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data/all_structures/chothia/7me7.pdb ADDED
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data/all_structures/chothia/7mem.pdb ADDED
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1
+ REMARK 5 CHOTHIA RENUMBERED STRUCTURE 7MFV GENERATED BY SABDAB
2
+ REMARK 5 ANTIBODY CHAINS ARE RENUMBERED IN THE VARIABLE REGIONS ONLY
3
+ REMARK 5 NON ANTIBODY CHAINS ARE LEFT WITH RESIDUE IDS AS IN PDB
4
+ REMARK 5 SINGLE HCHAIN=B AGCHAIN=NONE AGTYPE=NONE
5
+ ATOM 1 N GLN B 1 7.972 18.973 30.301 1.00 73.74 N
6
+ ATOM 2 CA GLN B 1 7.630 20.278 29.744 1.00 71.57 C
7
+ ATOM 3 C GLN B 1 8.487 20.578 28.520 1.00 67.58 C
8
+ ATOM 4 O GLN B 1 8.104 21.375 27.653 1.00 64.29 O
9
+ ATOM 5 CB GLN B 1 7.790 21.388 30.797 1.00 79.99 C
10
+ ATOM 6 CG GLN B 1 7.382 22.780 30.312 1.00 74.21 C
11
+ ATOM 7 CD GLN B 1 8.060 23.892 31.091 0.50 77.76 C
12
+ ATOM 8 OE1 GLN B 1 9.031 24.488 30.622 0.50 72.68 O
13
+ ATOM 9 NE2 GLN B 1 7.552 24.176 32.285 0.00 79.99 N
14
+ ATOM 10 N VAL B 2 9.658 19.962 28.423 1.00 65.57 N
15
+ ATOM 11 CA VAL B 2 10.442 20.098 27.200 1.00 60.94 C
16
+ ATOM 12 C VAL B 2 9.958 19.065 26.193 1.00 60.44 C
17
+ ATOM 13 O VAL B 2 9.884 17.861 26.488 1.00 60.35 O
18
+ ATOM 14 CB VAL B 2 11.945 19.956 27.472 1.00 60.64 C
19
+ ATOM 15 CG1 VAL B 2 12.688 19.704 26.164 1.00 56.50 C
20
+ ATOM 16 CG2 VAL B 2 12.467 21.219 28.089 1.00 61.79 C
21
+ ATOM 17 N GLN B 3 9.622 19.534 24.993 1.00 55.70 N
22
+ ATOM 18 CA GLN B 3 9.098 18.666 23.961 1.00 56.98 C
23
+ ATOM 19 C GLN B 3 9.693 19.080 22.631 1.00 49.86 C
24
+ ATOM 20 O GLN B 3 9.801 20.271 22.343 1.00 48.71 O
25
+ ATOM 21 CB GLN B 3 7.581 18.742 23.885 1.00 67.34 C
26
+ ATOM 22 CG GLN B 3 6.960 17.692 22.996 1.00 61.88 C
27
+ ATOM 23 CD GLN B 3 5.846 16.991 23.723 1.00 70.44 C
28
+ ATOM 24 OE1 GLN B 3 5.620 17.237 24.916 1.00 78.05 O
29
+ ATOM 25 NE2 GLN B 3 5.145 16.107 23.022 1.00 79.91 N
30
+ ATOM 26 N LEU B 4 10.110 18.085 21.864 1.00 54.60 N
31
+ ATOM 27 CA LEU B 4 10.520 18.236 20.483 1.00 44.69 C
32
+ ATOM 28 C LEU B 4 9.611 17.363 19.650 1.00 55.80 C
33
+ ATOM 29 O LEU B 4 9.325 16.220 20.022 1.00 54.14 O
34
+ ATOM 30 CB LEU B 4 11.987 17.822 20.266 1.00 45.28 C
35
+ ATOM 31 CG LEU B 4 13.018 18.742 20.930 1.00 50.57 C
36
+ ATOM 32 CD1 LEU B 4 14.361 18.616 20.246 1.00 54.58 C
37
+ ATOM 33 CD2 LEU B 4 12.557 20.182 20.921 1.00 52.76 C
38
+ ATOM 34 N VAL B 5 9.137 17.911 18.538 1.00 43.17 N
39
+ ATOM 35 CA VAL B 5 8.235 17.198 17.664 1.00 42.94 C
40
+ ATOM 36 C VAL B 5 8.779 17.375 16.255 1.00 46.28 C
41
+ ATOM 37 O VAL B 5 8.788 18.498 15.728 1.00 42.22 O
42
+ ATOM 38 CB VAL B 5 6.803 17.719 17.778 1.00 44.61 C
43
+ ATOM 39 CG1 VAL B 5 5.937 17.053 16.742 1.00 47.27 C
44
+ ATOM 40 CG2 VAL B 5 6.263 17.448 19.177 1.00 47.34 C
45
+ ATOM 41 N GLU B 6 9.272 16.285 15.668 1.00 44.54 N
46
+ ATOM 42 CA GLU B 6 9.730 16.281 14.275 1.00 36.80 C
47
+ ATOM 43 C GLU B 6 8.579 16.085 13.281 1.00 46.17 C
48
+ ATOM 44 O GLU B 6 7.643 15.335 13.540 1.00 42.38 O
49
+ ATOM 45 CB GLU B 6 10.751 15.169 14.080 1.00 35.32 C
50
+ ATOM 46 CG GLU B 6 11.987 15.281 14.932 1.00 40.92 C
51
+ ATOM 47 CD GLU B 6 11.924 14.415 16.205 1.00 49.78 C
52
+ ATOM 48 OE1 GLU B 6 12.969 14.283 16.895 1.00 48.61 O
53
+ ATOM 49 OE2 GLU B 6 10.838 13.861 16.513 1.00 52.54 O
54
+ ATOM 50 N SER B 7 8.664 16.733 12.112 1.00 33.64 N
55
+ ATOM 51 CA SER B 7 7.699 16.484 11.055 1.00 37.71 C
56
+ ATOM 52 C SER B 7 8.341 16.881 9.733 1.00 38.34 C
57
+ ATOM 53 O SER B 7 9.445 17.425 9.701 1.00 34.22 O
58
+ ATOM 54 CB SER B 7 6.395 17.242 11.289 1.00 41.87 C
59
+ ATOM 55 OG SER B 7 6.595 18.634 11.113 1.00 42.19 O
60
+ ATOM 56 N GLY B 8 7.654 16.586 8.643 1.00 34.70 N
61
+ ATOM 57 CA GLY B 8 8.153 16.945 7.323 1.00 33.78 C
62
+ ATOM 58 C GLY B 8 8.697 15.779 6.544 1.00 37.30 C
63
+ ATOM 59 O GLY B 8 9.025 15.942 5.363 1.00 39.61 O
64
+ ATOM 60 N GLY B 9 8.791 14.595 7.161 1.00 41.23 N
65
+ ATOM 61 CA GLY B 9 9.227 13.415 6.448 1.00 37.97 C
66
+ ATOM 62 C GLY B 9 8.235 12.981 5.380 1.00 49.21 C
67
+ ATOM 63 O GLY B 9 7.123 13.500 5.261 1.00 48.82 O
68
+ ATOM 64 N GLY B 10 8.659 11.999 4.588 1.00 44.97 N
69
+ ATOM 65 CA GLY B 10 7.755 11.381 3.630 1.00 48.11 C
70
+ ATOM 66 C GLY B 10 8.505 10.522 2.629 1.00 50.56 C
71
+ ATOM 67 O GLY B 10 9.609 10.040 2.903 1.00 47.03 O
72
+ ATOM 68 N LEU B 11 7.897 10.355 1.458 1.00 48.86 N
73
+ ATOM 69 CA LEU B 11 8.376 9.435 0.432 1.00 46.47 C
74
+ ATOM 70 C LEU B 11 8.654 10.210 -0.841 1.00 42.86 C
75
+ ATOM 71 O LEU B 11 7.724 10.731 -1.459 1.00 56.16 O
76
+ ATOM 72 CB LEU B 11 7.343 8.342 0.167 1.00 50.14 C
77
+ ATOM 73 CG LEU B 11 7.727 7.371 -0.947 1.00 59.62 C
78
+ ATOM 74 CD1 LEU B 11 8.615 6.258 -0.397 1.00 54.10 C
79
+ ATOM 75 CD2 LEU B 11 6.479 6.808 -1.595 1.00 61.58 C
80
+ ATOM 76 N VAL B 12 9.930 10.268 -1.248 1.00 47.39 N
81
+ ATOM 77 CA VAL B 12 10.324 10.892 -2.504 1.00 44.38 C
82
+ ATOM 78 C VAL B 12 11.182 9.913 -3.292 1.00 50.28 C
83
+ ATOM 79 O VAL B 12 11.642 8.887 -2.777 1.00 56.78 O
84
+ ATOM 80 CB VAL B 12 11.087 12.222 -2.303 1.00 50.75 C
85
+ ATOM 81 CG1 VAL B 12 10.229 13.203 -1.548 1.00 44.06 C
86
+ ATOM 82 CG2 VAL B 12 12.423 11.993 -1.575 1.00 43.30 C
87
+ ATOM 83 N GLN B 13 11.384 10.241 -4.561 1.00 49.03 N
88
+ ATOM 84 CA GLN B 13 12.277 9.488 -5.426 1.00 57.69 C
89
+ ATOM 85 C GLN B 13 13.667 10.100 -5.351 1.00 52.67 C
90
+ ATOM 86 O GLN B 13 13.832 11.274 -4.992 1.00 50.10 O
91
+ ATOM 87 CB GLN B 13 11.756 9.473 -6.872 0.50 54.29 C
92
+ ATOM 88 CG GLN B 13 11.006 10.745 -7.264 0.50 49.62 C
93
+ ATOM 89 CD GLN B 13 10.700 10.824 -8.743 0.50 55.20 C
94
+ ATOM 90 OE1 GLN B 13 11.009 9.904 -9.512 0.50 56.56 O
95
+ ATOM 91 NE2 GLN B 13 10.088 11.931 -9.156 1.00 49.08 N
96
+ ATOM 92 N ALA B 14 14.675 9.278 -5.651 1.00 45.46 N
97
+ ATOM 93 CA ALA B 14 16.049 9.764 -5.651 1.00 44.87 C
98
+ ATOM 94 C ALA B 14 16.117 11.093 -6.376 1.00 54.41 C
99
+ ATOM 95 O ALA B 14 15.549 11.248 -7.462 1.00 46.93 O
100
+ ATOM 96 CB ALA B 14 16.977 8.742 -6.306 1.00 48.15 C
101
+ ATOM 97 N GLY B 15 16.746 12.081 -5.731 1.00 47.93 N
102
+ ATOM 98 CA GLY B 15 16.969 13.382 -6.330 1.00 35.66 C
103
+ ATOM 99 C GLY B 15 16.058 14.487 -5.821 1.00 36.82 C
104
+ ATOM 100 O GLY B 15 16.367 15.664 -6.023 1.00 36.81 O
105
+ ATOM 101 N GLY B 16 14.950 14.143 -5.183 1.00 37.73 N
106
+ ATOM 102 CA GLY B 16 14.022 15.131 -4.693 1.00 40.78 C
107
+ ATOM 103 C GLY B 16 14.493 15.762 -3.391 1.00 39.08 C
108
+ ATOM 104 O GLY B 16 15.617 15.564 -2.925 1.00 36.03 O
109
+ ATOM 105 N SER B 17 13.596 16.546 -2.806 1.00 40.38 N
110
+ ATOM 106 CA SER B 17 13.903 17.348 -1.630 1.00 30.14 C
111
+ ATOM 107 C SER B 17 12.835 17.140 -0.584 1.00 33.61 C
112
+ ATOM 108 O SER B 17 11.707 16.782 -0.899 1.00 30.57 O
113
+ ATOM 109 CB SER B 17 13.950 18.835 -1.954 1.00 32.65 C
114
+ ATOM 110 OG SER B 17 15.082 19.174 -2.717 1.00 32.90 O
115
+ ATOM 111 N LEU B 18 13.201 17.379 0.668 1.00 27.74 N
116
+ ATOM 112 CA LEU B 18 12.250 17.417 1.768 1.00 29.88 C
117
+ ATOM 113 C LEU B 18 12.660 18.558 2.676 1.00 30.69 C
118
+ ATOM 114 O LEU B 18 13.800 19.037 2.617 1.00 27.00 O
119
+ ATOM 115 CB LEU B 18 12.232 16.097 2.553 1.00 28.59 C
120
+ ATOM 116 CG LEU B 18 11.556 14.881 1.894 1.00 36.70 C
121
+ ATOM 117 CD1 LEU B 18 11.805 13.626 2.696 1.00 34.32 C
122
+ ATOM 118 CD2 LEU B 18 10.074 15.126 1.796 1.00 34.23 C
123
+ ATOM 119 N ARG B 19 11.742 19.000 3.531 1.00 28.55 N
124
