NMR Restraints Grid
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NMR Restraints Grid |
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Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
532865 |
2khu   |
16882 | cing | 1-original | 6 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 H LYS 61 H LYS 61 -12.220 -0.563 1.462
2 HA LYS 61 HA LYS 61 -10.875 -1.920 3.720
3 HB2 LYS 61 1HB LYS 61 -12.823 -2.959 2.498
4 HB3 LYS 61 2HB LYS 61 -11.787 -3.092 1.076
5 HG2 LYS 61 1HG LYS 61 -11.161 -5.096 1.923
6 HG3 LYS 61 2HG LYS 61 -10.211 -4.163 3.081
7 HD2 LYS 61 1HD LYS 61 -12.380 -4.052 4.482
8 HD3 LYS 61 2HD LYS 61 -12.962 -5.354 3.443
9 HE2 LYS 61 1HE LYS 61 -11.941 -6.709 4.962
10 HE3 LYS 61 2HE LYS 61 -10.471 -6.276 4.090
11 HZ1 LYS 61 3HZ LYS 61 -10.695 -4.207 5.743
12 HZ2 LYS 61 1HZ LYS 61 -9.817 -5.608 6.119
13 HZ3 LYS 61 2HZ LYS 61 -11.401 -5.418 6.703
14 H ILE 62 H ILE 62 -8.658 -2.029 3.740
15 HA ILE 62 HA ILE 62 -7.231 -1.691 1.145
16 HB ILE 62 HB ILE 62 -6.158 -1.463 3.973
17 HG12 ILE 62 1HG1 ILE 62 -6.908 0.695 1.971
18 HG13 ILE 62 2HG1 ILE 62 -7.823 0.297 3.426
19 HG21 ILE 62 1HG2 ILE 62 -4.459 -2.063 2.298
20 HG22 ILE 62 2HG2 ILE 62 -4.230 -0.400 2.839
21 HG23 ILE 62 3HG2 ILE 62 -4.980 -0.724 1.276
22 HD11 ILE 62 3HD1 ILE 62 -5.207 0.636 4.339
23 HD12 ILE 62 1HD1 ILE 62 -6.527 1.792 4.512
24 HD13 ILE 62 2HD1 ILE 62 -5.417 1.919 3.148
25 H THR 63 H THR 63 -5.851 -3.271 0.408
26 HA THR 63 HA THR 63 -5.552 -5.733 2.094
27 HB THR 63 HB THR 63 -5.396 -6.837 -0.295
28 HG1 THR 63 1HG THR 63 -7.309 -5.263 -1.235
29 HG21 THR 63 3HG2 THR 63 -7.772 -7.339 -0.191
30 HG22 THR 63 1HG2 THR 63 -8.065 -5.907 0.796
31 HG23 THR 63 2HG2 THR 63 -7.137 -7.256 1.453
32 H PHE 64 H PHE 64 -3.444 -5.968 2.620
33 HA PHE 64 HA PHE 64 -1.396 -4.733 0.865
34 HB2 PHE 64 1HB PHE 64 -1.081 -5.980 3.608
35 HB3 PHE 64 2HB PHE 64 0.133 -5.039 2.744
36 HD1 PHE 64 1HD PHE 64 -0.227 -2.613 2.332
37 HD2 PHE 64 2HD PHE 64 -2.901 -4.922 4.765
38 HE1 PHE 64 1HE PHE 64 -1.156 -0.521 3.284
39 HE2 PHE 64 2HE PHE 64 -3.837 -2.833 5.720
40 HZ PHE 64 HZ PHE 64 -2.964 -0.632 4.981
41 HA PRO 65 HA PRO 65 -0.376 -8.697 -1.060
42 HB2 PRO 65 1HB PRO 65 2.398 -7.638 -0.745
43 HB3 PRO 65 2HB PRO 65 1.612 -8.342 -2.170
44 HG2 PRO 65 1HG PRO 65 1.988 -5.711 -1.907
45 HG3 PRO 65 2HG PRO 65 0.580 -6.389 -2.734
46 HD2 PRO 65 1HD PRO 65 0.715 -5.015 -0.117
47 HD3 PRO 65 2HD PRO 65 -0.671 -5.253 -1.202
48 H SER 66 H SER 66 0.788 -10.657 -0.457
49 HA SER 66 HA SER 66 0.963 -11.119 2.381
50 HB2 SER 66 1HB SER 66 0.797 -13.230 1.640
51 HB3 SER 66 2HB SER 66 1.005 -12.670 -0.017
52 HG SER 66 HG SER 66 3.237 -12.823 0.267
53 H ASP 67 H ASP 67 3.098 -9.482 0.393
54 HA ASP 67 HA ASP 67 5.395 -10.240 2.161
55 HB2 ASP 67 1HB ASP 67 5.491 -10.828 -0.375
56 HB3 ASP 67 2HB ASP 67 5.763 -9.098 -0.599
57 H ILE 68 H ILE 68 3.211 -7.903 1.909
58 HA ILE 68 HA ILE 68 5.199 -5.693 2.258
59 HB ILE 68 HB ILE 68 2.341 -5.665 1.307
60 HG12 ILE 68 1HG1 ILE 68 4.030 -6.070 -0.427
61 HG13 ILE 68 2HG1 ILE 68 3.340 -4.462 -0.623
62 HG21 ILE 68 1HG2 ILE 68 2.828 -3.104 1.194
63 HG22 ILE 68 2HG2 ILE 68 4.035 -3.453 2.432
64 HG23 ILE 68 3HG2 ILE 68 2.334 -3.812 2.732
65 HD11 ILE 68 3HD1 ILE 68 5.557 -3.891 -0.788
66 HD12 ILE 68 1HD1 ILE 68 6.091 -5.250 0.199
67 HD13 ILE 68 2HD1 ILE 68 5.411 -3.817 0.967
68 H ASP 69 H ASP 69 5.377 -4.868 4.214
69 HA ASP 69 HA ASP 69 3.490 -5.695 6.333
70 HB2 ASP 69 1HB ASP 69 5.912 -5.823 6.772
71 HB3 ASP 69 2HB ASP 69 6.060 -4.093 6.480
72 HA PRO 70 HA PRO 70 1.245 -1.854 5.967
73 HB2 PRO 70 1HB PRO 70 0.131 -1.762 8.488
74 HB3 PRO 70 2HB PRO 70 -0.495 -2.735 7.146
75 HG2 PRO 70 1HG PRO 70 1.138 -3.556 9.479
76 HG3 PRO 70 2HG PRO 70 -0.141 -4.432 8.622
77 HD2 PRO 70 1HD PRO 70 2.530 -4.963 8.287
78 HD3 PRO 70 2HD PRO 70 1.308 -5.262 7.032
79 H GLN 71 H GLN 71 3.212 -2.300 8.917
80 HA GLN 71 HA GLN 71 3.303 0.552 9.504
81 HB2 GLN 71 1HB GLN 71 3.633 -0.921 11.358
82 HB3 GLN 71 2HB GLN 71 4.869 -1.839 10.496
83 HG2 GLN 71 1HG GLN 71 5.721 -0.173 12.234
84 HG3 GLN 71 2HG GLN 71 6.434 -0.042 10.627
85 HE21 GLN 71 1HE2 GLN 71 3.247 1.135 11.832
86 HE22 GLN 71 2HE2 GLN 71 3.529 2.760 11.429
87 H VAL 72 H VAL 72 5.347 -1.679 7.670
88 HA VAL 72 HA VAL 72 7.419 0.377 7.316
89 HB VAL 72 HB VAL 72 7.090 -2.216 5.785
90 HG11 VAL 72 1HG1 VAL 72 9.660 -1.901 5.743
91 HG12 VAL 72 2HG1 VAL 72 9.320 -0.233 6.206
92 HG13 VAL 72 3HG1 VAL 72 8.690 -0.873 4.688
93 HG21 VAL 72 3HG2 VAL 72 8.364 -3.325 7.448
94 HG22 VAL 72 1HG2 VAL 72 7.193 -2.385 8.370
95 HG23 VAL 72 2HG2 VAL 72 8.850 -1.808 8.204
96 H PHE 73 H PHE 73 4.500 -0.658 5.761
97 HA PHE 73 HA PHE 73 5.083 0.457 3.142
98 HB2 PHE 73 1HB PHE 73 3.422 -1.343 3.491
99 HB3 PHE 73 2HB PHE 73 2.445 -0.244 4.460
100 HD1 PHE 73 1HD PHE 73 3.993 -0.604 1.077
101 HD2 PHE 73 2HD PHE 73 0.864 1.157 3.433
102 HE1 PHE 73 1HE PHE 73 2.921 0.258 -0.984
103 HE2 PHE 73 2HE PHE 73 -0.202 2.024 1.368
104 HZ PHE 73 HZ PHE 73 0.832 1.574 -0.838
105 H TYR 74 H TYR 74 2.884 1.489 5.776
106 HA TYR 74 HA TYR 74 2.239 4.000 4.611
107 HB2 TYR 74 1HB TYR 74 2.276 3.053 7.483
108 HB3 TYR 74 2HB TYR 74 1.788 4.693 7.057
109 HD1 TYR 74 2HD TYR 74 0.113 4.715 4.883
110 HD2 TYR 74 1HD TYR 74 0.550 1.527 7.729
111 HE1 TYR 74 2HE TYR 74 -2.146 3.882 4.299
112 HE2 TYR 74 1HE TYR 74 -1.709 0.693 7.142
113 HH TYR 74 HH TYR 74 -3.572 2.140 4.502
114 H GLU 75 H GLU 75 5.174 2.933 6.018
115 HA GLU 75 HA GLU 75 6.121 5.582 6.802
116 HB2 GLU 75 1HB GLU 75 6.905 3.255 7.666
117 HB3 GLU 75 2HB GLU 75 7.890 3.219 6.202
118 HG2 GLU 75 1HG GLU 75 9.298 4.181 7.855
119 HG3 GLU 75 2HG GLU 75 8.717 5.549 6.904
120 H LEU 76 H LEU 76 5.530 4.172 3.846
121 HA LEU 76 HA LEU 76 7.878 5.304 2.474
122 HB2 LEU 76 1HB LEU 76 5.422 3.899 1.386
123 HB3 LEU 76 2HB LEU 76 6.852 4.331 0.445
124 HG LEU 76 HG LEU 76 6.873 2.511 2.870
125 HD11 LEU 76 1HD1 LEU 76 6.855 1.944 -0.101
126 HD12 LEU 76 2HD1 LEU 76 5.738 1.339 1.122
127 HD13 LEU 76 3HD1 LEU 76 7.405 0.763 1.088
128 HD21 LEU 76 3HD2 LEU 76 8.947 3.669 1.064
129 HD22 LEU 76 1HD2 LEU 76 9.159 1.988 1.554
130 HD23 LEU 76 2HD2 LEU 76 9.052 3.256 2.774
131 HA PRO 77 HA PRO 77 6.072 9.245 1.454
132 HB2 PRO 77 1HB PRO 77 6.798 8.807 -1.384
133 HB3 PRO 77 2HB PRO 77 7.287 10.106 -0.284
134 HG2 PRO 77 1HG PRO 77 8.924 8.092 -1.068
135 HG3 PRO 77 2HG PRO 77 9.098 8.978 0.452
136 HD2 PRO 77 1HD PRO 77 8.194 6.201 0.013
137 HD3 PRO 77 2HD PRO 77 8.834 6.975 1.479
138 H GLU 78 H GLU 78 4.259 10.176 0.259
139 HA GLU 78 HA GLU 78 2.089 8.370 -0.187
140 HB2 GLU 78 1HB GLU 78 2.474 11.241 -1.086
141 HB3 GLU 78 2HB GLU 78 0.943 10.366 -1.145
142 HG2 GLU 78 1HG GLU 78 1.933 9.985 1.467
143 HG3 GLU 78 2HG GLU 78 2.183 11.693 1.105
144 H ALA 79 H ALA 79 4.086 10.197 -2.552
145 HA ALA 79 HA ALA 79 2.863 9.277 -4.899
146 HB1 ALA 79 1HB ALA 79 5.042 10.807 -4.404
147 HB2 ALA 79 2HB ALA 79 4.691 10.132 -5.995
148 HB3 ALA 79 3HB ALA 79 5.838 9.323 -4.927
149 H VAL 80 H VAL 80 5.128 7.598 -2.776
150 HA VAL 80 HA VAL 80 5.417 5.305 -4.570
151 HB VAL 80 HB VAL 80 6.150 5.789 -1.669
152 HG11 VAL 80 1HG1 VAL 80 6.170 3.296 -3.327
153 HG12 VAL 80 2HG1 VAL 80 5.867 3.490 -1.601
154 HG13 VAL 80 3HG1 VAL 80 7.516 3.574 -2.221
155 HG21 VAL 80 3HG2 VAL 80 8.290 5.071 -3.473
156 HG22 VAL 80 1HG2 VAL 80 8.088 6.551 -2.534
157 HG23 VAL 80 2HG2 VAL 80 7.375 6.423 -4.142
158 H GLN 81 H GLN 81 3.463 6.223 -1.799
159 HA GLN 81 HA GLN 81 2.239 3.685 -1.284
160 HB2 GLN 81 1HB GLN 81 2.154 5.691 0.223
161 HB3 GLN 81 2HB GLN 81 1.033 6.441 -0.910
162 HG2 GLN 81 1HG GLN 81 -0.707 5.155 -0.228
163 HG3 GLN 81 2HG GLN 81 0.286 3.700 -0.124
164 HE21 GLN 81 1HE2 GLN 81 2.255 4.532 1.723
165 HE22 GLN 81 2HE2 GLN 81 1.521 4.855 3.216
166 H LYS 82 H LYS 82 1.109 6.482 -3.214
167 HA LYS 82 HA LYS 82 -1.274 5.285 -4.187
168 HB2 LYS 82 1HB LYS 82 0.494 7.531 -5.058
169 HB3 LYS 82 2HB LYS 82 -0.696 6.926 -6.211
170 HG2 LYS 82 1HG LYS 82 -1.712 8.725 -4.941
171 HG3 LYS 82 2HG LYS 82 -2.460 7.207 -4.444
172 HD2 LYS 82 1HD LYS 82 -1.218 7.135 -2.418
173 HD3 LYS 82 2HD LYS 82 -0.093 8.374 -2.974
174 HE2 LYS 82 1HE LYS 82 -1.554 10.098 -2.541
175 HE3 LYS 82 2HE LYS 82 -2.978 9.111 -2.871
176 HZ1 LYS 82 3HZ LYS 82 -1.246 8.855 -0.473
177 HZ2 LYS 82 1HZ LYS 82 -2.664 7.976 -0.783
178 HZ3 LYS 82 2HZ LYS 82 -2.746 9.652 -0.512
179 H GLU 83 H GLU 83 1.962 5.450 -5.728
180 HA GLU 83 HA GLU 83 1.247 3.969 -8.049
181 HB2 GLU 83 1HB GLU 83 3.865 4.348 -6.592
182 HB3 GLU 83 2HB GLU 83 3.759 3.344 -8.038
183 HG2 GLU 83 1HG GLU 83 2.402 5.909 -8.376
184 HG3 GLU 83 2HG GLU 83 4.115 6.102 -7.998
185 H LEU 84 H LEU 84 2.316 2.854 -4.846
186 HA LEU 84 HA LEU 84 2.420 0.075 -5.680
187 HB2 LEU 84 1HB LEU 84 2.369 1.397 -2.954
188 HB3 LEU 84 2HB LEU 84 2.499 -0.349 -3.175
189 HG LEU 84 HG LEU 84 4.395 1.671 -4.412
190 HD11 LEU 84 1HD1 LEU 84 4.536 1.560 -1.906
191 HD12 LEU 84 2HD1 LEU 84 6.001 1.012 -2.719
192 HD13 LEU 84 3HD1 LEU 84 4.875 -0.165 -2.048
193 HD21 LEU 84 3HD2 LEU 84 3.991 -1.242 -4.637
194 HD22 LEU 84 1HD2 LEU 84 5.656 -0.771 -4.302
195 HD23 LEU 84 2HD2 LEU 84 4.829 -0.134 -5.724
196 H LEU 85 H LEU 85 -0.029 2.151 -4.163
197 HA LEU 85 HA LEU 85 -1.888 -0.016 -3.672
198 HB2 LEU 85 1HB LEU 85 -2.209 2.987 -3.898
199 HB3 LEU 85 2HB LEU 85 -3.590 1.923 -3.637
200 HG LEU 85 HG LEU 85 -1.143 1.823 -1.872
201 HD11 LEU 85 1HD1 LEU 85 -2.281 3.309 -0.315
202 HD12 LEU 85 2HD1 LEU 85 -3.668 3.432 -1.397
203 HD13 LEU 85 3HD1 LEU 85 -2.116 4.125 -1.870
204 HD21 LEU 85 3HD2 LEU 85 -3.492 0.264 -2.089
205 HD22 LEU 85 1HD2 LEU 85 -3.700 1.253 -0.643
206 HD23 LEU 85 2HD2 LEU 85 -2.291 0.204 -0.799
207 H ALA 86 H ALA 86 -1.330 2.229 -6.356
208 HA ALA 86 HA ALA 86 -3.605 1.465 -7.917
209 HB1 ALA 86 1HB ALA 86 -1.169 2.117 -9.440
210 HB2 ALA 86 2HB ALA 86 -1.566 3.302 -8.195
211 HB3 ALA 86 3HB ALA 86 -2.744 2.911 -9.449
212 H GLU 87 H GLU 87 -0.397 0.077 -7.485
213 HA GLU 87 HA GLU 87 -0.692 -1.862 -9.654
214 HB2 GLU 87 1HB GLU 87 1.546 -1.173 -8.839
215 HB3 GLU 87 2HB GLU 87 1.176 -1.861 -7.257
216 HG2 GLU 87 1HG GLU 87 1.002 -4.086 -8.194
217 HG3 GLU 87 2HG GLU 87 1.148 -3.454 -9.835
218 H TRP 88 H TRP 88 -1.348 -1.758 -6.197
219 HA TRP 88 HA TRP 88 -1.954 -4.572 -5.903
220 HB2 TRP 88 1HB TRP 88 -2.963 -2.193 -4.312
221 HB3 TRP 88 2HB TRP 88 -3.067 -3.880 -3.815
222 HD1 TRP 88 HD TRP 88 0.116 -3.781 -5.433
223 HE1 TRP 88 1HE TRP 88 2.043 -3.351 -3.766
224 HE3 TRP 88 3HE TRP 88 -2.533 -2.073 -1.411
225 HZ2 TRP 88 2HZ TRP 88 2.413 -2.414 -1.108
226 HZ3 TRP 88 3HZ TRP 88 -1.364 -1.417 0.674
227 HH2 TRP 88 HH TRP 88 1.105 -1.587 0.827
228 H LYS 89 H LYS 89 -3.741 -1.709 -6.866
229 HA LYS 89 HA LYS 89 -6.354 -2.966 -6.816
230 HB2 LYS 89 1HB LYS 89 -6.312 -0.575 -6.698
231 HB3 LYS 89 2HB LYS 89 -5.281 -0.454 -8.122
232 HG2 LYS 89 1HG LYS 89 -7.827 -1.895 -8.552
233 HG3 LYS 89 2HG LYS 89 -7.996 -0.181 -8.181
234 HD2 LYS 89 1HD LYS 89 -5.962 -1.052 -10.213
235 HD3 LYS 89 2HD LYS 89 -7.659 -0.932 -10.678
236 HE2 LYS 89 1HE LYS 89 -7.729 1.401 -9.945
237 HE3 LYS 89 2HE LYS 89 -6.061 1.296 -9.381
238 HZ1 LYS 89 3HZ LYS 89 -5.283 1.548 -11.438
239 HZ2 LYS 89 1HZ LYS 89 -6.840 2.073 -11.857
240 HZ3 LYS 89 2HZ LYS 89 -6.396 0.452 -12.104
241 H ARG 90 H ARG 90 -3.854 -2.502 -9.310
242 HA ARG 90 HA ARG 90 -5.439 -3.419 -11.501
243 HB2 ARG 90 1HB ARG 90 -2.450 -3.506 -10.998
244 HB3 ARG 90 2HB ARG 90 -3.176 -4.041 -12.514
245 HG2 ARG 90 1HG ARG 90 -4.142 -1.833 -12.880
246 HG3 ARG 90 2HG ARG 90 -3.550 -1.283 -11.313
247 HD2 ARG 90 1HD ARG 90 -1.403 -1.043 -12.058
248 HD3 ARG 90 2HD ARG 90 -1.507 -2.449 -13.118
249 HE ARG 90 HE ARG 90 -3.090 -0.150 -14.015
250 HH11 ARG 90 1HH2 ARG 90 -0.086 -1.842 -14.029
251 HH12 ARG 90 2HH2 ARG 90 0.449 -1.153 -15.525
252 HH21 ARG 90 1HH1 ARG 90 -2.409 0.758 -15.973
253 HH22 ARG 90 2HH1 ARG 90 -0.866 0.318 -16.626
254 H THR 91 H THR 91 -3.321 -5.158 -9.221
255 HA THR 91 HA THR 91 -4.089 -7.761 -10.381
256 HB THR 91 HB THR 91 -2.659 -8.705 -8.627
257 HG1 THR 91 1HG THR 91 -3.327 -7.097 -7.052
258 HG21 THR 91 3HG2 THR 91 -1.026 -6.351 -9.362
259 HG22 THR 91 1HG2 THR 91 -1.801 -7.181 -10.710
260 HG23 THR 91 2HG2 THR 91 -0.719 -8.064 -9.634
261 H GLY 92 H GLY 92 -4.689 -5.879 -7.448
262 HA2 GLY 92 1HA GLY 92 -6.971 -5.891 -6.481
263 HA3 GLY 92 2HA GLY 92 -7.094 -7.586 -6.949
Start of MODEL 2
1 H LYS 61 H LYS 61 -11.997 -0.681 2.113
2 HA LYS 61 HA LYS 61 -10.512 -2.252 4.139
3 HB2 LYS 61 1HB LYS 61 -11.902 -3.052 1.564
4 HB3 LYS 61 2HB LYS 61 -11.058 -4.180 2.625
5 HG2 LYS 61 1HG LYS 61 -12.610 -3.906 4.366
6 HG3 LYS 61 2HG LYS 61 -13.193 -2.368 3.729
7 HD2 LYS 61 1HD LYS 61 -14.778 -4.302 3.374
8 HD3 LYS 61 2HD LYS 61 -14.305 -3.472 1.891
9 HE2 LYS 61 1HE LYS 61 -12.838 -5.202 1.246
10 HE3 LYS 61 2HE LYS 61 -12.766 -5.868 2.878
11 HZ1 LYS 61 3HZ LYS 61 -15.275 -6.227 2.545
12 HZ2 LYS 61 1HZ LYS 61 -14.195 -7.299 1.797
13 HZ3 LYS 61 2HZ LYS 61 -14.931 -6.066 0.889
14 H ILE 62 H ILE 62 -8.314 -2.186 3.963
15 HA ILE 62 HA ILE 62 -7.121 -1.838 1.251
16 HB ILE 62 HB ILE 62 -5.828 -1.551 3.978
17 HG12 ILE 62 1HG1 ILE 62 -6.763 0.580 2.028
18 HG13 ILE 62 2HG1 ILE 62 -7.611 0.138 3.511
19 HG21 ILE 62 1HG2 ILE 62 -4.905 -0.888 1.165
20 HG22 ILE 62 2HG2 ILE 62 -4.204 -2.090 2.249
21 HG23 ILE 62 3HG2 ILE 62 -4.065 -0.374 2.627
22 HD11 ILE 62 3HD1 ILE 62 -5.329 1.885 3.177
23 HD12 ILE 62 1HD1 ILE 62 -4.932 0.559 4.269
24 HD13 ILE 62 2HD1 ILE 62 -6.309 1.604 4.616
25 H THR 63 H THR 63 -5.839 -3.439 0.389
26 HA THR 63 HA THR 63 -5.402 -5.882 2.072
27 HB THR 63 HB THR 63 -5.402 -7.116 -0.114
28 HG1 THR 63 1HG THR 63 -4.927 -5.376 -1.462
29 HG21 THR 63 3HG2 THR 63 -7.718 -7.335 -0.154
30 HG22 THR 63 1HG2 THR 63 -7.987 -5.605 0.065
31 HG23 THR 63 2HG2 THR 63 -7.473 -6.597 1.430
32 H PHE 64 H PHE 64 -3.294 -6.068 2.603
33 HA PHE 64 HA PHE 64 -1.260 -4.841 0.828
34 HB2 PHE 64 1HB PHE 64 -1.031 -5.949 3.640
35 HB3 PHE 64 2HB PHE 64 0.266 -5.151 2.753
36 HD1 PHE 64 1HD PHE 64 -0.060 -2.741 2.014
37 HD2 PHE 64 2HD PHE 64 -2.676 -4.697 4.798
38 HE1 PHE 64 1HE PHE 64 -0.886 -0.533 2.784
39 HE2 PHE 64 2HE PHE 64 -3.505 -2.491 5.571
40 HZ PHE 64 HZ PHE 64 -2.610 -0.408 4.563
41 HA PRO 65 HA PRO 65 -0.178 -8.845 -0.951
42 HB2 PRO 65 1HB PRO 65 2.603 -7.827 -0.596
43 HB3 PRO 65 2HB PRO 65 1.828 -8.528 -2.029
44 HG2 PRO 65 1HG PRO 65 2.260 -5.899 -1.765
45 HG3 PRO 65 2HG PRO 65 0.876 -6.556 -2.646
46 HD2 PRO 65 1HD PRO 65 0.925 -5.154 -0.045
47 HD3 PRO 65 2HD PRO 65 -0.421 -5.398 -1.176
48 H SER 66 H SER 66 0.827 -10.810 -0.264
49 HA SER 66 HA SER 66 0.978 -11.277 2.564
50 HB2 SER 66 1HB SER 66 0.512 -13.220 1.405
51 HB3 SER 66 2HB SER 66 1.613 -12.826 0.089
52 HG SER 66 HG SER 66 2.253 -13.705 2.712
53 H ASP 67 H ASP 67 3.151 -9.621 0.656
54 HA ASP 67 HA ASP 67 5.411 -10.383 2.473
55 HB2 ASP 67 1HB ASP 67 5.425 -10.863 -0.178
56 HB3 ASP 67 2HB ASP 67 6.042 -9.209 -0.180
57 H ILE 68 H ILE 68 3.260 -8.018 2.188
58 HA ILE 68 HA ILE 68 5.288 -5.841 2.527
59 HB ILE 68 HB ILE 68 2.459 -5.773 1.494
60 HG12 ILE 68 1HG1 ILE 68 4.194 -6.241 -0.183
61 HG13 ILE 68 2HG1 ILE 68 3.534 -4.626 -0.429
62 HG21 ILE 68 1HG2 ILE 68 4.121 -3.626 2.738
63 HG22 ILE 68 2HG2 ILE 68 2.376 -3.872 2.796
64 HG23 ILE 68 3HG2 ILE 68 3.124 -3.204 1.345
65 HD11 ILE 68 3HD1 ILE 68 5.756 -4.077 -0.533
66 HD12 ILE 68 1HD1 ILE 68 6.250 -5.441 0.468
67 HD13 ILE 68 2HD1 ILE 68 5.574 -3.996 1.217
68 H ASP 69 H ASP 69 5.395 -4.907 4.438
69 HA ASP 69 HA ASP 69 3.465 -5.673 6.546
70 HB2 ASP 69 1HB ASP 69 5.860 -5.764 7.078
71 HB3 ASP 69 2HB ASP 69 6.028 -4.059 6.677
72 HA PRO 70 HA PRO 70 1.202 -1.863 5.986
73 HB2 PRO 70 1HB PRO 70 0.023 -1.681 8.468
74 HB3 PRO 70 2HB PRO 70 -0.553 -2.739 7.166
75 HG2 PRO 70 1HG PRO 70 1.080 -3.397 9.557
76 HG3 PRO 70 2HG PRO 70 -0.197 -4.333 8.764
77 HD2 PRO 70 1HD PRO 70 2.458 -4.887 8.436
78 HD3 PRO 70 2HD PRO 70 1.242 -5.218 7.183
