM 610 OE2 GLU A 44 36.330 39.100 28.480 1.00 0.00 O
314
+ ATOM 611 C GLU A 44 32.830 35.230 31.290 1.00 0.00 C
315
+ ATOM 612 O GLU A 44 33.070 34.480 32.240 1.00 0.00 O
316
+ ATOM 613 N TYR A 45 31.580 35.460 30.890 1.00 0.00 N
317
+ ATOM 615 CA TYR A 45 30.420 34.870 31.510 1.00 0.00 C
318
+ ATOM 617 CB TYR A 45 29.140 35.470 30.880 1.00 0.00 C
319
+ ATOM 620 CG TYR A 45 27.830 34.740 31.110 1.00 0.00 C
320
+ ATOM 621 CD1 TYR A 45 27.320 34.670 32.450 1.00 0.00 C
321
+ ATOM 623 CE1 TYR A 45 26.090 34.040 32.740 1.00 0.00 C
322
+ ATOM 625 CZ TYR A 45 25.490 33.310 31.710 1.00 0.00 C
323
+ ATOM 626 OH TYR A 45 24.450 32.320 32.030 1.00 0.00 O
324
+ ATOM 628 CD2 TYR A 45 27.190 34.020 30.060 1.00 0.00 C
325
+ ATOM 630 CE2 TYR A 45 26.060 33.250 30.420 1.00 0.00 C
326
+ ATOM 632 C TYR A 45 30.400 33.310 31.580 1.00 0.00 C
327
+ ATOM 633 O TYR A 45 29.990 32.710 32.570 1.00 0.00 O
328
+ ATOM 634 N LEU A 46 30.780 32.650 30.480 1.00 0.00 N
329
+ ATOM 636 CA LEU A 46 30.920 31.250 30.450 1.00 0.00 C
330
+ ATOM 638 CB LEU A 46 31.060 30.820 29.000 1.00 0.00 C
331
+ ATOM 641 CG LEU A 46 29.780 30.940 28.180 1.00 0.00 C
332
+ ATOM 643 CD1 LEU A 46 30.170 31.010 26.620 1.00 0.00 C
333
+ ATOM 647 CD2 LEU A 46 28.920 29.700 28.590 1.00 0.00 C
334
+ ATOM 651 C LEU A 46 31.950 30.650 31.420 1.00 0.00 C
335
+ ATOM 652 O LEU A 46 31.630 29.710 32.150 1.00 0.00 O
336
+ ATOM 653 N ILE A 47 33.200 31.180 31.470 1.00 0.00 N
337
+ ATOM 655 CA ILE A 47 34.060 30.960 32.590 1.00 0.00 C
338
+ ATOM 657 CB ILE A 47 35.320 31.700 32.270 1.00 0.00 C
339
+ ATOM 659 CG2 ILE A 47 36.300 31.540 33.370 1.00 0.00 C
340
+ ATOM 663 CG1 ILE A 47 36.010 31.400 30.890 1.00 0.00 C
341
+ ATOM 666 CD1 ILE A 47 36.870 32.530 30.340 1.00 0.00 C
342
+ ATOM 670 C ILE A 47 33.480 31.270 34.020 1.00 0.00 C
343
+ ATOM 671 O ILE A 47 33.590 30.450 34.940 1.00 0.00 O
344
+ ATOM 672 N LEU A 48 32.720 32.360 34.170 1.00 0.00 N
345
+ ATOM 674 CA LEU A 48 31.940 32.580 35.390 1.00 0.00 C
346
+ ATOM 676 CB LEU A 48 31.340 33.920 35.550 1.00 0.00 C
347
+ ATOM 679 CG LEU A 48 32.360 35.050 35.300 1.00 0.00 C
348
+ ATOM 681 CD1 LEU A 48 31.650 36.410 35.100 1.00 0.00 C
349
+ ATOM 685 CD2 LEU A 48 33.400 35.170 36.440 1.00 0.00 C
350
+ ATOM 689 C LEU A 48 31.050 31.440 35.810 1.00 0.00 C
351
+ ATOM 690 O LEU A 48 31.040 31.110 37.020 1.00 0.00 O
352
+ ATOM 691 N VAL A 49 30.260 30.900 34.890 1.00 0.00 N
353
+ ATOM 693 CA VAL A 49 29.280 29.850 35.170 1.00 0.00 C
354
+ ATOM 695 CB VAL A 49 28.380 29.590 33.870 1.00 0.00 C
355
+ ATOM 697 CG1 VAL A 49 27.530 28.380 34.100 1.00 0.00 C
356
+ ATOM 701 CG2 VAL A 49 27.530 30.840 33.510 1.00 0.00 C
357
+ ATOM 705 C VAL A 49 29.980 28.570 35.550 1.00 0.00 C
358
+ ATOM 706 O VAL A 49 29.520 27.860 36.510 1.00 0.00 O
359
+ ATOM 707 N LEU A 50 31.140 28.210 34.970 1.00 0.00 N
360
+ ATOM 709 CA LEU A 50 32.040 27.130 35.380 1.00 0.00 C
361
+ ATOM 711 CB LEU A 50 33.090 26.880 34.240 1.00 0.00 C
362
+ ATOM 714 CG LEU A 50 32.620 25.660 33.380 1.00 0.00 C
363
+ ATOM 716 CD1 LEU A 50 32.640 24.250 34.150 1.00 0.00 C
364
+ ATOM 720 CD2 LEU A 50 31.270 25.920 32.650 1.00 0.00 C
365
+ ATOM 724 C LEU A 50 32.670 27.350 36.730 1.00 0.00 C
366
+ ATOM 725 O LEU A 50 32.620 26.540 37.650 1.00 0.00 O
367
+ ATOM 726 N LEU A 51 33.300 28.480 36.960 1.00 0.00 N
368
+ ATOM 728 CA LEU A 51 33.790 28.910 38.270 1.00 0.00 C
369
+ ATOM 730 CB LEU A 51 34.560 30.280 38.180 1.00 0.00 C
370
+ ATOM 733 CG LEU A 51 35.850 30.350 37.340 1.00 0.00 C
371
+ ATOM 735 CD1 LEU A 51 36.380 31.810 37.240 1.00 0.00 C
372
+ ATOM 739 CD2 LEU A 51 36.960 29.480 37.960 1.00 0.00 C
373
+ ATOM 743 C LEU A 51 32.800 29.080 39.450 1.00 0.00 C
374
+ ATOM 744 O LEU A 51 33.050 28.660 40.570 1.00 0.00 O
375
+ ATOM 745 N TYR A 52 31.590 29.660 39.210 1.00 0.00 N
376
+ ATOM 747 CA TYR A 52 30.810 30.230 40.280 1.00 0.00 C
377
+ ATOM 749 CB TYR A 52 30.790 31.770 40.250 1.00 0.00 C
378
+ ATOM 752 CG TYR A 52 32.210 32.310 40.450 1.00 0.00 C
379
+ ATOM 753 CD1 TYR A 52 32.890 32.190 41.700 1.00 0.00 C
380
+ ATOM 755 CE1 TYR A 52 34.210 32.610 41.880 1.00 0.00 C
381
+ ATOM 757 CZ TYR A 52 34.880 33.220 40.830 1.00 0.00 C
382
+ ATOM 758 OH TYR A 52 36.100 33.780 40.990 1.00 0.00 O
383
+ ATOM 760 CD2 TYR A 52 32.890 32.980 39.380 1.00 0.00 C
384
+ ATOM 762 CE2 TYR A 52 34.210 33.440 39.600 1.00 0.00 C
385
+ ATOM 764 C TYR A 52 29.400 29.770 40.380 1.00 0.00 C
386
+ ATOM 765 O TYR A 52 28.640 30.060 41.280 1.00 0.00 O
387
+ ATOM 766 N GLY A 53 29.000 28.900 39.370 1.00 0.00 N
388
+ ATOM 768 CA GLY A 53 27.660 28.320 39.280 1.00 0.00 C
389
+ ATOM 771 C GLY A 53 26.600 29.240 38.720 1.00 0.00 C
390
+ ATOM 772 O GLY A 53 26.760 30.380 38.370 1.00 0.00 O
391
+ ATOM 773 N LEU A 54 25.390 28.650 38.620 1.00 0.00 N
392
+ ATOM 775 CA LEU A 54 24.320 29.460 38.140 1.00 0.00 C
393
+ ATOM 777 CB LEU A 54 24.300 29.390 36.590 1.00 0.00 C
394
+ ATOM 780 CG LEU A 54 23.360 30.390 35.800 1.00 0.00 C
395
+ ATOM 782 CD1 LEU A 54 23.750 31.870 35.920 1.00 0.00 C
396
+ ATOM 786 CD2 LEU A 54 23.170 30.020 34.340 1.00 0.00 C
397
+ ATOM 790 C LEU A 54 22.920 29.110 38.620 1.00 0.00 C
398
+ ATOM 791 O LEU A 54 22.480 27.950 38.560 1.00 0.00 O
399
+ ATOM 792 N GLN A 55 22.160 30.090 39.120 1.00 0.00 N
400
+ ATOM 794 CA GLN A 55 20.950 29.910 39.870 1.00 0.00 C