+ ATOM 120 CA ARG B 19 12.146 19.927 4.584 1.00 30.98 C
125
+ ATOM 121 C ARG B 19 11.618 19.419 5.929 1.00 25.77 C
126
+ ATOM 122 O ARG B 19 10.410 19.459 6.179 1.00 31.05 O
127
+ ATOM 123 CB ARG B 19 11.683 21.359 4.328 1.00 26.54 C
128
+ ATOM 124 CG ARG B 19 12.263 22.255 5.466 1.00 31.04 C
129
+ ATOM 125 CD ARG B 19 12.181 23.744 5.210 1.00 34.44 C
130
+ ATOM 126 NE ARG B 19 10.915 24.251 5.681 1.00 41.23 N
131
+ ATOM 127 CZ ARG B 19 10.488 25.493 5.493 1.00 55.20 C
132
+ ATOM 128 NH1 ARG B 19 11.254 26.344 4.812 1.00 59.72 N
133
+ ATOM 129 NH2 ARG B 19 9.291 25.874 5.962 1.00 50.75 N
134
+ ATOM 130 N LEU B 20 12.514 18.936 6.774 1.00 25.66 N
135
+ ATOM 131 CA LEU B 20 12.108 18.554 8.127 1.00 31.39 C
136
+ ATOM 132 C LEU B 20 12.022 19.753 9.070 1.00 29.14 C
137
+ ATOM 133 O LEU B 20 12.835 20.675 8.997 1.00 30.95 O
138
+ ATOM 134 CB LEU B 20 13.098 17.559 8.706 1.00 34.72 C
139
+ ATOM 135 CG LEU B 20 13.444 16.446 7.744 1.00 29.88 C
140
+ ATOM 136 CD1 LEU B 20 14.308 15.441 8.505 1.00 27.60 C
141
+ ATOM 137 CD2 LEU B 20 12.140 15.816 7.220 1.00 33.46 C
142
+ ATOM 138 N SER B 21 11.055 19.705 9.985 1.00 30.51 N
143
+ ATOM 139 CA SER B 21 10.839 20.690 11.035 1.00 35.50 C
144
+ ATOM 140 C SER B 21 10.962 20.030 12.404 1.00 37.62 C
145
+ ATOM 141 O SER B 21 10.434 18.936 12.624 1.00 37.11 O
146
+ ATOM 142 CB SER B 21 9.458 21.308 10.983 1.00 32.77 C
147
+ ATOM 143 OG SER B 21 9.394 22.275 9.965 1.00 46.11 O
148
+ ATOM 144 N CYS B 22 11.589 20.734 13.327 1.00 35.31 N
149
+ ATOM 145 CA CYS B 22 11.710 20.331 14.727 1.00 41.77 C
150
+ ATOM 146 C CYS B 22 11.053 21.433 15.545 1.00 34.53 C
151
+ ATOM 147 O CYS B 22 11.656 22.491 15.740 1.00 37.03 O
152
+ ATOM 148 CB CYS B 22 13.166 20.174 15.111 1.00 39.54 C
153
+ ATOM 149 SG CYS B 22 13.385 19.716 16.894 0.80 46.56 S
154
+ ATOM 150 N ALA B 23 9.808 21.222 15.953 1.00 36.20 N
155
+ ATOM 151 CA ALA B 23 9.078 22.217 16.716 1.00 38.09 C
156
+ ATOM 152 C ALA B 23 9.368 21.987 18.207 1.00 45.46 C
157
+ ATOM 153 O ALA B 23 9.135 20.885 18.735 1.00 41.63 O
158
+ ATOM 154 CB ALA B 23 7.587 22.137 16.407 1.00 39.20 C
159
+ ATOM 155 N ALA B 24 9.923 23.006 18.855 1.00 41.43 N
160
+ ATOM 156 CA ALA B 24 10.325 22.933 20.256 1.00 45.26 C
161
+ ATOM 157 C ALA B 24 9.275 23.565 21.139 1.00 46.72 C
162
+ ATOM 158 O ALA B 24 8.594 24.509 20.744 1.00 49.85 O
163
+ ATOM 159 CB ALA B 24 11.654 23.639 20.502 1.00 46.22 C
164
+ ATOM 160 N SER B 25 9.169 23.049 22.357 1.00 49.13 N
165
+ ATOM 161 CA SER B 25 8.215 23.615 23.285 1.00 52.41 C
166
+ ATOM 162 C SER B 25 8.769 23.392 24.678 1.00 56.15 C
167
+ ATOM 163 O SER B 25 9.503 22.425 24.923 1.00 55.10 O
168
+ ATOM 164 CB SER B 25 6.803 23.017 23.115 1.00 59.54 C
169
+ ATOM 165 OG SER B 25 6.641 21.771 23.781 1.00 61.43 O
170
+ ATOM 166 N GLY B 26 8.427 24.317 25.573 1.00 58.85 N
171
+ ATOM 167 CA GLY B 26 9.120 24.477 26.842 1.00 75.57 C
172
+ ATOM 168 C GLY B 26 10.225 25.496 26.616 1.00 87.85 C
173
+ ATOM 169 O GLY B 26 9.975 26.706 26.550 1.00 94.80 O
174
+ ATOM 170 N PHE B 27 11.434 24.995 26.397 1.00 73.81 N
175
+ ATOM 171 CA PHE B 27 12.629 25.819 26.323 1.00 65.54 C
176
+ ATOM 172 C PHE B 27 12.658 26.667 25.053 1.00 70.62 C
177
+ ATOM 173 O PHE B 27 12.081 26.283 24.032 1.00 59.75 O
178
+ ATOM 174 CB PHE B 27 13.852 24.925 26.309 1.00 69.11 C
179
+ ATOM 175 CG PHE B 27 13.998 24.159 25.031 1.00 64.02 C
180
+ ATOM 176 CD1 PHE B 27 13.122 23.131 24.738 1.00 60.99 C
181
+ ATOM 177 CD2 PHE B 27 14.994 24.472 24.113 1.00 59.95 C
182
+ ATOM 178 CE1 PHE B 27 13.243 22.415 23.599 1.00 52.24 C
183
+ ATOM 179 CE2 PHE B 27 15.125 23.765 22.946 1.00 58.43 C
184
+ ATOM 180 CZ PHE B 27 14.246 22.729 22.672 1.00 60.88 C
185
+ ATOM 181 N PRO B 28 13.395 27.781 25.056 1.00 65.10 N
186
+ ATOM 182 CA PRO B 28 13.577 28.529 23.809 1.00 53.41 C
187
+ ATOM 183 C PRO B 28 14.685 27.925 22.956 1.00 58.13 C
188
+ ATOM 184 O PRO B 28 15.767 27.554 23.429 1.00 48.68 O
189
+ ATOM 185 CB PRO B 28 13.922 29.940 24.297 1.00 53.23 C
190
+ ATOM 186 CG PRO B 28 14.692 29.684 25.539 1.00 57.61 C
191
+ ATOM 187 CD PRO B 28 14.153 28.397 26.155 1.00 56.80 C
192
+ ATOM 188 N VAL B 29 14.379 27.840 21.667 1.00 52.54 N
193
+ ATOM 189 CA VAL B 29 15.178 27.105 20.702 1.00 55.90 C
194
+ ATOM 190 C VAL B 29 16.485 27.826 20.422 1.00 52.49 C
195
+ ATOM 191 O VAL B 29 17.549 27.192 20.309 1.00 45.70 O
196
+ ATOM 192 CB VAL B 29 14.322 26.913 19.427 1.00 52.54 C
197
+ ATOM 193 CG1 VAL B 29 14.803 27.716 18.265 1.00 46.31 C
198
+ ATOM 194 CG2 VAL B 29 14.170 25.503 19.084 1.00 50.35 C
199
+ ATOM 195 N ALA B 30 16.427 29.161 20.309 1.00 43.25 N
200
+ ATOM 196 CA ALA B 30 17.599 29.950 19.938 1.00 42.53 C
201
+ ATOM 197 C ALA B 30 18.750 29.810 20.948 1.00 48.38 C
202
+ ATOM 198 O ALA B 30 19.920 30.030 20.593 1.00 43.74 O
203
+ ATOM 199 CB ALA B 30 17.195 31.417 19.808 1.00 54.51 C
204
+ ATOM 200 N TYR B 31 18.461 29.468 22.212 1.00 46.65 N
205
+ ATOM 201 CA TYR B 31 19.527 29.458 23.193 1.00 48.90 C
206
+ ATOM 202 C TYR B 31 20.094 28.076 23.485 1.00 48.95 C
207
+ ATOM 203 O TYR B 31 20.736 27.885 24.532 1.00 51.36 O
208
+ ATOM 204 CB TYR B 31 19.036 30.097 24.495 1.00 52.50 C
209
+ ATOM 205 CG TYR B 31 18.806 31.540 24.287 1.00 53.26 C
210
+ ATOM 206 CD1 TYR B 31 19.867 32.413 24.275 1.00 54.16 C
211
+ ATOM 207 CD2 TYR B 31 17.547 32.033 24.075 1.00 53.35 C
212
+ ATOM 208 CE1 TYR B 31 19.681 33.745 24.072 1.00 60.63 C
213
+ ATOM 209 CE2 TYR B 31 17.347 33.371 23.862 1.00 59.18 C
214
+ ATOM 210 CZ TYR B 31 18.428 34.221 23.857 1.00 59.09 C
215
+ ATOM 211 OH TYR B 31 18.270 35.565 23.654 1.00 73.96 O
216
+ ATOM 212 N LYS B 32 19.837 27.098 22.641 1.00 46.27 N
217
+ ATOM 213 CA LYS B 32 20.424 25.785 22.834 1.00 46.34 C
218
+ ATOM 214 C LYS B 32 21.089 25.350 21.543 1.00 51.78 C
219
+ ATOM 215 O LYS B 32 20.633 25.710 20.472 1.00 41.23 O
220
+ ATOM 216 CB LYS B 32 19.378 24.792 23.212 1.00 46.81 C
221
+ ATOM 217 CG LYS B 32 18.823 25.065 24.618 1.00 50.28 C
222
+ ATOM 218 CD LYS B 32 19.367 24.044 25.569 1.00 53.72 C
223
+ ATOM 219 CE LYS B 32 20.752 24.355 26.059 1.00 54.27 C
224
+ ATOM 220 NZ LYS B 32 20.808 24.790 27.501 1.00 58.39 N
225
+ ATOM 221 N THR B 33 22.189 24.619 21.656 1.00 47.22 N
226
+ ATOM 222 CA THR B 33 22.740 23.971 20.483 1.00 41.73 C
227
+ ATOM 223 C THR B 33 21.850 22.787 20.114 1.00 47.78 C
228
+ ATOM 224 O THR B 33 21.369 22.064 20.981 1.00 42.22 O
229
+ ATOM 225 CB THR B 33 24.178 23.549 20.745 1.00 43.10 C
230
+ ATOM 226 OG1 THR B 33 24.954 24.716 21.060 1.00 44.39 O
231
+ ATOM 227 CG2 THR B 33 24.775 22.847 19.479 1.00 41.02 C
232
+ ATOM 228 N MET B 34 21.566 22.610 18.825 1.00 44.65 N
233
+ ATOM 229 CA MET B 34 20.661 21.536 18.457 1.00 42.84 C
234
+ ATOM 230 C MET B 34 21.274 20.669 17.383 1.00 38.98 C
235
+ ATOM 231 O MET B 34 22.022 21.150 16.539 1.00 36.81 O
236
+ ATOM 232 CB MET B 34 19.342 22.064 17.953 1.00 42.47 C
237
+ ATOM 233 CG MET B 34 18.598 22.767 18.989 0.00 46.72 C
238
+ ATOM 234 SD MET B 34 17.100 21.860 19.187 0.50 47.78 S
239
+ ATOM 235 CE MET B 34 16.152 23.173 19.675 1.00 51.57 C
240
+ ATOM 236 N TRP B 35 20.955 19.392 17.430 1.00 38.63 N
241
+ ATOM 237 CA TRP B 35 21.519 18.437 16.496 1.00 37.09 C
242
+ ATOM 238 C TRP B 35 20.364 17.699 15.848 1.00 41.27 C
243
+ ATOM 239 O TRP B 35 19.293 17.559 16.464 1.00 37.25 O
244
+ ATOM 240 CB TRP B 35 22.441 17.431 17.189 1.00 38.76 C
245
+ ATOM 241 CG TRP B 35 23.724 17.964 17.883 1.00 39.08 C
246