79 H GLN 71 H GLN 71 3.157 -2.218 8.939
80 HA GLN 71 HA GLN 71 3.228 0.661 9.451
81 HB2 GLN 71 1HB GLN 71 3.637 -1.406 11.086
82 HB3 GLN 71 2HB GLN 71 5.304 -1.199 10.547
83 HG2 GLN 71 1HG GLN 71 4.726 1.371 11.056
84 HG3 GLN 71 2HG GLN 71 3.600 0.618 12.185
85 HE21 GLN 71 1HE2 GLN 71 4.543 -0.846 13.854
86 HE22 GLN 71 2HE2 GLN 71 6.173 -0.684 14.296
87 H VAL 72 H VAL 72 5.218 -1.637 7.678
88 HA VAL 72 HA VAL 72 7.357 0.346 7.300
89 HB VAL 72 HB VAL 72 6.957 -2.224 5.755
90 HG11 VAL 72 1HG1 VAL 72 9.441 -0.661 6.516
91 HG12 VAL 72 2HG1 VAL 72 8.650 -0.590 4.941
92 HG13 VAL 72 3HG1 VAL 72 9.383 -2.097 5.494
93 HG21 VAL 72 3HG2 VAL 72 8.264 -3.355 7.469
94 HG22 VAL 72 1HG2 VAL 72 6.867 -2.605 8.239
95 HG23 VAL 72 2HG2 VAL 72 8.455 -1.850 8.367
96 H PHE 73 H PHE 73 4.405 -0.625 5.761
97 HA PHE 73 HA PHE 73 5.011 0.477 3.132
98 HB2 PHE 73 1HB PHE 73 3.311 -1.320 3.567
99 HB3 PHE 73 2HB PHE 73 2.325 -0.119 4.401
100 HD1 PHE 73 2HD PHE 73 4.083 -0.702 1.146
101 HD2 PHE 73 1HD PHE 73 0.805 1.179 3.186
102 HE1 PHE 73 2HE PHE 73 3.162 0.053 -1.029
103 HE2 PHE 73 1HE PHE 73 -0.117 1.932 1.013
104 HZ PHE 73 HZ PHE 73 1.062 1.372 -1.097
105 H TYR 74 H TYR 74 2.811 1.524 5.759
106 HA TYR 74 HA TYR 74 2.224 4.055 4.590
107 HB2 TYR 74 1HB TYR 74 2.191 3.096 7.458
108 HB3 TYR 74 2HB TYR 74 1.751 4.750 7.032
109 HD1 TYR 74 2HD TYR 74 0.115 4.829 4.832
110 HD2 TYR 74 1HD TYR 74 0.428 1.603 7.655
111 HE1 TYR 74 2HE TYR 74 -2.157 4.060 4.208
112 HE2 TYR 74 1HE TYR 74 -1.845 0.837 7.030
113 HH TYR 74 HH TYR 74 -4.041 2.410 5.813
114 H GLU 75 H GLU 75 5.105 2.885 5.995
115 HA GLU 75 HA GLU 75 6.155 5.475 6.844
116 HB2 GLU 75 1HB GLU 75 6.842 2.939 7.457
117 HB3 GLU 75 2HB GLU 75 7.988 3.232 6.149
118 HG2 GLU 75 1HG GLU 75 8.506 5.453 7.376
119 HG3 GLU 75 2HG GLU 75 7.701 4.713 8.759
120 H LEU 76 H LEU 76 5.501 4.125 3.866
121 HA LEU 76 HA LEU 76 7.860 5.246 2.500
122 HB2 LEU 76 1HB LEU 76 5.397 3.882 1.375
123 HB3 LEU 76 2HB LEU 76 6.857 4.280 0.469
124 HG LEU 76 HG LEU 76 6.782 2.454 2.888
125 HD11 LEU 76 1HD1 LEU 76 6.956 0.613 1.357
126 HD12 LEU 76 2HD1 LEU 76 7.169 1.696 -0.017
127 HD13 LEU 76 3HD1 LEU 76 5.608 1.602 0.798
128 HD21 LEU 76 3HD2 LEU 76 8.912 3.658 1.237
129 HD22 LEU 76 1HD2 LEU 76 9.067 1.916 1.461
130 HD23 LEU 76 2HD2 LEU 76 8.997 2.983 2.864
131 HA PRO 77 HA PRO 77 6.075 9.196 1.519
132 HB2 PRO 77 1HB PRO 77 6.747 8.823 -1.329
133 HB3 PRO 77 2HB PRO 77 7.310 10.059 -0.192
134 HG2 PRO 77 1HG PRO 77 8.818 7.966 -1.108
135 HG3 PRO 77 2HG PRO 77 9.128 8.870 0.379
136 HD2 PRO 77 1HD PRO 77 8.158 6.119 0.065
137 HD3 PRO 77 2HD PRO 77 8.821 6.931 1.498
138 H GLU 78 H GLU 78 4.261 10.153 0.341
139 HA GLU 78 HA GLU 78 2.076 8.354 -0.121
140 HB2 GLU 78 1HB GLU 78 2.237 11.159 -1.221
141 HB3 GLU 78 2HB GLU 78 0.815 10.282 -0.653
142 HG2 GLU 78 1HG GLU 78 2.968 11.633 0.930
143 HG3 GLU 78 2HG GLU 78 1.222 11.625 1.192
144 H ALA 79 H ALA 79 4.093 10.215 -2.445
145 HA ALA 79 HA ALA 79 2.808 9.389 -4.802
146 HB1 ALA 79 1HB ALA 79 5.305 10.615 -4.118
147 HB2 ALA 79 2HB ALA 79 4.473 10.629 -5.673
148 HB3 ALA 79 3HB ALA 79 5.621 9.343 -5.300
149 H VAL 80 H VAL 80 5.139 7.644 -2.803
150 HA VAL 80 HA VAL 80 5.386 5.407 -4.665
151 HB VAL 80 HB VAL 80 6.064 5.640 -1.715
152 HG11 VAL 80 1HG1 VAL 80 6.303 3.453 -3.726
153 HG12 VAL 80 2HG1 VAL 80 6.078 3.355 -1.978
154 HG13 VAL 80 3HG1 VAL 80 7.676 3.697 -2.643
155 HG21 VAL 80 3HG2 VAL 80 7.449 7.166 -2.887
156 HG22 VAL 80 1HG2 VAL 80 7.612 6.084 -4.270
157 HG23 VAL 80 2HG2 VAL 80 8.430 5.705 -2.754
158 H GLN 81 H GLN 81 3.457 6.241 -1.854
159 HA GLN 81 HA GLN 81 2.230 3.697 -1.390
160 HB2 GLN 81 1HB GLN 81 2.113 5.645 0.165
161 HB3 GLN 81 2HB GLN 81 1.043 6.457 -0.976
162 HG2 GLN 81 1HG GLN 81 -0.744 5.213 -0.361
163 HG3 GLN 81 2HG GLN 81 0.194 3.721 -0.347
164 HE21 GLN 81 1HE2 GLN 81 2.175 4.430 1.591
165 HE22 GLN 81 2HE2 GLN 81 1.415 4.650 3.089
166 H LYS 82 H LYS 82 1.205 6.483 -3.375
167 HA LYS 82 HA LYS 82 -1.219 5.318 -4.332
168 HB2 LYS 82 1HB LYS 82 0.538 7.584 -5.135
169 HB3 LYS 82 2HB LYS 82 -0.603 6.985 -6.340
170 HG2 LYS 82 1HG LYS 82 -1.660 8.758 -5.031
171 HG3 LYS 82 2HG LYS 82 -2.439 7.218 -4.668
172 HD2 LYS 82 1HD LYS 82 -1.401 7.044 -2.567
173 HD3 LYS 82 2HD LYS 82 -0.129 8.188 -2.996
174 HE2 LYS 82 1HE LYS 82 -1.566 10.048 -2.787
175 HE3 LYS 82 2HE LYS 82 -3.016 9.049 -2.879
176 HZ1 LYS 82 3HZ LYS 82 -2.965 8.687 -0.702
177 HZ2 LYS 82 1HZ LYS 82 -1.796 9.911 -0.595
178 HZ3 LYS 82 2HZ LYS 82 -1.314 8.287 -0.717
179 H GLU 83 H GLU 83 2.018 5.474 -5.882
180 HA GLU 83 HA GLU 83 1.263 4.029 -8.215
181 HB2 GLU 83 1HB GLU 83 3.912 4.357 -6.796
182 HB3 GLU 83 2HB GLU 83 3.762 3.419 -8.282
183 HG2 GLU 83 1HG GLU 83 2.563 6.157 -8.226
184 HG3 GLU 83 2HG GLU 83 4.317 6.022 -8.354
185 H LEU 84 H LEU 84 2.458 2.865 -5.068
186 HA LEU 84 HA LEU 84 2.525 0.101 -5.927
187 HB2 LEU 84 1HB LEU 84 2.452 1.363 -3.168
188 HB3 LEU 84 2HB LEU 84 2.636 -0.371 -3.443
189 HG LEU 84 HG LEU 84 4.475 1.758 -4.579
190 HD11 LEU 84 1HD1 LEU 84 5.016 -0.200 -2.330
191 HD12 LEU 84 2HD1 LEU 84 4.590 1.493 -2.074
192 HD13 LEU 84 3HD1 LEU 84 6.085 1.076 -2.911
193 HD21 LEU 84 3HD2 LEU 84 5.856 -0.557 -4.697
194 HD22 LEU 84 1HD2 LEU 84 4.819 -0.006 -6.012
195 HD23 LEU 84 2HD2 LEU 84 4.221 -1.197 -4.857
196 H LEU 85 H LEU 85 0.094 2.141 -4.333
197 HA LEU 85 HA LEU 85 -1.751 -0.044 -3.881
198 HB2 LEU 85 1HB LEU 85 -2.068 2.964 -3.983
199 HB3 LEU 85 2HB LEU 85 -3.450 1.897 -3.746
200 HG LEU 85 HG LEU 85 -0.984 1.697 -2.012
201 HD11 LEU 85 1HD1 LEU 85 -3.477 3.323 -1.430
202 HD12 LEU 85 2HD1 LEU 85 -1.939 4.023 -1.939
203 HD13 LEU 85 3HD1 LEU 85 -2.053 3.165 -0.402
204 HD21 LEU 85 3HD2 LEU 85 -3.327 0.166 -2.268
205 HD22 LEU 85 1HD2 LEU 85 -3.587 1.150 -0.829
206 HD23 LEU 85 2HD2 LEU 85 -2.174 0.102 -0.936
207 H ALA 86 H ALA 86 -1.201 2.239 -6.526
208 HA ALA 86 HA ALA 86 -3.531 1.596 -8.047
209 HB1 ALA 86 1HB ALA 86 -0.817 2.331 -9.178
210 HB2 ALA 86 2HB ALA 86 -1.923 3.515 -8.481
211 HB3 ALA 86 3HB ALA 86 -2.394 2.606 -9.917
212 H GLU 87 H GLU 87 -0.402 0.038 -7.683
213 HA GLU 87 HA GLU 87 -0.825 -1.865 -9.865
214 HB2 GLU 87 1HB GLU 87 1.451 -1.260 -9.060
215 HB3 GLU 87 2HB GLU 87 1.078 -1.998 -7.502
216 HG2 GLU 87 1HG GLU 87 0.452 -3.810 -9.679
217 HG3 GLU 87 2HG GLU 87 2.136 -3.293 -9.753
218 H TRP 88 H TRP 88 -1.338 -1.843 -6.362
219 HA TRP 88 HA TRP 88 -2.070 -4.629 -6.146
220 HB2 TRP 88 1HB TRP 88 -2.908 -2.265 -4.438
221 HB3 TRP 88 2HB TRP 88 -3.090 -3.961 -3.997
222 HD1 TRP 88 HD TRP 88 0.042 -4.138 -5.633
223 HE1 TRP 88 1HE TRP 88 2.028 -3.820 -4.017
224 HE3 TRP 88 3HE TRP 88 -2.366 -2.050 -1.638
225 HZ2 TRP 88 2HZ TRP 88 2.541 -2.801 -1.412
226 HZ3 TRP 88 3HZ TRP 88 -1.100 -1.413 0.396
227 HH2 TRP 88 HH TRP 88 1.348 -1.788 0.512
228 H LYS 89 H LYS 89 -3.914 -1.641 -6.678
229 HA LYS 89 HA LYS 89 -6.512 -2.909 -6.701
230 HB2 LYS 89 1HB LYS 89 -6.671 -0.622 -6.351
231 HB3 LYS 89 2HB LYS 89 -5.388 -0.252 -7.501
232 HG2 LYS 89 1HG LYS 89 -6.817 -0.600 -9.372
233 HG3 LYS 89 2HG LYS 89 -8.044 -1.395 -8.382
234 HD2 LYS 89 1HD LYS 89 -7.290 1.387 -7.626
235 HD3 LYS 89 2HD LYS 89 -8.243 1.186 -9.098
236 HE2 LYS 89 1HE LYS 89 -9.052 -0.236 -6.574
237 HE3 LYS 89 2HE LYS 89 -9.491 1.454 -6.817
238 HZ1 LYS 89 3HZ LYS 89 -10.246 -0.893 -8.447
239 HZ2 LYS 89 1HZ LYS 89 -10.349 0.684 -9.064
240 HZ3 LYS 89 2HZ LYS 89 -11.261 0.247 -7.698
241 H ARG 90 H ARG 90 -4.098 -2.225 -9.210
242 HA ARG 90 HA ARG 90 -5.794 -2.776 -11.440
243 HB2 ARG 90 1HB ARG 90 -2.893 -2.526 -10.964
244 HB3 ARG 90 2HB ARG 90 -3.326 -3.561 -12.324
245 HG2 ARG 90 1HG ARG 90 -4.793 -1.738 -13.198
246 HG3 ARG 90 2HG ARG 90 -4.230 -0.700 -11.887
247 HD2 ARG 90 1HD ARG 90 -1.882 -1.044 -12.700
248 HD3 ARG 90 2HD ARG 90 -2.537 -1.927 -14.079
249 HE ARG 90 HE ARG 90 -2.495 0.943 -13.800
250 HH11 ARG 90 1HH2 ARG 90 -4.332 -1.756 -14.913
251 HH12 ARG 90 2HH2 ARG 90 -5.181 -0.850 -16.120
252 HH21 ARG 90 1HH1 ARG 90 -3.595 2.142 -15.365
253 HH22 ARG 90 2HH1 ARG 90 -4.764 1.360 -16.375
254 H THR 91 H THR 91 -3.650 -4.940 -9.555
255 HA THR 91 HA THR 91 -4.872 -7.240 -11.028
256 HB THR 91 HB THR 91 -2.569 -7.531 -11.189
257 HG1 THR 91 1HG THR 91 -2.019 -8.996 -9.372
258 HG21 THR 91 3HG2 THR 91 -1.175 -7.133 -8.965
259 HG22 THR 91 1HG2 THR 91 -2.542 -6.094 -8.565
260 HG23 THR 91 2HG2 THR 91 -1.596 -5.785 -10.021
261 H GLY 92 H GLY 92 -4.153 -6.058 -7.744
262 HA2 GLY 92 1HA GLY 92 -5.848 -6.363 -5.979
263 HA3 GLY 92 2HA GLY 92 -6.319 -7.870 -6.762
Start of MODEL 3
1 H LYS 61 H LYS 61 -12.240 -0.512 1.620
2 HA LYS 61 HA LYS 61 -10.841 -1.949 3.800
3 HB2 LYS 61 1HB LYS 61 -12.648 -2.661 1.637
4 HB3 LYS 61 2HB LYS 61 -11.216 -3.692 1.636
5 HG2 LYS 61 1HG LYS 61 -11.561 -4.225 4.001
6 HG3 LYS 61 2HG LYS 61 -12.953 -3.141 4.060
7 HD2 LYS 61 1HD LYS 61 -14.200 -4.947 3.513
8 HD3 LYS 61 2HD LYS 61 -13.516 -4.786 1.894
9 HE2 LYS 61 1HE LYS 61 -12.267 -6.400 4.137
10 HE3 LYS 61 2HE LYS 61 -13.229 -7.084 2.827
11 HZ1 LYS 61 3HZ LYS 61 -11.039 -7.287 2.110
12 HZ2 LYS 61 1HZ LYS 61 -10.598 -5.750 2.676
13 HZ3 LYS 61 2HZ LYS 61 -11.593 -5.897 1.306
14 H ILE 62 H ILE 62 -8.628 -2.023 3.742
15 HA ILE 62 HA ILE 62 -7.288 -1.671 1.100
16 HB ILE 62 HB ILE 62 -6.196 -1.321 3.909
17 HG12 ILE 62 1HG1 ILE 62 -6.864 0.733 1.773
18 HG13 ILE 62 2HG1 ILE 62 -7.872 0.393 3.180
19 HG21 ILE 62 1HG2 ILE 62 -4.994 -0.906 1.157
20 HG22 ILE 62 2HG2 ILE 62 -4.411 -1.977 2.431
21 HG23 ILE 62 3HG2 ILE 62 -4.297 -0.228 2.628
22 HD11 ILE 62 3HD1 ILE 62 -6.004 1.016 4.671
23 HD12 ILE 62 1HD1 ILE 62 -6.425 2.346 3.593
24 HD13 ILE 62 2HD1 ILE 62 -4.999 1.364 3.264
25 H THR 63 H THR 63 -5.784 -3.195 0.404
26 HA THR 63 HA THR 63 -5.471 -5.650 2.098
27 HB THR 63 HB THR 63 -5.690 -5.591 -0.924
28 HG1 THR 63 1HG THR 63 -7.594 -5.225 0.784
29 HG21 THR 63 3HG2 THR 63 -5.098 -7.757 -0.816
30 HG22 THR 63 1HG2 THR 63 -6.328 -8.077 0.405
31 HG23 THR 63 2HG2 THR 63 -4.726 -7.520 0.892
32 H PHE 64 H PHE 64 -3.367 -5.904 2.617
33 HA PHE 64 HA PHE 64 -1.313 -4.678 0.857
34 HB2 PHE 64 1HB PHE 64 -0.990 -5.869 3.624
35 HB3 PHE 64 2HB PHE 64 0.197 -4.903 2.750
36 HD1 PHE 64 1HD PHE 64 -0.200 -2.488 2.342
37 HD2 PHE 64 2HD PHE 64 -2.869 -4.850 4.737
38 HE1 PHE 64 1HE PHE 64 -1.198 -0.416 3.272
39 HE2 PHE 64 2HE PHE 64 -3.865 -2.781 5.670
40 HZ PHE 64 HZ PHE 64 -3.031 -0.563 4.936
41 HA PRO 65 HA PRO 65 -0.309 -8.688 -0.970
42 HB2 PRO 65 1HB PRO 65 2.477 -7.664 -0.641
43 HB3 PRO 65 2HB PRO 65 1.698 -8.388 -2.061
44 HG2 PRO 65 1HG PRO 65 2.104 -5.761 -1.860
45 HG3 PRO 65 2HG PRO 65 0.686 -6.436 -2.673
46 HD2 PRO 65 1HD PRO 65 0.842 -5.013 -0.080
47 HD3 PRO 65 2HD PRO 65 -0.542 -5.237 -1.171
48 H SER 66 H SER 66 0.837 -10.649 -0.351
49 HA SER 66 HA SER 66 0.996 -11.092 2.504
50 HB2 SER 66 1HB SER 66 1.602 -13.342 1.926
51 HB3 SER 66 2HB SER 66 0.399 -12.818 0.748
52 HG SER 66 HG SER 66 3.197 -12.574 0.347
53 H ASP 67 H ASP 67 3.147 -9.545 0.462
54 HA ASP 67 HA ASP 67 5.455 -10.340 2.199
55 HB2 ASP 67 1HB ASP 67 5.251 -10.531 -0.590
56 HB3 ASP 67 2HB ASP 67 6.238 -9.096 -0.306
57 H ILE 68 H ILE 68 3.303 -7.962 1.948
58 HA ILE 68 HA ILE 68 5.333 -5.790 2.300
59 HB ILE 68 HB ILE 68 2.484 -5.715 1.320
60 HG12 ILE 68 1HG1 ILE 68 4.189 -6.169 -0.386
61 HG13 ILE 68 2HG1 ILE 68 3.526 -4.554 -0.611
62 HG21 ILE 68 1HG2 ILE 68 4.187 -3.549 2.501
63 HG22 ILE 68 2HG2 ILE 68 2.456 -3.837 2.685
64 HG23 ILE 68 3HG2 ILE 68 3.083 -3.153 1.184
65 HD11 ILE 68 3HD1 ILE 68 5.592 -3.928 0.999
66 HD12 ILE 68 1HD1 ILE 68 5.751 -4.014 -0.754
67 HD13 ILE 68 2HD1 ILE 68 6.255 -5.376 0.245
68 H ASP 69 H ASP 69 5.484 -4.917 4.257
69 HA ASP 69 HA ASP 69 3.571 -5.744 6.353
70 HB2 ASP 69 1HB ASP 69 6.078 -5.768 6.713
71 HB3 ASP 69 2HB ASP 69 6.032 -4.008 6.668
72 HA PRO 70 HA PRO 70 1.309 -1.915 5.933
73 HB2 PRO 70 1HB PRO 70 0.119 -1.858 8.423
74 HB3 PRO 70 2HB PRO 70 -0.464 -2.813 7.049
75 HG2 PRO 70 1HG PRO 70 1.092 -3.665 9.421
76 HG3 PRO 70 2HG PRO 70 -0.148 -4.534 8.503
77 HD2 PRO 70 1HD PRO 70 2.538 -5.038 8.261
78 HD3 PRO 70 2HD PRO 70 1.363 -5.338 6.963
79 H GLN 71 H GLN 71 3.221 -2.409 8.897
80 HA GLN 71 HA GLN 71 3.287 0.414 9.599
81 HB2 GLN 71 1HB GLN 71 3.900 -1.880 10.948
82 HB3 GLN 71 2HB GLN 71 5.512 -1.324 10.500
83 HG2 GLN 71 1HG GLN 71 4.718 0.993 11.372
84 HG3 GLN 71 2HG GLN 71 3.439 0.082 12.176
85 HE21 GLN 71 1HE2 GLN 71 4.875 1.135 14.076
86 HE22 GLN 71 2HE2 GLN 71 6.083 0.115 14.695
87 H VAL 72 H VAL 72 5.311 -1.700 7.629
88 HA VAL 72 HA VAL 72 7.344 0.401 7.311
89 HB VAL 72 HB VAL 72 7.030 -2.193 5.772
90 HG11 VAL 72 1HG1 VAL 72 9.013 0.007 5.824
91 HG12 VAL 72 2HG1 VAL 72 8.616 -1.122 4.531
92 HG13 VAL 72 3HG1 VAL 72 9.684 -1.623 5.841
93 HG21 VAL 72 3HG2 VAL 72 7.356 -2.153 8.423
94 HG22 VAL 72 1HG2 VAL 72 9.026 -1.815 7.970
95 HG23 VAL 72 2HG2 VAL 72 8.244 -3.294 7.414
96 H PHE 73 H PHE 73 4.418 -0.640 5.750
97 HA PHE 73 HA PHE 73 4.965 0.518 3.148
98 HB2 PHE 73 1HB PHE 73 3.281 -1.307 3.671
99 HB3 PHE 73 2HB PHE 73 2.275 -0.063 4.413
100 HD1 PHE 73 1HD PHE 73 4.207 -0.638 1.243
101 HD2 PHE 73 2HD PHE 73 0.671 0.958 3.083
102 HE1 PHE 73 1HE PHE 73 3.318 -0.029 -0.989
103 HE2 PHE 73 2HE PHE 73 -0.216 1.573 0.849
104 HZ PHE 73 HZ PHE 73 1.111 1.080 -1.186
105 H TYR 74 H TYR 74 2.774 1.537 5.799
106 HA TYR 74 HA TYR 74 2.140 4.061 4.653
107 HB2 TYR 74 1HB TYR 74 2.159 3.084 7.512
108 HB3 TYR 74 2HB TYR 74 1.680 4.731 7.102
109 HD1 TYR 74 2HD TYR 74 0.011 4.832 4.969
110 HD2 TYR 74 1HD TYR 74 0.453 1.512 7.661
111 HE1 TYR 74 2HE TYR 74 -2.249 4.023 4.344
112 HE2 TYR 74 1HE TYR 74 -1.807 0.703 7.036
113 HH TYR 74 HH TYR 74 -3.865 2.554 4.799
114 H GLU 75 H GLU 75 5.081 2.981 6.037
115 HA GLU 75 HA GLU 75 6.018 5.643 6.833
116 HB2 GLU 75 1HB GLU 75 7.127 2.878 6.781
117 HB3 GLU 75 2HB GLU 75 8.286 4.203 6.682
118 HG2 GLU 75 1HG GLU 75 6.118 4.054 8.790
119 HG3 GLU 75 2HG GLU 75 7.752 3.437 9.038
120 H LEU 76 H LEU 76 5.465 4.209 3.883
121 HA LEU 76 HA LEU 76 7.847 5.347 2.565
122 HB2 LEU 76 1HB LEU 76 5.482 3.789 1.489
123 HB3 LEU 76 2HB LEU 76 6.825 4.353 0.496
124 HG LEU 76 HG LEU 76 7.095 2.525 2.901
125 HD11 LEU 76 1HD1 LEU 76 6.498 0.882 1.479
126 HD12 LEU 76 2HD1 LEU 76 7.955 1.242 0.553
127 HD13 LEU 76 3HD1 LEU 76 6.425 2.010 0.124
128 HD21 LEU 76 3HD2 LEU 76 9.196 3.439 2.783
129 HD22 LEU 76 1HD2 LEU 76 8.994 3.944 1.106
130 HD23 LEU 76 2HD2 LEU 76 9.385 2.266 1.480
131 HA PRO 77 HA PRO 77 6.032 9.225 1.405
132 HB2 PRO 77 1HB PRO 77 6.742 8.729 -1.426
133 HB3 PRO 77 2HB PRO 77 7.239 10.049 -0.354
134 HG2 PRO 77 1HG PRO 77 8.867 8.016 -1.110
135 HG3 PRO 77 2HG PRO 77 9.053 8.932 0.391
136 HD2 PRO 77 1HD PRO 77 8.137 6.151 0.010
137 HD3 PRO 77 2HD PRO 77 8.796 6.947 1.455
138 H GLU 78 H GLU 78 4.222 10.136 0.212
139 HA GLU 78 HA GLU 78 2.044 8.327 -0.227
140 HB2 GLU 78 1HB GLU 78 2.377 11.187 -1.182
141 HB3 GLU 78 2HB GLU 78 0.855 10.301 -1.080
142 HG2 GLU 78 1HG GLU 78 0.843 10.321 1.255
143 HG3 GLU 78 2HG GLU 78 2.590 10.545 1.361
144 H ALA 79 H ALA 79 4.047 10.167 -2.573
145 HA ALA 79 HA ALA 79 2.809 9.286 -4.928
146 HB1 ALA 79 1HB ALA 79 5.258 10.569 -4.238
147 HB2 ALA 79 2HB ALA 79 4.495 10.484 -5.827
148 HB3 ALA 79 3HB ALA 79 5.653 9.247 -5.337
149 H VAL 80 H VAL 80 5.108 7.581 -2.857
150 HA VAL 80 HA VAL 80 5.356 5.314 -4.693
151 HB VAL 80 HB VAL 80 6.060 5.476 -1.745
152 HG11 VAL 80 1HG1 VAL 80 7.471 3.587 -2.180
153 HG12 VAL 80 2HG1 VAL 80 7.239 3.733 -3.922
154 HG13 VAL 80 3HG1 VAL 80 5.905 3.205 -2.897
155 HG21 VAL 80 3HG2 VAL 80 7.849 5.964 -4.145
156 HG22 VAL 80 1HG2 VAL 80 8.283 6.139 -2.445
157 HG23 VAL 80 2HG2 VAL 80 7.134 7.256 -3.182
158 H GLN 81 H GLN 81 3.482 6.183 -1.844
159 HA GLN 81 HA GLN 81 2.286 3.631 -1.334
160 HB2 GLN 81 1HB GLN 81 2.238 5.780 0.098
161 HB3 GLN 81 2HB GLN 81 0.898 6.284 -0.928
162 HG2 GLN 81 1HG GLN 81 -0.483 5.072 0.371
163 HG3 GLN 81 2HG GLN 81 0.333 3.616 -0.197