401
+ ATOM 796 CB GLN A 55 20.990 29.790 41.410 1.00 0.00 C
402
+ ATOM 799 CG GLN A 55 21.940 28.760 41.980 1.00 0.00 C
403
+ ATOM 802 CD GLN A 55 21.790 28.490 43.400 1.00 0.00 C
404
+ ATOM 803 OE1 GLN A 55 20.960 29.140 44.060 1.00 0.00 O
405
+ ATOM 804 NE2 GLN A 55 22.450 27.420 43.940 1.00 0.00 N
406
+ ATOM 807 C GLN A 55 20.050 31.150 39.510 1.00 0.00 C
407
+ ATOM 808 O GLN A 55 20.580 32.170 39.130 1.00 0.00 O
408
+ ATOM 809 N GLY A 56 18.640 30.980 39.490 1.00 0.00 N
409
+ ATOM 811 CA GLY A 56 17.680 32.000 39.210 1.00 0.00 C
410
+ ATOM 814 C GLY A 56 17.060 31.750 37.830 1.00 0.00 C
411
+ ATOM 815 O GLY A 56 17.620 31.160 36.890 1.00 0.00 O
412
+ ATOM 816 N GLN A 57 15.830 32.250 37.610 1.00 0.00 N
413
+ ATOM 818 CA GLN A 57 15.170 32.140 36.320 1.00 0.00 C
414
+ ATOM 820 CB GLN A 57 13.790 32.800 36.460 1.00 0.00 C
415
+ ATOM 823 CG GLN A 57 12.950 32.650 35.140 1.00 0.00 C
416
+ ATOM 826 CD GLN A 57 11.480 33.150 35.120 1.00 0.00 C
417
+ ATOM 827 OE1 GLN A 57 10.690 32.510 34.360 1.00 0.00 O
418
+ ATOM 828 NE2 GLN A 57 11.120 34.220 35.810 1.00 0.00 N
419
+ ATOM 831 C GLN A 57 15.960 32.630 35.110 1.00 0.00 C
420
+ ATOM 832 O GLN A 57 16.440 33.770 35.140 1.00 0.00 O
421
+ ATOM 833 N ILE A 58 16.010 31.910 33.960 1.00 0.00 N
422
+ ATOM 835 CA ILE A 58 16.510 32.210 32.670 1.00 0.00 C
423
+ ATOM 837 CB ILE A 58 17.910 31.780 32.430 1.00 0.00 C
424
+ ATOM 839 CG2 ILE A 58 18.910 32.240 33.590 1.00 0.00 C
425
+ ATOM 843 CG1 ILE A 58 18.060 30.230 32.130 1.00 0.00 C
426
+ ATOM 846 CD1 ILE A 58 19.500 29.780 31.770 1.00 0.00 C
427
+ ATOM 850 C ILE A 58 15.600 31.780 31.500 1.00 0.00 C
428
+ ATOM 851 O ILE A 58 14.690 30.910 31.570 1.00 0.00 O
429
+ ATOM 852 N GLU A 59 15.800 32.350 30.290 1.00 0.00 N
430
+ ATOM 854 CA GLU A 59 15.150 31.850 29.080 1.00 0.00 C
431
+ ATOM 856 CB GLU A 59 14.300 32.950 28.450 1.00 0.00 C
432
+ ATOM 859 CG GLU A 59 13.540 32.500 27.180 1.00 0.00 C
433
+ ATOM 862 CD GLU A 59 12.530 33.580 26.740 1.00 0.00 C
434
+ ATOM 863 OE1 GLU A 59 11.680 33.910 27.590 1.00 0.00 O
435
+ ATOM 864 OE2 GLU A 59 12.610 34.030 25.580 1.00 0.00 O
436
+ ATOM 865 C GLU A 59 16.060 31.390 27.940 1.00 0.00 C
437
+ ATOM 866 O GLU A 59 16.860 32.180 27.410 1.00 0.00 O
438
+ ATOM 867 N VAL A 60 16.130 30.070 27.710 1.00 0.00 N
439
+ ATOM 869 CA VAL A 60 17.000 29.420 26.710 1.00 0.00 C
440
+ ATOM 871 CB VAL A 60 18.020 28.420 27.260 1.00 0.00 C
441
+ ATOM 873 CG1 VAL A 60 18.820 27.790 26.170 1.00 0.00 C
442
+ ATOM 877 CG2 VAL A 60 18.900 29.130 28.300 1.00 0.00 C
443
+ ATOM 881 C VAL A 60 16.140 28.770 25.630 1.00 0.00 C
444
+ ATOM 882 O VAL A 60 15.160 28.080 25.930 1.00 0.00 O
445
+ ATOM 883 N LYS A 61 16.460 28.970 24.340 1.00 0.00 N
446
+ ATOM 885 CA LYS A 61 15.720 28.600 23.170 1.00 0.00 C
447
+ ATOM 887 CB LYS A 61 16.150 27.190 22.840 1.00 0.00 C
448
+ ATOM 890 CG LYS A 61 17.670 27.040 22.600 1.00 0.00 C
449
+ ATOM 893 CD LYS A 61 18.090 25.960 21.560 1.00 0.00 C
450
+ ATOM 896 CE LYS A 61 19.560 25.780 21.280 1.00 0.00 C
451
+ ATOM 899 NZ LYS A 61 19.710 24.990 20.060 1.00 0.00 N
452
+ ATOM 903 C LYS A 61 14.180 28.700 23.210 1.00 0.00 C
453
+ ATOM 904 O LYS A 61 13.560 27.740 22.790 1.00 0.00 O
454
+ ATOM 905 N GLY A 62 13.610 29.780 23.700 1.00 0.00 N
455
+ ATOM 907 CA GLY A 62 12.160 30.100 23.900 1.00 0.00 C
456
+ ATOM 910 C GLY A 62 11.580 29.250 24.970 1.00 0.00 C
457
+ ATOM 911 O GLY A 62 10.420 28.910 24.870 1.00 0.00 O
458
+ ATOM 912 N MET A 63 12.340 28.860 26.090 1.00 0.00 N
459
+ ATOM 914 CA MET A 63 11.760 27.990 27.030 1.00 0.00 C
460
+ ATOM 916 CB MET A 63 12.210 26.590 26.780 1.00 0.00 C
461
+ ATOM 919 CG MET A 63 11.730 25.970 25.460 1.00 0.00 C
462
+ ATOM 922 SD MET A 63 11.970 24.110 25.300 1.00 0.00 S
463
+ ATOM 923 CE MET A 63 10.870 23.800 23.800 1.00 0.00 C
464
+ ATOM 927 C MET A 63 12.400 28.490 28.300 1.00 0.00 C
465
+ ATOM 928 O MET A 63 13.590 28.800 28.330 1.00 0.00 O
466
+ ATOM 929 N LYS A 64 11.550 28.580 29.380 1.00 0.00 N
467
+ ATOM 931 CA LYS A 64 11.980 28.900 30.710 1.00 0.00 C
468
+ ATOM 933 CB LYS A 64 10.830 29.440 31.640 1.00 0.00 C
469
+ ATOM 936 CG LYS A 64 10.120 30.710 31.090 1.00 0.00 C
470
+ ATOM 939 CD LYS A 64 11.180 31.910 31.030 1.00 0.00 C
471
+ ATOM 942 CE LYS A 64 10.340 33.180 30.780 1.00 0.00 C
472
+ ATOM 945 NZ LYS A 64 11.260 34.310 30.410 1.00 0.00 N
473
+ ATOM 949 C LYS A 64 12.640 27.850 31.530 1.00 0.00 C
474
+ ATOM 950 O LYS A 64 12.210 26.720 31.420 1.00 0.00 O
475
+ ATOM 951 N TYR A 65 13.620 28.310 32.290 1.00 0.00 N
476
+ ATOM 953 CA TYR A 65 14.340 27.420 33.230 1.00 0.00 C
477
+ ATOM 955 CB TYR A 65 15.730 26.990 32.700 1.00 0.00 C
478
+ ATOM 958 CG TYR A 65 15.730 26.050 31.480 1.00 0.00 C
479
+ ATOM 959 CD1 TYR A 65 15.480 26.660 30.200 1.00 0.00 C
480
+ ATOM 961 CE1 TYR A 65 15.340 25.870 29.080 1.00 0.00 C
481
+ ATOM 963 CZ TYR A 65 15.480 24.530 29.110 1.00 0.00 C
482
+ ATOM 964 OH TYR A 65 15.330 23.700 27.950 1.00 0.00 O
483
+ ATOM 966 CD2 TYR A 65 15.840 24.640 31.500 1.00 0.00 C
484
+ ATOM 968 CE2 TYR A 65 15.770 23.870 30.320 1.00 0.00 C
485
+ ATOM 970 C TYR A 65 14.630 28.180 34.490 1.00 0.00 C
486
+ ATOM 971 O TYR A 65 14.790 29.390 34.530 1.00 0.00 O
487
+ ATOM 972 N ASN A 66 14.650 27.490 35.660 1.00 0.00 N
488
+ ATOM 974 CA ASN A 66 14.760 28.120 36.990 1.00 0.00 C