+ ATOM 242 CD1 TRP B 35 24.991 17.767 17.454 1.00 47.01 C
247
+ ATOM 243 CD2 TRP B 35 23.837 18.725 19.107 1.00 52.51 C
248
+ ATOM 244 NE1 TRP B 35 25.891 18.352 18.303 1.00 43.20 N
249
+ ATOM 245 CE2 TRP B 35 25.214 18.945 19.331 1.00 53.27 C
250
+ ATOM 246 CE3 TRP B 35 22.915 19.234 20.034 0.30 45.65 C
251
+ ATOM 247 CZ2 TRP B 35 25.703 19.650 20.454 1.00 66.76 C
252
+ ATOM 248 CZ3 TRP B 35 23.398 19.937 21.156 0.50 53.81 C
253
+ ATOM 249 CH2 TRP B 35 24.782 20.119 21.365 1.00 69.31 C
254
+ ATOM 250 N TRP B 36 20.568 17.281 14.597 1.00 33.20 N
255
+ ATOM 251 CA TRP B 36 19.765 16.274 13.921 1.00 31.34 C
256
+ ATOM 252 C TRP B 36 20.603 15.006 13.822 1.00 35.21 C
257
+ ATOM 253 O TRP B 36 21.807 15.070 13.494 1.00 31.13 O
258
+ ATOM 254 CB TRP B 36 19.371 16.716 12.480 1.00 30.08 C
259
+ ATOM 255 CG TRP B 36 18.221 17.748 12.381 1.00 33.94 C
260
+ ATOM 256 CD1 TRP B 36 18.348 19.103 12.311 1.00 31.19 C
261
+ ATOM 257 CD2 TRP B 36 16.801 17.483 12.318 1.00 34.73 C
262
+ ATOM 258 NE1 TRP B 36 17.110 19.698 12.232 1.00 35.14 N
263
+ ATOM 259 CE2 TRP B 36 16.144 18.730 12.253 1.00 30.91 C
264
+ ATOM 260 CE3 TRP B 36 16.026 16.315 12.340 1.00 32.15 C
265
+ ATOM 261 CZ2 TRP B 36 14.777 18.847 12.204 1.00 32.69 C
266
+ ATOM 262 CZ3 TRP B 36 14.673 16.430 12.262 1.00 34.27 C
267
+ ATOM 263 CH2 TRP B 36 14.051 17.693 12.197 1.00 35.93 C
268
+ ATOM 264 N TYR B 37 19.958 13.857 14.047 1.00 33.15 N
269
+ ATOM 265 CA TYR B 37 20.570 12.573 13.729 1.00 34.14 C
270
+ ATOM 266 C TYR B 37 19.537 11.689 13.030 1.00 36.33 C
271
+ ATOM 267 O TYR B 37 18.371 12.042 12.872 1.00 39.03 O
272
+ ATOM 268 CB TYR B 37 21.142 11.895 14.969 1.00 39.77 C
273
+ ATOM 269 CG TYR B 37 20.113 11.401 15.959 1.00 45.92 C
274
+ ATOM 270 CD1 TYR B 37 19.508 10.148 15.801 1.00 54.26 C
275
+ ATOM 271 CD2 TYR B 37 19.777 12.142 17.090 1.00 51.35 C
276
+ ATOM 272 CE1 TYR B 37 18.556 9.646 16.741 1.00 63.01 C
277
+ ATOM 273 CE2 TYR B 37 18.823 11.640 18.059 1.00 59.19 C
278
+ ATOM 274 CZ TYR B 37 18.220 10.387 17.871 1.00 57.77 C
279
+ ATOM 275 OH TYR B 37 17.287 9.864 18.770 1.00 57.60 O
280
+ ATOM 276 N ARG B 38 19.969 10.519 12.600 1.00 35.05 N
281
+ ATOM 277 CA ARG B 38 19.054 9.623 11.928 1.00 36.46 C
282
+ ATOM 278 C ARG B 38 19.440 8.188 12.243 1.00 39.39 C
283
+ ATOM 279 O ARG B 38 20.585 7.880 12.576 1.00 39.58 O
284
+ ATOM 280 CB ARG B 38 19.069 9.847 10.404 1.00 34.20 C
285
+ ATOM 281 CG ARG B 38 20.464 9.577 9.807 1.00 32.97 C
286
+ ATOM 282 CD ARG B 38 20.479 9.922 8.298 1.00 34.85 C
287
+ ATOM 283 NE ARG B 38 21.746 9.589 7.624 1.00 35.69 N
288
+ ATOM 284 CZ ARG B 38 22.054 9.987 6.389 1.00 39.38 C
289
+ ATOM 285 NH1 ARG B 38 21.194 10.724 5.704 1.00 31.66 N
290
+ ATOM 286 NH2 ARG B 38 23.209 9.646 5.839 1.00 37.51 N
291
+ ATOM 287 N GLN B 39 18.473 7.308 12.067 1.00 42.08 N
292
+ ATOM 288 CA GLN B 39 18.675 5.901 12.359 1.00 45.65 C
293
+ ATOM 289 C GLN B 39 17.912 5.114 11.309 1.00 51.01 C
294
+ ATOM 290 O GLN B 39 16.688 5.212 11.221 1.00 50.96 O
295
+ ATOM 291 CB GLN B 39 18.221 5.574 13.779 1.00 51.56 C
296
+ ATOM 292 CG GLN B 39 18.814 4.302 14.355 1.00 54.97 C
297
+ ATOM 293 CD GLN B 39 18.326 4.016 15.770 1.00 67.75 C
298
+ ATOM 294 OE1 GLN B 39 17.450 4.717 16.305 1.00 64.10 O
299
+ ATOM 295 NE2 GLN B 39 18.904 2.990 16.391 1.00 69.28 N
300
+ ATOM 296 N ALA B 40 18.651 4.422 10.456 1.00 56.48 N
301
+ ATOM 297 CA ALA B 40 18.102 3.482 9.497 1.00 59.22 C
302
+ ATOM 298 C ALA B 40 17.843 2.150 10.190 1.00 71.70 C
303
+ ATOM 299 O ALA B 40 18.435 1.865 11.238 1.00 74.24 O
304
+ ATOM 300 CB ALA B 40 19.071 3.324 8.325 1.00 63.37 C
305
+ ATOM 301 N PRO B 41 16.929 1.318 9.640 1.00 70.22 N
306
+ ATOM 302 CA PRO B 41 16.443 0.147 10.383 1.00 76.72 C
307
+ ATOM 303 C PRO B 41 17.512 -0.703 11.061 1.00 87.69 C
308
+ ATOM 304 O PRO B 41 17.592 -0.711 12.298 1.00 88.84 O
309
+ ATOM 305 CB PRO B 41 15.705 -0.651 9.303 1.00 74.91 C
310
+ ATOM 306 CG PRO B 41 15.156 0.397 8.425 1.00 73.77 C
311
+ ATOM 307 CD PRO B 41 16.175 1.509 8.391 1.00 74.77 C
312
+ ATOM 308 N GLY B 42 18.333 -1.420 10.287 1.00 79.25 N
313
+ ATOM 309 CA GLY B 42 19.245 -2.387 10.881 1.00 85.81 C
314
+ ATOM 310 C GLY B 42 20.602 -1.836 11.280 1.00 94.22 C
315
+ ATOM 311 O GLY B 42 21.594 -2.577 11.309 1.00 91.90 O
316
+ ATOM 312 N LYS B 43 20.656 -0.542 11.608 1.00 88.74 N
317
+ ATOM 313 CA LYS B 43 21.915 0.176 11.746 1.00 76.70 C
318
+ ATOM 314 C LYS B 43 21.866 1.075 12.984 1.00 64.98 C
319
+ ATOM 315 O LYS B 43 20.834 1.213 13.647 1.00 75.58 O
320
+ ATOM 316 CB LYS B 43 22.218 0.978 10.467 1.00 77.05 C
321
+ ATOM 317 CG LYS B 43 22.188 0.168 9.142 1.00 78.06 C
322
+ ATOM 318 CD LYS B 43 23.377 -0.784 9.008 1.00 83.92 C
323
+ ATOM 319 CE LYS B 43 23.359 -1.574 7.699 1.00 87.18 C
324
+ ATOM 320 NZ LYS B 43 23.591 -0.709 6.513 1.00 83.34 N
325
+ ATOM 321 N GLU B 44 23.010 1.670 13.304 1.00 61.27 N
326
+ ATOM 322 CA GLU B 44 23.187 2.517 14.475 1.00 59.29 C
327
+ ATOM 323 C GLU B 44 23.065 3.995 14.107 1.00 60.97 C
328
+ ATOM 324 O GLU B 44 23.234 4.393 12.953 1.00 51.50 O
329
+ ATOM 325 CB GLU B 44 24.545 2.248 15.122 0.00 58.71 C
330
+ ATOM 326 CG GLU B 44 24.794 0.782 15.410 0.00 61.52 C
331
+ ATOM 327 CD GLU B 44 23.675 0.147 16.216 0.00 64.60 C
332
+ ATOM 328 OE1 GLU B 44 22.793 -0.504 15.623 0.50 69.33 O
333
+ ATOM 329 OE2 GLU B 44 23.685 0.287 17.458 0.50 66.11 O
334
+ ATOM 330 N ARG B 45 22.780 4.816 15.109 1.00 54.19 N
335
+ ATOM 331 CA ARG B 45 22.442 6.201 14.831 1.00 45.62 C
336
+ ATOM 332 C ARG B 45 23.631 6.948 14.264 1.00 42.71 C
337
+ ATOM 333 O ARG B 45 24.787 6.695 14.619 1.00 43.74 O
338
+ ATOM 334 CB ARG B 45 21.967 6.885 16.091 1.00 46.44 C
339
+ ATOM 335 CG ARG B 45 20.890 6.084 16.750 1.00 54.54 C
340
+ ATOM 336 CD ARG B 45 20.140 6.886 17.755 1.00 63.38 C
341
+ ATOM 337 NE ARG B 45 20.736 6.723 19.062 1.00 59.60 N
342
+ ATOM 338 CZ ARG B 45 20.588 5.661 19.841 1.00 61.46 C
343
+ ATOM 339 NH1 ARG B 45 19.847 4.611 19.488 1.00 63.39 N
344
+ ATOM 340 NH2 ARG B 45 21.218 5.649 20.994 1.00 66.32 N
345
+ ATOM 341 N GLU B 46 23.328 7.906 13.392 1.00 35.30 N
346
+ ATOM 342 CA GLU B 46 24.346 8.667 12.685 1.00 31.56 C
347
+ ATOM 343 C GLU B 46 24.073 10.152 12.874 1.00 29.07 C
348
+ ATOM 344 O GLU B 46 22.981 10.621 12.553 1.00 32.40 O
349
+ ATOM 345 CB GLU B 46 24.341 8.301 11.175 1.00 31.28 C
350
+ ATOM 346 CG GLU B 46 25.086 9.284 10.306 1.00 40.13 C
351
+ ATOM 347 CD GLU B 46 25.247 8.807 8.830 1.00 40.75 C
352
+ ATOM 348 OE1 GLU B 46 24.419 7.990 8.334 1.00 38.17 O
353
+ ATOM 349 OE2 GLU B 46 26.224 9.238 8.186 1.00 53.87 O
354
+ ATOM 350 N TRP B 47 25.069 10.905 13.329 1.00 27.22 N
355
+ ATOM 351 CA TRP B 47 24.896 12.351 13.385 1.00 24.12 C
356
+ ATOM 352 C TRP B 47 24.741 12.930 11.965 1.00 32.26 C
357
+ ATOM 353 O TRP B 47 25.453 12.530 11.042 1.00 26.38 O
358
+ ATOM 354 CB TRP B 47 26.092 12.984 14.053 1.00 26.44 C
359
+ ATOM 355 CG TRP B 47 26.045 14.455 14.009 1.00 30.92 C
360
+ ATOM 356 CD1 TRP B 47 25.130 15.278 14.638 1.00 34.23 C
361
+ ATOM 357 CD2 TRP B 47 26.976 15.318 13.331 1.00 29.13 C
362
+ ATOM 358 NE1 TRP B 47 25.426 16.593 14.355 1.00 35.23 N
363
+ ATOM 359 CE2 TRP B 47 26.549 16.642 13.552 1.00 34.30 C
364
+ ATOM 360 CE3 TRP B 47 28.110 15.088 12.518 1.00 30.57 C
365
+ ATOM 361 CZ2 TRP B 47 27.218 17.746 12.996 1.00 31.77 C
366
+ ATOM 362 CZ3 TRP B 47 28.785 16.173 11.995 1.00 30.01 C
367
+ ATOM 363 CH2 TRP B 47 28.330 17.493 12.221 1.00 33.12 C
368
+ ATOM 364 N VAL B 48 23.850 13.902 11.812 1.00 25.91 N