164 HE21 GLN 81 1HE2 GLN 81 1.773 6.178 1.865
165 HE22 GLN 81 2HE2 GLN 81 2.037 5.168 3.200
166 H LYS 82 H LYS 82 1.214 6.395 -3.324
167 HA LYS 82 HA LYS 82 -1.220 5.212 -4.240
168 HB2 LYS 82 1HB LYS 82 0.522 7.479 -5.079
169 HB3 LYS 82 2HB LYS 82 -0.618 6.862 -6.273
170 HG2 LYS 82 1HG LYS 82 -1.713 8.629 -5.027
171 HG3 LYS 82 2HG LYS 82 -2.441 7.095 -4.554
172 HD2 LYS 82 1HD LYS 82 -1.075 7.017 -2.537
173 HD3 LYS 82 2HD LYS 82 -0.216 8.478 -3.029
174 HE2 LYS 82 1HE LYS 82 -2.646 8.293 -1.550
175 HE3 LYS 82 2HE LYS 82 -1.807 9.752 -2.079
176 HZ1 LYS 82 3HZ LYS 82 -3.618 8.197 -3.837
177 HZ2 LYS 82 1HZ LYS 82 -2.989 9.748 -4.109
178 HZ3 LYS 82 2HZ LYS 82 -4.146 9.503 -2.888
179 H GLU 83 H GLU 83 2.004 5.381 -5.809
180 HA GLU 83 HA GLU 83 1.280 3.928 -8.138
181 HB2 GLU 83 1HB GLU 83 3.931 4.115 -6.680
182 HB3 GLU 83 2HB GLU 83 3.741 3.365 -8.265
183 HG2 GLU 83 1HG GLU 83 2.841 5.481 -9.161
184 HG3 GLU 83 2HG GLU 83 3.039 6.235 -7.580
185 H LEU 84 H LEU 84 2.415 2.751 -4.975
186 HA LEU 84 HA LEU 84 2.429 -0.019 -5.862
187 HB2 LEU 84 1HB LEU 84 2.484 1.205 -3.084
188 HB3 LEU 84 2HB LEU 84 2.693 -0.516 -3.418
189 HG LEU 84 HG LEU 84 4.432 1.685 -4.572
190 HD11 LEU 84 1HD1 LEU 84 5.072 -0.332 -2.402
191 HD12 LEU 84 2HD1 LEU 84 4.711 1.370 -2.108
192 HD13 LEU 84 3HD1 LEU 84 6.148 0.918 -3.024
193 HD21 LEU 84 3HD2 LEU 84 5.829 -0.635 -4.805
194 HD22 LEU 84 1HD2 LEU 84 4.793 0.004 -6.080
195 HD23 LEU 84 2HD2 LEU 84 4.184 -1.241 -4.991
196 H LEU 85 H LEU 85 0.128 2.084 -4.165
197 HA LEU 85 HA LEU 85 -1.776 -0.005 -3.583
198 HB2 LEU 85 1HB LEU 85 -2.010 3.002 -3.875
199 HB3 LEU 85 2HB LEU 85 -3.410 1.992 -3.519
200 HG LEU 85 HG LEU 85 -0.889 1.847 -1.862
201 HD11 LEU 85 1HD1 LEU 85 -1.942 3.412 -0.286
202 HD12 LEU 85 2HD1 LEU 85 -3.300 3.624 -1.392
203 HD13 LEU 85 3HD1 LEU 85 -1.692 4.184 -1.851
204 HD21 LEU 85 3HD2 LEU 85 -3.765 0.981 -1.544
205 HD22 LEU 85 1HD2 LEU 85 -2.720 1.193 -0.141
206 HD23 LEU 85 2HD2 LEU 85 -2.301 0.015 -1.380
207 H ALA 86 H ALA 86 -1.282 2.171 -6.331
208 HA ALA 86 HA ALA 86 -3.637 1.387 -7.777
209 HB1 ALA 86 1HB ALA 86 -1.930 2.091 -9.761
210 HB2 ALA 86 2HB ALA 86 -1.113 2.834 -8.386
211 HB3 ALA 86 3HB ALA 86 -2.779 3.272 -8.764
212 H GLU 87 H GLU 87 -0.416 0.034 -7.449
213 HA GLU 87 HA GLU 87 -0.687 -1.862 -9.647
214 HB2 GLU 87 1HB GLU 87 1.518 -1.130 -8.643
215 HB3 GLU 87 2HB GLU 87 1.106 -2.069 -7.207
216 HG2 GLU 87 1HG GLU 87 0.726 -4.028 -8.881
217 HG3 GLU 87 2HG GLU 87 1.679 -3.049 -9.995
218 H TRP 88 H TRP 88 -1.290 -1.938 -6.154
219 HA TRP 88 HA TRP 88 -1.980 -4.744 -6.043
220 HB2 TRP 88 1HB TRP 88 -2.947 -2.489 -4.262
221 HB3 TRP 88 2HB TRP 88 -2.980 -4.208 -3.881
222 HD1 TRP 88 HD TRP 88 0.134 -4.107 -5.504
223 HE1 TRP 88 1HE TRP 88 2.099 -3.637 -3.890
224 HE3 TRP 88 3HE TRP 88 -2.421 -2.256 -1.493
225 HZ2 TRP 88 2HZ TRP 88 2.527 -2.608 -1.266
226 HZ3 TRP 88 3HZ TRP 88 -1.216 -1.534 0.546
227 HH2 TRP 88 HH TRP 88 1.254 -1.713 0.668
228 H LYS 89 H LYS 89 -3.725 -1.776 -6.758
229 HA LYS 89 HA LYS 89 -6.361 -3.033 -6.759
230 HB2 LYS 89 1HB LYS 89 -6.023 -0.613 -6.289
231 HB3 LYS 89 2HB LYS 89 -5.466 -0.393 -7.949
232 HG2 LYS 89 1HG LYS 89 -7.941 -1.829 -8.016
233 HG3 LYS 89 2HG LYS 89 -8.151 -0.406 -6.995
234 HD2 LYS 89 1HD LYS 89 -7.168 0.999 -8.798
235 HD3 LYS 89 2HD LYS 89 -7.057 -0.432 -9.823
236 HE2 LYS 89 1HE LYS 89 -9.630 -0.657 -9.204
237 HE3 LYS 89 2HE LYS 89 -9.482 1.080 -8.934
238 HZ1 LYS 89 3HZ LYS 89 -9.678 1.318 -11.116
239 HZ2 LYS 89 1HZ LYS 89 -9.571 -0.354 -11.383
240 HZ3 LYS 89 2HZ LYS 89 -8.156 0.583 -11.291
241 H ARG 90 H ARG 90 -3.933 -2.202 -9.232
242 HA ARG 90 HA ARG 90 -5.570 -2.689 -11.483
243 HB2 ARG 90 1HB ARG 90 -3.431 -1.628 -11.786
244 HB3 ARG 90 2HB ARG 90 -2.589 -2.987 -11.036
245 HG2 ARG 90 1HG ARG 90 -2.927 -4.378 -12.863
246 HG3 ARG 90 2HG ARG 90 -4.302 -3.443 -13.445
247 HD2 ARG 90 1HD ARG 90 -2.206 -3.141 -14.816
248 HD3 ARG 90 2HD ARG 90 -2.862 -1.641 -14.163
249 HE ARG 90 HE ARG 90 -1.076 -2.329 -12.228
250 HH11 ARG 90 1HH2 ARG 90 -0.927 -2.266 -15.671
251 HH12 ARG 90 2HH2 ARG 90 0.767 -1.913 -15.725
252 HH21 ARG 90 1HH1 ARG 90 1.135 -1.865 -12.276
253 HH22 ARG 90 2HH1 ARG 90 1.936 -1.685 -13.802
254 H THR 91 H THR 91 -3.512 -4.902 -9.569
255 HA THR 91 HA THR 91 -4.629 -7.177 -11.136
256 HB THR 91 HB THR 91 -2.317 -7.504 -10.925
257 HG1 THR 91 1HG THR 91 -3.451 -9.300 -10.111
258 HG21 THR 91 3HG2 THR 91 -2.710 -6.081 -8.340
259 HG22 THR 91 1HG2 THR 91 -1.442 -5.890 -9.550
260 HG23 THR 91 2HG2 THR 91 -1.384 -7.242 -8.421
261 H GLY 92 H GLY 92 -4.414 -5.936 -7.814
262 HA2 GLY 92 1HA GLY 92 -6.310 -6.149 -6.291
263 HA3 GLY 92 2HA GLY 92 -6.810 -7.591 -7.176
Start of MODEL 4
1 H LYS 61 H LYS 61 -12.162 -0.535 1.674
2 HA LYS 61 HA LYS 61 -10.775 -2.019 3.822
3 HB2 LYS 61 1HB LYS 61 -12.717 -3.093 2.810
4 HB3 LYS 61 2HB LYS 61 -12.010 -2.926 1.203
5 HG2 LYS 61 1HG LYS 61 -10.352 -4.532 1.621
6 HG3 LYS 61 2HG LYS 61 -10.510 -4.380 3.370
7 HD2 LYS 61 1HD LYS 61 -12.683 -5.489 1.572
8 HD3 LYS 61 2HD LYS 61 -11.518 -6.491 2.437
9 HE2 LYS 61 1HE LYS 61 -12.921 -6.438 4.200
10 HE3 LYS 61 2HE LYS 61 -12.516 -4.731 4.378
11 HZ1 LYS 61 3HZ LYS 61 -14.563 -4.203 3.778
12 HZ2 LYS 61 1HZ LYS 61 -14.965 -5.846 3.655
13 HZ3 LYS 61 2HZ LYS 61 -14.377 -5.015 2.297
14 H ILE 62 H ILE 62 -8.562 -2.119 3.757
15 HA ILE 62 HA ILE 62 -7.235 -1.789 1.105
16 HB ILE 62 HB ILE 62 -6.068 -1.488 3.887
17 HG12 ILE 62 1HG1 ILE 62 -6.949 0.606 1.872
18 HG13 ILE 62 2HG1 ILE 62 -7.778 0.230 3.382
19 HG21 ILE 62 1HG2 ILE 62 -4.198 -0.419 2.670
20 HG22 ILE 62 2HG2 ILE 62 -4.997 -0.772 1.138
21 HG23 ILE 62 3HG2 ILE 62 -4.419 -2.091 2.156
22 HD11 ILE 62 3HD1 ILE 62 -6.332 2.200 3.666
23 HD12 ILE 62 1HD1 ILE 62 -4.937 1.263 3.132
24 HD13 ILE 62 2HD1 ILE 62 -5.744 0.857 4.646
25 H THR 63 H THR 63 -5.827 -3.344 0.363
26 HA THR 63 HA THR 63 -5.461 -5.790 2.061
27 HB THR 63 HB THR 63 -5.799 -5.658 -0.953
28 HG1 THR 63 1HG THR 63 -7.686 -5.332 0.479
29 HG21 THR 63 3HG2 THR 63 -4.653 -7.623 0.787
30 HG22 THR 63 1HG2 THR 63 -4.894 -7.713 -0.957
31 HG23 THR 63 2HG2 THR 63 -6.164 -8.262 0.137
32 H PHE 64 H PHE 64 -3.341 -5.975 2.577
33 HA PHE 64 HA PHE 64 -1.339 -4.697 0.805
34 HB2 PHE 64 1HB PHE 64 -0.954 -5.910 3.555
35 HB3 PHE 64 2HB PHE 64 0.197 -4.899 2.681
36 HD1 PHE 64 1HD PHE 64 -0.222 -2.501 2.353
37 HD2 PHE 64 2HD PHE 64 -2.918 -4.954 4.624
38 HE1 PHE 64 1HE PHE 64 -1.290 -0.465 3.282
39 HE2 PHE 64 2HE PHE 64 -3.985 -2.918 5.558
40 HZ PHE 64 HZ PHE 64 -3.173 -0.673 4.885
41 HA PRO 65 HA PRO 65 -0.204 -8.619 -1.112
42 HB2 PRO 65 1HB PRO 65 2.560 -7.565 -0.745
43 HB3 PRO 65 2HB PRO 65 1.788 -8.235 -2.192
44 HG2 PRO 65 1HG PRO 65 2.174 -5.608 -1.856
45 HG3 PRO 65 2HG PRO 65 0.788 -6.263 -2.739
46 HD2 PRO 65 1HD PRO 65 0.848 -4.943 -0.096
47 HD3 PRO 65 2HD PRO 65 -0.507 -5.171 -1.219
48 H SER 66 H SER 66 0.856 -10.591 -0.503
49 HA SER 66 HA SER 66 1.048 -11.123 2.311
50 HB2 SER 66 1HB SER 66 0.842 -13.191 1.459
51 HB3 SER 66 2HB SER 66 1.204 -12.600 -0.160
52 HG SER 66 HG SER 66 3.153 -13.128 1.838
53 H ASP 67 H ASP 67 3.176 -9.404 0.401
54 HA ASP 67 HA ASP 67 5.472 -10.188 2.159
55 HB2 ASP 67 1HB ASP 67 5.806 -10.857 -0.214
56 HB3 ASP 67 2HB ASP 67 5.620 -9.168 -0.690
57 H ILE 68 H ILE 68 3.280 -7.858 2.014
58 HA ILE 68 HA ILE 68 5.277 -5.662 2.396
59 HB ILE 68 HB ILE 68 2.442 -5.594 1.376
60 HG12 ILE 68 1HG1 ILE 68 4.164 -6.011 -0.323
61 HG13 ILE 68 2HG1 ILE 68 3.504 -4.391 -0.520
62 HG21 ILE 68 1HG2 ILE 68 2.323 -3.701 2.665
63 HG22 ILE 68 2HG2 ILE 68 3.166 -3.012 1.277
64 HG23 ILE 68 3HG2 ILE 68 4.074 -3.492 2.710
65 HD11 ILE 68 3HD1 ILE 68 6.222 -5.234 0.353
66 HD12 ILE 68 1HD1 ILE 68 5.552 -3.794 1.116
67 HD13 ILE 68 2HD1 ILE 68 5.733 -3.859 -0.633
68 H ASP 69 H ASP 69 5.380 -4.811 4.350
69 HA ASP 69 HA ASP 69 3.430 -5.651 6.416
70 HB2 ASP 69 1HB ASP 69 5.961 -5.669 6.778
71 HB3 ASP 69 2HB ASP 69 5.870 -3.910 6.821
72 HA PRO 70 HA PRO 70 1.178 -1.823 5.957
73 HB2 PRO 70 1HB PRO 70 0.062 -1.691 8.494
74 HB3 PRO 70 2HB PRO 70 -0.596 -2.619 7.135
75 HG2 PRO 70 1HG PRO 70 0.960 -3.537 9.474
76 HG3 PRO 70 2HG PRO 70 -0.302 -4.366 8.552
77 HD2 PRO 70 1HD PRO 70 2.371 -4.936 8.306
78 HD3 PRO 70 2HD PRO 70 1.188 -5.204 7.009
79 H GLN 71 H GLN 71 3.144 -2.256 8.893
80 HA GLN 71 HA GLN 71 3.260 0.605 9.464
81 HB2 GLN 71 1HB GLN 71 5.309 -1.374 10.438
82 HB3 GLN 71 2HB GLN 71 4.633 0.023 11.276
83 HG2 GLN 71 1HG GLN 71 2.398 -1.202 11.255
84 HG3 GLN 71 2HG GLN 71 3.286 -2.630 10.724
85 HE21 GLN 71 1HE2 GLN 71 3.535 -3.958 12.533
86 HE22 GLN 71 2HE2 GLN 71 4.034 -3.425 14.066
87 H VAL 72 H VAL 72 5.197 -1.667 7.592
88 HA VAL 72 HA VAL 72 7.334 0.306 7.197
89 HB VAL 72 HB VAL 72 6.832 -2.243 5.637
90 HG11 VAL 72 1HG1 VAL 72 9.580 -1.651 5.978
91 HG12 VAL 72 2HG1 VAL 72 8.797 -0.141 5.508
92 HG13 VAL 72 3HG1 VAL 72 8.641 -1.570 4.487
93 HG21 VAL 72 3HG2 VAL 72 7.014 -2.493 8.193
94 HG22 VAL 72 1HG2 VAL 72 8.676 -1.928 8.014
95 HG23 VAL 72 2HG2 VAL 72 8.162 -3.421 7.226
96 H PHE 73 H PHE 73 4.335 -0.592 5.704
97 HA PHE 73 HA PHE 73 4.902 0.582 3.101
98 HB2 PHE 73 1HB PHE 73 3.199 -1.236 3.583
99 HB3 PHE 73 2HB PHE 73 2.209 0.000 4.356
100 HD1 PHE 73 2HD PHE 73 4.146 -0.488 1.177
101 HD2 PHE 73 1HD PHE 73 0.599 1.045 3.050
102 HE1 PHE 73 2HE PHE 73 3.263 0.188 -1.038
103 HE2 PHE 73 1HE PHE 73 -0.281 1.720 0.832
104 HZ PHE 73 HZ PHE 73 1.054 1.292 -1.213
105 H TYR 74 H TYR 74 2.772 1.561 5.812
106 HA TYR 74 HA TYR 74 2.124 4.106 4.722
107 HB2 TYR 74 1HB TYR 74 2.214 3.092 7.569
108 HB3 TYR 74 2HB TYR 74 1.727 4.743 7.190
109 HD1 TYR 74 2HD TYR 74 0.003 4.836 5.070
110 HD2 TYR 74 1HD TYR 74 0.490 1.554 7.800
111 HE1 TYR 74 2HE TYR 74 -2.274 4.032 4.513
112 HE2 TYR 74 1HE TYR 74 -1.786 0.751 7.242
113 HH TYR 74 HH TYR 74 -3.877 2.570 5.004
114 H GLU 75 H GLU 75 5.076 2.976 6.056
115 HA GLU 75 HA GLU 75 6.059 5.633 6.819
116 HB2 GLU 75 1HB GLU 75 6.930 2.878 7.089
117 HB3 GLU 75 2HB GLU 75 8.240 3.893 6.483
118 HG2 GLU 75 1HG GLU 75 6.542 4.648 8.873
119 HG3 GLU 75 2HG GLU 75 8.065 3.769 9.013
120 H LEU 76 H LEU 76 5.504 4.129 3.891
121 HA LEU 76 HA LEU 76 7.904 5.168 2.539
122 HB2 LEU 76 1HB LEU 76 5.429 3.783 1.468
123 HB3 LEU 76 2HB LEU 76 6.838 4.207 0.497
124 HG LEU 76 HG LEU 76 6.918 2.419 2.942
125 HD11 LEU 76 1HD1 LEU 76 7.100 0.561 1.419
126 HD12 LEU 76 2HD1 LEU 76 7.170 1.640 0.026
127 HD13 LEU 76 3HD1 LEU 76 5.673 1.484 0.947
128 HD21 LEU 76 3HD2 LEU 76 8.944 3.518 1.035
129 HD22 LEU 76 1HD2 LEU 76 9.166 1.864 1.606
130 HD23 LEU 76 2HD2 LEU 76 9.090 3.193 2.763
131 HA PRO 77 HA PRO 77 6.274 9.129 1.372
132 HB2 PRO 77 1HB PRO 77 6.935 8.600 -1.462
133 HB3 PRO 77 2HB PRO 77 7.526 9.879 -0.388
134 HG2 PRO 77 1HG PRO 77 9.000 7.729 -1.183
135 HG3 PRO 77 2HG PRO 77 9.295 8.660 0.291
136 HD2 PRO 77 1HD PRO 77 8.223 5.933 0.005
137 HD3 PRO 77 2HD PRO 77 8.930 6.733 1.424
138 H GLU 78 H GLU 78 4.479 10.100 0.181
139 HA GLU 78 HA GLU 78 2.242 8.354 -0.188
140 HB2 GLU 78 1HB GLU 78 2.749 11.222 -1.020
141 HB3 GLU 78 2HB GLU 78 1.200 10.412 -1.262
142 HG2 GLU 78 1HG GLU 78 0.879 10.110 1.086
143 HG3 GLU 78 2HG GLU 78 2.551 10.544 1.440
144 H ALA 79 H ALA 79 4.265 10.069 -2.609
145 HA ALA 79 HA ALA 79 2.961 9.147 -4.915
146 HB1 ALA 79 1HB ALA 79 4.953 10.760 -4.749
147 HB2 ALA 79 2HB ALA 79 4.960 9.645 -6.115
148 HB3 ALA 79 3HB ALA 79 5.974 9.322 -4.708
149 H VAL 80 H VAL 80 5.224 7.436 -2.809
150 HA VAL 80 HA VAL 80 5.429 5.129 -4.601
151 HB VAL 80 HB VAL 80 6.168 5.446 -1.671
152 HG11 VAL 80 1HG1 VAL 80 6.012 3.134 -3.369
153 HG12 VAL 80 2HG1 VAL 80 6.561 3.230 -1.696
154 HG13 VAL 80 3HG1 VAL 80 7.709 3.465 -3.015
155 HG21 VAL 80 3HG2 VAL 80 8.512 5.509 -2.705
156 HG22 VAL 80 1HG2 VAL 80 7.517 6.943 -2.959
157 HG23 VAL 80 2HG2 VAL 80 7.712 5.764 -4.255
158 H GLN 81 H GLN 81 3.567 6.092 -1.780
159 HA GLN 81 HA GLN 81 2.312 3.567 -1.241
160 HB2 GLN 81 1HB GLN 81 2.342 5.574 0.278
161 HB3 GLN 81 2HB GLN 81 1.163 6.333 -0.790
162 HG2 GLN 81 1HG GLN 81 -0.498 5.216 0.233
163 HG3 GLN 81 2HG GLN 81 0.251 3.684 -0.217
164 HE21 GLN 81 1HE2 GLN 81 1.734 6.108 1.952
165 HE22 GLN 81 2HE2 GLN 81 1.705 5.125 3.333
166 H LYS 82 H LYS 82 1.135 6.424 -3.051
167 HA LYS 82 HA LYS 82 -1.293 5.252 -3.964
168 HB2 LYS 82 1HB LYS 82 0.435 7.525 -4.886
169 HB3 LYS 82 2HB LYS 82 -0.919 6.999 -5.887
170 HG2 LYS 82 1HG LYS 82 -1.725 8.750 -4.432
171 HG3 LYS 82 2HG LYS 82 -2.404 7.228 -3.858
172 HD2 LYS 82 1HD LYS 82 -0.704 7.074 -2.119
173 HD3 LYS 82 2HD LYS 82 0.103 8.516 -2.737
174 HE2 LYS 82 1HE LYS 82 -1.708 9.927 -2.103
175 HE3 LYS 82 2HE LYS 82 -2.783 8.554 -1.841
176 HZ1 LYS 82 3HZ LYS 82 -1.916 8.144 0.175
177 HZ2 LYS 82 1HZ LYS 82 -1.445 9.772 0.108
178 HZ3 LYS 82 2HZ LYS 82 -0.333 8.552 -0.288
179 H GLU 83 H GLU 83 1.865 5.535 -5.649
180 HA GLU 83 HA GLU 83 1.061 4.179 -8.008
181 HB2 GLU 83 1HB GLU 83 3.787 4.243 -6.675
182 HB3 GLU 83 2HB GLU 83 3.489 3.704 -8.328
183 HG2 GLU 83 1HG GLU 83 2.406 6.373 -7.569
184 HG3 GLU 83 2HG GLU 83 4.156 6.244 -7.748
185 H LEU 84 H LEU 84 2.313 2.878 -4.939
186 HA LEU 84 HA LEU 84 2.339 0.156 -5.946
187 HB2 LEU 84 1HB LEU 84 2.450 1.289 -3.136
188 HB3 LEU 84 2HB LEU 84 2.584 -0.434 -3.495
189 HG LEU 84 HG LEU 84 4.378 1.706 -4.679
190 HD11 LEU 84 1HD1 LEU 84 4.963 -0.293 -2.474
191 HD12 LEU 84 2HD1 LEU 84 4.726 1.440 -2.237
192 HD13 LEU 84 3HD1 LEU 84 6.107 0.857 -3.164
193 HD21 LEU 84 3HD2 LEU 84 5.704 -0.650 -4.923
194 HD22 LEU 84 1HD2 LEU 84 4.650 -0.002 -6.178
195 HD23 LEU 84 2HD2 LEU 84 4.042 -1.220 -5.058
196 H LEU 85 H LEU 85 0.004 2.167 -4.196
197 HA LEU 85 HA LEU 85 -1.851 0.014 -3.674
198 HB2 LEU 85 1HB LEU 85 -2.157 3.023 -3.852
199 HB3 LEU 85 2HB LEU 85 -3.540 1.970 -3.558
200 HG LEU 85 HG LEU 85 -1.036 1.809 -1.877
201 HD11 LEU 85 1HD1 LEU 85 -1.686 4.048 -1.507
202 HD12 LEU 85 2HD1 LEU 85 -2.494 3.162 -0.213
203 HD13 LEU 85 3HD1 LEU 85 -3.403 3.663 -1.639
204 HD21 LEU 85 3HD2 LEU 85 -2.181 0.199 -0.788
205 HD22 LEU 85 1HD2 LEU 85 -3.415 0.294 -2.043
206 HD23 LEU 85 2HD2 LEU 85 -3.568 1.267 -0.582
207 H ALA 86 H ALA 86 -1.347 2.251 -6.372
208 HA ALA 86 HA ALA 86 -3.688 1.510 -7.854
209 HB1 ALA 86 1HB ALA 86 -0.994 2.535 -8.806
210 HB2 ALA 86 2HB ALA 86 -2.420 3.509 -8.448
211 HB3 ALA 86 3HB ALA 86 -2.429 2.405 -9.823
212 H GLU 87 H GLU 87 -0.477 0.104 -7.532
213 HA GLU 87 HA GLU 87 -0.848 -1.819 -9.705
214 HB2 GLU 87 1HB GLU 87 1.402 -1.038 -8.780
215 HB3 GLU 87 2HB GLU 87 1.073 -2.049 -7.372
216 HG2 GLU 87 1HG GLU 87 2.255 -3.539 -8.711
217 HG3 GLU 87 2HG GLU 87 0.597 -3.900 -9.194
218 H TRP 88 H TRP 88 -1.294 -1.809 -6.192
219 HA TRP 88 HA TRP 88 -1.928 -4.607 -5.928
220 HB2 TRP 88 1HB TRP 88 -2.920 -2.252 -4.289
221 HB3 TRP 88 2HB TRP 88 -2.999 -3.946 -3.810
222 HD1 TRP 88 HD TRP 88 0.158 -3.839 -5.462
223 HE1 TRP 88 1HE TRP 88 2.106 -3.394 -3.821
224 HE3 TRP 88 3HE TRP 88 -2.447 -2.104 -1.426
225 HZ2 TRP 88 2HZ TRP 88 2.503 -2.435 -1.168
226 HZ3 TRP 88 3HZ TRP 88 -1.262 -1.430 0.639
227 HH2 TRP 88 HH TRP 88 1.211 -1.594 0.776
228 H LYS 89 H LYS 89 -3.734 -1.751 -6.841
229 HA LYS 89 HA LYS 89 -6.349 -3.018 -6.747
230 HB2 LYS 89 1HB LYS 89 -5.862 -0.510 -6.632
231 HB3 LYS 89 2HB LYS 89 -5.604 -0.582 -8.375
232 HG2 LYS 89 1HG LYS 89 -7.853 -1.379 -8.749
233 HG3 LYS 89 2HG LYS 89 -8.127 -1.566 -7.017
234 HD2 LYS 89 1HD LYS 89 -9.140 0.489 -7.368
235 HD3 LYS 89 2HD LYS 89 -7.504 1.016 -6.979
236 HE2 LYS 89 1HE LYS 89 -6.984 1.012 -9.436
237 HE3 LYS 89 2HE LYS 89 -8.684 0.666 -9.747
238 HZ1 LYS 89 3HZ LYS 89 -9.059 2.718 -8.244
239 HZ2 LYS 89 1HZ LYS 89 -8.627 2.944 -9.869
240 HZ3 LYS 89 2HZ LYS 89 -7.455 3.101 -8.648
241 H ARG 90 H ARG 90 -3.904 -2.523 -9.287
242 HA ARG 90 HA ARG 90 -5.564 -3.344 -11.462
243 HB2 ARG 90 1HB ARG 90 -2.602 -3.245 -10.982
244 HB3 ARG 90 2HB ARG 90 -3.194 -4.139 -12.381
245 HG2 ARG 90 1HG ARG 90 -3.953 -1.271 -11.757