489
+ ATOM 976 CB ASN A 66 13.370 28.560 37.520 1.00 0.00 C
490
+ ATOM 979 CG ASN A 66 13.440 29.360 38.720 1.00 0.00 C
491
+ ATOM 980 OD1 ASN A 66 14.510 29.620 39.350 1.00 0.00 O
492
+ ATOM 981 ND2 ASN A 66 12.250 29.760 39.190 1.00 0.00 N
493
+ ATOM 984 C ASN A 66 15.420 27.200 37.880 1.00 0.00 C
494
+ ATOM 985 O ASN A 66 15.040 27.040 39.050 1.00 0.00 O
495
+ ATOM 986 N GLY A 67 16.370 26.430 37.400 1.00 0.00 N
496
+ ATOM 988 CA GLY A 67 17.090 25.330 38.110 1.00 0.00 C
497
+ ATOM 991 C GLY A 67 18.400 25.850 38.680 1.00 0.00 C
498
+ ATOM 992 O GLY A 67 18.670 27.070 38.810 1.00 0.00 O
499
+ ATOM 993 N VAL A 68 19.310 24.960 39.100 1.00 0.00 N
500
+ ATOM 995 CA VAL A 68 20.560 25.240 39.840 1.00 0.00 C
501
+ ATOM 997 CB VAL A 68 20.400 24.880 41.270 1.00 0.00 C
502
+ ATOM 999 CG1 VAL A 68 19.280 25.730 41.900 1.00 0.00 C
503
+ ATOM 1003 CG2 VAL A 68 20.070 23.400 41.540 1.00 0.00 C
504
+ ATOM 1007 C VAL A 68 21.710 24.450 39.220 1.00 0.00 C
505
+ ATOM 1008 O VAL A 68 21.530 23.270 38.900 1.00 0.00 O
506
+ ATOM 1009 N MET A 69 22.810 25.170 38.980 1.00 0.00 N
507
+ ATOM 1011 CA MET A 69 24.080 24.720 38.680 1.00 0.00 C
508
+ ATOM 1013 CB MET A 69 24.450 25.260 37.260 1.00 0.00 C
509
+ ATOM 1016 CG MET A 69 25.890 24.990 36.990 1.00 0.00 C
510
+ ATOM 1019 SD MET A 69 26.380 25.430 35.300 1.00 0.00 S
511
+ ATOM 1020 CE MET A 69 27.920 24.530 35.390 1.00 0.00 C
512
+ ATOM 1024 C MET A 69 25.140 25.060 39.670 1.00 0.00 C
513
+ ATOM 1025 O MET A 69 25.220 26.170 40.180 1.00 0.00 O
514
+ ATOM 1026 N SER A 70 25.940 24.020 40.030 1.00 0.00 N
515
+ ATOM 1028 CA SER A 70 27.040 24.000 41.010 1.00 0.00 C
516
+ ATOM 1030 CB SER A 70 27.380 22.610 41.660 1.00 0.00 C
517
+ ATOM 1033 OG SER A 70 27.780 21.580 40.720 1.00 0.00 O
518
+ ATOM 1035 C SER A 70 28.280 24.590 40.370 1.00 0.00 C
519
+ ATOM 1036 O SER A 70 28.440 24.660 39.170 1.00 0.00 O
520
+ ATOM 1037 N SER A 71 29.160 25.080 41.220 1.00 0.00 N
521
+ ATOM 1039 CA SER A 71 30.520 25.490 40.900 1.00 0.00 C
522
+ ATOM 1041 CB SER A 71 31.100 26.370 42.090 1.00 0.00 C
523
+ ATOM 1044 OG SER A 71 32.510 26.560 42.060 1.00 0.00 O
524
+ ATOM 1046 C SER A 71 31.410 24.300 40.650 1.00 0.00 C
525
+ ATOM 1047 O SER A 71 31.560 23.410 41.480 1.00 0.00 O
526
+ ATOM 1048 N PHE A 72 32.120 24.370 39.510 1.00 0.00 N
527
+ ATOM 1050 CA PHE A 72 33.180 23.370 39.140 1.00 0.00 C
528
+ ATOM 1052 CB PHE A 72 33.000 22.990 37.640 1.00 0.00 C
529
+ ATOM 1055 CG PHE A 72 31.810 22.100 37.530 1.00 0.00 C
530
+ ATOM 1056 CD1 PHE A 72 30.530 22.670 37.450 1.00 0.00 C
531
+ ATOM 1058 CE1 PHE A 72 29.420 21.820 37.200 1.00 0.00 C
532
+ ATOM 1060 CZ PHE A 72 29.590 20.460 37.040 1.00 0.00 C
533
+ ATOM 1062 CD2 PHE A 72 31.940 20.700 37.380 1.00 0.00 C
534
+ ATOM 1064 CE2 PHE A 72 30.870 19.910 37.160 1.00 0.00 C
535
+ ATOM 1066 C PHE A 72 34.530 23.990 39.330 1.00 0.00 C
536
+ ATOM 1067 O PHE A 72 35.520 23.590 38.760 1.00 0.00 O
537
+ ATOM 1068 N ALA A 73 34.710 24.990 40.220 1.00 0.00 N
538
+ ATOM 1070 CA ALA A 73 35.990 25.620 40.480 1.00 0.00 C
539
+ ATOM 1072 CB ALA A 73 35.820 26.810 41.480 1.00 0.00 C
540
+ ATOM 1076 C ALA A 73 37.070 24.740 40.990 1.00 0.00 C
541
+ ATOM 1077 O ALA A 73 38.240 25.150 41.010 1.00 0.00 O
542
+ ATOM 1078 N GLN A 74 36.770 23.400 41.320 1.00 0.00 N
543
+ ATOM 1080 CA GLN A 74 37.820 22.500 41.760 1.00 0.00 C
544
+ ATOM 1082 CB GLN A 74 37.280 21.240 42.500 1.00 0.00 C
545
+ ATOM 1085 CG GLN A 74 36.520 20.140 41.770 1.00 0.00 C
546
+ ATOM 1088 CD GLN A 74 35.120 20.550 41.300 1.00 0.00 C
547
+ ATOM 1089 OE1 GLN A 74 34.590 21.650 41.670 1.00 0.00 O
548
+ ATOM 1090 NE2 GLN A 74 34.500 19.570 40.700 1.00 0.00 N
549
+ ATOM 1093 C GLN A 74 38.650 22.030 40.550 1.00 0.00 C
550
+ ATOM 1094 O GLN A 74 39.800 21.650 40.680 1.00 0.00 O
551
+ ATOM 1095 N LEU A 75 38.070 22.050 39.360 1.00 0.00 N
552
+ ATOM 1097 CA LEU A 75 38.740 21.760 38.170 1.00 0.00 C
553
+ ATOM 1099 CB LEU A 75 37.810 21.880 36.870 1.00 0.00 C
554
+ ATOM 1102 CG LEU A 75 36.650 20.820 36.760 1.00 0.00 C
555
+ ATOM 1104 CD1 LEU A 75 35.900 21.210 35.500 1.00 0.00 C
556
+ ATOM 1108 CD2 LEU A 75 37.080 19.360 36.820 1.00 0.00 C
557
+ ATOM 1112 C LEU A 75 39.910 22.780 37.870 1.00 0.00 C
558
+ ATOM 1113 O LEU A 75 39.880 23.970 38.160 1.00 0.00 O
559
+ ATOM 1114 N LYS A 76 41.050 22.210 37.280 1.00 0.00 N
560
+ ATOM 1116 CA LYS A 76 42.180 23.010 36.810 1.00 0.00 C
561
+ ATOM 1118 CB LYS A 76 43.390 22.100 36.470 1.00 0.00 C
562
+ ATOM 1121 CG LYS A 76 43.970 21.230 37.670 1.00 0.00 C
563
+ ATOM 1124 CD LYS A 76 45.260 20.410 37.190 1.00 0.00 C
564
+ ATOM 1127 CE LYS A 76 45.010 19.360 36.090 1.00 0.00 C
565
+ ATOM 1130 NZ LYS A 76 44.480 18.120 36.690 1.00 0.00 N
566
+ ATOM 1134 C LYS A 76 41.890 23.900 35.740 1.00 0.00 C
567
+ ATOM 1135 O LYS A 76 41.080 23.690 34.840 1.00 0.00 O
568
+ ATOM 1136 N ASP A 77 42.590 25.070 35.730 1.00 0.00 N
569
+ ATOM 1138 CA ASP A 77 42.340 26.080 34.740 1.00 0.00 C
570
+ ATOM 1140 CB ASP A 77 43.630 27.030 34.750 1.00 0.00 C
571
+ ATOM 1143 CG ASP A 77 43.840 27.720 36.060 1.00 0.00 C
572
+ ATOM 1144 OD1 ASP A 77 43.000 27.700 36.990 1.00 0.00 O
573
+ ATOM 1145 OD2 ASP A 77 44.940 28.380 36.220 1.00 0.00 O
574
+ ATOM 1146 C ASP A 77 42.260 25.580 33.230 1.00 0.00 C
575