369
+ ATOM 365 CA VAL B 48 23.546 14.507 10.512 1.00 27.63 C
370
+ ATOM 366 C VAL B 48 23.984 15.959 10.446 1.00 28.62 C
371
+ ATOM 367 O VAL B 48 24.679 16.355 9.503 1.00 28.91 O
372
+ ATOM 368 CB VAL B 48 22.052 14.368 10.161 1.00 30.66 C
373
+ ATOM 369 CG1 VAL B 48 21.776 15.070 8.816 1.00 27.35 C
374
+ ATOM 370 CG2 VAL B 48 21.713 12.910 10.048 1.00 37.62 C
375
+ ATOM 371 N ALA B 49 23.558 16.779 11.410 1.00 26.24 N
376
+ ATOM 372 CA ALA B 49 23.922 18.194 11.342 1.00 21.56 C
377
+ ATOM 373 C ALA B 49 23.729 18.823 12.719 1.00 29.57 C
378
+ ATOM 374 O ALA B 49 22.998 18.303 13.556 1.00 27.10 O
379
+ ATOM 375 CB ALA B 49 23.083 18.982 10.311 1.00 21.25 C
380
+ ATOM 376 N ALA B 50 24.345 19.985 12.921 1.00 25.75 N
381
+ ATOM 377 CA ALA B 50 24.175 20.690 14.194 1.00 30.52 C
382
+ ATOM 378 C ALA B 50 24.210 22.194 13.942 1.00 30.90 C
383
+ ATOM 379 O ALA B 50 24.863 22.667 13.000 1.00 27.15 O
384
+ ATOM 380 CB ALA B 50 25.264 20.268 15.192 1.00 23.46 C
385
+ ATOM 381 N ILE B 51 23.485 22.940 14.780 1.00 26.94 N
386
+ ATOM 382 CA ILE B 51 23.485 24.398 14.730 1.00 24.19 C
387
+ ATOM 383 C ILE B 51 23.754 24.945 16.137 1.00 35.17 C
388
+ ATOM 384 O ILE B 51 23.144 24.500 17.113 1.00 29.49 O
389
+ ATOM 385 CB ILE B 51 22.160 24.950 14.171 1.00 25.12 C
390
+ ATOM 386 CG1 ILE B 51 22.151 26.478 14.122 1.00 30.91 C
391
+ ATOM 387 CG2 ILE B 51 20.951 24.356 14.884 1.00 28.76 C
392
+ ATOM 388 CD1 ILE B 51 21.125 27.058 13.113 1.00 31.98 C
393
+ ATOM 389 N GLU B 52 24.664 25.906 16.225 1.00 36.82 N
394
+ ATOM 390 CA GLU B 52 25.084 26.429 17.516 1.00 42.28 C
395
+ ATOM 391 C GLU B 52 23.999 27.337 18.074 1.00 41.48 C
396
+ ATOM 392 O GLU B 52 23.272 27.993 17.319 1.00 40.48 O
397
+ ATOM 393 CB GLU B 52 26.398 27.196 17.367 1.00 32.46 C
398
+ ATOM 394 CG GLU B 52 26.984 27.801 18.637 1.00 45.13 C
399
+ ATOM 395 CD GLU B 52 27.536 26.772 19.628 0.50 39.20 C
400
+ ATOM 396 OE1 GLU B 52 27.765 25.604 19.253 0.50 41.10 O
401
+ ATOM 397 OE2 GLU B 52 27.745 27.150 20.796 0.50 52.80 O
402
+ ATOM 398 N SER B 52A 23.906 27.386 19.409 1.00 39.61 N
403
+ ATOM 399 CA SER B 52A 22.969 28.303 20.044 1.00 45.94 C
404
+ ATOM 400 C SER B 52A 23.313 29.739 19.644 1.00 41.43 C
405
+ ATOM 401 O SER B 52A 24.419 30.030 19.166 1.00 35.33 O
406
+ ATOM 402 CB SER B 52A 22.968 28.120 21.575 1.00 53.01 C
407
+ ATOM 403 OG SER B 52A 24.210 28.405 22.189 1.00 47.37 O
408
+ ATOM 404 N TYR B 52B 22.341 30.631 19.851 1.00 44.97 N
409
+ ATOM 405 CA TYR B 52B 22.441 32.028 19.431 1.00 52.48 C
410
+ ATOM 406 C TYR B 52B 23.668 32.724 20.018 1.00 55.12 C
411
+ ATOM 407 O TYR B 52B 23.906 32.650 21.229 0.50 43.91 O
412
+ ATOM 408 CB TYR B 52B 21.173 32.765 19.871 1.00 46.81 C
413
+ ATOM 409 CG TYR B 52B 21.104 34.186 19.391 1.00 51.85 C
414
+ ATOM 410 CD1 TYR B 52B 20.799 34.463 18.055 0.60 52.81 C
415
+ ATOM 411 CD2 TYR B 52B 21.366 35.244 20.250 0.60 47.83 C
416
+ ATOM 412 CE1 TYR B 52B 20.739 35.754 17.594 0.50 51.89 C
417
+ ATOM 413 CE2 TYR B 52B 21.305 36.541 19.800 0.50 50.05 C
418
+ ATOM 414 CZ TYR B 52B 20.993 36.786 18.467 0.60 61.34 C
419
+ ATOM 415 OH TYR B 52B 20.926 38.070 17.997 0.60 69.32 O
420
+ ATOM 416 N GLY B 53 24.444 33.415 19.157 1.00 40.76 N
421
+ ATOM 417 CA GLY B 53 25.492 34.305 19.641 1.00 46.47 C
422
+ ATOM 418 C GLY B 53 26.745 34.363 18.780 1.00 57.51 C
423
+ ATOM 419 O GLY B 53 27.270 35.441 18.478 1.00 54.22 O
424
+ ATOM 420 N ILE B 54 27.270 33.200 18.414 1.00 57.22 N
425
+ ATOM 421 CA ILE B 54 28.212 33.081 17.296 1.00 53.94 C
426
+ ATOM 422 C ILE B 54 27.657 31.990 16.403 1.00 45.62 C
427
+ ATOM 423 O ILE B 54 27.363 30.885 16.876 1.00 45.38 O
428
+ ATOM 424 CB ILE B 54 29.651 32.767 17.749 1.00 62.60 C
429
+ ATOM 425 CG1 ILE B 54 30.080 33.730 18.872 1.00 69.37 C
430
+ ATOM 426 CG2 ILE B 54 30.630 32.839 16.574 1.00 54.89 C
431
+ ATOM 427 CD1 ILE B 54 31.158 34.796 18.513 1.00 56.16 C
432
+ ATOM 428 N LYS B 55 27.435 32.309 15.135 1.00 33.74 N
433
+ ATOM 429 CA LYS B 55 26.776 31.362 14.264 1.00 37.61 C
434
+ ATOM 430 C LYS B 55 27.785 30.310 13.834 1.00 35.73 C
435
+ ATOM 431 O LYS B 55 28.956 30.619 13.567 1.00 34.29 O
436
+ ATOM 432 CB LYS B 55 26.155 32.074 13.054 1.00 38.83 C
437
+ ATOM 433 CG LYS B 55 25.373 31.165 12.116 0.00 37.96 C
438
+ ATOM 434 CD LYS B 55 25.001 31.885 10.827 0.00 38.27 C
439
+ ATOM 435 CE LYS B 55 26.239 32.244 10.019 0.00 38.93 C
440
+ ATOM 436 NZ LYS B 55 25.895 32.880 8.717 0.00 40.21 N
441
+ ATOM 437 N TRP B 56 27.319 29.066 13.743 1.00 35.04 N
442
+ ATOM 438 CA TRP B 56 28.185 27.927 13.463 1.00 36.11 C
443
+ ATOM 439 C TRP B 56 27.266 26.778 13.084 1.00 39.34 C
444
+ ATOM 440 O TRP B 56 26.430 26.345 13.885 1.00 38.77 O
445
+ ATOM 441 CB TRP B 56 29.048 27.570 14.699 1.00 36.14 C
446
+ ATOM 442 CG TRP B 56 29.748 26.252 14.631 1.00 43.88 C
447
+ ATOM 443 CD1 TRP B 56 30.970 25.990 14.047 1.00 53.67 C
448
+ ATOM 444 CD2 TRP B 56 29.286 25.002 15.161 0.50 47.43 C
449
+ ATOM 445 NE1 TRP B 56 31.301 24.659 14.200 1.00 48.10 N
450
+ ATOM 446 CE2 TRP B 56 30.280 24.033 14.877 0.50 51.84 C
451
+ ATOM 447 CE3 TRP B 56 28.129 24.603 15.846 0.50 46.84 C
452
+ ATOM 448 CZ2 TRP B 56 30.141 22.696 15.250 0.00 47.74 C
453
+ ATOM 449 CZ3 TRP B 56 27.998 23.275 16.220 1.00 47.24 C
454
+ ATOM 450 CH2 TRP B 56 28.999 22.339 15.921 0.00 46.95 C
455
+ ATOM 451 N THR B 57 27.355 26.309 11.863 1.00 28.60 N
456
+ ATOM 452 CA THR B 57 26.604 25.130 11.475 1.00 29.11 C
457
+ ATOM 453 C THR B 57 27.591 24.077 11.006 1.00 29.11 C
458
+ ATOM 454 O THR B 57 28.662 24.397 10.481 1.00 33.86 O
459
+ ATOM 455 CB THR B 57 25.565 25.429 10.393 1.00 33.37 C
460
+ ATOM 456 OG1 THR B 57 26.217 26.018 9.259 1.00 30.77 O
461
+ ATOM 457 CG2 THR B 57 24.533 26.398 10.924 1.00 28.50 C
462
+ ATOM 458 N ARG B 58 27.228 22.819 11.206 1.00 25.55 N
463
+ ATOM 459 CA ARG B 58 28.148 21.730 10.935 1.00 32.93 C
464
+ ATOM 460 C ARG B 58 27.345 20.568 10.365 1.00 29.40 C
465
+ ATOM 461 O ARG B 58 26.180 20.370 10.722 1.00 26.77 O
466
+ ATOM 462 CB ARG B 58 28.917 21.341 12.249 1.00 32.82 C
467
+ ATOM 463 N TYR B 59 27.966 19.798 9.478 1.00 22.48 N
468
+ ATOM 464 CA TYR B 59 27.255 18.745 8.744 1.00 23.40 C
469
+ ATOM 465 C TYR B 59 28.120 17.504 8.716 1.00 25.76 C
470
+ ATOM 466 O TYR B 59 29.342 17.604 8.657 1.00 29.69 O
471
+ ATOM 467 CB TYR B 59 26.950 19.170 7.300 1.00 24.33 C
472
+ ATOM 468 CG TYR B 59 26.067 20.355 7.275 1.00 23.32 C
473
+ ATOM 469 CD1 TYR B 59 24.694 20.214 7.352 1.00 25.87 C
474
+ ATOM 470 CD2 TYR B 59 26.607 21.620 7.213 1.00 24.95 C
475
+ ATOM 471 CE1 TYR B 59 23.869 21.308 7.335 1.00 24.12 C
476
+ ATOM 472 CE2 TYR B 59 25.806 22.716 7.203 1.00 27.22 C
477
+ ATOM 473 CZ TYR B 59 24.436 22.555 7.266 1.00 23.63 C
478
+ ATOM 474 OH TYR B 59 23.667 23.678 7.204 1.00 22.11 O
479
+ ATOM 475 N ALA B 60 27.496 16.336 8.752 1.00 23.05 N
480
+ ATOM 476 CA ALA B 60 28.277 15.141 8.455 1.00 30.47 C
481
+ ATOM 477 C ALA B 60 28.753 15.200 6.990 1.00 27.69 C
482
+ ATOM 478 O ALA B 60 28.023 15.684 6.096 1.00 24.29 O
483
+ ATOM 479 CB ALA B 60 27.438 13.893 8.704 1.00 24.49 C
484
+ ATOM 480 N ASP B 61 29.981 14.709 6.741 1.00 27.56 N
485
+ ATOM 481 CA ASP B 61 30.546 14.746 5.385 1.00 35.42 C
486
+ ATOM 482 C ASP B 61 29.574 14.224 4.332 1.00 36.45 C
487
+ ATOM 483 O ASP B 61 29.496 14.770 3.219 1.00 30.07 O
488
+ ATOM 484 CB ASP B 61 31.843 13.931 5.335 1.00 34.50 C
489
+ ATOM 485 CG ASP B 61 33.008 14.612 6.076 1.00 40.94 C