246 HG3 ARG 90 2HG ARG 90 -2.669 -1.730 -12.874
247 HD2 ARG 90 1HD ARG 90 -4.756 -3.273 -13.773
248 HD3 ARG 90 2HD ARG 90 -5.594 -1.818 -13.235
249 HE ARG 90 HE ARG 90 -4.499 -0.594 -14.958
250 HH11 ARG 90 1HH2 ARG 90 -3.270 -3.791 -14.564
251 HH12 ARG 90 2HH2 ARG 90 -2.344 -3.757 -16.027
252 HH21 ARG 90 1HH1 ARG 90 -3.294 -0.530 -16.868
253 HH22 ARG 90 2HH1 ARG 90 -2.357 -1.912 -17.331
254 H THR 91 H THR 91 -3.446 -5.193 -9.274
255 HA THR 91 HA THR 91 -4.418 -7.728 -10.480
256 HB THR 91 HB THR 91 -2.716 -8.809 -9.212
257 HG1 THR 91 1HG THR 91 -1.585 -7.514 -7.585
258 HG21 THR 91 3HG2 THR 91 -2.101 -6.826 -10.967
259 HG22 THR 91 1HG2 THR 91 -0.897 -7.873 -10.215
260 HG23 THR 91 2HG2 THR 91 -1.223 -6.277 -9.540
261 H GLY 92 H GLY 92 -4.506 -5.940 -7.425
262 HA2 GLY 92 1HA GLY 92 -6.618 -5.941 -6.132
263 HA3 GLY 92 2HA GLY 92 -6.845 -7.620 -6.620
Start of MODEL 5
1 H LYS 61 H LYS 61 -11.885 -0.241 1.990
2 HA LYS 61 HA LYS 61 -10.486 -1.761 4.108
3 HB2 LYS 61 1HB LYS 61 -11.374 -2.998 1.530
4 HB3 LYS 61 2HB LYS 61 -11.394 -3.672 3.159
5 HG2 LYS 61 1HG LYS 61 -13.157 -1.833 3.667
6 HG3 LYS 61 2HG LYS 61 -13.310 -1.707 1.916
7 HD2 LYS 61 1HD LYS 61 -14.973 -3.282 2.710
8 HD3 LYS 61 2HD LYS 61 -13.734 -4.176 1.830
9 HE2 LYS 61 1HE LYS 61 -13.067 -5.302 3.684
10 HE3 LYS 61 2HE LYS 61 -13.145 -3.860 4.695
11 HZ1 LYS 61 3HZ LYS 61 -15.691 -4.915 3.783
12 HZ2 LYS 61 1HZ LYS 61 -15.255 -4.284 5.295
13 HZ3 LYS 61 2HZ LYS 61 -14.850 -5.884 4.895
14 H ILE 62 H ILE 62 -8.275 -1.872 3.973
15 HA ILE 62 HA ILE 62 -7.030 -1.606 1.274
16 HB ILE 62 HB ILE 62 -5.794 -1.284 4.023
17 HG12 ILE 62 1HG1 ILE 62 -6.577 0.783 1.940
18 HG13 ILE 62 2HG1 ILE 62 -7.461 0.471 3.435
19 HG21 ILE 62 1HG2 ILE 62 -3.923 -0.270 2.688
20 HG22 ILE 62 2HG2 ILE 62 -4.739 -0.805 1.220
21 HG23 ILE 62 3HG2 ILE 62 -4.145 -1.992 2.380
22 HD11 ILE 62 3HD1 ILE 62 -6.124 2.116 4.272
23 HD12 ILE 62 1HD1 ILE 62 -4.901 1.895 3.020
24 HD13 ILE 62 2HD1 ILE 62 -4.948 0.810 4.409
25 H THR 63 H THR 63 -5.585 -3.157 0.541
26 HA THR 63 HA THR 63 -5.272 -5.616 2.226
27 HB THR 63 HB THR 63 -5.184 -6.702 -0.197
28 HG1 THR 63 1HG THR 63 -5.601 -5.144 -1.562
29 HG21 THR 63 3HG2 THR 63 -6.782 -7.233 1.639
30 HG22 THR 63 1HG2 THR 63 -7.543 -7.273 0.047
31 HG23 THR 63 2HG2 THR 63 -7.793 -5.888 1.111
32 H PHE 64 H PHE 64 -3.155 -5.867 2.680
33 HA PHE 64 HA PHE 64 -1.155 -4.716 0.818
34 HB2 PHE 64 1HB PHE 64 -0.722 -5.858 3.589
35 HB3 PHE 64 2HB PHE 64 0.426 -4.905 2.650
36 HD1 PHE 64 1HD PHE 64 -0.119 -2.503 2.098
37 HD2 PHE 64 2HD PHE 64 -2.436 -4.817 4.876
38 HE1 PHE 64 1HE PHE 64 -1.089 -0.416 3.027
39 HE2 PHE 64 2HE PHE 64 -3.408 -2.732 5.804
40 HZ PHE 64 HZ PHE 64 -2.733 -0.533 4.880
41 HA PRO 65 HA PRO 65 -0.217 -8.730 -0.986
42 HB2 PRO 65 1HB PRO 65 2.608 -7.846 -0.649
43 HB3 PRO 65 2HB PRO 65 1.782 -8.480 -2.083
44 HG2 PRO 65 1HG PRO 65 2.349 -5.874 -1.761
45 HG3 PRO 65 2HG PRO 65 0.946 -6.452 -2.667
46 HD2 PRO 65 1HD PRO 65 1.028 -5.088 -0.054
47 HD3 PRO 65 2HD PRO 65 -0.326 -5.284 -1.187
48 H SER 66 H SER 66 0.732 -10.744 -0.324
49 HA SER 66 HA SER 66 0.890 -11.247 2.493
50 HB2 SER 66 1HB SER 66 1.414 -13.469 1.895
51 HB3 SER 66 2HB SER 66 0.428 -12.892 0.554
52 HG SER 66 HG SER 66 2.104 -13.520 -0.570
53 H ASP 67 H ASP 67 3.065 -9.593 0.600
54 HA ASP 67 HA ASP 67 5.340 -10.415 2.373
55 HB2 ASP 67 1HB ASP 67 6.802 -10.408 0.604
56 HB3 ASP 67 2HB ASP 67 5.331 -10.820 -0.281
57 H ILE 68 H ILE 68 3.204 -8.037 2.237
58 HA ILE 68 HA ILE 68 5.253 -5.880 2.594
59 HB ILE 68 HB ILE 68 2.409 -5.764 1.608
60 HG12 ILE 68 1HG1 ILE 68 4.116 -6.197 -0.103
61 HG13 ILE 68 2HG1 ILE 68 3.462 -4.574 -0.295
62 HG21 ILE 68 1HG2 ILE 68 2.490 -3.947 3.110
63 HG22 ILE 68 2HG2 ILE 68 2.898 -3.230 1.550
64 HG23 ILE 68 3HG2 ILE 68 4.172 -3.586 2.718
65 HD11 ILE 68 3HD1 ILE 68 5.527 -3.992 1.332
66 HD12 ILE 68 1HD1 ILE 68 5.690 -4.043 -0.422
67 HD13 ILE 68 2HD1 ILE 68 6.184 -5.427 0.551
68 H ASP 69 H ASP 69 5.403 -5.011 4.530
69 HA ASP 69 HA ASP 69 3.485 -5.791 6.641
70 HB2 ASP 69 1HB ASP 69 5.910 -5.873 7.130
71 HB3 ASP 69 2HB ASP 69 6.030 -4.146 6.811
72 HA PRO 70 HA PRO 70 1.193 -2.002 6.085
73 HB2 PRO 70 1HB PRO 70 0.094 -1.763 8.604
74 HB3 PRO 70 2HB PRO 70 -0.528 -2.837 7.338
75 HG2 PRO 70 1HG PRO 70 1.195 -3.467 9.677
76 HG3 PRO 70 2HG PRO 70 -0.129 -4.404 8.961
77 HD2 PRO 70 1HD PRO 70 2.481 -5.018 8.526
78 HD3 PRO 70 2HD PRO 70 1.222 -5.306 7.305
79 H GLN 71 H GLN 71 3.240 -2.273 8.978
80 HA GLN 71 HA GLN 71 3.306 0.619 9.412
81 HB2 GLN 71 1HB GLN 71 4.935 -1.681 10.524
82 HB3 GLN 71 2HB GLN 71 5.201 0.001 10.988
83 HG2 GLN 71 1HG GLN 71 2.433 -1.158 11.131
84 HG3 GLN 71 2HG GLN 71 3.584 -1.485 12.428
85 HE21 GLN 71 1HE2 GLN 71 1.615 1.014 10.922
86 HE22 GLN 71 2HE2 GLN 71 1.945 2.225 12.065
87 H VAL 72 H VAL 72 5.219 -1.697 7.594
88 HA VAL 72 HA VAL 72 7.373 0.243 7.147
89 HB VAL 72 HB VAL 72 6.814 -2.353 5.682
90 HG11 VAL 72 1HG1 VAL 72 9.538 -1.919 5.765
91 HG12 VAL 72 2HG1 VAL 72 8.901 -0.289 5.547
92 HG13 VAL 72 3HG1 VAL 72 8.496 -1.557 4.389
93 HG21 VAL 72 3HG2 VAL 72 8.340 -3.400 7.261
94 HG22 VAL 72 1HG2 VAL 72 7.057 -2.608 8.175
95 HG23 VAL 72 2HG2 VAL 72 8.646 -1.853 8.049
96 H PHE 73 H PHE 73 4.343 -0.631 5.693
97 HA PHE 73 HA PHE 73 4.903 0.491 3.064
98 HB2 PHE 73 1HB PHE 73 3.164 -1.278 3.584
99 HB3 PHE 73 2HB PHE 73 2.216 -0.015 4.368
100 HD1 PHE 73 1HD PHE 73 4.048 -0.625 1.146
101 HD2 PHE 73 2HD PHE 73 0.639 1.118 3.091
102 HE1 PHE 73 1HE PHE 73 3.141 0.065 -1.056
103 HE2 PHE 73 2HE PHE 73 -0.267 1.807 0.889
104 HZ PHE 73 HZ PHE 73 0.985 1.280 -1.186
105 H TYR 74 H TYR 74 2.811 1.559 5.775
106 HA TYR 74 HA TYR 74 2.243 4.117 4.656
107 HB2 TYR 74 1HB TYR 74 2.361 3.225 7.552
108 HB3 TYR 74 2HB TYR 74 1.778 4.809 7.049
109 HD1 TYR 74 1HD TYR 74 0.060 4.589 4.892
110 HD2 TYR 74 2HD TYR 74 0.712 1.661 7.973
111 HE1 TYR 74 1HE TYR 74 -2.174 3.615 4.443
112 HE2 TYR 74 2HE TYR 74 -1.523 0.690 7.520
113 HH TYR 74 HH TYR 74 -3.891 2.235 5.860
114 H GLU 75 H GLU 75 5.131 2.873 6.016
115 HA GLU 75 HA GLU 75 6.248 5.446 6.816
116 HB2 GLU 75 1HB GLU 75 6.962 2.693 7.046
117 HB3 GLU 75 2HB GLU 75 8.282 3.517 6.214
118 HG2 GLU 75 1HG GLU 75 8.213 5.277 8.020
119 HG3 GLU 75 2HG GLU 75 7.062 4.258 8.886
120 H LEU 76 H LEU 76 5.517 4.077 3.859
121 HA LEU 76 HA LEU 76 7.861 5.143 2.432
122 HB2 LEU 76 1HB LEU 76 5.326 3.854 1.377
123 HB3 LEU 76 2HB LEU 76 6.770 4.214 0.429
124 HG LEU 76 HG LEU 76 6.680 2.363 2.829
125 HD11 LEU 76 1HD1 LEU 76 6.588 0.564 1.365
126 HD12 LEU 76 2HD1 LEU 76 7.285 1.482 0.031
127 HD13 LEU 76 3HD1 LEU 76 5.601 1.733 0.487
128 HD21 LEU 76 3HD2 LEU 76 8.842 3.492 1.118
129 HD22 LEU 76 1HD2 LEU 76 8.981 1.788 1.551
130 HD23 LEU 76 2HD2 LEU 76 8.888 3.014 2.816
131 HA PRO 77 HA PRO 77 6.158 9.145 1.518
132 HB2 PRO 77 1HB PRO 77 6.755 8.781 -1.344
133 HB3 PRO 77 2HB PRO 77 7.389 9.983 -0.209
134 HG2 PRO 77 1HG PRO 77 8.790 7.836 -1.192
135 HG3 PRO 77 2HG PRO 77 9.191 8.736 0.276
136 HD2 PRO 77 1HD PRO 77 8.134 6.015 0.020
137 HD3 PRO 77 2HD PRO 77 8.847 6.824 1.431
138 H GLU 78 H GLU 78 4.333 10.141 0.387
139 HA GLU 78 HA GLU 78 2.112 8.378 -0.033
140 HB2 GLU 78 1HB GLU 78 2.646 11.278 -0.246
141 HB3 GLU 78 2HB GLU 78 1.349 10.678 -1.283
142 HG2 GLU 78 1HG GLU 78 0.205 9.696 0.613
143 HG3 GLU 78 2HG GLU 78 1.554 10.085 1.682
144 H ALA 79 H ALA 79 4.085 10.236 -2.395
145 HA ALA 79 HA ALA 79 2.762 9.423 -4.731
146 HB1 ALA 79 1HB ALA 79 4.464 10.988 -5.097
147 HB2 ALA 79 2HB ALA 79 5.191 9.513 -5.733
148 HB3 ALA 79 3HB ALA 79 5.631 10.092 -4.126
149 H VAL 80 H VAL 80 5.055 7.651 -2.730
150 HA VAL 80 HA VAL 80 5.298 5.406 -4.583
151 HB VAL 80 HB VAL 80 5.994 5.742 -1.650
152 HG11 VAL 80 1HG1 VAL 80 6.118 3.387 -3.492
153 HG12 VAL 80 2HG1 VAL 80 5.788 3.439 -1.761
154 HG13 VAL 80 3HG1 VAL 80 7.440 3.622 -2.349
155 HG21 VAL 80 3HG2 VAL 80 7.745 5.547 -4.120
156 HG22 VAL 80 1HG2 VAL 80 8.285 5.864 -2.472
157 HG23 VAL 80 2HG2 VAL 80 7.311 7.061 -3.326
158 H GLN 81 H GLN 81 3.350 6.266 -1.787
159 HA GLN 81 HA GLN 81 2.102 3.726 -1.340
160 HB2 GLN 81 1HB GLN 81 2.015 5.676 0.225
161 HB3 GLN 81 2HB GLN 81 0.919 6.480 -0.895
162 HG2 GLN 81 1HG GLN 81 -0.848 5.225 -0.246
163 HG3 GLN 81 2HG GLN 81 0.095 3.737 -0.266
164 HE21 GLN 81 1HE2 GLN 81 2.122 4.489 1.641
165 HE22 GLN 81 2HE2 GLN 81 1.385 4.664 3.155
166 H LYS 82 H LYS 82 1.079 6.544 -3.288
167 HA LYS 82 HA LYS 82 -1.352 5.397 -4.243
168 HB2 LYS 82 1HB LYS 82 0.435 7.632 -5.128
169 HB3 LYS 82 2HB LYS 82 -0.844 7.085 -6.212
170 HG2 LYS 82 1HG LYS 82 -1.718 8.885 -4.837
171 HG3 LYS 82 2HG LYS 82 -2.483 7.377 -4.336
172 HD2 LYS 82 1HD LYS 82 -0.922 7.173 -2.462
173 HD3 LYS 82 2HD LYS 82 -0.073 8.628 -2.986
174 HE2 LYS 82 1HE LYS 82 -1.697 10.025 -2.186
175 HE3 LYS 82 2HE LYS 82 -3.000 8.913 -2.603
176 HZ1 LYS 82 3HZ LYS 82 -2.461 7.562 -0.716
177 HZ2 LYS 82 1HZ LYS 82 -2.673 9.160 -0.191
178 HZ3 LYS 82 2HZ LYS 82 -1.108 8.521 -0.349
179 H GLU 83 H GLU 83 1.878 5.567 -5.795
180 HA GLU 83 HA GLU 83 1.116 4.150 -8.146
181 HB2 GLU 83 1HB GLU 83 3.802 4.337 -6.752
182 HB3 GLU 83 2HB GLU 83 3.570 3.656 -8.363
183 HG2 GLU 83 1HG GLU 83 2.581 6.424 -7.687
184 HG3 GLU 83 2HG GLU 83 4.246 6.151 -8.202
185 H LEU 84 H LEU 84 2.421 2.941 -5.044
186 HA LEU 84 HA LEU 84 2.488 0.199 -5.957
187 HB2 LEU 84 1HB LEU 84 2.408 1.374 -3.159
188 HB3 LEU 84 2HB LEU 84 2.651 -0.339 -3.501
189 HG LEU 84 HG LEU 84 4.418 1.910 -4.516
190 HD11 LEU 84 1HD1 LEU 84 6.075 1.052 -2.932
191 HD12 LEU 84 2HD1 LEU 84 4.951 -0.196 -2.398
192 HD13 LEU 84 3HD1 LEU 84 4.607 1.501 -2.064
193 HD21 LEU 84 3HD2 LEU 84 5.874 -0.320 -4.843
194 HD22 LEU 84 1HD2 LEU 84 4.768 0.256 -6.090
195 HD23 LEU 84 2HD2 LEU 84 4.268 -1.034 -4.996
196 H LEU 85 H LEU 85 0.052 2.211 -4.375
197 HA LEU 85 HA LEU 85 -1.786 0.036 -3.867
198 HB2 LEU 85 1HB LEU 85 -2.119 3.037 -4.083
199 HB3 LEU 85 2HB LEU 85 -3.491 1.969 -3.789
200 HG LEU 85 HG LEU 85 -0.990 1.920 -2.086
201 HD11 LEU 85 1HD1 LEU 85 -3.571 3.437 -1.599
202 HD12 LEU 85 2HD1 LEU 85 -2.010 4.165 -1.983
203 HD13 LEU 85 3HD1 LEU 85 -2.228 3.297 -0.464
204 HD21 LEU 85 3HD2 LEU 85 -2.019 0.139 -1.162
205 HD22 LEU 85 1HD2 LEU 85 -3.408 0.348 -2.228
206 HD23 LEU 85 2HD2 LEU 85 -3.348 1.193 -0.682
207 H ALA 86 H ALA 86 -1.216 2.214 -6.597
208 HA ALA 86 HA ALA 86 -3.554 1.495 -8.094
209 HB1 ALA 86 1HB ALA 86 -0.925 2.769 -8.704
210 HB2 ALA 86 2HB ALA 86 -2.557 3.351 -9.034
211 HB3 ALA 86 3HB ALA 86 -1.837 2.112 -10.062
212 H GLU 87 H GLU 87 -0.371 0.030 -7.734
213 HA GLU 87 HA GLU 87 -0.729 -1.906 -9.888
214 HB2 GLU 87 1HB GLU 87 1.507 -1.201 -8.916
215 HB3 GLU 87 2HB GLU 87 1.094 -2.126 -7.473
216 HG2 GLU 87 1HG GLU 87 2.228 -3.758 -8.647
217 HG3 GLU 87 2HG GLU 87 0.605 -4.028 -9.282
218 H TRP 88 H TRP 88 -1.294 -1.891 -6.391
219 HA TRP 88 HA TRP 88 -2.041 -4.676 -6.203
220 HB2 TRP 88 1HB TRP 88 -2.887 -2.325 -4.482
221 HB3 TRP 88 2HB TRP 88 -3.061 -4.025 -4.055
222 HD1 TRP 88 HD TRP 88 0.076 -4.194 -5.667
223 HE1 TRP 88 1HE TRP 88 2.054 -3.860 -4.043
224 HE3 TRP 88 3HE TRP 88 -2.365 -2.093 -1.702
225 HZ2 TRP 88 2HZ TRP 88 2.541 -2.826 -1.434
226 HZ3 TRP 88 3HZ TRP 88 -1.119 -1.443 0.338
227 HH2 TRP 88 HH TRP 88 1.329 -1.810 0.477
228 H LYS 89 H LYS 89 -3.733 -1.713 -7.035
229 HA LYS 89 HA LYS 89 -6.392 -2.846 -6.892
230 HB2 LYS 89 1HB LYS 89 -6.609 -0.565 -6.888
231 HB3 LYS 89 2HB LYS 89 -5.153 -0.325 -7.853
232 HG2 LYS 89 1HG LYS 89 -6.306 -0.825 -9.891
233 HG3 LYS 89 2HG LYS 89 -7.716 -1.437 -9.021
234 HD2 LYS 89 1HD LYS 89 -7.971 0.890 -8.032
235 HD3 LYS 89 2HD LYS 89 -6.747 1.426 -9.184
236 HE2 LYS 89 1HE LYS 89 -8.416 1.698 -10.675
237 HE3 LYS 89 2HE LYS 89 -8.547 -0.060 -10.725
238 HZ1 LYS 89 3HZ LYS 89 -9.840 1.176 -8.461
239 HZ2 LYS 89 1HZ LYS 89 -10.403 -0.037 -9.503
240 HZ3 LYS 89 2HZ LYS 89 -10.517 1.596 -9.961
241 H ARG 90 H ARG 90 -3.986 -2.501 -9.481
242 HA ARG 90 HA ARG 90 -5.686 -3.345 -11.602
243 HB2 ARG 90 1HB ARG 90 -3.119 -2.445 -11.457
244 HB3 ARG 90 2HB ARG 90 -2.840 -4.164 -11.742
245 HG2 ARG 90 1HG ARG 90 -4.700 -3.848 -13.580
246 HG3 ARG 90 2HG ARG 90 -4.223 -2.154 -13.487
247 HD2 ARG 90 1HD ARG 90 -1.928 -2.706 -14.024
248 HD3 ARG 90 2HD ARG 90 -2.272 -4.433 -13.927
249 HE ARG 90 HE ARG 90 -4.002 -3.255 -15.873
250 HH11 ARG 90 1HH2 ARG 90 -0.705 -4.050 -15.248
251 HH12 ARG 90 2HH2 ARG 90 -0.297 -4.246 -16.921
252 HH21 ARG 90 1HH1 ARG 90 -3.489 -3.505 -18.057
253 HH22 ARG 90 2HH1 ARG 90 -1.875 -3.936 -18.512
254 H THR 91 H THR 91 -3.547 -5.204 -9.420
255 HA THR 91 HA THR 91 -4.607 -7.715 -10.619
256 HB THR 91 HB THR 91 -2.777 -8.809 -9.669
257 HG1 THR 91 1HG THR 91 -2.720 -6.684 -7.793
258 HG21 THR 91 3HG2 THR 91 -1.740 -5.971 -9.848
259 HG22 THR 91 1HG2 THR 91 -2.077 -6.978 -11.255
260 HG23 THR 91 2HG2 THR 91 -0.828 -7.458 -10.107
261 H GLY 92 H GLY 92 -4.453 -6.015 -7.501
262 HA2 GLY 92 1HA GLY 92 -6.245 -6.036 -5.887
263 HA3 GLY 92 2HA GLY 92 -6.904 -7.468 -6.681
Start of MODEL 6
1 H LYS 61 H LYS 61 -10.430 1.271 2.368
2 HA LYS 61 HA LYS 61 -10.906 -1.649 2.338
3 HB2 LYS 61 1HB LYS 61 -12.316 -0.619 0.508
4 HB3 LYS 61 2HB LYS 61 -10.821 -0.059 -0.240
5 HG2 LYS 61 1HG LYS 61 -10.489 -2.084 -1.159
6 HG3 LYS 61 2HG LYS 61 -10.545 -2.842 0.433
7 HD2 LYS 61 1HD LYS 61 -12.987 -2.950 0.331
8 HD3 LYS 61 2HD LYS 61 -12.979 -2.117 -1.223
9 HE2 LYS 61 1HE LYS 61 -12.957 -4.848 -0.919
10 HE3 LYS 61 2HE LYS 61 -12.405 -3.995 -2.360
11 HZ1 LYS 61 3HZ LYS 61 -10.655 -4.620 -0.048
12 HZ2 LYS 61 1HZ LYS 61 -10.182 -4.020 -1.562
13 HZ3 LYS 61 2HZ LYS 61 -10.780 -5.605 -1.428
14 H ILE 62 H ILE 62 -8.833 -2.438 2.704
15 HA ILE 62 HA ILE 62 -6.661 -1.383 1.020
16 HB ILE 62 HB ILE 62 -6.390 -1.447 4.041
17 HG12 ILE 62 1HG1 ILE 62 -6.583 0.899 2.120
18 HG13 ILE 62 2HG1 ILE 62 -7.792 0.444 3.320
19 HG21 ILE 62 1HG2 ILE 62 -4.514 -0.495 1.855
20 HG22 ILE 62 2HG2 ILE 62 -4.326 -1.980 2.787
21 HG23 ILE 62 3HG2 ILE 62 -4.201 -0.416 3.588
22 HD11 ILE 62 3HD1 ILE 62 -5.735 0.614 4.979
23 HD12 ILE 62 1HD1 ILE 62 -6.640 2.055 4.513
24 HD13 ILE 62 2HD1 ILE 62 -5.103 1.684 3.728
25 H THR 63 H THR 63 -5.571 -3.110 0.266
26 HA THR 63 HA THR 63 -5.429 -5.581 1.965
27 HB THR 63 HB THR 63 -5.541 -5.485 -1.065
28 HG1 THR 63 1HG THR 63 -7.494 -4.847 0.164
29 HG21 THR 63 3HG2 THR 63 -4.409 -7.453 -0.188
30 HG22 THR 63 1HG2 THR 63 -6.007 -7.922 -0.770
31 HG23 THR 63 2HG2 THR 63 -5.719 -7.733 0.959
32 H PHE 64 H PHE 64 -3.352 -5.964 2.550
33 HA PHE 64 HA PHE 64 -1.190 -4.778 0.903
34 HB2 PHE 64 1HB PHE 64 -1.148 -6.006 3.672
35 HB3 PHE 64 2HB PHE 64 0.246 -5.294 2.865
36 HD1 PHE 64 1HD PHE 64 0.020 -2.837 2.071
37 HD2 PHE 64 2HD PHE 64 -2.591 -4.661 4.947
38 HE1 PHE 64 1HE PHE 64 -0.631 -0.592 2.900
39 HE2 PHE 64 2HE PHE 64 -3.246 -2.417 5.776
40 HZ PHE 64 HZ PHE 64 -2.259 -0.383 4.756
41 HA PRO 65 HA PRO 65 -0.317 -8.786 -1.007
42 HB2 PRO 65 1HB PRO 65 2.496 -7.857 -0.693
43 HB3 PRO 65 2HB PRO 65 1.671 -8.501 -2.122
44 HG2 PRO 65 1HG PRO 65 2.193 -5.889 -1.803
45 HG3 PRO 65 2HG PRO 65 0.783 -6.486 -2.685
46 HD2 PRO 65 1HD PRO 65 0.893 -5.137 -0.063
47 HD3 PRO 65 2HD PRO 65 -0.476 -5.334 -1.174
48 H SER 66 H SER 66 0.756 -10.778 -0.389
49 HA SER 66 HA SER 66 0.879 -11.286 2.430
50 HB2 SER 66 1HB SER 66 0.685 -12.846 0.207
51 HB3 SER 66 2HB SER 66 2.371 -13.110 0.643
52 HG SER 66 HG SER 66 1.547 -14.443 2.047
53 H ASP 67 H ASP 67 3.067 -9.584 0.574
54 HA ASP 67 HA ASP 67 5.304 -10.366 2.409
55 HB2 ASP 67 1HB ASP 67 5.555 -11.006 -0.063
56 HB3 ASP 67 2HB ASP 67 5.702 -9.277 -0.377
57 H ILE 68 H ILE 68 3.150 -8.015 2.183
58 HA ILE 68 HA ILE 68 5.165 -5.827 2.509
59 HB ILE 68 HB ILE 68 2.308 -5.775 1.559
60 HG12 ILE 68 1HG1 ILE 68 3.978 -6.205 -0.184
61 HG13 ILE 68 2HG1 ILE 68 3.320 -4.583 -0.377
62 HG21 ILE 68 1HG2 ILE 68 3.963 -3.646 2.820
63 HG22 ILE 68 2HG2 ILE 68 2.213 -3.871 2.835
64 HG23 ILE 68 3HG2 ILE 68 3.003 -3.191 1.412
65 HD11 ILE 68 3HD1 ILE 68 5.554 -4.075 -0.559