+ ATOM 1147 O ASP A 77 41.440 26.040 32.430 1.00 0.00 O
576
+ ATOM 1148 N GLU A 78 43.180 24.710 32.770 1.00 0.00 N
577
+ ATOM 1150 CA GLU A 78 43.130 23.910 31.560 1.00 0.00 C
578
+ ATOM 1152 CB GLU A 78 44.410 23.080 31.250 1.00 0.00 C
579
+ ATOM 1155 CG GLU A 78 45.730 23.830 30.970 1.00 0.00 C
580
+ ATOM 1158 CD GLU A 78 46.890 22.900 30.650 1.00 0.00 C
581
+ ATOM 1159 OE1 GLU A 78 47.320 22.020 31.400 1.00 0.00 O
582
+ ATOM 1160 OE2 GLU A 78 47.520 23.160 29.590 1.00 0.00 O
583
+ ATOM 1161 C GLU A 78 41.900 22.990 31.470 1.00 0.00 C
584
+ ATOM 1162 O GLU A 78 41.310 22.880 30.430 1.00 0.00 O
585
+ ATOM 1163 N GLU A 79 41.430 22.360 32.530 1.00 0.00 N
586
+ ATOM 1165 CA GLU A 79 40.240 21.540 32.570 1.00 0.00 C
587
+ ATOM 1167 CB GLU A 79 40.230 20.790 33.890 1.00 0.00 C
588
+ ATOM 1170 CG GLU A 79 41.470 19.840 33.850 1.00 0.00 C
589
+ ATOM 1173 CD GLU A 79 41.500 19.110 35.210 1.00 0.00 C
590
+ ATOM 1174 OE1 GLU A 79 41.060 19.610 36.300 1.00 0.00 O
591
+ ATOM 1175 OE2 GLU A 79 42.060 17.960 35.200 1.00 0.00 O
592
+ ATOM 1176 C GLU A 79 39.010 22.390 32.260 1.00 0.00 C
593
+ ATOM 1177 O GLU A 79 38.230 22.070 31.350 1.00 0.00 O
594
+ ATOM 1178 N ILE A 80 38.960 23.570 32.890 1.00 0.00 N
595
+ ATOM 1180 CA ILE A 80 37.880 24.520 32.510 1.00 0.00 C
596
+ ATOM 1182 CB ILE A 80 37.740 25.680 33.520 1.00 0.00 C
597
+ ATOM 1184 CG2 ILE A 80 36.880 26.930 33.050 1.00 0.00 C
598
+ ATOM 1188 CG1 ILE A 80 37.460 25.140 34.950 1.00 0.00 C
599
+ ATOM 1191 CD1 ILE A 80 37.390 26.140 36.030 1.00 0.00 C
600
+ ATOM 1195 C ILE A 80 37.940 24.940 31.060 1.00 0.00 C
601
+ ATOM 1196 O ILE A 80 36.930 25.060 30.340 1.00 0.00 O
602
+ ATOM 1197 N ALA A 81 39.120 25.230 30.470 1.00 0.00 N
603
+ ATOM 1199 CA ALA A 81 39.350 25.590 29.100 1.00 0.00 C
604
+ ATOM 1201 CB ALA A 81 40.820 25.900 28.890 1.00 0.00 C
605
+ ATOM 1205 C ALA A 81 38.940 24.450 28.150 1.00 0.00 C
606
+ ATOM 1206 O ALA A 81 38.350 24.660 27.080 1.00 0.00 O
607
+ ATOM 1207 N ALA A 82 39.360 23.180 28.450 1.00 0.00 N
608
+ ATOM 1209 CA ALA A 82 39.040 21.980 27.690 1.00 0.00 C
609
+ ATOM 1211 CB ALA A 82 39.830 20.810 28.350 1.00 0.00 C
610
+ ATOM 1215 C ALA A 82 37.540 21.660 27.530 1.00 0.00 C
611
+ ATOM 1216 O ALA A 82 37.110 21.300 26.470 1.00 0.00 O
612
+ ATOM 1217 N VAL A 83 36.760 21.800 28.620 1.00 0.00 N
613
+ ATOM 1219 CA VAL A 83 35.320 21.550 28.690 1.00 0.00 C
614
+ ATOM 1221 CB VAL A 83 34.840 21.220 30.100 1.00 0.00 C
615
+ ATOM 1223 CG1 VAL A 83 34.660 22.490 31.040 1.00 0.00 C
616
+ ATOM 1227 CG2 VAL A 83 33.500 20.480 30.040 1.00 0.00 C
617
+ ATOM 1231 C VAL A 83 34.610 22.830 28.040 1.00 0.00 C
618
+ ATOM 1232 O VAL A 83 33.670 22.670 27.240 1.00 0.00 O
619
+ ATOM 1233 N LEU A 84 35.190 24.060 28.210 1.00 0.00 N
620
+ ATOM 1235 CA LEU A 84 34.590 25.190 27.550 1.00 0.00 C
621
+ ATOM 1237 CB LEU A 84 35.050 26.570 28.150 1.00 0.00 C
622
+ ATOM 1240 CG LEU A 84 34.510 26.810 29.570 1.00 0.00 C
623
+ ATOM 1242 CD1 LEU A 84 35.190 28.000 30.370 1.00 0.00 C
624
+ ATOM 1246 CD2 LEU A 84 32.940 26.980 29.550 1.00 0.00 C
625
+ ATOM 1250 C LEU A 84 34.770 25.260 26.020 1.00 0.00 C
626
+ ATOM 1251 O LEU A 84 33.770 25.470 25.350 1.00 0.00 O
627
+ ATOM 1252 N ASN A 85 35.950 24.900 25.460 1.00 0.00 N
628
+ ATOM 1254 CA ASN A 85 36.100 24.490 24.040 1.00 0.00 C
629
+ ATOM 1256 CB ASN A 85 37.610 24.040 23.750 1.00 0.00 C
630
+ ATOM 1259 CG ASN A 85 38.540 25.200 23.710 1.00 0.00 C
631
+ ATOM 1260 OD1 ASN A 85 38.130 26.390 23.670 1.00 0.00 O
632
+ ATOM 1261 ND2 ASN A 85 39.900 24.940 23.700 1.00 0.00 N
633
+ ATOM 1264 C ASN A 85 35.180 23.420 23.610 1.00 0.00 C
634
+ ATOM 1265 O ASN A 85 34.610 23.530 22.500 1.00 0.00 O
635
+ ATOM 1266 N HIS A 86 35.030 22.340 24.480 1.00 0.00 N
636
+ ATOM 1268 CA HIS A 86 34.200 21.130 24.150 1.00 0.00 C
637
+ ATOM 1270 CB HIS A 86 34.280 20.020 25.200 1.00 0.00 C
638
+ ATOM 1273 ND1 HIS A 86 34.510 17.830 23.970 1.00 0.00 N
639
+ ATOM 1274 CG HIS A 86 33.730 18.720 24.660 1.00 0.00 C
640
+ ATOM 1275 CE1 HIS A 86 33.710 16.820 23.630 1.00 0.00 C
641
+ ATOM 1277 NE2 HIS A 86 32.510 16.980 24.160 1.00 0.00 N
642
+ ATOM 1279 CD2 HIS A 86 32.480 18.190 24.810 1.00 0.00 C
643
+ ATOM 1281 C HIS A 86 32.750 21.480 23.900 1.00 0.00 C
644
+ ATOM 1282 O HIS A 86 32.180 21.150 22.870 1.00 0.00 O
645
+ ATOM 1283 N ILE A 87 32.110 22.290 24.810 1.00 0.00 N
646
+ ATOM 1285 CA ILE A 87 30.730 22.770 24.600 1.00 0.00 C
647
+ ATOM 1287 CB ILE A 87 30.090 23.330 25.820 1.00 0.00 C
648
+ ATOM 1289 CG2 ILE A 87 30.220 22.230 26.920 1.00 0.00 C
649
+ ATOM 1293 CG1 ILE A 87 30.560 24.680 26.240 1.00 0.00 C
650
+ ATOM 1296 CD1 ILE A 87 30.150 25.190 27.570 1.00 0.00 C
651
+ ATOM 1300 C ILE A 87 30.640 23.610 23.360 1.00 0.00 C
652
+ ATOM 1301 O ILE A 87 29.630 23.550 22.750 1.00 0.00 O
653
+ ATOM 1302 N ALA A 88 31.700 24.390 23.060 1.00 0.00 N
654
+ ATOM 1304 CA ALA A 88 31.790 25.130 21.920 1.00 0.00 C
655
+ ATOM 1306 CB ALA A 88 32.910 26.230 22.220 1.00 0.00 C
656
+ ATOM 1310 C ALA A 88 32.050 24.350 20.630 1.00 0.00 C
657
+ ATOM 1311 O ALA A 88 31.620 24.790 19.560 1.00 0.00 O
658
+ ATOM 1312 N THR A 89 32.690 23.210 20.610 1.00 0.00 N
659
+ ATOM 1314 CA THR A 89 33.100 22.640 19.350 1.00 0.00 C
660
+ ATOM 1316 CB THR A 89 34.600 22.180 19.380 1.00 0.00 C
661
+ ATOM 1318 OG1 THR A 89 34.940 21.520 20.550 1.00 0.00 O