490
+ ATOM 486 OD1 ASP B 61 32.943 15.846 6.329 1.00 38.75 O
491
+ ATOM 487 OD2 ASP B 61 34.012 13.914 6.397 1.00 39.87 O
492
+ ATOM 488 N SER B 62 28.820 13.165 4.655 1.00 30.51 N
493
+ ATOM 489 CA SER B 62 27.980 12.525 3.645 1.00 31.55 C
494
+ ATOM 490 C SER B 62 26.786 13.379 3.222 1.00 36.55 C
495
+ ATOM 491 O SER B 62 26.197 13.103 2.160 1.00 30.61 O
496
+ ATOM 492 CB SER B 62 27.475 11.165 4.130 1.00 35.75 C
497
+ ATOM 493 OG SER B 62 26.577 11.301 5.221 1.00 34.51 O
498
+ ATOM 494 N VAL B 63 26.428 14.411 3.998 1.00 30.32 N
499
+ ATOM 495 CA VAL B 63 25.328 15.310 3.642 1.00 26.87 C
500
+ ATOM 496 C VAL B 63 25.771 16.730 3.351 1.00 26.17 C
501
+ ATOM 497 O VAL B 63 24.935 17.535 2.902 1.00 26.78 O
502
+ ATOM 498 CB VAL B 63 24.236 15.338 4.742 1.00 26.39 C
503
+ ATOM 499 CG1 VAL B 63 23.847 13.901 5.101 1.00 29.44 C
504
+ ATOM 500 CG2 VAL B 63 24.701 16.153 5.945 1.00 24.55 C
505
+ ATOM 501 N LYS B 64 27.033 17.082 3.593 1.00 26.23 N
506
+ ATOM 502 CA LYS B 64 27.453 18.459 3.395 1.00 27.64 C
507
+ ATOM 503 C LYS B 64 27.171 18.863 1.950 1.00 31.79 C
508
+ ATOM 504 O LYS B 64 27.450 18.115 1.011 1.00 27.50 O
509
+ ATOM 505 CB LYS B 64 28.945 18.627 3.715 1.00 33.17 C
510
+ ATOM 506 CG LYS B 64 29.444 20.073 3.689 1.00 39.60 C
511
+ ATOM 507 CD LYS B 64 30.952 20.183 4.033 1.00 44.32 C
512
+ ATOM 508 CE LYS B 64 31.270 19.576 5.447 1.00 64.28 C
513
+ ATOM 509 NZ LYS B 64 32.448 20.163 6.223 1.00 47.84 N
514
+ ATOM 510 N GLY B 65 26.624 20.053 1.766 1.00 26.34 N
515
+ ATOM 511 CA GLY B 65 26.329 20.509 0.433 1.00 32.98 C
516
+ ATOM 512 C GLY B 65 24.967 20.093 -0.075 1.00 30.09 C
517
+ ATOM 513 O GLY B 65 24.496 20.654 -1.052 1.00 36.17 O
518
+ ATOM 514 N ARG B 66 24.329 19.112 0.546 1.00 25.14 N
519
+ ATOM 515 CA ARG B 66 22.962 18.744 0.223 1.00 24.55 C
520
+ ATOM 516 C ARG B 66 21.954 19.211 1.268 1.00 29.01 C
521
+ ATOM 517 O ARG B 66 20.817 19.553 0.914 1.00 29.76 O
522
+ ATOM 518 CB ARG B 66 22.863 17.224 0.067 1.00 25.67 C
523
+ ATOM 519 CG ARG B 66 23.834 16.659 -1.016 1.00 30.42 C
524
+ ATOM 520 CD ARG B 66 23.502 15.202 -1.380 1.00 32.44 C
525
+ ATOM 521 NE ARG B 66 23.808 14.291 -0.276 1.00 30.08 N
526
+ ATOM 522 CZ ARG B 66 22.933 13.489 0.315 1.00 34.63 C
527
+ ATOM 523 NH1 ARG B 66 21.658 13.485 -0.078 1.00 32.49 N
528
+ ATOM 524 NH2 ARG B 66 23.345 12.692 1.307 1.00 31.69 N
529
+ ATOM 525 N PHE B 67 22.347 19.235 2.541 1.00 23.97 N
530
+ ATOM 526 CA PHE B 67 21.467 19.584 3.664 1.00 22.57 C
531
+ ATOM 527 C PHE B 67 21.829 20.958 4.220 1.00 23.00 C
532
+ ATOM 528 O PHE B 67 23.003 21.333 4.317 1.00 27.78 O
533
+ ATOM 529 CB PHE B 67 21.576 18.560 4.839 1.00 21.21 C
534
+ ATOM 530 CG PHE B 67 21.092 17.165 4.512 1.00 30.43 C
535
+ ATOM 531 CD1 PHE B 67 20.762 16.793 3.184 1.00 26.68 C
536
+ ATOM 532 CD2 PHE B 67 20.926 16.222 5.534 1.00 26.70 C
537
+ ATOM 533 CE1 PHE B 67 20.313 15.496 2.895 1.00 27.00 C
538
+ ATOM 534 CE2 PHE B 67 20.465 14.936 5.247 1.00 24.56 C
539
+ ATOM 535 CZ PHE B 67 20.165 14.562 3.936 1.00 30.52 C
540
+ ATOM 536 N THR B 68 20.818 21.665 4.679 1.00 25.12 N
541
+ ATOM 537 CA THR B 68 21.006 22.949 5.337 1.00 21.64 C
542
+ ATOM 538 C THR B 68 20.182 22.959 6.615 1.00 26.43 C
543
+ ATOM 539 O THR B 68 18.951 22.826 6.559 1.00 22.09 O
544
+ ATOM 540 CB THR B 68 20.560 24.092 4.434 1.00 26.90 C
545
+ ATOM 541 OG1 THR B 68 21.183 23.946 3.158 1.00 26.59 O
546
+ ATOM 542 CG2 THR B 68 20.952 25.437 5.067 1.00 27.44 C
547
+ ATOM 543 N ILE B 69 20.844 23.170 7.754 1.00 24.39 N
548
+ ATOM 544 CA ILE B 69 20.134 23.329 9.028 1.00 24.06 C
549
+ ATOM 545 C ILE B 69 19.967 24.812 9.276 1.00 27.29 C
550
+ ATOM 546 O ILE B 69 20.870 25.625 8.982 1.00 28.06 O
551
+ ATOM 547 CB ILE B 69 20.884 22.631 10.185 1.00 24.74 C
552
+ ATOM 548 CG1 ILE B 69 20.086 22.683 11.493 1.00 26.65 C
553
+ ATOM 549 CG2 ILE B 69 22.266 23.223 10.334 1.00 25.55 C
554
+ ATOM 550 CD1 ILE B 69 20.682 21.739 12.577 1.00 30.41 C
555
+ ATOM 551 N SER B 70 18.790 25.188 9.770 1.00 29.39 N
556
+ ATOM 552 CA SER B 70 18.540 26.590 10.093 1.00 30.26 C
557
+ ATOM 553 C SER B 70 17.480 26.675 11.181 1.00 30.57 C
558
+ ATOM 554 O SER B 70 16.873 25.680 11.551 1.00 33.87 O
559
+ ATOM 555 CB SER B 70 18.089 27.371 8.864 1.00 31.00 C
560
+ ATOM 556 OG SER B 70 16.859 26.838 8.402 1.00 33.57 O
561
+ ATOM 557 N ARG B 71 17.259 27.886 11.679 1.00 37.11 N
562
+ ATOM 558 CA ARG B 71 16.467 28.101 12.886 1.00 33.86 C
563
+ ATOM 559 C ARG B 71 15.561 29.303 12.684 1.00 40.50 C
564
+ ATOM 560 O ARG B 71 16.003 30.319 12.150 1.00 44.14 O
565
+ ATOM 561 CB ARG B 71 17.405 28.304 14.122 1.00 34.32 C
566
+ ATOM 562 CG ARG B 71 16.710 28.377 15.416 1.00 45.31 C
567
+ ATOM 563 CD ARG B 71 17.726 28.370 16.597 1.00 41.21 C
568
+ ATOM 564 NE ARG B 71 18.766 29.404 16.511 1.00 39.92 N
569
+ ATOM 565 CZ ARG B 71 20.062 29.170 16.708 1.00 42.33 C
570
+ ATOM 566 NH1 ARG B 71 20.953 30.168 16.629 1.00 44.57 N
571
+ ATOM 567 NH2 ARG B 71 20.454 27.953 17.084 1.00 40.94 N
572
+ ATOM 568 N ASP B 72 14.285 29.179 13.078 1.00 39.70 N
573
+ ATOM 569 CA ASP B 72 13.380 30.315 13.242 1.00 49.43 C
574
+ ATOM 570 C ASP B 72 13.067 30.492 14.730 1.00 52.07 C
575
+ ATOM 571 O ASP B 72 12.271 29.723 15.286 1.00 49.39 O
576
+ ATOM 572 CB ASP B 72 12.100 30.085 12.451 1.00 51.21 C
577
+ ATOM 573 CG ASP B 72 11.210 31.305 12.421 1.00 60.97 C
578
+ ATOM 574 OD1 ASP B 72 11.118 32.052 13.434 1.00 64.47 O
579
+ ATOM 575 OD2 ASP B 72 10.600 31.523 11.359 1.00 59.52 O
580
+ ATOM 576 N ASN B 73 13.661 31.530 15.359 1.00 54.74 N
581
+ ATOM 577 CA ASN B 73 13.541 31.718 16.814 1.00 62.79 C
582
+ ATOM 578 C ASN B 73 12.130 32.128 17.220 1.00 55.32 C
583
+ ATOM 579 O ASN B 73 11.671 31.767 18.314 1.00 62.42 O
584
+ ATOM 580 CB ASN B 73 14.527 32.781 17.331 1.00 60.22 C
585
+ ATOM 581 CG ASN B 73 15.957 32.584 16.821 1.00 55.70 C
586
+ ATOM 582 OD1 ASN B 73 16.471 31.463 16.736 1.00 59.77 O
587
+ ATOM 583 ND2 ASN B 73 16.609 33.690 16.486 1.00 58.97 N
588
+ ATOM 584 N ALA B 74 11.468 32.924 16.375 1.00 52.63 N
589
+ ATOM 585 CA ALA B 74 10.100 33.370 16.611 1.00 60.74 C
590
+ ATOM 586 C ALA B 74 9.135 32.197 16.655 1.00 66.29 C
591
+ ATOM 587 O ALA B 74 8.260 32.121 17.532 1.00 61.89 O
592
+ ATOM 588 CB ALA B 74 9.680 34.338 15.506 1.00 62.48 C
593
+ ATOM 589 N LYS B 75 9.250 31.301 15.676 1.00 56.81 N
594
+ ATOM 590 CA LYS B 75 8.446 30.092 15.603 1.00 52.73 C
595
+ ATOM 591 C LYS B 75 8.986 28.967 16.477 1.00 53.77 C
596
+ ATOM 592 O LYS B 75 8.320 27.929 16.586 1.00 46.20 O
597
+ ATOM 593 CB LYS B 75 8.360 29.619 14.153 1.00 47.14 C
598
+ ATOM 594 CG LYS B 75 7.530 30.516 13.225 1.00 48.98 C
599
+ ATOM 595 CD LYS B 75 7.505 29.882 11.855 1.00 56.62 C
600
+ ATOM 596 CE LYS B 75 6.731 30.692 10.831 1.00 67.58 C
601
+ ATOM 597 NZ LYS B 75 6.782 29.949 9.524 1.00 66.90 N
602
+ ATOM 598 N ASN B 76 10.166 29.159 17.099 1.00 44.02 N
603
+ ATOM 599 CA ASN B 76 10.774 28.188 18.009 1.00 41.60 C
604
+ ATOM 600 C ASN B 76 10.991 26.841 17.323 1.00 43.10 C
605
+ ATOM 601 O ASN B 76 10.663 25.781 17.873 1.00 39.77 O
606
+ ATOM 602 CB ASN B 76 9.931 28.029 19.280 1.00 45.92 C
607
+ ATOM 603 CG ASN B 76 10.795 27.763 20.507 1.00 54.30 C
608
+ ATOM 604 OD1 ASN B 76 11.861 28.360 20.653 1.00 48.45 O
609
+ ATOM 605 ND2 ASN B 76 10.374 26.822 21.348 1.00 50.99 N
610
+ ATOM 606 N THR B 77 11.553 26.891 16.104 1.00 42.29 N
611
+ ATOM 607 CA THR B 77 11.635 25.721 15.238 1.00 35.83 C
612