66 HD12 ILE 68 1HD1 ILE 68 6.054 -5.428 0.454
67 HD13 ILE 68 2HD1 ILE 68 5.401 -3.967 1.193
68 H ASP 69 H ASP 69 5.368 -5.020 4.459
69 HA ASP 69 HA ASP 69 3.454 -5.767 6.583
70 HB2 ASP 69 1HB ASP 69 5.893 -5.911 7.014
71 HB3 ASP 69 2HB ASP 69 6.033 -4.178 6.742
72 HA PRO 70 HA PRO 70 1.261 -1.903 6.129
73 HB2 PRO 70 1HB PRO 70 0.193 -1.711 8.670
74 HB3 PRO 70 2HB PRO 70 -0.480 -2.706 7.365
75 HG2 PRO 70 1HG PRO 70 1.188 -3.502 9.685
76 HG3 PRO 70 2HG PRO 70 -0.134 -4.369 8.888
77 HD2 PRO 70 1HD PRO 70 2.496 -4.993 8.500
78 HD3 PRO 70 2HD PRO 70 1.247 -5.261 7.266
79 H GLN 71 H GLN 71 3.298 -2.290 9.029
80 HA GLN 71 HA GLN 71 3.435 0.584 9.526
81 HB2 GLN 71 1HB GLN 71 4.949 -1.809 10.582
82 HB3 GLN 71 2HB GLN 71 5.416 -0.163 11.008
83 HG2 GLN 71 1HG GLN 71 3.937 -0.895 12.738
84 HG3 GLN 71 2HG GLN 71 2.994 0.199 11.727
85 HE21 GLN 71 1HE2 GLN 71 0.906 -0.712 11.816
86 HE22 GLN 71 2HE2 GLN 71 0.554 -2.322 11.412
87 H VAL 72 H VAL 72 5.311 -1.719 7.644
88 HA VAL 72 HA VAL 72 7.469 0.231 7.229
89 HB VAL 72 HB VAL 72 6.950 -2.367 5.753
90 HG11 VAL 72 1HG1 VAL 72 9.671 -1.904 5.883
91 HG12 VAL 72 2HG1 VAL 72 9.015 -0.285 5.647
92 HG13 VAL 72 3HG1 VAL 72 8.645 -1.565 4.490
93 HG21 VAL 72 3HG2 VAL 72 8.183 -3.511 7.383
94 HG22 VAL 72 1HG2 VAL 72 7.252 -2.384 8.369
95 HG23 VAL 72 2HG2 VAL 72 8.937 -2.035 7.988
96 H PHE 73 H PHE 73 4.463 -0.660 5.739
97 HA PHE 73 HA PHE 73 5.069 0.453 3.118
98 HB2 PHE 73 1HB PHE 73 3.363 -1.328 3.520
99 HB3 PHE 73 2HB PHE 73 2.391 -0.155 4.406
100 HD1 PHE 73 1HD PHE 73 4.094 -0.621 1.101
101 HD2 PHE 73 2HD PHE 73 0.825 1.140 3.255
102 HE1 PHE 73 1HE PHE 73 3.111 0.164 -1.033
103 HE2 PHE 73 2HE PHE 73 -0.159 1.929 1.120
104 HZ PHE 73 HZ PHE 73 0.986 1.443 -1.027
105 H TYR 74 H TYR 74 2.876 1.519 5.761
106 HA TYR 74 HA TYR 74 2.304 4.054 4.616
107 HB2 TYR 74 1HB TYR 74 2.407 3.189 7.522
108 HB3 TYR 74 2HB TYR 74 1.833 4.775 7.012
109 HD1 TYR 74 2HD TYR 74 0.114 4.566 4.866
110 HD2 TYR 74 1HD TYR 74 0.753 1.622 7.928
111 HE1 TYR 74 2HE TYR 74 -2.119 3.594 4.401
112 HE2 TYR 74 1HE TYR 74 -1.478 0.652 7.463
113 HH TYR 74 HH TYR 74 -3.359 0.845 6.305
114 H GLU 75 H GLU 75 5.211 2.867 5.955
115 HA GLU 75 HA GLU 75 6.289 5.453 6.763
116 HB2 GLU 75 1HB GLU 75 6.999 3.038 7.507
117 HB3 GLU 75 2HB GLU 75 7.979 3.072 6.040
118 HG2 GLU 75 1HG GLU 75 9.486 3.983 7.539
119 HG3 GLU 75 2HG GLU 75 8.686 5.455 6.988
120 H LEU 76 H LEU 76 5.545 4.153 3.790
121 HA LEU 76 HA LEU 76 7.894 5.255 2.389
122 HB2 LEU 76 1HB LEU 76 5.422 3.812 1.406
123 HB3 LEU 76 2HB LEU 76 6.709 4.382 0.346
124 HG LEU 76 HG LEU 76 7.177 2.517 2.687
125 HD11 LEU 76 1HD1 LEU 76 7.367 0.741 0.939
126 HD12 LEU 76 2HD1 LEU 76 6.777 1.898 -0.254
127 HD13 LEU 76 3HD1 LEU 76 5.734 1.393 1.075
128 HD21 LEU 76 3HD2 LEU 76 9.255 3.433 2.173
129 HD22 LEU 76 1HD2 LEU 76 8.851 3.670 0.474
130 HD23 LEU 76 2HD2 LEU 76 9.229 2.056 1.074
131 HA PRO 77 HA PRO 77 6.123 9.219 1.437
132 HB2 PRO 77 1HB PRO 77 6.742 8.804 -1.427
133 HB3 PRO 77 2HB PRO 77 7.302 10.074 -0.328
134 HG2 PRO 77 1HG PRO 77 8.861 8.036 -1.201
135 HG3 PRO 77 2HG PRO 77 9.110 8.892 0.326
136 HD2 PRO 77 1HD PRO 77 8.113 6.147 -0.127
137 HD3 PRO 77 2HD PRO 77 8.842 6.873 1.321
138 H GLU 78 H GLU 78 4.297 10.197 0.309
139 HA GLU 78 HA GLU 78 2.073 8.432 -0.096
140 HB2 GLU 78 1HB GLU 78 2.496 11.322 -0.911
141 HB3 GLU 78 2HB GLU 78 0.948 10.480 -0.989
142 HG2 GLU 78 1HG GLU 78 0.664 11.255 1.130
143 HG3 GLU 78 2HG GLU 78 1.738 9.931 1.581
144 H ALA 79 H ALA 79 4.050 10.268 -2.468
145 HA ALA 79 HA ALA 79 2.736 9.458 -4.806
146 HB1 ALA 79 1HB ALA 79 5.240 10.649 -4.157
147 HB2 ALA 79 2HB ALA 79 4.437 10.612 -5.726
148 HB3 ALA 79 3HB ALA 79 5.565 9.330 -5.283
149 H VAL 80 H VAL 80 5.008 7.654 -2.802
150 HA VAL 80 HA VAL 80 5.168 5.400 -4.669
151 HB VAL 80 HB VAL 80 5.996 5.717 -1.765
152 HG11 VAL 80 1HG1 VAL 80 5.925 3.439 -1.813
153 HG12 VAL 80 2HG1 VAL 80 7.424 3.607 -2.728
154 HG13 VAL 80 3HG1 VAL 80 5.894 3.379 -3.576
155 HG21 VAL 80 3HG2 VAL 80 8.254 5.323 -3.266
156 HG22 VAL 80 1HG2 VAL 80 7.638 6.909 -2.804
157 HG23 VAL 80 2HG2 VAL 80 7.253 6.242 -4.389
158 H GLN 81 H GLN 81 3.347 6.286 -1.793
159 HA GLN 81 HA GLN 81 2.094 3.768 -1.271
160 HB2 GLN 81 1HB GLN 81 2.048 5.776 0.238
161 HB3 GLN 81 2HB GLN 81 0.914 6.533 -0.876
162 HG2 GLN 81 1HG GLN 81 -0.821 5.289 -0.128
163 HG3 GLN 81 2HG GLN 81 0.136 3.808 -0.120
164 HE21 GLN 81 1HE2 GLN 81 2.191 4.475 1.673
165 HE22 GLN 81 2HE2 GLN 81 1.535 4.786 3.203
166 H LYS 82 H LYS 82 1.046 6.549 -3.242
167 HA LYS 82 HA LYS 82 -1.397 5.389 -4.168
168 HB2 LYS 82 1HB LYS 82 0.372 7.636 -5.040
169 HB3 LYS 82 2HB LYS 82 -0.861 7.062 -6.163
170 HG2 LYS 82 1HG LYS 82 -1.797 8.860 -4.807
171 HG3 LYS 82 2HG LYS 82 -2.570 7.339 -4.358
172 HD2 LYS 82 1HD LYS 82 -1.038 7.123 -2.437
173 HD3 LYS 82 2HD LYS 82 -0.261 8.643 -2.884
174 HE2 LYS 82 1HE LYS 82 -1.874 9.129 -1.150
175 HE3 LYS 82 2HE LYS 82 -2.509 9.766 -2.668
176 HZ1 LYS 82 3HZ LYS 82 -3.908 7.861 -2.901
177 HZ2 LYS 82 1HZ LYS 82 -4.156 8.506 -1.352
178 HZ3 LYS 82 2HZ LYS 82 -3.211 7.107 -1.547
179 H GLU 83 H GLU 83 1.828 5.564 -5.733
180 HA GLU 83 HA GLU 83 1.089 4.124 -8.074
181 HB2 GLU 83 1HB GLU 83 3.748 4.381 -6.646
182 HB3 GLU 83 2HB GLU 83 3.565 3.581 -8.207
183 HG2 GLU 83 1HG GLU 83 2.486 5.707 -9.058
184 HG3 GLU 83 2HG GLU 83 2.973 6.476 -7.550
185 H LEU 84 H LEU 84 2.374 2.944 -4.957
186 HA LEU 84 HA LEU 84 2.446 0.192 -5.831
187 HB2 LEU 84 1HB LEU 84 2.383 1.408 -3.051
188 HB3 LEU 84 2HB LEU 84 2.635 -0.307 -3.372
189 HG LEU 84 HG LEU 84 4.364 1.922 -4.485
190 HD11 LEU 84 1HD1 LEU 84 6.042 1.217 -2.873
191 HD12 LEU 84 2HD1 LEU 84 4.991 -0.070 -2.287
192 HD13 LEU 84 3HD1 LEU 84 4.561 1.617 -2.003
193 HD21 LEU 84 3HD2 LEU 84 5.832 -0.330 -4.694
194 HD22 LEU 84 1HD2 LEU 84 4.747 0.212 -5.974
195 HD23 LEU 84 2HD2 LEU 84 4.222 -1.033 -4.840
196 H LEU 85 H LEU 85 0.012 2.193 -4.211
197 HA LEU 85 HA LEU 85 -1.803 0.007 -3.689
198 HB2 LEU 85 1HB LEU 85 -2.168 3.001 -3.935
199 HB3 LEU 85 2HB LEU 85 -3.534 1.926 -3.644
200 HG LEU 85 HG LEU 85 -1.054 1.862 -1.918
201 HD11 LEU 85 1HD1 LEU 85 -3.592 3.425 -1.374
202 HD12 LEU 85 2HD1 LEU 85 -2.095 4.156 -1.949
203 HD13 LEU 85 3HD1 LEU 85 -2.142 3.370 -0.371
204 HD21 LEU 85 3HD2 LEU 85 -3.405 0.287 -2.091
205 HD22 LEU 85 1HD2 LEU 85 -3.576 1.273 -0.638
206 HD23 LEU 85 2HD2 LEU 85 -2.170 0.228 -0.835
207 H ALA 86 H ALA 86 -1.250 2.147 -6.443
208 HA ALA 86 HA ALA 86 -3.584 1.378 -7.932
209 HB1 ALA 86 1HB ALA 86 -2.433 2.323 -9.865
210 HB2 ALA 86 2HB ALA 86 -0.891 2.265 -9.012
211 HB3 ALA 86 3HB ALA 86 -2.157 3.365 -8.470
212 H GLU 87 H GLU 87 -0.388 -0.034 -7.522
213 HA GLU 87 HA GLU 87 -0.660 -1.976 -9.676
214 HB2 GLU 87 1HB GLU 87 1.518 -1.214 -8.516
215 HB3 GLU 87 2HB GLU 87 1.062 -2.315 -7.215
216 HG2 GLU 87 1HG GLU 87 0.736 -4.042 -9.172
217 HG3 GLU 87 2HG GLU 87 1.801 -2.949 -10.057
218 H TRP 88 H TRP 88 -1.230 -2.052 -6.162
219 HA TRP 88 HA TRP 88 -2.013 -4.822 -6.051
220 HB2 TRP 88 1HB TRP 88 -2.973 -2.548 -4.292
221 HB3 TRP 88 2HB TRP 88 -3.005 -4.265 -3.902
222 HD1 TRP 88 HD TRP 88 0.104 -4.236 -5.489
223 HE1 TRP 88 1HE TRP 88 2.071 -3.739 -3.890
224 HE3 TRP 88 3HE TRP 88 -2.436 -2.204 -1.552
225 HZ2 TRP 88 2HZ TRP 88 2.507 -2.633 -1.300
226 HZ3 TRP 88 3HZ TRP 88 -1.222 -1.435 0.467
227 HH2 TRP 88 HH TRP 88 1.248 -1.647 0.594
228 H LYS 89 H LYS 89 -3.672 -1.841 -6.877
229 HA LYS 89 HA LYS 89 -6.341 -3.001 -6.843
230 HB2 LYS 89 1HB LYS 89 -5.616 -0.493 -6.672
231 HB3 LYS 89 2HB LYS 89 -5.579 -0.564 -8.434
232 HG2 LYS 89 1HG LYS 89 -7.912 -1.369 -8.455
233 HG3 LYS 89 2HG LYS 89 -7.951 -1.288 -6.692
234 HD2 LYS 89 1HD LYS 89 -7.369 1.168 -6.884
235 HD3 LYS 89 2HD LYS 89 -7.613 1.020 -8.625
236 HE2 LYS 89 1HE LYS 89 -9.843 1.179 -8.373
237 HE3 LYS 89 2HE LYS 89 -9.847 -0.159 -7.225
238 HZ1 LYS 89 3HZ LYS 89 -10.255 2.533 -6.689
239 HZ2 LYS 89 1HZ LYS 89 -8.751 2.140 -6.011
240 HZ3 LYS 89 2HZ LYS 89 -10.136 1.260 -5.570
241 H ARG 90 H ARG 90 -3.881 -2.394 -9.350
242 HA ARG 90 HA ARG 90 -5.513 -3.050 -11.582
243 HB2 ARG 90 1HB ARG 90 -2.559 -3.118 -11.040
244 HB3 ARG 90 2HB ARG 90 -3.168 -3.859 -12.520
245 HG2 ARG 90 1HG ARG 90 -4.226 -1.157 -11.859
246 HG3 ARG 90 2HG ARG 90 -2.536 -1.237 -12.353
247 HD2 ARG 90 1HD ARG 90 -3.050 -1.910 -14.495
248 HD3 ARG 90 2HD ARG 90 -4.496 -2.782 -13.987
249 HE ARG 90 HE ARG 90 -5.706 -0.835 -14.485
250 HH11 ARG 90 1HH2 ARG 90 -2.428 -0.112 -13.694
251 HH12 ARG 90 2HH2 ARG 90 -2.606 1.593 -13.941
252 HH21 ARG 90 1HH1 ARG 90 -5.957 1.385 -14.809
253 HH22 ARG 90 2HH1 ARG 90 -4.604 2.440 -14.572
254 H THR 91 H THR 91 -3.552 -5.106 -9.439
255 HA THR 91 HA THR 91 -4.591 -7.524 -10.825
256 HB THR 91 HB THR 91 -2.961 -8.745 -9.588
257 HG1 THR 91 1HG THR 91 -3.197 -6.569 -7.874
258 HG21 THR 91 3HG2 THR 91 -2.197 -6.855 -11.291
259 HG22 THR 91 1HG2 THR 91 -1.010 -7.787 -10.379
260 HG23 THR 91 2HG2 THR 91 -1.463 -6.170 -9.841
261 H GLY 92 H GLY 92 -4.679 -5.925 -7.656
262 HA2 GLY 92 1HA GLY 92 -6.435 -5.990 -6.061
263 HA3 GLY 92 2HA GLY 92 -7.310 -7.093 -7.123
Start of MODEL 7
1 H LYS 61 H LYS 61 -12.052 -0.372 1.350
2 HA LYS 61 HA LYS 61 -10.673 -1.624 3.656
3 HB2 LYS 61 1HB LYS 61 -11.082 -3.737 2.426
4 HB3 LYS 61 2HB LYS 61 -12.569 -2.823 2.679
5 HG2 LYS 61 1HG LYS 61 -11.677 -1.797 0.291
6 HG3 LYS 61 2HG LYS 61 -11.184 -3.486 0.168
7 HD2 LYS 61 1HD LYS 61 -13.971 -2.497 0.835
8 HD3 LYS 61 2HD LYS 61 -13.465 -3.196 -0.705
9 HE2 LYS 61 1HE LYS 61 -12.618 -5.110 1.066
10 HE3 LYS 61 2HE LYS 61 -14.086 -4.529 1.851
11 HZ1 LYS 61 3HZ LYS 61 -15.040 -5.996 0.455
12 HZ2 LYS 61 1HZ LYS 61 -13.765 -5.951 -0.663
13 HZ3 LYS 61 2HZ LYS 61 -14.928 -4.714 -0.654
14 H ILE 62 H ILE 62 -8.459 -1.797 3.629
15 HA ILE 62 HA ILE 62 -7.087 -1.564 0.986
16 HB ILE 62 HB ILE 62 -5.975 -1.121 3.772
17 HG12 ILE 62 1HG1 ILE 62 -6.650 0.915 1.626
18 HG13 ILE 62 2HG1 ILE 62 -7.704 0.553 2.993
19 HG21 ILE 62 1HG2 ILE 62 -4.834 -1.138 1.019
20 HG22 ILE 62 2HG2 ILE 62 -4.072 -1.557 2.553
21 HG23 ILE 62 3HG2 ILE 62 -4.278 0.136 2.105
22 HD11 ILE 62 3HD1 ILE 62 -6.144 2.545 3.306
23 HD12 ILE 62 1HD1 ILE 62 -4.816 1.385 3.337
24 HD13 ILE 62 2HD1 ILE 62 -6.074 1.318 4.571
25 H THR 63 H THR 63 -5.739 -3.205 0.317
26 HA THR 63 HA THR 63 -5.415 -5.553 2.159
27 HB THR 63 HB THR 63 -5.192 -6.606 -0.361
28 HG1 THR 63 1HG THR 63 -6.741 -4.306 -0.432
29 HG21 THR 63 3HG2 THR 63 -7.706 -6.265 1.297
30 HG22 THR 63 1HG2 THR 63 -6.503 -7.538 1.490
31 HG23 THR 63 2HG2 THR 63 -7.484 -7.468 0.026
32 H PHE 64 H PHE 64 -3.317 -5.886 2.658
33 HA PHE 64 HA PHE 64 -1.241 -4.757 0.858
34 HB2 PHE 64 1HB PHE 64 -0.913 -5.897 3.647
35 HB3 PHE 64 2HB PHE 64 0.270 -4.954 2.745
36 HD1 PHE 64 1HD PHE 64 -0.249 -2.544 2.176
37 HD2 PHE 64 2HD PHE 64 -2.633 -4.845 4.906
38 HE1 PHE 64 1HE PHE 64 -1.206 -0.451 3.099
39 HE2 PHE 64 2HE PHE 64 -3.595 -2.755 5.829
40 HZ PHE 64 HZ PHE 64 -2.883 -0.557 4.926
41 HA PRO 65 HA PRO 65 -0.352 -8.845 -0.855
42 HB2 PRO 65 1HB PRO 65 2.467 -7.921 -0.546
43 HB3 PRO 65 2HB PRO 65 1.661 -8.641 -1.951
44 HG2 PRO 65 1HG PRO 65 2.177 -6.025 -1.793
45 HG3 PRO 65 2HG PRO 65 0.745 -6.659 -2.613
46 HD2 PRO 65 1HD PRO 65 0.919 -5.188 -0.052
47 HD3 PRO 65 2HD PRO 65 -0.461 -5.393 -1.149
48 H SER 66 H SER 66 0.710 -10.830 -0.172
49 HA SER 66 HA SER 66 0.843 -11.224 2.686
50 HB2 SER 66 1HB SER 66 0.950 -12.844 0.291
51 HB3 SER 66 2HB SER 66 2.199 -13.344 1.427
52 HG SER 66 HG SER 66 0.080 -12.894 2.873
53 H ASP 67 H ASP 67 3.030 -9.722 0.670
54 HA ASP 67 HA ASP 67 5.314 -10.516 2.442
55 HB2 ASP 67 1HB ASP 67 5.217 -10.932 -0.248
56 HB3 ASP 67 2HB ASP 67 5.954 -9.329 -0.190
57 H ILE 68 H ILE 68 3.193 -8.127 2.159
58 HA ILE 68 HA ILE 68 5.238 -5.962 2.465
59 HB ILE 68 HB ILE 68 2.380 -5.889 1.522
60 HG12 ILE 68 1HG1 ILE 68 4.081 -6.348 -0.194
61 HG13 ILE 68 2HG1 ILE 68 3.393 -4.743 -0.425
62 HG21 ILE 68 1HG2 ILE 68 4.099 -3.709 2.659
63 HG22 ILE 68 2HG2 ILE 68 2.377 -4.011 2.898
64 HG23 ILE 68 3HG2 ILE 68 2.950 -3.332 1.375
65 HD11 ILE 68 3HD1 ILE 68 6.143 -5.520 0.377
66 HD12 ILE 68 1HD1 ILE 68 5.475 -4.099 1.177
67 HD13 ILE 68 2HD1 ILE 68 5.595 -4.146 -0.579
68 H ASP 69 H ASP 69 5.425 -5.058 4.396
69 HA ASP 69 HA ASP 69 3.539 -5.813 6.543
70 HB2 ASP 69 1HB ASP 69 6.075 -5.834 6.822
71 HB3 ASP 69 2HB ASP 69 6.005 -4.075 6.793
72 HA PRO 70 HA PRO 70 1.287 -1.986 6.040
73 HB2 PRO 70 1HB PRO 70 0.198 -1.791 8.570
74 HB3 PRO 70 2HB PRO 70 -0.449 -2.811 7.271
75 HG2 PRO 70 1HG PRO 70 1.224 -3.553 9.606
76 HG3 PRO 70 2HG PRO 70 -0.086 -4.449 8.818
77 HD2 PRO 70 1HD PRO 70 2.552 -5.043 8.438
78 HD3 PRO 70 2HD PRO 70 1.311 -5.334 7.201
79 H GLN 71 H GLN 71 3.320 -2.339 8.944
80 HA GLN 71 HA GLN 71 3.422 0.537 9.439
81 HB2 GLN 71 1HB GLN 71 3.834 -1.425 11.117
82 HB3 GLN 71 2HB GLN 71 5.466 -1.432 10.447
83 HG2 GLN 71 1HG GLN 71 5.227 1.204 10.865
84 HG3 GLN 71 2HG GLN 71 4.105 0.641 12.104
85 HE21 GLN 71 1HE2 GLN 71 4.974 -0.704 13.851
86 HE22 GLN 71 2HE2 GLN 71 6.644 -0.776 14.151
87 H VAL 72 H VAL 72 5.357 -1.756 7.595
88 HA VAL 72 HA VAL 72 7.487 0.219 7.168
89 HB VAL 72 HB VAL 72 6.998 -2.375 5.675
90 HG11 VAL 72 1HG1 VAL 72 9.410 -2.211 5.205
91 HG12 VAL 72 2HG1 VAL 72 9.488 -0.696 6.104
92 HG13 VAL 72 3HG1 VAL 72 8.561 -0.786 4.607
93 HG21 VAL 72 3HG2 VAL 72 8.288 -3.508 7.296
94 HG22 VAL 72 1HG2 VAL 72 7.242 -2.473 8.269
95 HG23 VAL 72 2HG2 VAL 72 8.917 -2.006 7.975
96 H PHE 73 H PHE 73 4.483 -0.695 5.694
97 HA PHE 73 HA PHE 73 5.052 0.411 3.064
98 HB2 PHE 73 1HB PHE 73 3.351 -1.367 3.508
99 HB3 PHE 73 2HB PHE 73 2.392 -0.179 4.389
100 HD1 PHE 73 2HD PHE 73 4.018 -0.758 1.068
101 HD2 PHE 73 1HD PHE 73 0.861 1.171 3.246
102 HE1 PHE 73 2HE PHE 73 3.014 0.008 -1.064
103 HE2 PHE 73 1HE PHE 73 -0.144 1.938 1.114
104 HZ PHE 73 HZ PHE 73 0.935 1.360 -1.043
105 H TYR 74 H TYR 74 2.927 1.486 5.745
106 HA TYR 74 HA TYR 74 2.334 4.018 4.587
107 HB2 TYR 74 1HB TYR 74 2.342 3.048 7.448
108 HB3 TYR 74 2HB TYR 74 1.916 4.711 7.043
109 HD1 TYR 74 2HD TYR 74 0.245 4.851 4.898
110 HD2 TYR 74 1HD TYR 74 0.569 1.555 7.636
111 HE1 TYR 74 2HE TYR 74 -2.046 4.124 4.295
112 HE2 TYR 74 1HE TYR 74 -1.725 0.830 7.034
113 HH TYR 74 HH TYR 74 -3.243 1.200 4.808
114 H GLU 75 H GLU 75 5.248 2.868 5.995
115 HA GLU 75 HA GLU 75 6.274 5.467 6.816
116 HB2 GLU 75 1HB GLU 75 7.063 2.814 7.151
117 HB3 GLU 75 2HB GLU 75 8.295 3.491 6.084
118 HG2 GLU 75 1HG GLU 75 8.989 3.864 8.379
119 HG3 GLU 75 2HG GLU 75 8.525 5.418 7.681
120 H LEU 76 H LEU 76 5.554 4.207 3.824
121 HA LEU 76 HA LEU 76 7.869 5.405 2.441
122 HB2 LEU 76 1HB LEU 76 5.462 3.850 1.478
123 HB3 LEU 76 2HB LEU 76 6.654 4.545 0.381
124 HG LEU 76 HG LEU 76 7.329 2.623 2.627
125 HD11 LEU 76 1HD1 LEU 76 6.606 2.210 -0.253
126 HD12 LEU 76 2HD1 LEU 76 6.188 1.234 1.154
127 HD13 LEU 76 3HD1 LEU 76 7.816 1.159 0.481
128 HD21 LEU 76 3HD2 LEU 76 9.381 2.463 0.906
129 HD22 LEU 76 1HD2 LEU 76 9.338 3.672 2.190
130 HD23 LEU 76 2HD2 LEU 76 8.873 4.112 0.547
131 HA PRO 77 HA PRO 77 5.957 9.328 1.564
132 HB2 PRO 77 1HB PRO 77 6.607 9.021 -1.294
133 HB3 PRO 77 2HB PRO 77 7.151 10.251 -0.144
134 HG2 PRO 77 1HG PRO 77 8.697 8.212 -1.117
135 HG3 PRO 77 2HG PRO 77 9.010 9.104 0.377
136 HD2 PRO 77 1HD PRO 77 8.112 6.331 0.041
137 HD3 PRO 77 2HD PRO 77 8.765 7.147 1.479
138 H GLU 78 H GLU 78 4.115 10.257 0.408
139 HA GLU 78 HA GLU 78 1.960 8.432 -0.049
140 HB2 GLU 78 1HB GLU 78 1.850 11.100 -1.347
141 HB3 GLU 78 2HB GLU 78 0.675 10.305 -0.299
142 HG2 GLU 78 1HG GLU 78 3.192 11.771 0.501
143 HG3 GLU 78 2HG GLU 78 1.534 12.104 0.996
144 H ALA 79 H ALA 79 3.907 10.336 -2.391
145 HA ALA 79 HA ALA 79 2.664 9.477 -4.748
146 HB1 ALA 79 1HB ALA 79 4.923 10.937 -4.170
147 HB2 ALA 79 2HB ALA 79 4.429 10.463 -5.795
148 HB3 ALA 79 3HB ALA 79 5.609 9.492 -4.914
149 H VAL 80 H VAL 80 5.005 7.759 -2.731
150 HA VAL 80 HA VAL 80 5.269 5.511 -4.582