662
+ ATOM 1320 CG2 THR A 89 35.540 23.370 19.350 1.00 0.00 C
663
+ ATOM 1324 C THR A 89 32.170 21.390 19.050 1.00 0.00 C
664
+ ATOM 1325 O THR A 89 31.930 21.020 17.880 1.00 0.00 O
665
+ ATOM 1326 N ALA A 90 31.610 20.680 20.060 1.00 0.00 N
666
+ ATOM 1328 CA ALA A 90 31.170 19.370 19.910 1.00 0.00 C
667
+ ATOM 1330 CB ALA A 90 30.780 18.850 21.280 1.00 0.00 C
668
+ ATOM 1334 C ALA A 90 30.030 19.180 18.880 1.00 0.00 C
669
+ ATOM 1335 O ALA A 90 29.950 18.200 18.160 1.00 0.00 O
670
+ ATOM 1336 N TRP A 91 29.070 20.170 18.890 1.00 0.00 N
671
+ ATOM 1338 CA TRP A 91 27.900 20.240 18.080 1.00 0.00 C
672
+ ATOM 1340 CB TRP A 91 26.620 20.200 19.020 1.00 0.00 C
673
+ ATOM 1343 CG TRP A 91 26.730 19.330 20.210 1.00 0.00 C
674
+ ATOM 1344 CD1 TRP A 91 26.850 17.970 20.180 1.00 0.00 C
675
+ ATOM 1346 NE1 TRP A 91 27.180 17.480 21.420 1.00 0.00 N
676
+ ATOM 1348 CE2 TRP A 91 27.340 18.570 22.280 1.00 0.00 C
677
+ ATOM 1349 CD2 TRP A 91 27.090 19.760 21.590 1.00 0.00 C
678
+ ATOM 1350 CE3 TRP A 91 27.300 20.950 22.290 1.00 0.00 C
679
+ ATOM 1352 CZ3 TRP A 91 27.720 20.930 23.640 1.00 0.00 C
680
+ ATOM 1354 CZ2 TRP A 91 27.690 18.530 23.620 1.00 0.00 C
681
+ ATOM 1356 CH2 TRP A 91 27.870 19.720 24.290 1.00 0.00 C
682
+ ATOM 1358 C TRP A 91 27.950 21.410 17.170 1.00 0.00 C
683
+ ATOM 1359 O TRP A 91 27.000 21.720 16.410 1.00 0.00 O
684
+ ATOM 1360 N GLY A 92 29.150 22.010 17.070 1.00 0.00 N
685
+ ATOM 1362 CA GLY A 92 29.520 22.940 15.990 1.00 0.00 C
686
+ ATOM 1365 C GLY A 92 29.300 24.440 16.110 1.00 0.00 C
687
+ ATOM 1366 O GLY A 92 29.370 25.160 15.150 1.00 0.00 O
688
+ ATOM 1367 N ASP A 93 29.090 24.880 17.380 1.00 0.00 N
689
+ ATOM 1369 CA ASP A 93 28.960 26.250 17.790 1.00 0.00 C
690
+ ATOM 1371 CB ASP A 93 28.830 26.350 19.380 1.00 0.00 C
691
+ ATOM 1374 CG ASP A 93 27.430 25.810 19.800 1.00 0.00 C
692
+ ATOM 1375 OD1 ASP A 93 26.900 24.740 19.360 1.00 0.00 O
693
+ ATOM 1376 OD2 ASP A 93 26.860 26.450 20.690 1.00 0.00 O
694
+ ATOM 1377 C ASP A 93 30.120 27.070 17.350 1.00 0.00 C
695
+ ATOM 1378 O ASP A 93 29.890 28.080 16.720 1.00 0.00 O
696
+ ATOM 1379 N ALA A 94 31.380 26.710 17.490 1.00 0.00 N
697
+ ATOM 1381 CA ALA A 94 32.600 27.490 17.140 1.00 0.00 C
698
+ ATOM 1383 CB ALA A 94 33.900 26.610 17.270 1.00 0.00 C
699
+ ATOM 1387 C ALA A 94 32.620 28.060 15.790 1.00 0.00 C
700
+ ATOM 1388 O ALA A 94 32.950 29.210 15.540 1.00 0.00 O
701
+ ATOM 1389 N LYS A 95 32.110 27.180 14.870 1.00 0.00 N
702
+ ATOM 1391 CA LYS A 95 32.050 27.570 13.450 1.00 0.00 C
703
+ ATOM 1393 CB LYS A 95 31.580 26.330 12.670 1.00 0.00 C
704
+ ATOM 1396 CG LYS A 95 31.880 26.470 11.160 1.00 0.00 C
705
+ ATOM 1399 CD LYS A 95 31.730 25.220 10.310 1.00 0.00 C
706
+ ATOM 1402 CE LYS A 95 32.450 25.320 8.940 1.00 0.00 C
707
+ ATOM 1405 NZ LYS A 95 31.740 26.170 8.080 1.00 0.00 N
708
+ ATOM 1409 C LYS A 95 30.910 28.590 13.090 1.00 0.00 C
709
+ ATOM 1410 O LYS A 95 31.110 29.370 12.140 1.00 0.00 O
710
+ ATOM 1411 N LYS A 96 29.870 28.760 13.920 1.00 0.00 N
711
+ ATOM 1413 CA LYS A 96 28.770 29.660 13.610 1.00 0.00 C
712
+ ATOM 1415 CB LYS A 96 27.480 28.980 14.220 1.00 0.00 C
713
+ ATOM 1418 CG LYS A 96 27.210 27.720 13.420 1.00 0.00 C
714
+ ATOM 1421 CD LYS A 96 25.800 27.170 13.740 1.00 0.00 C
715
+ ATOM 1424 CE LYS A 96 25.770 26.120 14.930 1.00 0.00 C
716
+ ATOM 1427 NZ LYS A 96 24.430 25.530 15.050 1.00 0.00 N
717
+ ATOM 1431 C LYS A 96 29.060 30.990 14.400 1.00 0.00 C
718
+ ATOM 1432 O LYS A 96 28.380 31.950 14.150 1.00 0.00 O
719
+ ATOM 1433 N VAL A 97 30.240 31.050 15.140 1.00 0.00 N
720
+ ATOM 1435 CA VAL A 97 30.590 32.350 15.740 1.00 0.00 C
721
+ ATOM 1437 CB VAL A 97 30.930 32.190 17.190 1.00 0.00 C
722
+ ATOM 1439 CG1 VAL A 97 31.110 33.570 17.850 1.00 0.00 C
723
+ ATOM 1443 CG2 VAL A 97 29.870 31.460 17.960 1.00 0.00 C
724
+ ATOM 1447 C VAL A 97 31.690 33.020 14.990 1.00 0.00 C
725
+ ATOM 1448 O VAL A 97 32.710 32.360 14.650 1.00 0.00 O
726
+ ATOM 1449 N LYS A 98 31.480 34.290 14.670 1.00 0.00 N
727
+ ATOM 1451 CA LYS A 98 32.530 35.000 13.900 1.00 0.00 C
728
+ ATOM 1453 CB LYS A 98 32.010 36.330 13.310 1.00 0.00 C
729
+ ATOM 1456 CG LYS A 98 32.830 37.160 12.210 1.00 0.00 C
730
+ ATOM 1459 CD LYS A 98 31.990 38.300 11.660 1.00 0.00 C
731
+ ATOM 1462 CE LYS A 98 32.250 39.600 12.480 1.00 0.00 C
732
+ ATOM 1465 NZ LYS A 98 32.240 39.470 13.930 1.00 0.00 N
733
+ ATOM 1469 C LYS A 98 33.670 35.360 14.800 1.00 0.00 C
734
+ ATOM 1470 O LYS A 98 33.440 35.810 15.900 1.00 0.00 O
735
+ ATOM 1471 N GLY A 99 34.940 35.100 14.360 1.00 0.00 N
736
+ ATOM 1473 CA GLY A 99 36.190 35.590 14.920 1.00 0.00 C
737
+ ATOM 1476 C GLY A 99 36.520 34.770 16.100 1.00 0.00 C
738
+ ATOM 1477 O GLY A 99 37.220 35.260 16.950 1.00 0.00 O
739
+ ATOM 1478 N PHE A 100 35.960 33.530 16.220 1.00 0.00 N
740
+ ATOM 1480 CA PHE A 100 35.940 32.820 17.460 1.00 0.00 C
741
+ ATOM 1482 CB PHE A 100 35.050 31.550 17.320 1.00 0.00 C
742
+ ATOM 1485 CG PHE A 100 35.310 30.420 18.340 1.00 0.00 C
743
+ ATOM 1486 CD1 PHE A 100 34.780 30.510 19.670 1.00 0.00 C
744
+ ATOM 1488 CE1 PHE A 100 34.990 29.410 20.580 1.00 0.00 C
745
+ ATOM 1490 CZ PHE A 100 35.670 28.210 20.200 1.00 0.00 C
746
+ ATOM 1492 CD2 PHE A 100 35.980 29.290 18.030 1.00 0.00 C
747
+ ATOM 1494 CE2 PHE A 100 36.340 28.300 18.990 1.00 0.00 C