+ ATOM 608 C THR B 77 13.007 25.642 14.575 1.00 35.38 C
613
+ ATOM 609 O THR B 77 13.565 26.651 14.150 1.00 32.13 O
614
+ ATOM 610 CB THR B 77 10.525 25.766 14.176 1.00 36.50 C
615
+ ATOM 611 OG1 THR B 77 9.255 25.804 14.819 1.00 35.13 O
616
+ ATOM 612 CG2 THR B 77 10.573 24.554 13.228 1.00 38.50 C
617
+ ATOM 613 N VAL B 78 13.564 24.441 14.506 1.00 34.05 N
618
+ ATOM 614 CA VAL B 78 14.766 24.189 13.719 1.00 34.81 C
619
+ ATOM 615 C VAL B 78 14.370 23.398 12.471 1.00 34.59 C
620
+ ATOM 616 O VAL B 78 13.490 22.545 12.531 1.00 36.42 O
621
+ ATOM 617 CB VAL B 78 15.823 23.435 14.547 1.00 30.49 C
622
+ ATOM 618 CG1 VAL B 78 17.034 23.156 13.721 1.00 36.18 C
623
+ ATOM 619 CG2 VAL B 78 16.188 24.219 15.745 1.00 41.01 C
624
+ ATOM 620 N TYR B 79 15.011 23.681 11.341 1.00 30.86 N
625
+ ATOM 621 CA TYR B 79 14.688 23.061 10.049 1.00 35.00 C
626
+ ATOM 622 C TYR B 79 15.901 22.318 9.510 1.00 27.81 C
627
+ ATOM 623 O TYR B 79 17.042 22.752 9.704 1.00 29.03 O
628
+ ATOM 624 CB TYR B 79 14.279 24.103 9.004 1.00 29.95 C
629
+ ATOM 625 CG TYR B 79 13.072 24.915 9.380 1.00 34.51 C
630
+ ATOM 626 CD1 TYR B 79 11.809 24.375 9.317 1.00 32.37 C
631
+ ATOM 627 CD2 TYR B 79 13.203 26.215 9.812 1.00 43.19 C
632
+ ATOM 628 CE1 TYR B 79 10.716 25.093 9.689 1.00 36.61 C
633
+ ATOM 629 CE2 TYR B 79 12.096 26.963 10.186 1.00 49.21 C
634
+ ATOM 630 CZ TYR B 79 10.852 26.394 10.118 1.00 49.63 C
635
+ ATOM 631 OH TYR B 79 9.737 27.133 10.494 1.00 57.21 O
636
+ ATOM 632 N LEU B 80 15.644 21.239 8.781 1.00 26.28 N
637
+ ATOM 633 CA LEU B 80 16.660 20.575 7.953 1.00 25.45 C
638
+ ATOM 634 C LEU B 80 16.131 20.494 6.502 1.00 22.09 C
639
+ ATOM 635 O LEU B 80 15.290 19.653 6.159 1.00 23.22 O
640
+ ATOM 636 CB LEU B 80 17.029 19.200 8.499 1.00 30.65 C
641
+ ATOM 637 CG LEU B 80 18.217 18.481 7.843 1.00 25.20 C
642
+ ATOM 638 CD1 LEU B 80 19.524 19.173 8.202 1.00 23.17 C
643
+ ATOM 639 CD2 LEU B 80 18.288 17.010 8.235 1.00 28.07 C
644
+ ATOM 640 N GLN B 81 16.588 21.418 5.679 1.00 27.13 N
645
+ ATOM 641 CA GLN B 81 16.349 21.359 4.234 1.00 23.62 C
646
+ ATOM 642 C GLN B 81 17.217 20.248 3.668 1.00 24.97 C
647
+ ATOM 643 O GLN B 81 18.437 20.301 3.830 1.00 27.40 O
648
+ ATOM 644 CB GLN B 81 16.730 22.700 3.612 1.00 23.73 C
649
+ ATOM 645 CG GLN B 81 16.480 22.659 2.056 1.00 28.64 C
650
+ ATOM 646 CD GLN B 81 14.970 22.546 1.744 1.00 40.14 C
651
+ ATOM 647 OE1 GLN B 81 14.534 21.696 0.951 1.00 50.90 O
652
+ ATOM 648 NE2 GLN B 81 14.174 23.445 2.345 1.00 35.70 N
653
+ ATOM 649 N MET B 82 16.626 19.248 3.006 1.00 21.67 N
654
+ ATOM 650 CA MET B 82 17.370 18.137 2.406 1.00 26.68 C
655
+ ATOM 651 C MET B 82 17.165 18.147 0.887 1.00 31.04 C
656
+ ATOM 652 O MET B 82 16.059 17.871 0.418 1.00 30.65 O
657
+ ATOM 653 CB MET B 82 16.893 16.800 3.006 1.00 24.42 C
658
+ ATOM 654 CG MET B 82 16.989 16.709 4.617 1.00 34.63 C
659
+ ATOM 655 SD MET B 82 15.949 15.313 5.156 1.00 40.88 S
660
+ ATOM 656 CE MET B 82 16.973 13.932 4.820 1.00 33.66 C
661
+ ATOM 657 N ASN B 82A 18.209 18.457 0.123 1.00 25.63 N
662
+ ATOM 658 CA ASN B 82A 18.170 18.367 -1.349 1.00 32.05 C
663
+ ATOM 659 C ASN B 82A 18.964 17.170 -1.820 1.00 32.86 C
664
+ ATOM 660 O ASN B 82A 19.710 16.572 -1.057 1.00 31.65 O
665
+ ATOM 661 CB ASN B 82A 18.739 19.611 -1.988 1.00 29.89 C
666
+ ATOM 662 CG ASN B 82A 17.954 20.829 -1.630 1.00 40.43 C
667
+ ATOM 663 OD1 ASN B 82A 16.731 20.769 -1.479 1.00 41.88 O
668
+ ATOM 664 ND2 ASN B 82A 18.643 21.939 -1.451 1.00 41.05 N
669
+ ATOM 665 N SER B 82B 18.754 16.792 -3.083 1.00 38.23 N
670
+ ATOM 666 CA SER B 82B 19.500 15.721 -3.748 1.00 35.72 C
671
+ ATOM 667 C SER B 82B 19.483 14.425 -2.930 1.00 38.68 C
672
+ ATOM 668 O SER B 82B 20.505 13.765 -2.732 1.00 35.31 O
673
+ ATOM 669 CB SER B 82B 20.928 16.172 -4.046 1.00 40.96 C
674
+ ATOM 670 OG SER B 82B 20.943 17.408 -4.749 1.00 42.04 O
675
+ ATOM 671 N LEU B 82C 18.291 14.027 -2.500 1.00 34.87 N
676
+ ATOM 672 CA LEU B 82C 18.170 12.860 -1.632 1.00 37.47 C
677
+ ATOM 673 C LEU B 82C 18.647 11.584 -2.338 1.00 42.28 C
678
+ ATOM 674 O LEU B 82C 18.490 11.418 -3.553 1.00 42.42 O
679
+ ATOM 675 CB LEU B 82C 16.717 12.723 -1.169 1.00 36.54 C
680
+ ATOM 676 CG LEU B 82C 16.271 13.219 0.209 1.00 44.56 C
681
+ ATOM 677 CD1 LEU B 82C 17.409 13.696 1.108 1.00 43.31 C
682
+ ATOM 678 CD2 LEU B 82C 15.236 14.266 0.122 1.00 37.22 C
683
+ ATOM 679 N LYS B 83 19.230 10.662 -1.561 1.00 38.17 N
684
+ ATOM 680 CA LYS B 83 19.678 9.369 -2.053 1.00 44.51 C
685
+ ATOM 681 C LYS B 83 18.999 8.268 -1.269 1.00 42.03 C
686
+ ATOM 682 O LYS B 83 18.430 8.523 -0.200 1.00 43.60 O
687
+ ATOM 683 CB LYS B 83 21.200 9.212 -1.926 1.00 43.80 C
688
+ ATOM 684 CG LYS B 83 21.999 10.417 -2.363 1.00 39.20 C
689
+ ATOM 685 CD LYS B 83 23.507 10.108 -2.349 1.00 46.74 C
690
+ ATOM 686 CE LYS B 83 24.335 11.390 -2.420 1.00 44.30 C
691
+ ATOM 687 NZ LYS B 83 25.806 11.112 -2.397 1.00 49.24 N
692
+ ATOM 688 N PRO B 84 18.966 7.038 -1.787 1.00 46.19 N
693
+ ATOM 689 CA PRO B 84 18.482 5.915 -0.970 1.00 41.95 C
694
+ ATOM 690 C PRO B 84 19.217 5.777 0.357 1.00 47.58 C
695
+ ATOM 691 O PRO B 84 18.586 5.501 1.384 1.00 54.35 O
696
+ ATOM 692 CB PRO B 84 18.722 4.709 -1.879 1.00 50.11 C
697
+ ATOM 693 CG PRO B 84 18.466 5.273 -3.264 1.00 54.66 C
698
+ ATOM 694 CD PRO B 84 18.980 6.707 -3.228 1.00 42.02 C
699
+ ATOM 695 N GLU B 85 20.540 5.981 0.362 1.00 44.63 N
700
+ ATOM 696 CA GLU B 85 21.347 5.898 1.575 1.00 50.58 C
701
+ ATOM 697 C GLU B 85 20.848 6.864 2.642 1.00 36.89 C
702
+ ATOM 698 O GLU B 85 21.247 6.765 3.796 1.00 45.53 O
703
+ ATOM 699 CB GLU B 85 22.832 6.164 1.255 1.00 50.12 C
704
+ ATOM 700 CG GLU B 85 23.186 7.612 0.869 1.00 49.67 C
705
+ ATOM 701 CD GLU B 85 24.588 7.751 0.326 0.50 50.22 C
706
+ ATOM 702 OE1 GLU B 85 24.954 6.961 -0.576 0.50 49.27 O
707
+ ATOM 703 OE2 GLU B 85 25.324 8.642 0.800 0.00 46.66 O
708
+ ATOM 704 N ASP B 86 20.000 7.820 2.269 1.00 44.41 N
709
+ ATOM 705 CA ASP B 86 19.442 8.773 3.221 1.00 40.95 C
710
+ ATOM 706 C ASP B 86 18.171 8.272 3.903 1.00 40.18 C
711
+ ATOM 707 O ASP B 86 17.640 8.991 4.755 1.00 33.66 O
712
+ ATOM 708 CB ASP B 86 19.093 10.104 2.538 1.00 32.15 C
713
+ ATOM 709 CG ASP B 86 20.309 10.892 2.087 1.00 44.77 C
714
+ ATOM 710 OD1 ASP B 86 21.365 10.874 2.777 1.00 35.82 O
715
+ ATOM 711 OD2 ASP B 86 20.182 11.578 1.041 1.00 42.37 O
716
+ ATOM 712 N THR B 87 17.639 7.104 3.505 1.00 37.99 N
717
+ ATOM 713 CA THR B 87 16.391 6.591 4.072 1.00 44.06 C
718
+ ATOM 714 C THR B 87 16.595 6.226 5.540 1.00 45.66 C
719
+ ATOM 715 O THR B 87 17.477 5.419 5.858 1.00 46.54 O
720
+ ATOM 716 CB THR B 87 15.914 5.378 3.272 1.00 48.64 C
721
+ ATOM 717 OG1 THR B 87 15.469 5.812 1.981 1.00 46.28 O
722
+ ATOM 718 CG2 THR B 87 14.757 4.631 3.998 1.00 43.59 C
723
+ ATOM 719 N ALA B 88 15.789 6.809 6.431 1.00 42.10 N
724
+ ATOM 720 CA ALA B 88 15.967 6.610 7.870 1.00 45.27 C
725
+ ATOM 721 C ALA B 88 14.852 7.334 8.614 1.00 42.42 C
726
+ ATOM 722 O ALA B 88 14.124 8.138 8.037 1.00 43.07 O
727
+ ATOM 723 CB ALA B 88 17.323 7.134 8.343 1.00 45.55 C
728
+ ATOM 724 N VAL B 89 14.741 7.067 9.911 1.00 45.52 N
729
+ ATOM 725 CA VAL B 89 13.998 7.968 10.786 1.00 47.35 C
730
+ ATOM 726 C VAL B 89 14.927 9.074 11.242 1.00 38.62 C
731
+ ATOM 727 O VAL B 89 15.993 8.796 11.797 1.00 46.15 O
732
+ ATOM 728 CB VAL B 89 13.444 7.233 12.014 1.00 47.39 C
733
+ ATOM 729 CG1 VAL B 89 12.527 8.173 12.762 1.00 45.58 C
734
+ ATOM 730 CG2 VAL B 89 12.754 5.933 11.637 1.00 50.04 C
735