151 HB VAL 80 HB VAL 80 6.024 5.917 -1.675
152 HG11 VAL 80 1HG1 VAL 80 5.599 3.582 -1.844
153 HG12 VAL 80 2HG1 VAL 80 7.339 3.750 -2.076
154 HG13 VAL 80 3HG1 VAL 80 6.284 3.497 -3.467
155 HG21 VAL 80 3HG2 VAL 80 7.343 7.137 -3.396
156 HG22 VAL 80 1HG2 VAL 80 7.676 5.605 -4.205
157 HG23 VAL 80 2HG2 VAL 80 8.308 5.902 -2.585
158 H GLN 81 H GLN 81 3.341 6.329 -1.758
159 HA GLN 81 HA GLN 81 2.151 3.776 -1.276
160 HB2 GLN 81 1HB GLN 81 2.008 5.775 0.232
161 HB3 GLN 81 2HB GLN 81 0.883 6.503 -0.908
162 HG2 GLN 81 1HG GLN 81 -0.836 5.232 -0.180
163 HG3 GLN 81 2HG GLN 81 0.138 3.762 -0.219
164 HE21 GLN 81 1HE2 GLN 81 2.193 4.508 1.623
165 HE22 GLN 81 2HE2 GLN 81 1.502 4.701 3.157
166 H LYS 82 H LYS 82 1.085 6.516 -3.296
167 HA LYS 82 HA LYS 82 -1.309 5.291 -4.262
168 HB2 LYS 82 1HB LYS 82 0.420 7.575 -5.116
169 HB3 LYS 82 2HB LYS 82 -0.775 6.962 -6.259
170 HG2 LYS 82 1HG LYS 82 -1.805 8.732 -4.959
171 HG3 LYS 82 2HG LYS 82 -2.520 7.199 -4.465
172 HD2 LYS 82 1HD LYS 82 -1.235 7.126 -2.460
173 HD3 LYS 82 2HD LYS 82 -0.160 8.410 -3.016
174 HE2 LYS 82 1HE LYS 82 -1.548 10.014 -2.253
175 HE3 LYS 82 2HE LYS 82 -2.940 9.270 -3.040
176 HZ1 LYS 82 3HZ LYS 82 -3.440 8.036 -1.205
177 HZ2 LYS 82 1HZ LYS 82 -2.787 9.409 -0.453
178 HZ3 LYS 82 2HZ LYS 82 -1.841 8.008 -0.630
179 H GLU 83 H GLU 83 1.944 5.517 -5.781
180 HA GLU 83 HA GLU 83 1.246 4.069 -8.125
181 HB2 GLU 83 1HB GLU 83 3.902 4.286 -6.674
182 HB3 GLU 83 2HB GLU 83 3.713 3.564 -8.272
183 HG2 GLU 83 1HG GLU 83 2.653 5.732 -9.025
184 HG3 GLU 83 2HG GLU 83 3.124 6.425 -7.476
185 H LEU 84 H LEU 84 2.397 2.895 -4.961
186 HA LEU 84 HA LEU 84 2.508 0.140 -5.850
187 HB2 LEU 84 1HB LEU 84 2.383 1.365 -3.077
188 HB3 LEU 84 2HB LEU 84 2.591 -0.360 -3.374
189 HG LEU 84 HG LEU 84 4.424 1.801 -4.454
190 HD11 LEU 84 1HD1 LEU 84 4.957 -0.185 -2.228
191 HD12 LEU 84 2HD1 LEU 84 4.498 1.495 -1.948
192 HD13 LEU 84 3HD1 LEU 84 6.012 1.120 -2.769
193 HD21 LEU 84 3HD2 LEU 84 4.900 0.090 -5.888
194 HD22 LEU 84 1HD2 LEU 84 4.157 -1.121 -4.844
195 HD23 LEU 84 2HD2 LEU 84 5.796 -0.561 -4.517
196 H LEU 85 H LEU 85 0.030 2.170 -4.345
197 HA LEU 85 HA LEU 85 -1.812 -0.021 -3.891
198 HB2 LEU 85 1HB LEU 85 -2.188 2.981 -4.081
199 HB3 LEU 85 2HB LEU 85 -3.526 1.877 -3.766
200 HG LEU 85 HG LEU 85 -1.007 1.859 -2.095
201 HD11 LEU 85 1HD1 LEU 85 -1.950 4.111 -1.958
202 HD12 LEU 85 2HD1 LEU 85 -2.272 3.241 -0.459
203 HD13 LEU 85 3HD1 LEU 85 -3.554 3.443 -1.653
204 HD21 LEU 85 3HD2 LEU 85 -3.475 1.203 -0.754
205 HD22 LEU 85 1HD2 LEU 85 -2.054 0.195 -1.005
206 HD23 LEU 85 2HD2 LEU 85 -3.328 0.232 -2.219
207 H ALA 86 H ALA 86 -1.224 2.230 -6.564
208 HA ALA 86 HA ALA 86 -3.523 1.539 -8.119
209 HB1 ALA 86 1HB ALA 86 -2.171 3.489 -8.690
210 HB2 ALA 86 2HB ALA 86 -2.164 2.372 -10.056
211 HB3 ALA 86 3HB ALA 86 -0.765 2.467 -8.986
212 H GLU 87 H GLU 87 -0.343 0.065 -7.744
213 HA GLU 87 HA GLU 87 -0.718 -1.879 -9.894
214 HB2 GLU 87 1HB GLU 87 1.548 -1.342 -9.192
215 HB3 GLU 87 2HB GLU 87 1.182 -1.792 -7.526
216 HG2 GLU 87 1HG GLU 87 1.139 -4.072 -8.006
217 HG3 GLU 87 2HG GLU 87 0.767 -3.808 -9.711
218 H TRP 88 H TRP 88 -1.264 -1.802 -6.405
219 HA TRP 88 HA TRP 88 -1.982 -4.582 -6.126
220 HB2 TRP 88 1HB TRP 88 -2.828 -2.151 -4.518
221 HB3 TRP 88 2HB TRP 88 -3.092 -3.822 -4.031
222 HD1 TRP 88 HD TRP 88 0.108 -4.092 -5.580
223 HE1 TRP 88 1HE TRP 88 2.038 -3.829 -3.892
224 HE3 TRP 88 3HE TRP 88 -2.401 -1.970 -1.666
225 HZ2 TRP 88 2HZ TRP 88 2.472 -2.833 -1.261
226 HZ3 TRP 88 3HZ TRP 88 -1.197 -1.373 0.417
227 HH2 TRP 88 HH TRP 88 1.232 -1.803 0.622
228 H LYS 89 H LYS 89 -3.767 -1.639 -6.935
229 HA LYS 89 HA LYS 89 -6.383 -2.833 -6.864
230 HB2 LYS 89 1HB LYS 89 -5.791 -0.331 -6.911
231 HB3 LYS 89 2HB LYS 89 -5.566 -0.532 -8.648
232 HG2 LYS 89 1HG LYS 89 -7.901 -1.520 -8.730
233 HG3 LYS 89 2HG LYS 89 -8.096 -1.004 -7.055
234 HD2 LYS 89 1HD LYS 89 -7.690 1.317 -7.680
235 HD3 LYS 89 2HD LYS 89 -7.368 0.841 -9.347
236 HE2 LYS 89 1HE LYS 89 -9.786 1.688 -8.568
237 HE3 LYS 89 2HE LYS 89 -9.589 0.457 -9.816
238 HZ1 LYS 89 3HZ LYS 89 -9.804 -0.250 -6.952
239 HZ2 LYS 89 1HZ LYS 89 -10.037 -1.246 -8.304
240 HZ3 LYS 89 2HZ LYS 89 -11.181 -0.049 -7.926
241 H ARG 90 H ARG 90 -3.946 -2.486 -9.439
242 HA ARG 90 HA ARG 90 -5.600 -3.422 -11.560
243 HB2 ARG 90 1HB ARG 90 -2.648 -3.323 -11.067
244 HB3 ARG 90 2HB ARG 90 -3.226 -4.348 -12.381
245 HG2 ARG 90 1HG ARG 90 -4.187 -2.532 -13.538
246 HG3 ARG 90 2HG ARG 90 -4.183 -1.503 -12.106
247 HD2 ARG 90 1HD ARG 90 -2.370 -1.078 -13.915
248 HD3 ARG 90 2HD ARG 90 -1.860 -1.133 -12.227
249 HE ARG 90 HE ARG 90 -0.742 -3.185 -12.672
250 HH11 ARG 90 1HH2 ARG 90 -2.776 -2.153 -15.257
251 HH12 ARG 90 2HH2 ARG 90 -2.165 -3.321 -16.381
252 HH21 ARG 90 1HH1 ARG 90 0.066 -4.719 -14.122
253 HH22 ARG 90 2HH1 ARG 90 -0.555 -4.774 -15.739
254 H THR 91 H THR 91 -3.572 -5.174 -9.214
255 HA THR 91 HA THR 91 -4.342 -7.793 -10.287
256 HB THR 91 HB THR 91 -3.391 -8.525 -7.972
257 HG1 THR 91 1HG THR 91 -3.630 -6.253 -7.239
258 HG21 THR 91 3HG2 THR 91 -1.935 -7.259 -10.260
259 HG22 THR 91 1HG2 THR 91 -1.954 -8.945 -9.740
260 HG23 THR 91 2HG2 THR 91 -1.012 -7.756 -8.842
261 H GLY 92 H GLY 92 -5.258 -5.726 -7.581
262 HA2 GLY 92 1HA GLY 92 -7.569 -5.562 -6.813
263 HA3 GLY 92 2HA GLY 92 -7.837 -7.207 -7.390
Start of MODEL 8
1 H LYS 61 H LYS 61 -11.960 -0.148 2.473
2 HA LYS 61 HA LYS 61 -10.479 -1.688 4.525
3 HB2 LYS 61 1HB LYS 61 -12.677 -2.423 3.272
4 HB3 LYS 61 2HB LYS 61 -11.559 -2.885 1.988
5 HG2 LYS 61 1HG LYS 61 -10.360 -4.369 3.468
6 HG3 LYS 61 2HG LYS 61 -11.262 -3.788 4.867
7 HD2 LYS 61 1HD LYS 61 -13.359 -4.651 3.835
8 HD3 LYS 61 2HD LYS 61 -12.404 -5.310 2.506
9 HE2 LYS 61 1HE LYS 61 -12.349 -7.179 3.815
10 HE3 LYS 61 2HE LYS 61 -11.043 -6.320 4.633
11 HZ1 LYS 61 3HZ LYS 61 -13.911 -6.268 5.402
12 HZ2 LYS 61 1HZ LYS 61 -12.673 -5.405 6.174
13 HZ3 LYS 61 2HZ LYS 61 -12.675 -7.104 6.214
14 H ILE 62 H ILE 62 -8.293 -1.801 4.285
15 HA ILE 62 HA ILE 62 -7.156 -1.521 1.544
16 HB ILE 62 HB ILE 62 -5.832 -1.294 4.261
17 HG12 ILE 62 1HG1 ILE 62 -6.472 0.818 2.176
18 HG13 ILE 62 2HG1 ILE 62 -7.413 0.549 3.644
19 HG21 ILE 62 1HG2 ILE 62 -4.216 -2.088 2.657
20 HG22 ILE 62 2HG2 ILE 62 -3.940 -0.359 2.858
21 HG23 ILE 62 3HG2 ILE 62 -4.793 -0.955 1.435
22 HD11 ILE 62 3HD1 ILE 62 -5.899 1.620 4.938
23 HD12 ILE 62 1HD1 ILE 62 -5.234 2.244 3.429
24 HD13 ILE 62 2HD1 ILE 62 -4.542 0.801 4.168
25 H THR 63 H THR 63 -5.720 -3.060 0.729
26 HA THR 63 HA THR 63 -5.453 -5.598 2.297
27 HB THR 63 HB THR 63 -5.619 -6.793 0.097
28 HG1 THR 63 1HG THR 63 -5.957 -5.692 -1.682
29 HG21 THR 63 3HG2 THR 63 -8.111 -6.364 -0.178
30 HG22 THR 63 1HG2 THR 63 -7.938 -5.095 1.035
31 HG23 THR 63 2HG2 THR 63 -7.587 -6.772 1.456
32 H PHE 64 H PHE 64 -3.330 -5.839 2.751
33 HA PHE 64 HA PHE 64 -1.323 -4.702 0.888
34 HB2 PHE 64 1HB PHE 64 -0.914 -5.916 3.635
35 HB3 PHE 64 2HB PHE 64 0.267 -4.992 2.708
36 HD1 PHE 64 1HD PHE 64 -0.413 -2.581 2.021
37 HD2 PHE 64 2HD PHE 64 -2.345 -4.814 5.136
38 HE1 PHE 64 1HE PHE 64 -1.280 -0.470 2.992
39 HE2 PHE 64 2HE PHE 64 -3.216 -2.706 6.109
40 HZ PHE 64 HZ PHE 64 -2.685 -0.533 5.036
41 HA PRO 65 HA PRO 65 -0.491 -8.717 -0.989
42 HB2 PRO 65 1HB PRO 65 2.346 -7.859 -0.725
43 HB3 PRO 65 2HB PRO 65 1.477 -8.475 -2.140
44 HG2 PRO 65 1HG PRO 65 2.073 -5.880 -1.826
45 HG3 PRO 65 2HG PRO 65 0.627 -6.437 -2.677
46 HD2 PRO 65 1HD PRO 65 0.834 -5.107 -0.049
47 HD3 PRO 65 2HD PRO 65 -0.559 -5.250 -1.140
48 H SER 66 H SER 66 0.450 -10.744 -0.362
49 HA SER 66 HA SER 66 0.677 -11.268 2.443
50 HB2 SER 66 1HB SER 66 1.163 -12.782 -0.075
51 HB3 SER 66 2HB SER 66 1.924 -13.397 1.390
52 HG SER 66 HG SER 66 -0.710 -13.361 0.642
53 H ASP 67 H ASP 67 2.828 -9.600 0.534
54 HA ASP 67 HA ASP 67 5.123 -10.453 2.266
55 HB2 ASP 67 1HB ASP 67 4.904 -10.283 -0.627
56 HB3 ASP 67 2HB ASP 67 6.222 -9.282 -0.018
57 H ILE 68 H ILE 68 3.021 -8.065 2.175
58 HA ILE 68 HA ILE 68 5.084 -5.909 2.429
59 HB ILE 68 HB ILE 68 2.182 -5.798 1.637
60 HG12 ILE 68 1HG1 ILE 68 3.791 -6.198 -0.179
61 HG13 ILE 68 2HG1 ILE 68 3.104 -4.582 -0.315
62 HG21 ILE 68 1HG2 ILE 68 3.978 -3.642 2.718
63 HG22 ILE 68 2HG2 ILE 68 2.293 -3.981 3.109
64 HG23 ILE 68 3HG2 ILE 68 2.708 -3.248 1.560
65 HD11 ILE 68 3HD1 ILE 68 5.885 -5.410 0.340
66 HD12 ILE 68 1HD1 ILE 68 5.263 -3.997 1.191
67 HD13 ILE 68 2HD1 ILE 68 5.311 -4.013 -0.570
68 H ASP 69 H ASP 69 5.411 -5.102 4.359
69 HA ASP 69 HA ASP 69 3.661 -5.859 6.609
70 HB2 ASP 69 1HB ASP 69 6.128 -5.932 6.871
71 HB3 ASP 69 2HB ASP 69 6.200 -4.197 6.574
72 HA PRO 70 HA PRO 70 1.336 -2.066 6.238
73 HB2 PRO 70 1HB PRO 70 0.354 -1.893 8.805
74 HB3 PRO 70 2HB PRO 70 -0.312 -2.954 7.550
75 HG2 PRO 70 1HG PRO 70 1.504 -3.601 9.809
76 HG3 PRO 70 2HG PRO 70 0.180 -4.549 9.111
77 HD2 PRO 70 1HD PRO 70 2.811 -5.070 8.585
78 HD3 PRO 70 2HD PRO 70 1.509 -5.420 7.430
79 H GLN 71 H GLN 71 3.486 -2.343 9.075
80 HA GLN 71 HA GLN 71 3.546 0.545 9.506
81 HB2 GLN 71 1HB GLN 71 3.977 -1.252 11.276
82 HB3 GLN 71 2HB GLN 71 5.542 -1.504 10.501
83 HG2 GLN 71 1HG GLN 71 6.086 0.072 12.120
84 HG3 GLN 71 2HG GLN 71 5.749 1.106 10.732
85 HE21 GLN 71 1HE2 GLN 71 4.714 2.923 11.617
86 HE22 GLN 71 2HE2 GLN 71 3.372 2.851 12.653
87 H VAL 72 H VAL 72 5.379 -1.740 7.591
88 HA VAL 72 HA VAL 72 7.525 0.205 7.106
89 HB VAL 72 HB VAL 72 6.978 -2.334 5.551
90 HG11 VAL 72 1HG1 VAL 72 8.633 -0.879 4.546
91 HG12 VAL 72 2HG1 VAL 72 9.475 -2.236 5.295
92 HG13 VAL 72 3HG1 VAL 72 9.446 -0.664 6.096
93 HG21 VAL 72 3HG2 VAL 72 8.708 -2.049 8.026
94 HG22 VAL 72 1HG2 VAL 72 8.325 -3.534 7.155
95 HG23 VAL 72 2HG2 VAL 72 7.068 -2.698 8.066
96 H PHE 73 H PHE 73 4.458 -0.647 5.719
97 HA PHE 73 HA PHE 73 4.984 0.494 3.087
98 HB2 PHE 73 1HB PHE 73 3.295 -1.303 3.528
99 HB3 PHE 73 2HB PHE 73 2.339 -0.127 4.430
100 HD1 PHE 73 2HD PHE 73 3.994 -0.578 1.094
101 HD2 PHE 73 1HD PHE 73 0.744 1.149 3.305
102 HE1 PHE 73 2HE PHE 73 2.979 0.219 -1.022
103 HE2 PHE 73 1HE PHE 73 -0.273 1.945 1.190
104 HZ PHE 73 HZ PHE 73 0.844 1.480 -0.975
105 H TYR 74 H TYR 74 2.906 1.513 5.830
106 HA TYR 74 HA TYR 74 2.262 4.051 4.720
107 HB2 TYR 74 1HB TYR 74 2.404 3.081 7.580
108 HB3 TYR 74 2HB TYR 74 1.929 4.732 7.188
109 HD1 TYR 74 2HD TYR 74 0.157 4.795 5.088
110 HD2 TYR 74 1HD TYR 74 0.670 1.592 7.906
111 HE1 TYR 74 2HE TYR 74 -2.149 4.012 4.620
112 HE2 TYR 74 1HE TYR 74 -1.636 0.811 7.439
113 HH TYR 74 HH TYR 74 -3.484 1.142 6.270
114 H GLU 75 H GLU 75 5.234 2.928 6.041
115 HA GLU 75 HA GLU 75 6.242 5.570 6.773
116 HB2 GLU 75 1HB GLU 75 7.173 2.810 6.868
117 HB3 GLU 75 2HB GLU 75 8.431 3.903 6.291
118 HG2 GLU 75 1HG GLU 75 7.978 5.388 8.254
119 HG3 GLU 75 2HG GLU 75 6.833 4.186 8.853
120 H LEU 76 H LEU 76 5.493 4.189 3.848
121 HA LEU 76 HA LEU 76 7.806 5.273 2.375
122 HB2 LEU 76 1HB LEU 76 5.284 3.847 1.481
123 HB3 LEU 76 2HB LEU 76 6.544 4.388 0.374
124 HG LEU 76 HG LEU 76 7.050 2.528 2.714
125 HD11 LEU 76 1HD1 LEU 76 5.504 1.601 0.923
126 HD12 LEU 76 2HD1 LEU 76 7.001 0.698 1.157
127 HD13 LEU 76 3HD1 LEU 76 6.837 1.793 -0.216
128 HD21 LEU 76 3HD2 LEU 76 9.201 3.015 2.216
129 HD22 LEU 76 1HD2 LEU 76 8.727 3.932 0.786
130 HD23 LEU 76 2HD2 LEU 76 8.950 2.186 0.680
131 HA PRO 77 HA PRO 77 6.066 9.251 1.493
132 HB2 PRO 77 1HB PRO 77 6.625 9.118 -1.346
133 HB3 PRO 77 2HB PRO 77 7.447 10.067 -0.101
134 HG2 PRO 77 1HG PRO 77 8.367 7.730 -1.419
135 HG3 PRO 77 2HG PRO 77 9.175 8.666 -0.159
136 HD2 PRO 77 1HD PRO 77 8.056 6.054 0.076
137 HD3 PRO 77 2HD PRO 77 8.775 7.043 1.360
138 H GLU 78 H GLU 78 4.265 10.281 0.334
139 HA GLU 78 HA GLU 78 2.027 8.547 -0.074
140 HB2 GLU 78 1HB GLU 78 2.203 11.304 -1.275
141 HB3 GLU 78 2HB GLU 78 0.808 10.495 -0.559
142 HG2 GLU 78 1HG GLU 78 2.346 10.507 1.608
143 HG3 GLU 78 2HG GLU 78 3.097 11.875 0.786
144 H ALA 79 H ALA 79 4.042 10.330 -2.456
145 HA ALA 79 HA ALA 79 2.705 9.490 -4.776
146 HB1 ALA 79 1HB ALA 79 5.272 10.639 -4.139
147 HB2 ALA 79 2HB ALA 79 4.359 10.749 -5.644
148 HB3 ALA 79 3HB ALA 79 5.472 9.405 -5.384
149 H VAL 80 H VAL 80 5.009 7.715 -2.775
150 HA VAL 80 HA VAL 80 5.186 5.458 -4.638
151 HB VAL 80 HB VAL 80 5.998 5.792 -1.733
152 HG11 VAL 80 1HG1 VAL 80 7.422 3.666 -2.783
153 HG12 VAL 80 2HG1 VAL 80 5.809 3.424 -3.453
154 HG13 VAL 80 3HG1 VAL 80 6.032 3.529 -1.707
155 HG21 VAL 80 3HG2 VAL 80 7.299 7.134 -3.332
156 HG22 VAL 80 1HG2 VAL 80 7.582 5.703 -4.321
157 HG23 VAL 80 2HG2 VAL 80 8.282 5.810 -2.706
158 H GLN 81 H GLN 81 3.356 6.336 -1.766
159 HA GLN 81 HA GLN 81 2.123 3.814 -1.237
160 HB2 GLN 81 1HB GLN 81 2.063 5.837 0.258
161 HB3 GLN 81 2HB GLN 81 0.909 6.565 -0.854
162 HG2 GLN 81 1HG GLN 81 -0.803 5.249 -0.142
163 HG3 GLN 81 2HG GLN 81 0.225 3.821 -0.004
164 HE21 GLN 81 1HE2 GLN 81 2.160 4.600 1.819
165 HE22 GLN 81 2HE2 GLN 81 1.451 5.021 3.299
166 H LYS 82 H LYS 82 1.056 6.571 -3.235
167 HA LYS 82 HA LYS 82 -1.379 5.375 -4.148
168 HB2 LYS 82 1HB LYS 82 0.350 7.655 -5.009
169 HB3 LYS 82 2HB LYS 82 -0.864 7.062 -6.143
170 HG2 LYS 82 1HG LYS 82 -1.856 8.830 -4.805
171 HG3 LYS 82 2HG LYS 82 -2.587 7.296 -4.335
172 HD2 LYS 82 1HD LYS 82 -1.028 7.147 -2.420
173 HD3 LYS 82 2HD LYS 82 -0.322 8.695 -2.883
174 HE2 LYS 82 1HE LYS 82 -2.200 9.900 -2.247
175 HE3 LYS 82 2HE LYS 82 -3.288 8.535 -2.494
176 HZ1 LYS 82 3HZ LYS 82 -1.842 7.537 -0.562
177 HZ2 LYS 82 1HZ LYS 82 -3.168 8.544 -0.238
178 HZ3 LYS 82 2HZ LYS 82 -1.593 9.177 -0.197
179 H GLU 83 H GLU 83 1.842 5.597 -5.725
180 HA GLU 83 HA GLU 83 1.096 4.175 -8.070
181 HB2 GLU 83 1HB GLU 83 3.767 4.464 -6.672
182 HB3 GLU 83 2HB GLU 83 3.583 3.671 -8.236
183 HG2 GLU 83 1HG GLU 83 2.395 5.813 -9.000
184 HG3 GLU 83 2HG GLU 83 3.038 6.557 -7.538
185 H LEU 84 H LEU 84 2.335 2.970 -4.950
186 HA LEU 84 HA LEU 84 2.476 0.235 -5.890
187 HB2 LEU 84 1HB LEU 84 2.337 1.385 -3.082
188 HB3 LEU 84 2HB LEU 84 2.618 -0.320 -3.437
189 HG LEU 84 HG LEU 84 4.352 1.960 -4.438
190 HD11 LEU 84 1HD1 LEU 84 4.528 1.623 -1.984
191 HD12 LEU 84 2HD1 LEU 84 6.007 1.143 -2.816
192 HD13 LEU 84 3HD1 LEU 84 4.873 -0.085 -2.258
193 HD21 LEU 84 3HD2 LEU 84 4.237 -0.976 -4.911
194 HD22 LEU 84 1HD2 LEU 84 5.842 -0.287 -4.667
195 HD23 LEU 84 2HD2 LEU 84 4.814 0.311 -5.969
196 H LEU 85 H LEU 85 -0.004 2.211 -4.349
197 HA LEU 85 HA LEU 85 -1.831 0.020 -3.868
198 HB2 LEU 85 1HB LEU 85 -2.171 3.019 -4.083
199 HB3 LEU 85 2HB LEU 85 -3.553 1.951 -3.844
200 HG LEU 85 HG LEU 85 -1.117 1.841 -2.057
201 HD11 LEU 85 1HD1 LEU 85 -2.138 4.140 -2.060
202 HD12 LEU 85 2HD1 LEU 85 -2.243 3.319 -0.504
203 HD13 LEU 85 3HD1 LEU 85 -3.660 3.411 -1.549
204 HD21 LEU 85 3HD2 LEU 85 -3.477 0.287 -2.314
205 HD22 LEU 85 1HD2 LEU 85 -3.666 1.241 -0.844
206 HD23 LEU 85 2HD2 LEU 85 -2.266 0.192 -1.040
207 H ALA 86 H ALA 86 -1.210 2.170 -6.608
208 HA ALA 86 HA ALA 86 -3.524 1.409 -8.131
209 HB1 ALA 86 1HB ALA 86 -0.973 2.101 -9.526
210 HB2 ALA 86 2HB ALA 86 -1.689 3.324 -8.476
211 HB3 ALA 86 3HB ALA 86 -2.611 2.680 -9.833
212 H GLU 87 H GLU 87 -0.266 0.067 -7.818
213 HA GLU 87 HA GLU 87 -0.594 -1.898 -9.943
214 HB2 GLU 87 1HB GLU 87 1.658 -1.297 -9.232
215 HB3 GLU 87 2HB GLU 87 1.301 -1.778 -7.573
216 HG2 GLU 87 1HG GLU 87 1.374 -4.040 -8.063
217 HG3 GLU 87 2HG GLU 87 0.904 -3.796 -9.747
218 H TRP 88 H TRP 88 -1.150 -1.851 -6.456
219 HA TRP 88 HA TRP 88 -1.784 -4.647 -6.175
220 HB2 TRP 88 1HB TRP 88 -2.793 -2.252 -4.607
221 HB3 TRP 88 2HB TRP 88 -2.967 -3.933 -4.115
222 HD1 TRP 88 HD TRP 88 0.279 -4.023 -5.578
223 HE1 TRP 88 1HE TRP 88 2.148 -3.623 -3.840
224 HE3 TRP 88 3HE TRP 88 -2.451 -2.022 -1.745
225 HZ2 TRP 88 2HZ TRP 88 2.455 -2.585 -1.214
226 HZ3 TRP 88 3HZ TRP 88 -1.339 -1.335 0.360
227 HH2 TRP 88 HH TRP 88 1.110 -1.614 0.630
228 H LYS 89 H LYS 89 -3.646 -1.789 -7.077
229 HA LYS 89 HA LYS 89 -6.221 -3.094 -7.057
230 HB2 LYS 89 1HB LYS 89 -6.138 -0.684 -6.941
231 HB3 LYS 89 2HB LYS 89 -5.227 -0.591 -8.448
232 HG2 LYS 89 1HG LYS 89 -7.080 -1.204 -9.755
233 HG3 LYS 89 2HG LYS 89 -7.931 -1.914 -8.383