748
+ ATOM 1496 C PHE A 100 37.330 32.430 17.980 1.00 0.00 C
749
+ ATOM 1497 O PHE A 100 38.230 31.890 17.310 1.00 0.00 O
750
+ ATOM 1498 N LYS A 101 37.610 32.610 19.290 1.00 0.00 N
751
+ ATOM 1500 CA LYS A 101 38.900 32.400 19.890 1.00 0.00 C
752
+ ATOM 1502 CB LYS A 101 39.420 33.770 20.510 1.00 0.00 C
753
+ ATOM 1505 CG LYS A 101 39.450 34.960 19.520 1.00 0.00 C
754
+ ATOM 1508 CD LYS A 101 40.430 34.870 18.260 1.00 0.00 C
755
+ ATOM 1511 CE LYS A 101 41.830 34.470 18.550 1.00 0.00 C
756
+ ATOM 1514 NZ LYS A 101 42.420 33.880 17.300 1.00 0.00 N
757
+ ATOM 1518 C LYS A 101 38.730 31.290 20.950 1.00 0.00 C
758
+ ATOM 1519 O LYS A 101 37.780 31.390 21.740 1.00 0.00 O
759
+ ATOM 1520 N PRO A 102 39.510 30.210 20.980 1.00 0.00 N
760
+ ATOM 1521 CD PRO A 102 40.100 29.710 19.700 1.00 0.00 C
761
+ ATOM 1524 CA PRO A 102 39.400 29.170 22.050 1.00 0.00 C
762
+ ATOM 1526 CB PRO A 102 40.660 28.310 21.630 1.00 0.00 C
763
+ ATOM 1529 CG PRO A 102 40.520 28.300 20.050 1.00 0.00 C
764
+ ATOM 1532 C PRO A 102 39.490 29.720 23.440 1.00 0.00 C
765
+ ATOM 1533 O PRO A 102 39.920 30.870 23.630 1.00 0.00 O
766
+ ATOM 1534 N PHE A 103 39.040 28.960 24.420 1.00 0.00 N
767
+ ATOM 1536 CA PHE A 103 39.340 29.150 25.800 1.00 0.00 C
768
+ ATOM 1538 CB PHE A 103 38.370 28.280 26.670 1.00 0.00 C
769
+ ATOM 1541 CG PHE A 103 36.990 28.880 26.620 1.00 0.00 C
770
+ ATOM 1542 CD1 PHE A 103 36.090 28.540 25.600 1.00 0.00 C
771
+ ATOM 1544 CE1 PHE A 103 34.890 29.160 25.320 1.00 0.00 C
772
+ ATOM 1546 CZ PHE A 103 34.450 30.100 26.220 1.00 0.00 C
773
+ ATOM 1548 CD2 PHE A 103 36.530 29.920 27.460 1.00 0.00 C
774
+ ATOM 1550 CE2 PHE A 103 35.190 30.420 27.370 1.00 0.00 C
775
+ ATOM 1552 C PHE A 103 40.800 28.950 26.230 1.00 0.00 C
776
+ ATOM 1553 O PHE A 103 41.470 27.930 25.860 1.00 0.00 O
777
+ ATOM 1554 N THR A 104 41.330 29.770 27.040 1.00 0.00 N
778
+ ATOM 1556 CA THR A 104 42.660 29.780 27.600 1.00 0.00 C
779
+ ATOM 1558 CB THR A 104 43.610 30.970 27.270 1.00 0.00 C
780
+ ATOM 1560 OG1 THR A 104 43.130 32.230 27.580 1.00 0.00 O
781
+ ATOM 1562 CG2 THR A 104 43.910 31.070 25.770 1.00 0.00 C
782
+ ATOM 1566 C THR A 104 42.650 29.670 29.090 1.00 0.00 C
783
+ ATOM 1567 O THR A 104 41.850 30.360 29.670 1.00 0.00 O
784
+ ATOM 1568 N ALA A 105 43.630 28.960 29.690 1.00 0.00 N
785
+ ATOM 1570 CA ALA A 105 43.880 28.840 31.100 1.00 0.00 C
786
+ ATOM 1572 CB ALA A 105 45.030 27.840 31.290 1.00 0.00 C
787
+ ATOM 1576 C ALA A 105 44.100 30.110 31.820 1.00 0.00 C
788
+ ATOM 1577 O ALA A 105 43.720 30.340 32.980 1.00 0.00 O
789
+ ATOM 1578 N GLU A 106 44.770 31.030 31.160 1.00 0.00 N
790
+ ATOM 1580 CA GLU A 106 45.080 32.370 31.620 1.00 0.00 C
791
+ ATOM 1582 CB GLU A 106 46.170 33.010 30.590 1.00 0.00 C
792
+ ATOM 1585 CG GLU A 106 47.550 32.340 30.800 1.00 0.00 C
793
+ ATOM 1588 CD GLU A 106 48.570 32.850 29.840 1.00 0.00 C
794
+ ATOM 1589 OE1 GLU A 106 49.450 33.720 30.180 1.00 0.00 O
795
+ ATOM 1590 OE2 GLU A 106 48.660 32.190 28.750 1.00 0.00 O
796
+ ATOM 1591 C GLU A 106 43.820 33.230 31.810 1.00 0.00 C
797
+ ATOM 1592 O GLU A 106 43.680 33.930 32.820 1.00 0.00 O
798
+ ATOM 1593 N GLU A 107 42.830 33.040 30.920 1.00 0.00 N
799
+ ATOM 1595 CA GLU A 107 41.500 33.600 31.100 1.00 0.00 C
800
+ ATOM 1597 CB GLU A 107 40.570 33.500 29.830 1.00 0.00 C
801
+ ATOM 1600 CG GLU A 107 41.090 34.430 28.650 1.00 0.00 C
802
+ ATOM 1603 CD GLU A 107 40.360 33.980 27.400 1.00 0.00 C
803
+ ATOM 1604 OE1 GLU A 107 40.550 32.790 27.010 1.00 0.00 O
804
+ ATOM 1605 OE2 GLU A 107 39.590 34.810 26.820 1.00 0.00 O
805
+ ATOM 1606 C GLU A 107 40.740 33.060 32.250 1.00 0.00 C
806
+ ATOM 1607 O GLU A 107 40.190 33.810 33.040 1.00 0.00 O
807
+ ATOM 1608 N VAL A 108 40.810 31.760 32.500 1.00 0.00 N
808
+ ATOM 1610 CA VAL A 108 40.280 31.170 33.710 1.00 0.00 C
809
+ ATOM 1612 CB VAL A 108 40.220 29.690 33.550 1.00 0.00 C
810
+ ATOM 1614 CG1 VAL A 108 39.870 28.960 34.850 1.00 0.00 C
811
+ ATOM 1618 CG2 VAL A 108 39.300 29.250 32.380 1.00 0.00 C
812
+ ATOM 1622 C VAL A 108 40.940 31.590 34.980 1.00 0.00 C
813
+ ATOM 1623 O VAL A 108 40.210 31.990 35.910 1.00 0.00 O
814
+ ATOM 1624 N LYS A 109 42.280 31.510 35.070 1.00 0.00 N
815
+ ATOM 1626 CA LYS A 109 43.140 31.900 36.230 1.00 0.00 C
816
+ ATOM 1628 CB LYS A 109 44.650 31.760 35.750 1.00 0.00 C
817
+ ATOM 1631 CG LYS A 109 45.710 32.050 36.820 1.00 0.00 C
818
+ ATOM 1634 CD LYS A 109 47.130 31.550 36.460 1.00 0.00 C
819
+ ATOM 1637 CE LYS A 109 48.110 31.370 37.610 1.00 0.00 C
820
+ ATOM 1640 NZ LYS A 109 49.400 30.860 37.090 1.00 0.00 N
821
+ ATOM 1644 C LYS A 109 42.880 33.290 36.730 1.00 0.00 C
822
+ ATOM 1645 O LYS A 109 42.900 33.660 37.910 1.00 0.00 O
823
+ ATOM 1646 N LYS A 110 42.680 34.230 35.770 1.00 0.00 N
824
+ ATOM 1648 CA LYS A 110 42.520 35.620 36.050 1.00 0.00 C
825
+ ATOM 1650 CB LYS A 110 42.840 36.410 34.780 1.00 0.00 C
826
+ ATOM 1653 CG LYS A 110 42.450 37.890 34.690 1.00 0.00 C
827
+ ATOM 1656 CD LYS A 110 43.200 38.740 35.740 1.00 0.00 C
828
+ ATOM 1659 CE LYS A 110 42.960 40.230 35.440 1.00 0.00 C
829
+ ATOM 1662 NZ LYS A 110 43.690 40.960 36.520 1.00 0.00 N
830
+ ATOM 1666 C LYS A 110 41.160 35.910 36.700 1.00 0.00 C
831
+ ATOM 1667 O LYS A 110 41.050 36.750 37.540 1.00 0.00 O
832
+ ATOM 1668 N LEU A 111 40.080 35.120 36.230 1.00 0.00 N