+ ATOM 731 N TYR B 90 14.498 10.318 11.071 1.00 39.10 N
736
+ ATOM 732 CA TYR B 90 15.256 11.509 11.442 1.00 41.38 C
737
+ ATOM 733 C TYR B 90 14.734 12.063 12.761 1.00 40.47 C
738
+ ATOM 734 O TYR B 90 13.522 12.163 12.959 1.00 39.40 O
739
+ ATOM 735 CB TYR B 90 15.152 12.584 10.338 1.00 30.86 C
740
+ ATOM 736 CG TYR B 90 16.025 12.249 9.139 1.00 37.44 C
741
+ ATOM 737 CD1 TYR B 90 15.685 11.220 8.267 1.00 34.16 C
742
+ ATOM 738 CD2 TYR B 90 17.219 12.927 8.912 1.00 35.41 C
743
+ ATOM 739 CE1 TYR B 90 16.506 10.875 7.195 1.00 38.50 C
744
+ ATOM 740 CE2 TYR B 90 18.042 12.606 7.823 1.00 33.32 C
745
+ ATOM 741 CZ TYR B 90 17.677 11.581 6.969 1.00 37.15 C
746
+ ATOM 742 OH TYR B 90 18.504 11.238 5.912 1.00 35.43 O
747
+ ATOM 743 N TYR B 91 15.653 12.419 13.660 1.00 38.61 N
748
+ ATOM 744 CA TYR B 91 15.331 12.967 14.969 1.00 39.19 C
749
+ ATOM 745 C TYR B 91 16.109 14.248 15.203 1.00 42.80 C
750
+ ATOM 746 O TYR B 91 17.245 14.374 14.728 1.00 40.69 O
751
+ ATOM 747 CB TYR B 91 15.743 12.008 16.103 1.00 43.86 C
752
+ ATOM 748 CG TYR B 91 15.209 10.619 16.019 1.00 50.52 C
753
+ ATOM 749 CD1 TYR B 91 15.702 9.717 15.086 1.00 51.17 C
754
+ ATOM 750 CD2 TYR B 91 14.220 10.190 16.904 1.00 52.70 C
755
+ ATOM 751 CE1 TYR B 91 15.208 8.419 15.025 1.00 52.39 C
756
+ ATOM 752 CE2 TYR B 91 13.727 8.903 16.860 1.00 51.44 C
757
+ ATOM 753 CZ TYR B 91 14.221 8.020 15.921 1.00 56.73 C
758
+ ATOM 754 OH TYR B 91 13.724 6.735 15.884 1.00 55.92 O
759
+ ATOM 755 N ACYS B 92 15.516 15.181 15.955 0.50 37.42 N
760
+ ATOM 756 CA ACYS B 92 16.268 16.311 16.487 0.50 37.53 C
761
+ ATOM 757 C ACYS B 92 16.489 16.101 17.972 0.50 39.88 C
762
+ ATOM 758 O ACYS B 92 15.752 15.367 18.639 0.50 42.03 O
763
+ ATOM 759 CB ACYS B 92 15.573 17.659 16.260 0.50 37.38 C
764
+ ATOM 760 SG ACYS B 92 13.886 17.744 16.845 0.50 54.25 S
765
+ ATOM 761 N ILE B 93 17.519 16.753 18.492 1.00 34.32 N
766
+ ATOM 762 CA ILE B 93 17.930 16.469 19.859 1.00 46.55 C
767
+ ATOM 763 C ILE B 93 18.603 17.690 20.470 1.00 41.81 C
768
+ ATOM 764 O ILE B 93 19.295 18.473 19.799 1.00 36.53 O
769
+ ATOM 765 CB ILE B 93 18.782 15.178 19.898 1.00 41.32 C
770
+ ATOM 766 CG1 ILE B 93 19.091 14.774 21.324 1.00 47.65 C
771
+ ATOM 767 CG2 ILE B 93 20.077 15.334 19.198 1.00 40.42 C
772
+ ATOM 768 CD1 ILE B 93 19.557 13.338 21.413 1.00 56.42 C
773
+ ATOM 769 N VAL B 94 18.311 17.872 21.753 1.00 42.34 N
774
+ ATOM 770 CA VAL B 94 18.816 18.979 22.544 1.00 40.39 C
775
+ ATOM 771 C VAL B 94 19.107 18.473 23.961 1.00 53.85 C
776
+ ATOM 772 O VAL B 94 18.617 17.428 24.395 1.00 45.51 O
777
+ ATOM 773 CB VAL B 94 17.818 20.144 22.563 1.00 47.35 C
778
+ ATOM 774 CG1 VAL B 94 16.561 19.751 23.337 1.00 40.64 C
779
+ ATOM 775 CG2 VAL B 94 18.475 21.409 23.086 1.00 46.72 C
780
+ ATOM 776 N TRP B 95 19.934 19.223 24.670 1.00 43.36 N
781
+ ATOM 777 CA TRP B 95 20.412 18.826 25.981 1.00 47.12 C
782
+ ATOM 778 C TRP B 95 20.048 19.973 26.925 1.00 50.18 C
783
+ ATOM 779 O TRP B 95 20.604 21.082 26.854 1.00 46.76 O
784
+ ATOM 780 CB TRP B 95 21.887 18.470 25.908 1.00 50.30 C
785
+ ATOM 781 CG TRP B 95 22.107 17.004 25.313 0.50 51.00 C
786
+ ATOM 782 CD1 TRP B 95 22.011 15.829 26.010 0.50 52.92 C
787
+ ATOM 783 CD2 TRP B 95 22.442 16.611 23.946 0.50 49.21 C
788
+ ATOM 784 NE1 TRP B 95 22.272 14.746 25.181 1.00 54.69 N
789
+ ATOM 785 CE2 TRP B 95 22.533 15.201 23.917 1.00 61.22 C
790
+ ATOM 786 CE3 TRP B 95 22.685 17.307 22.762 0.60 42.51 C
791
+ ATOM 787 CZ2 TRP B 95 22.839 14.486 22.745 1.00 52.65 C
792
+ ATOM 788 CZ3 TRP B 95 22.995 16.585 21.612 0.60 48.29 C
793
+ ATOM 789 CH2 TRP B 95 23.076 15.201 21.613 0.60 43.30 C
794
+ ATOM 790 N VAL B 96 18.993 19.724 27.700 1.00 50.99 N
795
+ ATOM 791 CA VAL B 96 18.520 20.618 28.756 1.00 53.03 C
796
+ ATOM 792 C VAL B 96 18.599 19.836 30.060 1.00 57.66 C
797
+ ATOM 793 O VAL B 96 17.575 19.370 30.570 1.00 60.38 O
798
+ ATOM 794 CB VAL B 96 17.092 21.103 28.503 1.00 52.53 C
799
+ ATOM 795 CG1 VAL B 96 16.761 22.238 29.445 1.00 54.20 C
800
+ ATOM 796 CG2 VAL B 96 16.920 21.508 27.029 1.00 48.17 C
801
+ ATOM 797 N GLY B 97 19.821 19.661 30.558 1.00 58.79 N
802
+ ATOM 798 CA GLY B 97 20.137 18.655 31.562 1.00 67.34 C
803
+ ATOM 799 C GLY B 97 20.157 17.287 30.910 1.00 63.36 C
804
+ ATOM 800 O GLY B 97 21.191 16.824 30.426 1.00 62.41 O
805
+ ATOM 801 N ALA B 98 19.005 16.640 30.867 1.00 64.92 N
806
+ ATOM 802 CA ALA B 98 18.883 15.440 30.066 1.00 66.26 C
807
+ ATOM 803 C ALA B 98 18.930 15.772 28.560 1.00 59.74 C
808
+ ATOM 804 O ALA B 98 18.809 16.925 28.133 1.00 56.45 O
809
+ ATOM 805 CB ALA B 98 17.582 14.704 30.404 1.00 68.22 C
810
+ ATOM 806 N GLN B 101 19.167 14.734 27.764 1.00 59.78 N
811
+ ATOM 807 CA GLN B 101 18.837 14.769 26.352 1.00 56.05 C
812
+ ATOM 808 C GLN B 101 17.352 14.536 26.168 1.00 60.26 C
813
+ ATOM 809 O GLN B 101 16.733 13.714 26.867 1.00 61.24 O
814
+ ATOM 810 CB GLN B 101 19.631 13.720 25.578 1.00 69.67 C
815
+ ATOM 811 CG GLN B 101 18.912 12.491 25.046 1.00 67.85 C
816
+ ATOM 812 CD GLN B 101 19.919 11.417 24.656 1.00 66.65 C
817
+ ATOM 813 OE1 GLN B 101 21.135 11.691 24.524 1.00 58.73 O
818
+ ATOM 814 NE2 GLN B 101 19.434 10.178 24.521 1.00 72.73 N
819
+ ATOM 815 N TYR B 102 16.791 15.315 25.250 1.00 52.96 N
820
+ ATOM 816 CA TYR B 102 15.415 15.245 24.800 1.00 60.09 C
821
+ ATOM 817 C TYR B 102 15.447 15.133 23.278 1.00 49.24 C
822
+ ATOM 818 O TYR B 102 16.119 15.936 22.622 1.00 48.24 O
823
+ ATOM 819 CB TYR B 102 14.652 16.502 25.224 1.00 56.68 C
824
+ ATOM 820 CG TYR B 102 14.449 16.652 26.701 1.00 59.89 C
825
+ ATOM 821 CD1 TYR B 102 15.398 17.276 27.500 1.00 57.89 C
826
+ ATOM 822 CD2 TYR B 102 13.301 16.171 27.306 1.00 60.20 C
827
+ ATOM 823 CE1 TYR B 102 15.206 17.411 28.840 1.00 60.04 C
828
+ ATOM 824 CE2 TYR B 102 13.099 16.305 28.636 1.00 63.45 C
829
+ ATOM 825 CZ TYR B 102 14.048 16.921 29.412 1.00 65.90 C
830
+ ATOM 826 OH TYR B 102 13.828 17.031 30.774 1.00 73.69 O
831
+ ATOM 827 N HIS B 103 14.772 14.122 22.720 1.00 50.72 N
832
+ ATOM 828 CA HIS B 103 14.574 13.998 21.269 1.00 47.58 C
833
+ ATOM 829 C HIS B 103 13.087 13.800 21.008 1.00 56.16 C
834
+ ATOM 830 O HIS B 103 12.324 13.556 21.937 1.00 52.33 O
835
+ ATOM 831 CB HIS B 103 15.366 12.824 20.695 1.00 48.52 C
836
+ ATOM 832 CG HIS B 103 15.015 11.505 21.316 1.00 54.51 C
837
+ ATOM 833 ND1 HIS B 103 14.332 10.520 20.638 1.00 55.30 N
838
+ ATOM 834 CD2 HIS B 103 15.243 11.016 22.560 1.00 60.84 C
839
+ ATOM 835 CE1 HIS B 103 14.162 9.477 21.427 1.00 60.46 C
840
+ ATOM 836 NE2 HIS B 103 14.690 9.758 22.609 1.00 62.27 N
841
+ ATOM 837 N GLY B 104 12.640 13.896 19.751 1.00 47.06 N
842
+ ATOM 838 CA GLY B 104 11.242 13.661 19.433 1.00 48.04 C
843
+ ATOM 839 C GLY B 104 10.955 12.198 19.120 1.00 53.97 C
844
+ ATOM 840 O GLY B 104 11.802 11.315 19.281 1.00 55.64 O
845
+ ATOM 841 N GLN B 105 9.727 11.942 18.653 1.00 51.13 N
846
+ ATOM 842 CA GLN B 105 9.383 10.604 18.165 1.00 53.93 C
847
+ ATOM 843 C GLN B 105 10.010 10.276 16.800 1.00 50.82 C
848
+ ATOM 844 O GLN B 105 9.952 9.120 16.363 1.00 53.13 O
849
+ ATOM 845 CB GLN B 105 7.865 10.444 18.068 0.50 56.14 C
850
+ ATOM 846 CG GLN B 105 7.167 10.211 19.398 0.00 61.20 C
851
+ ATOM 847 CD GLN B 105 5.688 9.922 19.231 0.00 63.96 C
852
+ ATOM 848 OE1 GLN B 105 5.047 10.418 18.304 0.00 61.23 O
853
+ ATOM 849 NE2 GLN B 105 5.139 9.107 20.125 0.00 69.69 N
854
+ ATOM 850 N GLY B 106 10.583 11.244 16.101 1.00 50.12 N
855
+ ATOM 851 CA GLY B 106 11.202 10.955 14.823 1.00 45.63 C