234 HD2 LYS 89 1HD LYS 89 -7.293 0.962 -8.109
235 HD3 LYS 89 2HD LYS 89 -8.465 0.570 -9.367
236 HE2 LYS 89 1HE LYS 89 -8.687 -0.529 -6.560
237 HE3 LYS 89 2HE LYS 89 -9.428 0.999 -7.037
238 HZ1 LYS 89 3HZ LYS 89 -10.767 -0.079 -8.617
239 HZ2 LYS 89 1HZ LYS 89 -10.870 -1.035 -7.220
240 HZ3 LYS 89 2HZ LYS 89 -9.883 -1.527 -8.512
241 H ARG 90 H ARG 90 -3.728 -2.683 -9.577
242 HA ARG 90 HA ARG 90 -5.382 -3.580 -11.725
243 HB2 ARG 90 1HB ARG 90 -2.595 -2.931 -11.305
244 HB3 ARG 90 2HB ARG 90 -2.735 -4.406 -12.263
245 HG2 ARG 90 1HG ARG 90 -2.737 -2.384 -13.695
246 HG3 ARG 90 2HG ARG 90 -4.253 -3.276 -13.818
247 HD2 ARG 90 1HD ARG 90 -5.436 -1.531 -13.027
248 HD3 ARG 90 2HD ARG 90 -4.348 -1.345 -11.651
249 HE ARG 90 HE ARG 90 -3.421 0.475 -12.803
250 HH11 ARG 90 1HH2 ARG 90 -4.716 -1.866 -14.977
251 HH12 ARG 90 2HH2 ARG 90 -4.281 -0.980 -16.401
252 HH21 ARG 90 1HH1 ARG 90 -2.841 1.643 -14.649
253 HH22 ARG 90 2HH1 ARG 90 -3.219 1.006 -16.214
254 H THR 91 H THR 91 -3.147 -5.356 -9.561
255 HA THR 91 HA THR 91 -4.130 -7.910 -10.727
256 HB THR 91 HB THR 91 -2.308 -8.950 -9.685
257 HG1 THR 91 1HG THR 91 -2.739 -6.973 -7.797
258 HG21 THR 91 3HG2 THR 91 -1.664 -7.100 -11.332
259 HG22 THR 91 1HG2 THR 91 -0.394 -7.648 -10.238
260 HG23 THR 91 2HG2 THR 91 -1.241 -6.135 -9.918
261 H GLY 92 H GLY 92 -4.070 -6.176 -7.628
262 HA2 GLY 92 1HA GLY 92 -5.904 -6.212 -6.051
263 HA3 GLY 92 2HA GLY 92 -6.508 -7.673 -6.833
Start of MODEL 9
1 H LYS 61 H LYS 61 -12.201 -0.645 2.051
2 HA LYS 61 HA LYS 61 -10.758 -2.181 4.129
3 HB2 LYS 61 1HB LYS 61 -12.806 -3.079 2.911
4 HB3 LYS 61 2HB LYS 61 -11.795 -3.188 1.469
5 HG2 LYS 61 1HG LYS 61 -10.185 -4.410 3.288
6 HG3 LYS 61 2HG LYS 61 -11.772 -4.850 3.920
7 HD2 LYS 61 1HD LYS 61 -10.769 -5.310 1.095
8 HD3 LYS 61 2HD LYS 61 -11.054 -6.546 2.322
9 HE2 LYS 61 1HE LYS 61 -13.116 -6.713 1.383
10 HE3 LYS 61 2HE LYS 61 -13.468 -5.235 2.278
11 HZ1 LYS 61 3HZ LYS 61 -13.675 -4.143 0.380
12 HZ2 LYS 61 1HZ LYS 61 -13.439 -5.587 -0.477
13 HZ3 LYS 61 2HZ LYS 61 -12.111 -4.594 -0.105
14 H ILE 62 H ILE 62 -8.546 -2.167 4.015
15 HA ILE 62 HA ILE 62 -7.285 -1.767 1.343
16 HB ILE 62 HB ILE 62 -6.230 -1.395 4.158
17 HG12 ILE 62 1HG1 ILE 62 -6.548 0.589 1.889
18 HG13 ILE 62 2HG1 ILE 62 -7.776 0.340 3.130
19 HG21 ILE 62 1HG2 ILE 62 -4.862 -1.391 1.472
20 HG22 ILE 62 2HG2 ILE 62 -4.345 -2.163 2.971
21 HG23 ILE 62 3HG2 ILE 62 -4.242 -0.410 2.801
22 HD11 ILE 62 3HD1 ILE 62 -4.918 1.251 3.565
23 HD12 ILE 62 1HD1 ILE 62 -6.036 0.844 4.867
24 HD13 ILE 62 2HD1 ILE 62 -6.381 2.208 3.803
25 H THR 63 H THR 63 -5.744 -3.235 0.593
26 HA THR 63 HA THR 63 -5.393 -5.742 2.198
27 HB THR 63 HB THR 63 -5.772 -5.541 -0.805
28 HG1 THR 63 1HG THR 63 -7.459 -6.180 1.347
29 HG21 THR 63 3HG2 THR 63 -5.979 -8.073 -0.507
30 HG22 THR 63 1HG2 THR 63 -5.291 -7.836 1.099
31 HG23 THR 63 2HG2 THR 63 -4.358 -7.400 -0.333
32 H PHE 64 H PHE 64 -3.283 -5.945 2.692
33 HA PHE 64 HA PHE 64 -1.265 -4.708 0.904
34 HB2 PHE 64 1HB PHE 64 -0.894 -5.914 3.660
35 HB3 PHE 64 2HB PHE 64 0.280 -4.945 2.771
36 HD1 PHE 64 1HD PHE 64 -0.356 -2.541 2.157
37 HD2 PHE 64 2HD PHE 64 -2.522 -4.886 5.027
38 HE1 PHE 64 1HE PHE 64 -1.342 -0.471 3.102
39 HE2 PHE 64 2HE PHE 64 -3.507 -2.819 5.974
40 HZ PHE 64 HZ PHE 64 -2.919 -0.609 5.011
41 HA PRO 65 HA PRO 65 -0.255 -8.695 -0.955
42 HB2 PRO 65 1HB PRO 65 2.544 -7.737 -0.621
43 HB3 PRO 65 2HB PRO 65 1.734 -8.390 -2.055
44 HG2 PRO 65 1HG PRO 65 2.225 -5.776 -1.744
45 HG3 PRO 65 2HG PRO 65 0.812 -6.387 -2.615
46 HD2 PRO 65 1HD PRO 65 0.936 -5.047 0.017
47 HD3 PRO 65 2HD PRO 65 -0.432 -5.227 -1.102
48 H SER 66 H SER 66 0.794 -10.683 -0.335
49 HA SER 66 HA SER 66 0.961 -11.202 2.493
50 HB2 SER 66 1HB SER 66 1.646 -12.737 0.004
51 HB3 SER 66 2HB SER 66 2.131 -13.356 1.579
52 HG SER 66 HG SER 66 -0.042 -13.944 0.683
53 H ASP 67 H ASP 67 3.111 -9.534 0.568
54 HA ASP 67 HA ASP 67 5.404 -10.353 2.317
55 HB2 ASP 67 1HB ASP 67 5.377 -10.751 -0.338
56 HB3 ASP 67 2HB ASP 67 5.951 -9.083 -0.320
57 H ILE 68 H ILE 68 3.253 -7.985 2.172
58 HA ILE 68 HA ILE 68 5.286 -5.812 2.520
59 HB ILE 68 HB ILE 68 2.418 -5.716 1.602
60 HG12 ILE 68 1HG1 ILE 68 4.091 -6.136 -0.147
61 HG13 ILE 68 2HG1 ILE 68 3.422 -4.519 -0.323
62 HG21 ILE 68 1HG2 ILE 68 4.157 -3.579 2.784
63 HG22 ILE 68 2HG2 ILE 68 2.433 -3.870 3.014
64 HG23 ILE 68 3HG2 ILE 68 3.015 -3.156 1.509
65 HD11 ILE 68 3HD1 ILE 68 6.168 -5.354 0.453
66 HD12 ILE 68 1HD1 ILE 68 5.520 -3.925 1.255
67 HD13 ILE 68 2HD1 ILE 68 5.639 -3.969 -0.501
68 H ASP 69 H ASP 69 5.486 -4.969 4.462
69 HA ASP 69 HA ASP 69 3.638 -5.782 6.620
70 HB2 ASP 69 1HB ASP 69 6.091 -5.853 6.997
71 HB3 ASP 69 2HB ASP 69 6.167 -4.113 6.738
72 HA PRO 70 HA PRO 70 1.319 -1.989 6.215
73 HB2 PRO 70 1HB PRO 70 0.271 -1.852 8.769
74 HB3 PRO 70 2HB PRO 70 -0.387 -2.847 7.459
75 HG2 PRO 70 1HG PRO 70 1.307 -3.627 9.760
76 HG3 PRO 70 2HG PRO 70 0.019 -4.524 8.943
77 HD2 PRO 70 1HD PRO 70 2.682 -5.042 8.557
78 HD3 PRO 70 2HD PRO 70 1.439 -5.360 7.329
79 H GLN 71 H GLN 71 3.429 -2.325 9.064
80 HA GLN 71 HA GLN 71 3.474 0.562 9.560
81 HB2 GLN 71 1HB GLN 71 5.273 -1.677 10.555
82 HB3 GLN 71 2HB GLN 71 5.337 -0.009 11.125
83 HG2 GLN 71 1HG GLN 71 2.748 -0.387 11.536
84 HG3 GLN 71 2HG GLN 71 3.226 -2.086 11.581
85 HE21 GLN 71 1HE2 GLN 71 4.442 -2.825 13.407
86 HE22 GLN 71 2HE2 GLN 71 4.813 -1.830 14.731
87 H VAL 72 H VAL 72 5.295 -1.690 7.606
88 HA VAL 72 HA VAL 72 7.423 0.280 7.116
89 HB VAL 72 HB VAL 72 6.915 -2.299 5.613
90 HG11 VAL 72 1HG1 VAL 72 9.297 -2.153 5.119
91 HG12 VAL 72 2HG1 VAL 72 9.452 -0.721 6.136
92 HG13 VAL 72 3HG1 VAL 72 8.517 -0.644 4.643
93 HG21 VAL 72 3HG2 VAL 72 8.305 -3.431 7.217
94 HG22 VAL 72 1HG2 VAL 72 7.079 -2.572 8.147
95 HG23 VAL 72 2HG2 VAL 72 8.711 -1.918 8.026
96 H PHE 73 H PHE 73 4.355 -0.626 5.753
97 HA PHE 73 HA PHE 73 4.874 0.494 3.108
98 HB2 PHE 73 1HB PHE 73 3.203 -1.352 3.686
99 HB3 PHE 73 2HB PHE 73 2.194 -0.088 4.388
100 HD1 PHE 73 1HD PHE 73 4.183 -0.655 1.247
101 HD2 PHE 73 2HD PHE 73 0.554 0.803 3.019
102 HE1 PHE 73 1HE PHE 73 3.306 -0.100 -1.004
103 HE2 PHE 73 2HE PHE 73 -0.322 1.362 0.767
104 HZ PHE 73 HZ PHE 73 1.056 0.913 -1.245
105 H TYR 74 H TYR 74 2.702 1.469 5.791
106 HA TYR 74 HA TYR 74 2.040 4.005 4.689
107 HB2 TYR 74 1HB TYR 74 2.118 3.004 7.542
108 HB3 TYR 74 2HB TYR 74 1.621 4.651 7.156
109 HD1 TYR 74 2HD TYR 74 -0.141 4.807 5.140
110 HD2 TYR 74 1HD TYR 74 0.461 1.373 7.648
111 HE1 TYR 74 2HE TYR 74 -2.413 3.994 4.570
112 HE2 TYR 74 1HE TYR 74 -1.811 0.560 7.080
113 HH TYR 74 HH TYR 74 -4.149 2.469 5.686
114 H GLU 75 H GLU 75 5.016 2.940 6.011
115 HA GLU 75 HA GLU 75 5.937 5.609 6.804
116 HB2 GLU 75 1HB GLU 75 6.714 3.164 7.579
117 HB3 GLU 75 2HB GLU 75 7.857 3.399 6.256
118 HG2 GLU 75 1HG GLU 75 8.913 4.266 8.228
119 HG3 GLU 75 2HG GLU 75 8.399 5.660 7.277
120 H LEU 76 H LEU 76 5.377 4.184 3.855
121 HA LEU 76 HA LEU 76 7.761 5.316 2.542
122 HB2 LEU 76 1HB LEU 76 5.375 3.823 1.421
123 HB3 LEU 76 2HB LEU 76 6.778 4.327 0.478
124 HG LEU 76 HG LEU 76 6.878 2.495 2.893
125 HD11 LEU 76 1HD1 LEU 76 7.470 0.764 1.182
126 HD12 LEU 76 2HD1 LEU 76 7.082 1.935 -0.080
127 HD13 LEU 76 3HD1 LEU 76 5.820 1.368 1.014
128 HD21 LEU 76 3HD2 LEU 76 8.911 3.809 1.148
129 HD22 LEU 76 1HD2 LEU 76 9.221 2.138 1.620
130 HD23 LEU 76 2HD2 LEU 76 9.007 3.377 2.856
131 HA PRO 77 HA PRO 77 5.985 9.227 1.438
132 HB2 PRO 77 1HB PRO 77 6.709 8.762 -1.393
133 HB3 PRO 77 2HB PRO 77 7.217 10.059 -0.300
134 HG2 PRO 77 1HG PRO 77 8.813 7.998 -1.081
135 HG3 PRO 77 2HG PRO 77 9.024 8.918 0.415
136 HD2 PRO 77 1HD PRO 77 8.096 6.144 0.060
137 HD3 PRO 77 2HD PRO 77 8.729 6.957 1.507
138 H GLU 78 H GLU 78 4.191 10.165 0.229
139 HA GLU 78 HA GLU 78 2.001 8.374 -0.218
140 HB2 GLU 78 1HB GLU 78 1.916 11.007 -1.572
141 HB3 GLU 78 2HB GLU 78 0.760 10.274 -0.460
142 HG2 GLU 78 1HG GLU 78 2.587 10.665 1.349
143 HG3 GLU 78 2HG GLU 78 3.281 11.793 0.182
144 H ALA 79 H ALA 79 4.043 10.179 -2.558
145 HA ALA 79 HA ALA 79 2.775 9.269 -4.903
146 HB1 ALA 79 1HB ALA 79 5.750 9.727 -4.508
147 HB2 ALA 79 2HB ALA 79 4.570 10.991 -4.859
148 HB3 ALA 79 3HB ALA 79 4.894 9.731 -6.051
149 H VAL 80 H VAL 80 5.116 7.625 -2.827
150 HA VAL 80 HA VAL 80 5.453 5.372 -4.665
151 HB VAL 80 HB VAL 80 6.135 5.687 -1.722
152 HG11 VAL 80 1HG1 VAL 80 6.193 3.396 -1.915
153 HG12 VAL 80 2HG1 VAL 80 7.778 3.747 -2.605
154 HG13 VAL 80 3HG1 VAL 80 6.402 3.445 -3.665
155 HG21 VAL 80 3HG2 VAL 80 8.458 5.916 -2.621
156 HG22 VAL 80 1HG2 VAL 80 7.394 7.222 -3.145
157 HG23 VAL 80 2HG2 VAL 80 7.792 5.909 -4.254
158 H GLN 81 H GLN 81 3.512 6.187 -1.859
159 HA GLN 81 HA GLN 81 2.355 3.605 -1.380
160 HB2 GLN 81 1HB GLN 81 2.278 5.745 0.072
161 HB3 GLN 81 2HB GLN 81 0.928 6.228 -0.950
162 HG2 GLN 81 1HG GLN 81 -0.412 4.994 0.370
163 HG3 GLN 81 2HG GLN 81 0.400 3.554 -0.246
164 HE21 GLN 81 1HE2 GLN 81 1.486 6.178 1.991
165 HE22 GLN 81 2HE2 GLN 81 1.963 5.120 3.225
166 H LYS 82 H LYS 82 1.258 6.398 -3.307
167 HA LYS 82 HA LYS 82 -1.171 5.240 -4.247
168 HB2 LYS 82 1HB LYS 82 0.571 7.518 -5.034
169 HB3 LYS 82 2HB LYS 82 -0.554 6.922 -6.253
170 HG2 LYS 82 1HG LYS 82 -1.639 8.674 -4.949
171 HG3 LYS 82 2HG LYS 82 -2.405 7.126 -4.591
172 HD2 LYS 82 1HD LYS 82 -1.082 6.908 -2.544
173 HD3 LYS 82 2HD LYS 82 -0.227 8.409 -2.914
174 HE2 LYS 82 1HE LYS 82 -3.237 8.288 -2.627
175 HE3 LYS 82 2HE LYS 82 -2.169 8.609 -1.260
176 HZ1 LYS 82 3HZ LYS 82 -1.574 10.625 -2.070
177 HZ2 LYS 82 1HZ LYS 82 -3.125 10.536 -2.753
178 HZ3 LYS 82 2HZ LYS 82 -1.760 10.169 -3.696
179 H GLU 83 H GLU 83 2.046 5.422 -5.828
180 HA GLU 83 HA GLU 83 1.289 4.010 -8.175
181 HB2 GLU 83 1HB GLU 83 3.958 4.187 -6.746
182 HB3 GLU 83 2HB GLU 83 3.753 3.426 -8.324
183 HG2 GLU 83 1HG GLU 83 2.697 6.201 -7.898
184 HG3 GLU 83 2HG GLU 83 4.424 5.971 -8.169
185 H LEU 84 H LEU 84 2.504 2.782 -5.058
186 HA LEU 84 HA LEU 84 2.516 0.028 -5.958
187 HB2 LEU 84 1HB LEU 84 2.449 1.205 -3.160
188 HB3 LEU 84 2HB LEU 84 2.719 -0.500 -3.522
189 HG LEU 84 HG LEU 84 4.433 1.742 -4.628
190 HD11 LEU 84 1HD1 LEU 84 5.131 -0.143 -2.366
191 HD12 LEU 84 2HD1 LEU 84 4.517 1.490 -2.101
192 HD13 LEU 84 3HD1 LEU 84 6.053 1.249 -2.933
193 HD21 LEU 84 3HD2 LEU 84 5.993 -0.395 -4.779
194 HD22 LEU 84 1HD2 LEU 84 4.793 -0.080 -6.031
195 HD23 LEU 84 2HD2 LEU 84 4.457 -1.258 -4.762
196 H LEU 85 H LEU 85 0.152 2.100 -4.323
197 HA LEU 85 HA LEU 85 -1.745 -0.025 -3.842
198 HB2 LEU 85 1HB LEU 85 -1.967 2.990 -3.988
199 HB3 LEU 85 2HB LEU 85 -3.386 1.975 -3.737
200 HG LEU 85 HG LEU 85 -0.926 1.686 -2.008
201 HD11 LEU 85 1HD1 LEU 85 -1.996 3.185 -0.378
202 HD12 LEU 85 2HD1 LEU 85 -3.317 3.488 -1.508
203 HD13 LEU 85 3HD1 LEU 85 -1.686 4.044 -1.887
204 HD21 LEU 85 3HD2 LEU 85 -3.332 0.264 -2.243
205 HD22 LEU 85 1HD2 LEU 85 -3.560 1.282 -0.822
206 HD23 LEU 85 2HD2 LEU 85 -2.194 0.174 -0.902
207 H ALA 86 H ALA 86 -1.191 2.230 -6.521
208 HA ALA 86 HA ALA 86 -3.530 1.555 -8.018
209 HB1 ALA 86 1HB ALA 86 -2.268 2.440 -9.970
210 HB2 ALA 86 2HB ALA 86 -0.805 2.474 -8.987
211 HB3 ALA 86 3HB ALA 86 -2.167 3.517 -8.578
212 H GLU 87 H GLU 87 -0.391 0.017 -7.660
213 HA GLU 87 HA GLU 87 -0.809 -1.863 -9.867
214 HB2 GLU 87 1HB GLU 87 1.463 -1.173 -8.902
215 HB3 GLU 87 2HB GLU 87 1.084 -2.216 -7.531
216 HG2 GLU 87 1HG GLU 87 1.903 -3.937 -8.737
217 HG3 GLU 87 2HG GLU 87 0.492 -3.773 -9.782
218 H TRP 88 H TRP 88 -1.385 -1.831 -6.388
219 HA TRP 88 HA TRP 88 -2.059 -4.633 -6.163
220 HB2 TRP 88 1HB TRP 88 -2.966 -2.271 -4.490
221 HB3 TRP 88 2HB TRP 88 -3.142 -3.965 -4.042
222 HD1 TRP 88 HD TRP 88 0.042 -4.079 -5.616
223 HE1 TRP 88 1HE TRP 88 1.982 -3.741 -3.943
224 HE3 TRP 88 3HE TRP 88 -2.513 -2.087 -1.663
225 HZ2 TRP 88 2HZ TRP 88 2.399 -2.742 -1.309
226 HZ3 TRP 88 3HZ TRP 88 -1.318 -1.453 0.412
227 HH2 TRP 88 HH TRP 88 1.132 -1.779 0.595
228 H LYS 89 H LYS 89 -3.920 -1.677 -6.778
229 HA LYS 89 HA LYS 89 -6.500 -3.018 -6.867
230 HB2 LYS 89 1HB LYS 89 -6.284 -0.615 -6.350
231 HB3 LYS 89 2HB LYS 89 -5.632 -0.329 -7.964
232 HG2 LYS 89 1HG LYS 89 -7.703 -1.040 -8.997
233 HG3 LYS 89 2HG LYS 89 -8.353 -1.555 -7.440
234 HD2 LYS 89 1HD LYS 89 -8.092 0.846 -6.659
235 HD3 LYS 89 2HD LYS 89 -7.741 1.271 -8.334
236 HE2 LYS 89 1HE LYS 89 -10.264 -0.119 -7.384
237 HE3 LYS 89 2HE LYS 89 -10.141 1.594 -7.789
238 HZ1 LYS 89 3HZ LYS 89 -9.123 0.532 -9.984
239 HZ2 LYS 89 1HZ LYS 89 -10.783 0.826 -9.795
240 HZ3 LYS 89 2HZ LYS 89 -10.164 -0.735 -9.537
241 H ARG 90 H ARG 90 -4.030 -2.182 -9.278
242 HA ARG 90 HA ARG 90 -5.655 -2.627 -11.563
243 HB2 ARG 90 1HB ARG 90 -3.558 -1.549 -11.918
244 HB3 ARG 90 2HB ARG 90 -2.680 -2.818 -11.060
245 HG2 ARG 90 1HG ARG 90 -2.824 -4.306 -12.820
246 HG3 ARG 90 2HG ARG 90 -4.280 -3.554 -13.466
247 HD2 ARG 90 1HD ARG 90 -1.871 -3.191 -14.600
248 HD3 ARG 90 2HD ARG 90 -3.109 -1.936 -14.612
249 HE ARG 90 HE ARG 90 -1.405 -1.810 -12.251
250 HH11 ARG 90 1HH2 ARG 90 -1.806 -0.992 -15.576
251 HH12 ARG 90 2HH2 ARG 90 -0.753 0.381 -15.504
252 HH21 ARG 90 1HH1 ARG 90 -0.025 -0.022 -12.137
253 HH22 ARG 90 2HH1 ARG 90 0.257 0.930 -13.556
254 H THR 91 H THR 91 -3.560 -4.833 -9.688
255 HA THR 91 HA THR 91 -4.698 -7.103 -11.251
256 HB THR 91 HB THR 91 -2.369 -7.380 -11.206
257 HG1 THR 91 1HG THR 91 -2.193 -9.197 -10.106
258 HG21 THR 91 3HG2 THR 91 -1.295 -7.134 -8.741
259 HG22 THR 91 1HG2 THR 91 -2.622 -5.982 -8.600
260 HG23 THR 91 2HG2 THR 91 -1.415 -5.784 -9.871
261 H GLY 92 H GLY 92 -4.278 -5.934 -7.921
262 HA2 GLY 92 1HA GLY 92 -6.186 -6.223 -6.358
263 HA3 GLY 92 2HA GLY 92 -6.499 -7.777 -7.128
Start of MODEL 10
1 H LYS 61 H LYS 61 -10.570 1.074 3.045
2 HA LYS 61 HA LYS 61 -10.949 -1.855 2.867
3 HB2 LYS 61 1HB LYS 61 -11.154 -1.737 0.385
4 HB3 LYS 61 2HB LYS 61 -12.535 -1.020 1.216
5 HG2 LYS 61 1HG LYS 61 -10.757 1.101 0.979
6 HG3 LYS 61 2HG LYS 61 -10.576 0.240 -0.549
7 HD2 LYS 61 1HD LYS 61 -13.224 1.102 0.649
8 HD3 LYS 61 2HD LYS 61 -12.385 1.941 -0.656
9 HE2 LYS 61 1HE LYS 61 -12.401 -0.448 -1.786
10 HE3 LYS 61 2HE LYS 61 -13.759 -0.724 -0.694
11 HZ1 LYS 61 3HZ LYS 61 -14.315 1.708 -1.692
12 HZ2 LYS 61 1HZ LYS 61 -14.944 0.254 -2.297
13 HZ3 LYS 61 2HZ LYS 61 -13.584 0.959 -3.030
14 H ILE 62 H ILE 62 -8.850 -2.566 3.067
15 HA ILE 62 HA ILE 62 -6.825 -1.435 1.260
16 HB ILE 62 HB ILE 62 -6.292 -1.476 4.246
17 HG12 ILE 62 1HG1 ILE 62 -6.797 0.872 2.381
18 HG13 ILE 62 2HG1 ILE 62 -7.853 0.347 3.690
19 HG21 ILE 62 1HG2 ILE 62 -4.218 -0.300 3.565
20 HG22 ILE 62 2HG2 ILE 62 -4.699 -0.444 1.878
21 HG23 ILE 62 3HG2 ILE 62 -4.331 -1.890 2.816
22 HD11 ILE 62 3HD1 ILE 62 -5.831 0.670 5.238
23 HD12 ILE 62 1HD1 ILE 62 -6.611 2.128 4.625
24 HD13 ILE 62 2HD1 ILE 62 -5.104 1.564 3.902
25 H THR 63 H THR 63 -5.653 -3.100 0.484
26 HA THR 63 HA THR 63 -5.366 -5.562 2.171
27 HB THR 63 HB THR 63 -5.741 -5.426 -0.839
28 HG1 THR 63 1HG THR 63 -7.659 -6.735 -0.034
29 HG21 THR 63 3HG2 THR 63 -6.039 -7.970 -0.406
30 HG22 THR 63 1HG2 THR 63 -5.193 -7.655 1.109
31 HG23 THR 63 2HG2 THR 63 -4.403 -7.315 -0.429
32 H PHE 64 H PHE 64 -3.252 -5.824 2.668
33 HA PHE 64 HA PHE 64 -1.209 -4.621 0.886
34 HB2 PHE 64 1HB PHE 64 -0.864 -5.897 3.612
35 HB3 PHE 64 2HB PHE 64 0.341 -4.957 2.737
36 HD1 PHE 64 1HD PHE 64 -0.382 -2.520 2.055
37 HD2 PHE 64 2HD PHE 64 -2.259 -4.833 5.147
38 HE1 PHE 64 1HE PHE 64 -1.253 -0.437 3.084
39 HE2 PHE 64 2HE PHE 64 -3.133 -2.752 6.175
40 HZ PHE 64 HZ PHE 64 -2.624 -0.555 5.149
41 HA PRO 65 HA PRO 65 -0.303 -8.604 -1.052
42 HB2 PRO 65 1HB PRO 65 2.508 -7.650 -0.797
43 HB3 PRO 65 2HB PRO 65 1.654 -8.294 -2.210
44 HG2 PRO 65 1HG PRO 65 2.157 -5.681 -1.890
45 HG3 PRO 65 2HG PRO 65 0.728 -6.286 -2.737
46 HD2 PRO 65 1HD PRO 65 0.898 -4.952 -0.108
47 HD3 PRO 65 2HD PRO 65 -0.496 -5.150 -1.186
48 H SER 66 H SER 66 0.760 -10.600 -0.464
49 HA SER 66 HA SER 66 0.975 -11.132 2.343
50 HB2 SER 66 1HB SER 66 1.505 -13.338 1.712
51 HB3 SER 66 2HB SER 66 0.519 -12.754 0.374
52 HG SER 66 HG SER 66 2.579 -13.821 -0.165