833
+ ATOM 1670 CA LEU A 111 38.710 35.420 36.700 1.00 0.00 C
834
+ ATOM 1672 CB LEU A 111 37.650 34.950 35.620 1.00 0.00 C
835
+ ATOM 1675 CG LEU A 111 37.500 35.820 34.310 1.00 0.00 C
836
+ ATOM 1677 CD1 LEU A 111 36.920 35.020 33.210 1.00 0.00 C
837
+ ATOM 1681 CD2 LEU A 111 36.850 37.230 34.490 1.00 0.00 C
838
+ ATOM 1685 C LEU A 111 38.350 34.720 38.010 1.00 0.00 C
839
+ ATOM 1686 O LEU A 111 37.300 34.970 38.660 1.00 0.00 O
840
+ ATOM 1687 N ARG A 112 39.330 33.970 38.540 1.00 0.00 N
841
+ ATOM 1689 CA ARG A 112 39.370 33.470 39.860 1.00 0.00 C
842
+ ATOM 1691 CB ARG A 112 40.530 32.430 40.080 1.00 0.00 C
843
+ ATOM 1694 CG ARG A 112 40.280 31.090 39.270 1.00 0.00 C
844
+ ATOM 1697 CD ARG A 112 41.170 30.000 39.810 1.00 0.00 C
845
+ ATOM 1700 NE ARG A 112 41.090 28.810 38.830 1.00 0.00 N
846
+ ATOM 1702 CZ ARG A 112 40.300 27.740 38.980 1.00 0.00 C
847
+ ATOM 1703 NH1 ARG A 112 39.460 27.620 39.900 1.00 0.00 N
848
+ ATOM 1706 NH2 ARG A 112 40.510 26.700 38.140 1.00 0.00 N
849
+ ATOM 1709 C ARG A 112 39.390 34.620 40.930 1.00 0.00 C
850
+ ATOM 1710 O ARG A 112 38.940 34.330 42.060 1.00 0.00 O
851
+ ATOM 1711 N ALA A 113 39.800 35.850 40.700 1.00 0.00 N
852
+ ATOM 1713 CA ALA A 113 39.770 36.910 41.680 1.00 0.00 C
853
+ ATOM 1715 CB ALA A 113 40.910 37.950 41.590 1.00 0.00 C
854
+ ATOM 1719 C ALA A 113 38.490 37.630 41.690 1.00 0.00 C
855
+ ATOM 1720 O ALA A 113 38.280 38.510 42.500 1.00 0.00 O
856
+ ATOM 1721 N LYS A 114 37.480 37.290 40.850 1.00 0.00 N
857
+ ATOM 1723 CA LYS A 114 36.170 37.840 40.950 1.00 0.00 C
858
+ ATOM 1725 CB LYS A 114 35.410 37.380 39.700 1.00 0.00 C
859
+ ATOM 1728 CG LYS A 114 35.810 38.160 38.430 1.00 0.00 C
860
+ ATOM 1731 CD LYS A 114 35.340 39.610 38.360 1.00 0.00 C
861
+ ATOM 1734 CE LYS A 114 36.130 40.570 37.520 1.00 0.00 C
862
+ ATOM 1737 NZ LYS A 114 35.610 41.960 37.630 1.00 0.00 N
863
+ ATOM 1741 C LYS A 114 35.330 37.540 42.180 1.00 0.00 C
864
+ ATOM 1742 O LYS A 114 34.650 38.370 42.740 1.00 0.00 O
865
+ ATOM 1743 N LYS A 115 35.290 36.240 42.580 1.00 0.00 N
866
+ ATOM 1745 CA LYS A 115 34.810 35.840 43.890 1.00 0.00 C
867
+ ATOM 1747 CB LYS A 115 35.600 36.370 45.050 1.00 0.00 C
868
+ ATOM 1750 CG LYS A 115 37.040 35.790 45.080 1.00 0.00 C
869
+ ATOM 1753 CD LYS A 115 37.780 36.330 46.330 1.00 0.00 C
870
+ ATOM 1756 CE LYS A 115 39.200 35.710 46.520 1.00 0.00 C
871
+ ATOM 1759 NZ LYS A 115 39.790 36.000 47.840 1.00 0.00 N
872
+ ATOM 1763 C LYS A 115 33.300 35.870 44.020 1.00 0.00 C
873
+ ATOM 1764 O LYS A 115 32.690 36.010 45.030 1.00 0.00 O
874
+ ATOM 1765 N LEU A 116 32.590 35.640 42.870 1.00 0.00 N
875
+ ATOM 1767 CA LEU A 116 31.100 35.700 42.850 1.00 0.00 C
876
+ ATOM 1769 CB LEU A 116 30.570 35.600 41.370 1.00 0.00 C
877
+ ATOM 1772 CG LEU A 116 31.340 36.560 40.410 1.00 0.00 C
878
+ ATOM 1774 CD1 LEU A 116 30.600 36.610 39.120 1.00 0.00 C
879
+ ATOM 1778 CD2 LEU A 116 31.430 38.000 40.970 1.00 0.00 C
880
+ ATOM 1782 C LEU A 116 30.310 34.750 43.690 1.00 0.00 C
881
+ ATOM 1783 O LEU A 116 30.790 33.740 44.240 1.00 0.00 O
882
+ ATOM 1784 N THR A 117 29.040 35.120 43.940 1.00 0.00 N
883
+ ATOM 1786 CA THR A 117 27.900 34.180 44.140 1.00 0.00 C
884
+ ATOM 1788 CB THR A 117 26.910 34.810 45.210 1.00 0.00 C
885
+ ATOM 1790 OG1 THR A 117 26.020 35.740 44.660 1.00 0.00 O
886
+ ATOM 1792 CG2 THR A 117 27.580 35.470 46.460 1.00 0.00 C
887
+ ATOM 1796 C THR A 117 27.150 33.920 42.810 1.00 0.00 C
888
+ ATOM 1797 O THR A 117 27.360 34.670 41.850 1.00 0.00 O
889
+ ATOM 1798 N PRO A 118 26.260 32.840 42.750 1.00 0.00 N
890
+ ATOM 1799 CD PRO A 118 26.320 31.750 43.770 1.00 0.00 C
891
+ ATOM 1802 CA PRO A 118 25.580 32.540 41.480 1.00 0.00 C
892
+ ATOM 1804 CB PRO A 118 25.040 31.150 41.770 1.00 0.00 C
893
+ ATOM 1807 CG PRO A 118 25.140 30.820 43.270 1.00 0.00 C
894
+ ATOM 1810 C PRO A 118 24.550 33.560 41.030 1.00 0.00 C
895
+ ATOM 1811 O PRO A 118 24.030 33.590 39.910 1.00 0.00 O
896
+ ATOM 1812 N GLN A 119 24.050 34.340 42.030 1.00 0.00 N
897
+ ATOM 1814 CA GLN A 119 23.170 35.510 41.950 1.00 0.00 C
898
+ ATOM 1816 CB GLN A 119 22.710 36.010 43.330 1.00 0.00 C
899
+ ATOM 1819 CG GLN A 119 21.540 35.240 43.920 1.00 0.00 C
900
+ ATOM 1822 CD GLN A 119 21.860 33.810 44.080 1.00 0.00 C
901
+ ATOM 1823 OE1 GLN A 119 21.290 32.900 43.380 1.00 0.00 O
902
+ ATOM 1824 NE2 GLN A 119 22.780 33.430 44.980 1.00 0.00 N
903
+ ATOM 1827 C GLN A 119 23.990 36.630 41.230 1.00 0.00 C
904
+ ATOM 1828 O GLN A 119 23.420 37.310 40.400 1.00 0.00 O
905
+ ATOM 1829 N GLN A 120 25.380 36.790 41.470 1.00 0.00 N
906
+ ATOM 1831 CA GLN A 120 26.080 37.770 40.810 1.00 0.00 C
907
+ ATOM 1833 CB GLN A 120 27.340 38.270 41.540 1.00 0.00 C
908
+ ATOM 1836 CG GLN A 120 27.050 39.240 42.660 1.00 0.00 C
909
+ ATOM 1839 CD GLN A 120 28.050 39.220 43.870 1.00 0.00 C
910
+ ATOM 1840 OE1 GLN A 120 29.090 39.880 43.900 1.00 0.00 O
911
+ ATOM 1841 NE2 GLN A 120 27.680 38.470 44.910 1.00 0.00 N
912
+ ATOM 1844 C GLN A 120 26.350 37.370 39.380 1.00 0.00 C
913
+ ATOM 1845 O GLN A 120 26.350 38.120 38.420 1.00 0.00 O
914
+ ATOM 1846 N VAL A 121 26.590 36.030 39.110 1.00 0.00 N
915
+ ATOM 1848 CA VAL A 121 26.750 35.440 37.780 1.00 0.00 C
916
+ ATOM 1850 CB VAL A 121 27.150 33.950 37.760 1.00 0.00 C
917
+ ATOM 1852 CG1 VAL A 121 27.370 33.540 36.290 1.00 0.00 C