856
+ ATOM 852 C GLY B 106 10.242 11.147 13.664 1.00 47.99 C
857
+ ATOM 853 O GLY B 106 9.022 11.145 13.819 1.00 53.37 O
858
+ ATOM 854 N THR B 107 10.819 11.346 12.477 1.00 44.22 N
859
+ ATOM 855 CA THR B 107 10.054 11.463 11.243 1.00 36.53 C
860
+ ATOM 856 C THR B 107 10.698 10.599 10.152 1.00 47.94 C
861
+ ATOM 857 O THR B 107 11.918 10.636 9.948 1.00 47.96 O
862
+ ATOM 858 CB THR B 107 9.910 12.936 10.827 1.00 41.72 C
863
+ ATOM 859 OG1 THR B 107 8.964 13.034 9.768 1.00 42.73 O
864
+ ATOM 860 CG2 THR B 107 11.233 13.543 10.367 1.00 32.98 C
865
+ ATOM 861 N GLN B 108 9.881 9.784 9.483 1.00 45.41 N
866
+ ATOM 862 CA GLN B 108 10.408 8.815 8.532 1.00 49.12 C
867
+ ATOM 863 C GLN B 108 10.676 9.482 7.191 1.00 45.39 C
868
+ ATOM 864 O GLN B 108 9.815 10.186 6.646 1.00 48.93 O
869
+ ATOM 865 CB GLN B 108 9.439 7.647 8.365 1.00 47.70 C
870
+ ATOM 866 CG GLN B 108 9.862 6.640 7.309 1.00 51.80 C
871
+ ATOM 867 CD GLN B 108 11.057 5.803 7.710 1.00 51.74 C
872
+ ATOM 868 OE1 GLN B 108 11.112 5.278 8.821 1.00 53.55 O
873
+ ATOM 869 NE2 GLN B 108 12.002 5.639 6.794 1.00 46.45 N
874
+ ATOM 870 N VAL B 109 11.886 9.291 6.673 1.00 44.02 N
875
+ ATOM 871 CA VAL B 109 12.267 9.742 5.343 1.00 37.14 C
876
+ ATOM 872 C VAL B 109 12.585 8.496 4.533 1.00 46.38 C
877
+ ATOM 873 O VAL B 109 13.448 7.696 4.930 1.00 44.51 O
878
+ ATOM 874 CB VAL B 109 13.469 10.692 5.388 1.00 37.37 C
879
+ ATOM 875 CG1 VAL B 109 14.017 10.923 4.005 1.00 37.88 C
880
+ ATOM 876 CG2 VAL B 109 13.054 12.019 5.967 1.00 38.84 C
881
+ ATOM 877 N THR B 110 11.892 8.325 3.406 1.00 45.76 N
882
+ ATOM 878 CA THR B 110 12.116 7.201 2.499 1.00 50.12 C
883
+ ATOM 879 C THR B 110 12.383 7.723 1.087 1.00 44.50 C
884
+ ATOM 880 O THR B 110 11.567 8.464 0.521 1.00 49.19 O
885
+ ATOM 881 CB THR B 110 10.918 6.233 2.500 1.00 50.26 C
886
+ ATOM 882 OG1 THR B 110 10.540 5.911 3.845 1.00 60.10 O
887
+ ATOM 883 CG2 THR B 110 11.288 4.952 1.790 1.00 51.13 C
888
+ ATOM 884 N VAL B 111 13.506 7.303 0.514 1.00 46.87 N
889
+ ATOM 885 CA VAL B 111 13.977 7.756 -0.792 1.00 47.18 C
890
+ ATOM 886 C VAL B 111 14.134 6.538 -1.696 1.00 55.58 C
891
+ ATOM 887 O VAL B 111 15.006 5.697 -1.444 1.00 56.80 O
892
+ ATOM 888 CB VAL B 111 15.314 8.494 -0.674 1.00 39.36 C
893
+ ATOM 889 CG1 VAL B 111 15.788 8.924 -2.052 1.00 50.08 C
894
+ ATOM 890 CG2 VAL B 111 15.194 9.656 0.306 1.00 38.67 C
895
+ ATOM 891 N SER B 112 13.327 6.459 -2.762 1.00 51.96 N
896
+ ATOM 892 CA SER B 112 13.352 5.306 -3.666 1.00 54.45 C
897
+ ATOM 893 C SER B 112 14.269 5.544 -4.862 1.00 63.15 C
898
+ ATOM 894 O SER B 112 14.325 6.653 -5.404 1.00 69.62 O
899
+ ATOM 895 CB SER B 112 11.949 4.980 -4.163 1.00 49.98 C
900
+ ATOM 896 OG SER B 112 11.258 6.181 -4.381 1.00 60.85 O
901
+ ATOM 897 N ALA B 113 14.961 4.483 -5.292 1.00 62.77 N
902
+ ATOM 898 CA ALA B 113 16.061 4.607 -6.257 1.00 58.65 C
903
+ ATOM 899 C ALA B 113 15.564 4.963 -7.650 1.00 54.35 C
904
+ ATOM 900 O ALA B 113 14.493 4.514 -8.053 1.00 71.99 O
905
+ ATOM 901 CB ALA B 113 16.877 3.316 -6.296 1.00 58.12 C
906
+ HETATM 902 C1 EDO B 114 23.969 25.365 25.066 1.00 49.76 C
907
+ HETATM 903 O1 EDO B 114 24.534 26.265 24.121 1.00 57.29 O
908
+ HETATM 904 C2 EDO B 114 23.723 24.036 24.366 1.00 51.61 C
909
+ HETATM 905 O2 EDO B 114 24.056 22.959 25.258 1.00 64.47 O
910
+ HETATM 906 O HOH B 115 15.122 18.570 31.700 1.00 55.63 O
911
+ HETATM 907 O HOH B 116 21.221 21.393 30.161 1.00 56.54 O
912
+ HETATM 908 O HOH B 117 24.631 25.751 7.094 1.00 30.89 O
913
+ HETATM 909 O HOH B 118 23.319 30.551 16.574 1.00 40.10 O
914
+ HETATM 910 O HOH B 119 28.594 9.799 8.739 1.00 44.87 O
915
+ HETATM 911 O HOH B 120 21.215 0.585 17.769 1.00 59.73 O
916
+ HETATM 912 O HOH B 121 23.595 17.546 29.974 1.00 49.77 O
917
+ HETATM 913 O HOH B 122 13.890 30.139 20.638 1.00 44.83 O
918
+ HETATM 914 O HOH B 123 7.429 26.013 10.784 1.00 40.83 O
919
+ HETATM 915 O HOH B 124 16.367 18.144 -4.713 1.00 35.62 O
920
+ HETATM 916 O HOH B 125 14.663 33.499 14.002 1.00 60.63 O
921
+ HETATM 917 O HOH B 126 26.527 28.577 9.584 1.00 43.36 O
922
+ HETATM 918 O HOH B 127 5.811 20.992 26.117 1.00 59.77 O
923
+ HETATM 919 O HOH B 128 19.144 25.664 18.308 1.00 38.15 O
924
+ HETATM 920 O HOH B 129 9.202 17.945 3.651 1.00 27.43 O
925
+ HETATM 921 O HOH B 130 31.595 16.195 2.476 1.00 39.74 O
926
+ HETATM 922 O HOH B 131 20.340 6.914 6.277 1.00 44.24 O
927
+ HETATM 923 O HOH B 132 17.205 24.890 6.641 1.00 28.93 O
928
+ HETATM 924 O HOH B 133 27.733 11.173 11.109 1.00 29.85 O
929
+ HETATM 925 O HOH B 134 19.087 3.620 4.755 1.00 55.82 O
930
+ HETATM 926 O HOH B 135 8.539 20.808 7.513 1.00 35.49 O
931
+ HETATM 927 O HOH B 136 20.062 22.301 1.361 1.00 35.26 O
932
+ HETATM 928 O HOH B 137 28.370 15.220 0.810 1.00 36.48 O
933
+ HETATM 929 O HOH B 138 28.079 25.676 7.336 1.00 40.21 O
934
+ HETATM 930 O HOH B 139 26.749 11.278 0.161 1.00 44.86 O
935
+ HETATM 931 O HOH B 140 25.709 21.750 3.710 1.00 27.94 O
936
+ HETATM 932 O HOH B 141 22.310 19.439 -3.494 1.00 35.89 O
937
+ HETATM 933 O HOH B 142 7.463 13.006 15.125 1.00 47.61 O
938
+ HETATM 934 O HOH B 143 19.000 29.947 11.014 1.00 40.84 O
939
+ HETATM 935 O HOH B 144 23.057 3.508 17.557 1.00 58.85 O
940
+ HETATM 936 O HOH B 145 7.683 13.700 17.916 1.00 49.58 O
941
+ HETATM 937 O HOH B 146 31.518 14.110 9.002 1.00 35.19 O
942
+ HETATM 938 O HOH B 147 22.726 5.758 -1.780 1.00 45.38 O
943
+ HETATM 939 O HOH B 148 14.788 28.378 7.277 1.00 50.01 O
944
+ HETATM 940 O HOH B 149 10.305 29.476 9.036 1.00 58.97 O
945
+ HETATM 941 O HOH B 150 24.021 9.985 3.137 1.00 41.11 O
946
+ HETATM 942 O HOH B 151 26.622 14.359 -0.529 1.00 45.92 O
947
+ HETATM 943 O HOH B 152 21.434 4.830 10.770 1.00 45.36 O
948
+ HETATM 944 O HOH B 153 13.654 12.586 24.849 1.00 51.17 O
949
+ HETATM 945 O HOH B 154 34.715 12.087 4.291 1.00 31.18 O
950
+ HETATM 946 O HOH B 155 24.648 28.798 14.783 1.00 33.94 O
951
+ HETATM 947 O HOH B 156 7.298 19.850 13.642 1.00 35.97 O
952
+ HETATM 948 O HOH B 157 35.494 15.619 8.207 1.00 33.90 O
953
+ HETATM 949 O HOH B 158 31.757 16.778 10.076 1.00 40.64 O
954
+ HETATM 950 O HOH B 159 29.534 27.644 10.422 1.00 36.23 O
955
+ HETATM 951 O HOH B 160 6.349 19.803 8.414 1.00 47.83 O
956
+ HETATM 952 O HOH B 161 26.084 8.717 -4.126 1.00 60.03 O
957
+ HETATM 953 O HOH B 162 12.113 28.745 3.279 1.00 45.88 O
958
+ HETATM 954 O HOH B 163 21.557 21.814 -2.241 1.00 42.97 O
959
+ HETATM 955 O HOH B 164 7.387 25.475 18.125 1.00 51.67 O
960
+ HETATM 956 O HOH B 165 29.719 11.278 6.919 1.00 33.22 O
961
+ HETATM 957 O HOH B 166 21.969 6.056 8.311 1.00 51.15 O
962
+ HETATM 958 O HOH B 167 14.592 4.223 14.080 1.00 51.70 O
963
+ HETATM 959 O HOH B 168 11.522 11.774 24.598 1.00 55.58 O
964
+ HETATM 960 O HOH B 169 23.173 19.579 28.444 1.00 66.38 O
965
+ HETATM 961 O HOH B 170 24.888 30.515 6.347 1.00 56.06 O
966
+ HETATM 962 O HOH B 171 24.494 18.866 -4.119 1.00 49.58 O
967
+ HETATM 963 O HOH B 172 23.358 33.625 15.755 1.00 51.80 O
968
+ HETATM 964 O HOH B 173 31.288 11.786 2.128 1.00 44.79 O
969
+ HETATM 965 O HOH B 174 26.038 25.564 4.772 1.00 37.80 O
970
+ HETATM 966 O HOH B 175 14.145 34.410 12.019 1.00 64.96 O
971
+ HETATM 967 O HOH B 176 6.588 22.726 13.095 1.00 45.48 O
972
+ HETATM 968 O HOH B 177 28.761 23.893 1.833 1.00 44.59 O
973
+ HETATM 969 O HOH B 178 13.982 32.534 21.981 1.00 51.01 O
974
+ HETATM 970 O HOH B 179 14.193 33.476 24.280 1.00 56.77 O
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