918
+ ATOM 1856 CG2 VAL A 121 28.400 33.670 38.600 1.00 0.00 C
919
+ ATOM 1860 C VAL A 121 25.490 35.590 36.820 1.00 0.00 C
920
+ ATOM 1861 O VAL A 121 25.600 36.180 35.770 1.00 0.00 O
921
+ ATOM 1862 N LEU A 122 24.290 35.350 37.330 1.00 0.00 N
922
+ ATOM 1864 CA LEU A 122 23.030 35.800 36.810 1.00 0.00 C
923
+ ATOM 1866 CB LEU A 122 21.750 35.390 37.670 1.00 0.00 C
924
+ ATOM 1869 CG LEU A 122 20.380 35.690 37.000 1.00 0.00 C
925
+ ATOM 1871 CD1 LEU A 122 20.270 35.030 35.620 1.00 0.00 C
926
+ ATOM 1875 CD2 LEU A 122 19.240 35.340 38.010 1.00 0.00 C
927
+ ATOM 1879 C LEU A 122 22.900 37.290 36.400 1.00 0.00 C
928
+ ATOM 1880 O LEU A 122 22.570 37.660 35.290 1.00 0.00 O
929
+ ATOM 1881 N ALA A 123 23.390 38.220 37.350 1.00 0.00 N
930
+ ATOM 1883 CA ALA A 123 23.470 39.630 36.980 1.00 0.00 C
931
+ ATOM 1885 CB ALA A 123 23.920 40.420 38.210 1.00 0.00 C
932
+ ATOM 1889 C ALA A 123 24.360 39.880 35.710 1.00 0.00 C
933
+ ATOM 1890 O ALA A 123 23.960 40.560 34.780 1.00 0.00 O
934
+ ATOM 1891 N GLU A 124 25.560 39.250 35.670 1.00 0.00 N
935
+ ATOM 1893 CA GLU A 124 26.380 39.320 34.500 1.00 0.00 C
936
+ ATOM 1895 CB GLU A 124 27.820 38.670 34.690 1.00 0.00 C
937
+ ATOM 1898 CG GLU A 124 28.560 39.340 35.810 1.00 0.00 C
938
+ ATOM 1901 CD GLU A 124 28.860 40.810 35.590 1.00 0.00 C
939
+ ATOM 1902 OE1 GLU A 124 29.310 41.260 34.510 1.00 0.00 O
940
+ ATOM 1903 OE2 GLU A 124 28.610 41.620 36.570 1.00 0.00 O
941
+ ATOM 1904 C GLU A 124 25.720 38.730 33.260 1.00 0.00 C
942
+ ATOM 1905 O GLU A 124 25.810 39.340 32.170 1.00 0.00 O
943
+ ATOM 1906 N ARG A 125 24.950 37.570 33.420 1.00 0.00 N
944
+ ATOM 1908 CA ARG A 125 24.110 37.050 32.290 1.00 0.00 C
945
+ ATOM 1910 CB ARG A 125 23.240 35.890 32.780 1.00 0.00 C
946
+ ATOM 1913 CG ARG A 125 22.530 35.150 31.640 1.00 0.00 C
947
+ ATOM 1916 CD ARG A 125 21.540 34.100 32.180 1.00 0.00 C
948
+ ATOM 1919 NE ARG A 125 21.360 33.050 31.170 1.00 0.00 N
949
+ ATOM 1921 CZ ARG A 125 20.660 33.300 30.100 1.00 0.00 C
950
+ ATOM 1922 NH1 ARG A 125 19.870 34.360 29.990 1.00 0.00 N
951
+ ATOM 1925 NH2 ARG A 125 21.040 32.630 28.980 1.00 0.00 N
952
+ ATOM 1928 C ARG A 125 23.110 38.080 31.750 1.00 0.00 C
953
+ ATOM 1929 O ARG A 125 22.930 38.310 30.550 1.00 0.00 O
954
+ ATOM 1930 N LYS A 126 22.460 38.820 32.690 1.00 0.00 N
955
+ ATOM 1932 CA LYS A 126 21.510 39.930 32.460 1.00 0.00 C
956
+ ATOM 1934 CB LYS A 126 20.710 40.320 33.720 1.00 0.00 C
957
+ ATOM 1937 CG LYS A 126 19.550 39.330 34.160 1.00 0.00 C
958
+ ATOM 1940 CD LYS A 126 18.760 39.670 35.510 1.00 0.00 C
959
+ ATOM 1943 CE LYS A 126 17.780 38.580 36.010 1.00 0.00 C
960
+ ATOM 1946 NZ LYS A 126 17.120 38.980 37.180 1.00 0.00 N
961
+ ATOM 1950 C LYS A 126 22.140 41.120 31.760 1.00 0.00 C
962
+ ATOM 1951 O LYS A 126 21.550 41.860 30.970 1.00 0.00 O
963
+ ATOM 1952 N LYS A 127 23.420 41.360 31.930 1.00 0.00 N
964
+ ATOM 1954 CA LYS A 127 24.190 42.360 31.180 1.00 0.00 C
965
+ ATOM 1956 CB LYS A 127 25.470 42.680 31.920 1.00 0.00 C
966
+ ATOM 1959 CG LYS A 127 25.360 43.410 33.260 1.00 0.00 C
967
+ ATOM 1962 CD LYS A 127 26.530 43.310 34.170 1.00 0.00 C
968
+ ATOM 1965 CE LYS A 127 26.210 43.670 35.640 1.00 0.00 C
969
+ ATOM 1968 NZ LYS A 127 27.440 43.920 36.380 1.00 0.00 N
970
+ ATOM 1972 C LYS A 127 24.480 42.020 29.730 1.00 0.00 C
971
+ ATOM 1973 O LYS A 127 24.700 42.860 28.840 1.00 0.00 O
972
+ ATOM 1974 N LEU A 128 24.480 40.710 29.400 1.00 0.00 N
973
+ ATOM 1976 CA LEU A 128 24.620 40.270 27.990 1.00 0.00 C
974
+ ATOM 1978 CB LEU A 128 24.930 38.790 27.860 1.00 0.00 C
975
+ ATOM 1981 CG LEU A 128 26.100 38.330 28.800 1.00 0.00 C
976
+ ATOM 1983 CD1 LEU A 128 26.220 36.760 28.860 1.00 0.00 C
977
+ ATOM 1987 CD2 LEU A 128 27.470 38.880 28.280 1.00 0.00 C
978
+ ATOM 1991 C LEU A 128 23.570 40.670 26.960 1.00 0.00 C
979
+ ATOM 1992 O LEU A 128 23.850 40.920 25.780 1.00 0.00 O
980
+ ATOM 1993 N GLY A 129 22.280 40.660 27.420 1.00 0.00 N
981
+ ATOM 1995 CA GLY A 129 21.210 41.190 26.610 1.00 0.00 C
982
+ ATOM 1998 C GLY A 129 20.630 40.110 25.790 1.00 0.00 C
983
+ ATOM 1999 O GLY A 129 20.300 40.340 24.590 1.00 0.00 O
984
+ ATOM 2000 N LEU A 130 20.450 38.870 26.300 1.00 0.00 N
985
+ ATOM 2002 CA LEU A 130 20.010 37.670 25.500 1.00 0.00 C
986
+ ATOM 2004 CB LEU A 130 20.580 36.330 26.070 1.00 0.00 C
987
+ ATOM 2007 CG LEU A 130 22.100 36.130 26.100 1.00 0.00 C
988
+ ATOM 2009 CD1 LEU A 130 22.500 34.940 27.030 1.00 0.00 C
989
+ ATOM 2013 CD2 LEU A 130 22.640 35.950 24.700 1.00 0.00 C
990
+ ATOM 2017 C LEU A 130 18.520 37.570 25.200 1.00 0.00 C
991
+ ATOM 2018 O LEU A 130 18.070 38.170 24.200 1.00 0.00 O
992
+ ATOM 2019 N LYS A 131 17.770 36.780 26.010 1.00 0.00 N
993
+ ATOM 2021 CA LYS A 131 16.410 36.600 25.680 1.00 0.00 C
994
+ ATOM 2023 CB LYS A 131 16.100 35.310 24.870 1.00 0.00 C
995
+ ATOM 2026 CG LYS A 131 16.900 35.210 23.510 1.00 0.00 C
996
+ ATOM 2029 CD LYS A 131 16.680 33.980 22.630 1.00 0.00 C
997
+ ATOM 2032 CE LYS A 131 17.960 33.600 21.870 1.00 0.00 C
998
+ ATOM 2035 NZ LYS A 131 17.750 32.510 20.910 1.00 0.00 N
999
+ ATOM 2039 C LYS A 131 15.570 36.570 27.030 1.00 0.00 C
1000
+ ATOM 2040 O LYS A 131 16.170 36.490 28.100 1.00 0.00 O
1001
+ ATOM 2041 OXT LYS A 131 14.360 36.750 26.890 1.00 0.00 O
1002
+ TER 2042 LYS A 131
1003
+ ENDMDL
1004
+ END