53 H ASP 67 H ASP 67 3.111 -9.426 0.430
54 HA ASP 67 HA ASP 67 5.403 -10.220 2.191
55 HB2 ASP 67 1HB ASP 67 5.218 -10.186 -0.670
56 HB3 ASP 67 2HB ASP 67 6.390 -8.969 -0.160
57 H ILE 68 H ILE 68 3.225 -7.890 2.041
58 HA ILE 68 HA ILE 68 5.217 -5.681 2.386
59 HB ILE 68 HB ILE 68 2.356 -5.654 1.449
60 HG12 ILE 68 1HG1 ILE 68 4.046 -6.036 -0.290
61 HG13 ILE 68 2HG1 ILE 68 3.342 -4.432 -0.472
62 HG21 ILE 68 1HG2 ILE 68 2.329 -3.810 2.873
63 HG22 ILE 68 2HG2 ILE 68 2.852 -3.086 1.353
64 HG23 ILE 68 3HG2 ILE 68 4.036 -3.453 2.609
65 HD11 ILE 68 3HD1 ILE 68 5.410 -3.786 1.118
66 HD12 ILE 68 1HD1 ILE 68 5.551 -3.841 -0.638
67 HD13 ILE 68 2HD1 ILE 68 6.100 -5.205 0.334
68 H ASP 69 H ASP 69 5.399 -4.876 4.352
69 HA ASP 69 HA ASP 69 3.492 -5.700 6.460
70 HB2 ASP 69 1HB ASP 69 5.959 -5.831 6.857
71 HB3 ASP 69 2HB ASP 69 6.042 -4.076 6.715
72 HA PRO 70 HA PRO 70 1.283 -1.836 6.084
73 HB2 PRO 70 1HB PRO 70 0.207 -1.714 8.629
74 HB3 PRO 70 2HB PRO 70 -0.466 -2.657 7.288
75 HG2 PRO 70 1HG PRO 70 1.169 -3.546 9.592
76 HG3 PRO 70 2HG PRO 70 -0.140 -4.381 8.741
77 HD2 PRO 70 1HD PRO 70 2.503 -4.989 8.378
78 HD3 PRO 70 2HD PRO 70 1.270 -5.223 7.119
79 H GLN 71 H GLN 71 3.281 -2.312 8.992
80 HA GLN 71 HA GLN 71 3.420 0.516 9.645
81 HB2 GLN 71 1HB GLN 71 5.365 -1.675 10.432
82 HB3 GLN 71 2HB GLN 71 5.104 -0.138 11.255
83 HG2 GLN 71 1HG GLN 71 2.958 -0.784 12.027
84 HG3 GLN 71 2HG GLN 71 2.860 -2.127 10.889
85 HE21 GLN 71 1HE2 GLN 71 3.188 -1.652 14.099
86 HE22 GLN 71 2HE2 GLN 71 4.211 -2.945 14.504
87 H VAL 72 H VAL 72 5.387 -1.666 7.678
88 HA VAL 72 HA VAL 72 7.439 0.391 7.265
89 HB VAL 72 HB VAL 72 6.984 -2.227 5.802
90 HG11 VAL 72 1HG1 VAL 72 9.355 -0.342 5.938
91 HG12 VAL 72 2HG1 VAL 72 8.373 -0.696 4.517
92 HG13 VAL 72 3HG1 VAL 72 9.399 -1.949 5.213
93 HG21 VAL 72 3HG2 VAL 72 9.236 -2.005 7.673
94 HG22 VAL 72 1HG2 VAL 72 8.047 -3.297 7.499
95 HG23 VAL 72 2HG2 VAL 72 7.664 -1.870 8.463
96 H PHE 73 H PHE 73 4.450 -0.602 5.794
97 HA PHE 73 HA PHE 73 4.948 0.531 3.176
98 HB2 PHE 73 1HB PHE 73 3.250 -1.239 3.668
99 HB3 PHE 73 2HB PHE 73 2.319 -0.050 4.573
100 HD1 PHE 73 1HD PHE 73 3.946 -0.478 1.218
101 HD2 PHE 73 2HD PHE 73 0.657 1.141 3.458
102 HE1 PHE 73 1HE PHE 73 2.882 0.283 -0.887
103 HE2 PHE 73 2HE PHE 73 -0.403 1.906 1.350
104 HZ PHE 73 HZ PHE 73 0.712 1.475 -0.823
105 H TYR 74 H TYR 74 2.891 1.615 5.905
106 HA TYR 74 HA TYR 74 2.297 4.156 4.757
107 HB2 TYR 74 1HB TYR 74 2.345 3.210 7.630
108 HB3 TYR 74 2HB TYR 74 1.857 4.846 7.187
109 HD1 TYR 74 2HD TYR 74 0.164 4.846 5.024
110 HD2 TYR 74 1HD TYR 74 0.621 1.683 7.899
111 HE1 TYR 74 2HE TYR 74 -2.103 4.012 4.471
112 HE2 TYR 74 1HE TYR 74 -1.647 0.850 7.343
113 HH TYR 74 HH TYR 74 -3.876 2.670 5.533
114 H GLU 75 H GLU 75 5.209 2.971 6.134
115 HA GLU 75 HA GLU 75 6.260 5.577 6.933
116 HB2 GLU 75 1HB GLU 75 7.447 2.826 6.557
117 HB3 GLU 75 2HB GLU 75 8.475 4.228 6.859
118 HG2 GLU 75 1HG GLU 75 6.125 3.524 8.629
119 HG3 GLU 75 2HG GLU 75 7.756 2.924 8.930
120 H LEU 76 H LEU 76 5.588 4.188 3.972
121 HA LEU 76 HA LEU 76 7.916 5.331 2.574
122 HB2 LEU 76 1HB LEU 76 5.489 3.803 1.603
123 HB3 LEU 76 2HB LEU 76 6.765 4.390 0.535
124 HG LEU 76 HG LEU 76 7.252 2.561 2.904
125 HD11 LEU 76 1HD1 LEU 76 6.975 1.930 -0.049
126 HD12 LEU 76 2HD1 LEU 76 5.908 1.385 1.245
127 HD13 LEU 76 3HD1 LEU 76 7.570 0.797 1.165
128 HD21 LEU 76 3HD2 LEU 76 8.952 4.020 1.016
129 HD22 LEU 76 1HD2 LEU 76 9.289 2.289 1.027
130 HD23 LEU 76 2HD2 LEU 76 9.386 3.218 2.524
131 HA PRO 77 HA PRO 77 6.057 9.245 1.576
132 HB2 PRO 77 1HB PRO 77 6.737 8.868 -1.270
133 HB3 PRO 77 2HB PRO 77 7.279 10.119 -0.140
134 HG2 PRO 77 1HG PRO 77 8.823 8.047 -1.045
135 HG3 PRO 77 2HG PRO 77 9.117 8.963 0.438
136 HD2 PRO 77 1HD PRO 77 8.189 6.195 0.135
137 HD3 PRO 77 2HD PRO 77 8.842 7.025 1.564
138 H GLU 78 H GLU 78 4.227 10.164 0.384
139 HA GLU 78 HA GLU 78 2.068 8.336 -0.036
140 HB2 GLU 78 1HB GLU 78 1.154 10.483 -1.329
141 HB3 GLU 78 2HB GLU 78 1.271 10.450 0.431
142 HG2 GLU 78 1HG GLU 78 3.251 11.735 0.444
143 HG3 GLU 78 2HG GLU 78 3.578 11.408 -1.258
144 H ALA 79 H ALA 79 4.057 10.144 -2.418
145 HA ALA 79 HA ALA 79 2.804 9.223 -4.749
146 HB1 ALA 79 1HB ALA 79 4.462 10.456 -5.642
147 HB2 ALA 79 2HB ALA 79 5.615 9.186 -5.235
148 HB3 ALA 79 3HB ALA 79 5.289 10.483 -4.085
149 H VAL 80 H VAL 80 5.120 7.534 -2.675
150 HA VAL 80 HA VAL 80 5.398 5.261 -4.493
151 HB VAL 80 HB VAL 80 6.040 5.546 -1.539
152 HG11 VAL 80 1HG1 VAL 80 5.846 3.219 -1.974
153 HG12 VAL 80 2HG1 VAL 80 7.570 3.561 -2.119
154 HG13 VAL 80 3HG1 VAL 80 6.585 3.375 -3.569
155 HG21 VAL 80 3HG2 VAL 80 7.956 5.519 -3.878
156 HG22 VAL 80 1HG2 VAL 80 8.274 6.016 -2.216
157 HG23 VAL 80 2HG2 VAL 80 7.263 7.018 -3.258
158 H GLN 81 H GLN 81 3.438 6.135 -1.715
159 HA GLN 81 HA GLN 81 2.222 3.592 -1.228
160 HB2 GLN 81 1HB GLN 81 2.110 5.594 0.286
161 HB3 GLN 81 2HB GLN 81 0.988 6.335 -0.851
162 HG2 GLN 81 1HG GLN 81 -0.743 5.035 -0.172
163 HG3 GLN 81 2HG GLN 81 0.262 3.588 -0.079
164 HE21 GLN 81 1HE2 GLN 81 2.214 4.365 1.778
165 HE22 GLN 81 2HE2 GLN 81 1.485 4.699 3.269
166 H LYS 82 H LYS 82 1.189 6.356 -3.246
167 HA LYS 82 HA LYS 82 -1.223 5.158 -4.187
168 HB2 LYS 82 1HB LYS 82 0.546 7.390 -5.128
169 HB3 LYS 82 2HB LYS 82 -0.741 6.812 -6.185
170 HG2 LYS 82 1HG LYS 82 -1.658 8.613 -4.883
171 HG3 LYS 82 2HG LYS 82 -2.341 7.120 -4.241
172 HD2 LYS 82 1HD LYS 82 -0.698 7.110 -2.429
173 HD3 LYS 82 2HD LYS 82 0.074 8.550 -3.095
174 HE2 LYS 82 1HE LYS 82 -1.640 9.948 -2.430
175 HE3 LYS 82 2HE LYS 82 -2.857 8.676 -2.528
176 HZ1 LYS 82 3HZ LYS 82 -2.423 9.223 -0.241
177 HZ2 LYS 82 1HZ LYS 82 -0.761 8.950 -0.444
178 HZ3 LYS 82 2HZ LYS 82 -1.852 7.653 -0.558
179 H GLU 83 H GLU 83 2.005 5.339 -5.749
180 HA GLU 83 HA GLU 83 1.280 3.903 -8.079
181 HB2 GLU 83 1HB GLU 83 3.946 3.917 -6.626
182 HB3 GLU 83 2HB GLU 83 3.701 3.359 -8.281
183 HG2 GLU 83 1HG GLU 83 3.066 5.548 -9.023
184 HG3 GLU 83 2HG GLU 83 2.953 6.144 -7.365
185 H LEU 84 H LEU 84 2.310 2.664 -4.902
186 HA LEU 84 HA LEU 84 2.325 -0.085 -5.847
187 HB2 LEU 84 1HB LEU 84 2.303 1.113 -3.062
188 HB3 LEU 84 2HB LEU 84 2.393 -0.622 -3.370
189 HG LEU 84 HG LEU 84 4.351 1.426 -4.456
190 HD11 LEU 84 1HD1 LEU 84 4.599 1.223 -2.038
191 HD12 LEU 84 2HD1 LEU 84 5.931 0.382 -2.829
192 HD13 LEU 84 3HD1 LEU 84 4.585 -0.537 -2.156
193 HD21 LEU 84 3HD2 LEU 84 3.913 -1.490 -4.838
194 HD22 LEU 84 1HD2 LEU 84 5.586 -0.982 -4.606
195 HD23 LEU 84 2HD2 LEU 84 4.636 -0.307 -5.930
196 H LEU 85 H LEU 85 -0.052 2.045 -4.337
197 HA LEU 85 HA LEU 85 -1.987 -0.053 -3.842
198 HB2 LEU 85 1HB LEU 85 -2.197 2.958 -4.092
199 HB3 LEU 85 2HB LEU 85 -3.612 1.945 -3.813
200 HG LEU 85 HG LEU 85 -1.159 1.776 -2.058
201 HD11 LEU 85 1HD1 LEU 85 -3.603 3.538 -1.700
202 HD12 LEU 85 2HD1 LEU 85 -1.957 4.098 -1.994
203 HD13 LEU 85 3HD1 LEU 85 -2.354 3.277 -0.484
204 HD21 LEU 85 3HD2 LEU 85 -3.570 0.305 -2.250
205 HD22 LEU 85 1HD2 LEU 85 -3.727 1.311 -0.811
206 HD23 LEU 85 2HD2 LEU 85 -2.361 0.208 -0.971
207 H ALA 86 H ALA 86 -1.368 2.180 -6.534
208 HA ALA 86 HA ALA 86 -3.661 1.460 -8.081
209 HB1 ALA 86 1HB ALA 86 -2.243 3.443 -8.563
210 HB2 ALA 86 2HB ALA 86 -2.433 2.414 -9.982
211 HB3 ALA 86 3HB ALA 86 -0.934 2.369 -9.054
212 H GLU 87 H GLU 87 -0.471 0.011 -7.696
213 HA GLU 87 HA GLU 87 -0.807 -1.903 -9.880
214 HB2 GLU 87 1HB GLU 87 1.426 -1.199 -8.928
215 HB3 GLU 87 2HB GLU 87 1.024 -2.103 -7.467
216 HG2 GLU 87 1HG GLU 87 0.702 -4.144 -8.898
217 HG3 GLU 87 2HG GLU 87 1.306 -3.215 -10.272
218 H TRP 88 H TRP 88 -1.428 -1.881 -6.402
219 HA TRP 88 HA TRP 88 -2.104 -4.683 -6.190
220 HB2 TRP 88 1HB TRP 88 -3.068 -2.340 -4.519
221 HB3 TRP 88 2HB TRP 88 -3.181 -4.040 -4.073
222 HD1 TRP 88 HD TRP 88 -0.015 -4.073 -5.639
223 HE1 TRP 88 1HE TRP 88 1.923 -3.647 -3.987
224 HE3 TRP 88 3HE TRP 88 -2.605 -2.094 -1.702
225 HZ2 TRP 88 2HZ TRP 88 2.327 -2.601 -1.371
226 HZ3 TRP 88 3HZ TRP 88 -1.416 -1.390 0.358
227 HH2 TRP 88 HH TRP 88 1.048 -1.641 0.526
228 H LYS 89 H LYS 89 -3.868 -1.772 -7.079
229 HA LYS 89 HA LYS 89 -6.489 -3.012 -6.998
230 HB2 LYS 89 1HB LYS 89 -5.952 -0.500 -6.911
231 HB3 LYS 89 2HB LYS 89 -5.727 -0.603 -8.657
232 HG2 LYS 89 1HG LYS 89 -8.032 -1.612 -8.819
233 HG3 LYS 89 2HG LYS 89 -8.243 -1.261 -7.103
234 HD2 LYS 89 1HD LYS 89 -7.811 1.141 -7.556
235 HD3 LYS 89 2HD LYS 89 -7.666 0.776 -9.275
236 HE2 LYS 89 1HE LYS 89 -10.021 -0.304 -9.008
237 HE3 LYS 89 2HE LYS 89 -10.110 0.639 -7.521
238 HZ1 LYS 89 3HZ LYS 89 -9.194 2.440 -9.304
239 HZ2 LYS 89 1HZ LYS 89 -10.820 2.264 -8.854
240 HZ3 LYS 89 2HZ LYS 89 -10.244 1.511 -10.264
241 H ARG 90 H ARG 90 -4.067 -2.488 -9.567
242 HA ARG 90 HA ARG 90 -5.711 -3.314 -11.721
243 HB2 ARG 90 1HB ARG 90 -3.644 -2.255 -12.253
244 HB3 ARG 90 2HB ARG 90 -2.724 -3.389 -11.262
245 HG2 ARG 90 1HG ARG 90 -3.019 -5.155 -12.773
246 HG3 ARG 90 2HG ARG 90 -4.381 -4.367 -13.562
247 HD2 ARG 90 1HD ARG 90 -2.623 -4.076 -15.099
248 HD3 ARG 90 2HD ARG 90 -2.652 -2.541 -14.241
249 HE ARG 90 HE ARG 90 -0.566 -4.612 -14.020
250 HH11 ARG 90 1HH2 ARG 90 -2.056 -1.748 -12.804
251 HH12 ARG 90 2HH2 ARG 90 -0.657 -1.238 -11.923
252 HH21 ARG 90 1HH1 ARG 90 1.265 -3.959 -12.875
253 HH22 ARG 90 2HH1 ARG 90 1.221 -2.488 -11.960
254 H THR 91 H THR 91 -3.545 -5.172 -9.571
255 HA THR 91 HA THR 91 -4.528 -7.680 -10.830
256 HB THR 91 HB THR 91 -2.082 -7.379 -10.331
257 HG1 THR 91 1HG THR 91 -2.291 -9.410 -8.769
258 HG21 THR 91 3HG2 THR 91 -2.864 -7.711 -7.435
259 HG22 THR 91 1HG2 THR 91 -2.615 -6.118 -8.152
260 HG23 THR 91 2HG2 THR 91 -1.287 -7.279 -8.099
261 H GLY 92 H GLY 92 -4.476 -6.025 -7.688
262 HA2 GLY 92 1HA GLY 92 -6.390 -6.107 -6.183
263 HA3 GLY 92 2HA GLY 92 -6.852 -7.643 -6.915
Start of MODEL 11
1 H LYS 61 H LYS 61 -10.728 0.707 3.620
2 HA LYS 61 HA LYS 61 -11.014 -2.199 3.097
3 HB2 LYS 61 1HB LYS 61 -12.612 -0.622 1.671
4 HB3 LYS 61 2HB LYS 61 -11.141 -0.380 0.729
5 HG2 LYS 61 1HG LYS 61 -10.966 -3.002 0.858
6 HG3 LYS 61 2HG LYS 61 -12.696 -2.907 1.191
7 HD2 LYS 61 1HD LYS 61 -13.096 -1.726 -0.885
8 HD3 LYS 61 2HD LYS 61 -11.364 -1.587 -1.191
9 HE2 LYS 61 1HE LYS 61 -12.288 -3.424 -2.518
10 HE3 LYS 61 2HE LYS 61 -11.207 -4.068 -1.282
11 HZ1 LYS 61 3HZ LYS 61 -13.542 -4.024 0.019
12 HZ2 LYS 61 1HZ LYS 61 -12.945 -5.377 -0.812
13 HZ3 LYS 61 2HZ LYS 61 -14.072 -4.351 -1.563
14 H ILE 62 H ILE 62 -8.921 -2.863 3.161
15 HA ILE 62 HA ILE 62 -6.971 -1.596 1.369
16 HB ILE 62 HB ILE 62 -6.299 -1.787 4.324
17 HG12 ILE 62 1HG1 ILE 62 -6.920 0.659 2.623
18 HG13 ILE 62 2HG1 ILE 62 -7.906 0.048 3.949
19 HG21 ILE 62 1HG2 ILE 62 -4.848 -0.708 1.888
20 HG22 ILE 62 2HG2 ILE 62 -4.380 -2.095 2.870
21 HG23 ILE 62 3HG2 ILE 62 -4.293 -0.470 3.542
22 HD11 ILE 62 3HD1 ILE 62 -5.384 0.276 5.084
23 HD12 ILE 62 1HD1 ILE 62 -6.724 1.402 5.301
24 HD13 ILE 62 2HD1 ILE 62 -5.510 1.704 4.058
25 H THR 63 H THR 63 -5.681 -3.152 0.530
26 HA THR 63 HA THR 63 -5.420 -5.736 2.031
27 HB THR 63 HB THR 63 -5.145 -6.119 -0.806
28 HG1 THR 63 1HG THR 63 -6.488 -4.440 -1.187
29 HG21 THR 63 3HG2 THR 63 -5.718 -7.899 0.731
30 HG22 THR 63 1HG2 THR 63 -7.069 -7.679 -0.381
31 HG23 THR 63 2HG2 THR 63 -7.163 -7.037 1.258
32 H PHE 64 H PHE 64 -3.319 -5.956 2.611
33 HA PHE 64 HA PHE 64 -1.238 -4.645 0.961
34 HB2 PHE 64 1HB PHE 64 -1.003 -6.031 3.645
35 HB3 PHE 64 2HB PHE 64 0.252 -5.080 2.856
36 HD1 PHE 64 1HD PHE 64 -0.270 -2.615 2.330
37 HD2 PHE 64 2HD PHE 64 -2.595 -4.999 5.035
38 HE1 PHE 64 1HE PHE 64 -1.179 -0.551 3.363
39 HE2 PHE 64 2HE PHE 64 -3.504 -2.939 6.073
40 HZ PHE 64 HZ PHE 64 -2.794 -0.714 5.239
41 HA PRO 65 HA PRO 65 -0.207 -8.528 -1.131
42 HB2 PRO 65 1HB PRO 65 2.563 -7.485 -0.750
43 HB3 PRO 65 2HB PRO 65 1.789 -8.129 -2.208
44 HG2 PRO 65 1HG PRO 65 2.163 -5.512 -1.842
45 HG3 PRO 65 2HG PRO 65 0.755 -6.153 -2.698
46 HD2 PRO 65 1HD PRO 65 0.890 -4.894 -0.021
47 HD3 PRO 65 2HD PRO 65 -0.492 -5.069 -1.123
48 H SER 66 H SER 66 0.747 -10.545 -0.521
49 HA SER 66 HA SER 66 0.988 -11.097 2.276
50 HB2 SER 66 1HB SER 66 1.694 -13.311 1.591
51 HB3 SER 66 2HB SER 66 0.414 -12.776 0.507
52 HG SER 66 HG SER 66 2.673 -11.905 -0.508
53 H ASP 67 H ASP 67 3.140 -9.414 0.359
54 HA ASP 67 HA ASP 67 5.435 -10.271 2.084
55 HB2 ASP 67 1HB ASP 67 5.383 -10.636 -0.577
56 HB3 ASP 67 2HB ASP 67 5.985 -8.978 -0.538
57 H ILE 68 H ILE 68 3.298 -7.904 1.989
58 HA ILE 68 HA ILE 68 5.332 -5.739 2.377
59 HB ILE 68 HB ILE 68 2.491 -5.630 1.395
60 HG12 ILE 68 1HG1 ILE 68 4.235 -6.001 -0.305
61 HG13 ILE 68 2HG1 ILE 68 3.534 -4.398 -0.480
62 HG21 ILE 68 1HG2 ILE 68 3.087 -3.058 1.381
63 HG22 ILE 68 2HG2 ILE 68 4.166 -3.516 2.699
64 HG23 ILE 68 3HG2 ILE 68 2.433 -3.813 2.834
65 HD11 ILE 68 3HD1 ILE 68 5.730 -3.773 -0.566
66 HD12 ILE 68 1HD1 ILE 68 6.275 -5.179 0.345
67 HD13 ILE 68 2HD1 ILE 68 5.576 -3.800 1.188
68 H ASP 69 H ASP 69 5.498 -4.910 4.323
69 HA ASP 69 HA ASP 69 3.652 -5.768 6.456
70 HB2 ASP 69 1HB ASP 69 6.049 -5.798 6.927
71 HB3 ASP 69 2HB ASP 69 6.173 -4.086 6.535
72 HA PRO 70 HA PRO 70 1.205 -2.054 6.079
73 HB2 PRO 70 1HB PRO 70 0.119 -1.975 8.607
74 HB3 PRO 70 2HB PRO 70 -0.449 -3.045 7.312
75 HG2 PRO 70 1HG PRO 70 1.325 -3.644 9.619
76 HG3 PRO 70 2HG PRO 70 0.056 -4.634 8.881
77 HD2 PRO 70 1HD PRO 70 2.707 -5.061 8.411
78 HD3 PRO 70 2HD PRO 70 1.452 -5.420 7.209
79 H GLN 71 H GLN 71 3.223 -2.319 9.015
80 HA GLN 71 HA GLN 71 3.180 0.564 9.491
81 HB2 GLN 71 1HB GLN 71 4.739 -1.757 10.628
82 HB3 GLN 71 2HB GLN 71 5.182 -0.094 11.020
83 HG2 GLN 71 1HG GLN 71 3.137 0.333 12.096
84 HG3 GLN 71 2HG GLN 71 2.330 -1.019 11.300
85 HE21 GLN 71 1HE2 GLN 71 1.902 -1.225 13.892
86 HE22 GLN 71 2HE2 GLN 71 2.965 -2.288 14.678
87 H VAL 72 H VAL 72 5.223 -1.631 7.662
88 HA VAL 72 HA VAL 72 7.281 0.435 7.289
89 HB VAL 72 HB VAL 72 6.944 -2.131 5.718
90 HG11 VAL 72 1HG1 VAL 72 8.579 -0.839 4.651
91 HG12 VAL 72 2HG1 VAL 72 9.538 -1.815 5.763
92 HG13 VAL 72 3HG1 VAL 72 9.157 -0.142 6.165
93 HG21 VAL 72 3HG2 VAL 72 8.412 -3.188 7.367
94 HG22 VAL 72 1HG2 VAL 72 6.971 -2.572 8.174
95 HG23 VAL 72 2HG2 VAL 72 8.491 -1.687 8.289
96 H PHE 73 H PHE 73 4.337 -0.598 5.766
97 HA PHE 73 HA PHE 73 4.879 0.528 3.144
98 HB2 PHE 73 1HB PHE 73 3.196 -1.294 3.699
99 HB3 PHE 73 2HB PHE 73 2.195 -0.039 4.426
100 HD1 PHE 73 2HD PHE 73 4.118 -0.667 1.263
101 HD2 PHE 73 1HD PHE 73 0.593 0.977 3.088
102 HE1 PHE 73 2HE PHE 73 3.226 -0.083 -0.975
103 HE2 PHE 73 1HE PHE 73 -0.295 1.562 0.848
104 HZ PHE 73 HZ PHE 73 1.027 1.034 -1.184
105 H TYR 74 H TYR 74 2.698 1.546 5.798
106 HA TYR 74 HA TYR 74 2.049 4.063 4.641
107 HB2 TYR 74 1HB TYR 74 2.070 3.094 7.504
108 HB3 TYR 74 2HB TYR 74 1.595 4.742 7.094
109 HD1 TYR 74 2HD TYR 74 -0.073 4.851 4.964
110 HD2 TYR 74 1HD TYR 74 0.354 1.519 7.642
111 HE1 TYR 74 2HE TYR 74 -2.330 4.050 4.326
112 HE2 TYR 74 1HE TYR 74 -1.906 0.718 7.004
113 HH TYR 74 HH TYR 74 -3.569 0.948 5.462
114 H GLU 75 H GLU 75 4.985 2.985 6.031
115 HA GLU 75 HA GLU 75 5.946 5.652 6.785
116 HB2 GLU 75 1HB GLU 75 6.671 3.156 7.549
117 HB3 GLU 75 2HB GLU 75 7.873 3.446 6.292
118 HG2 GLU 75 1HG GLU 75 7.302 5.332 8.598
119 HG3 GLU 75 2HG GLU 75 8.648 4.194 8.542
120 H LEU 76 H LEU 76 5.419 4.133 3.856
121 HA LEU 76 HA LEU 76 7.814 5.202 2.516
122 HB2 LEU 76 1HB LEU 76 5.370 3.827 1.367
123 HB3 LEU 76 2HB LEU 76 6.858 4.181 0.491
124 HG LEU 76 HG LEU 76 6.689 2.439 2.963
125 HD11 LEU 76 1HD1 LEU 76 5.598 1.533 0.845
126 HD12 LEU 76 2HD1 LEU 76 6.906 0.550 1.505
127 HD13 LEU 76 3HD1 LEU 76 7.198 1.583 0.105
128 HD21 LEU 76 3HD2 LEU 76 8.884 3.224 2.928
129 HD22 LEU 76 1HD2 LEU 76 8.903 3.391 1.172
130 HD23 LEU 76 2HD2 LEU 76 9.026 1.793 1.908
131 HA PRO 77 HA PRO 77 6.132 9.142 1.326
132 HB2 PRO 77 1HB PRO 77 6.836 8.598 -1.496
133 HB3 PRO 77 2HB PRO 77 7.382 9.906 -0.433
134 HG2 PRO 77 1HG PRO 77 8.924 7.796 -1.177
135 HG3 PRO 77 2HG PRO 77 9.159 8.730 0.306
136 HD2 PRO 77 1HD PRO 77 8.148 5.980 -0.014
137 HD3 PRO 77 2HD PRO 77 8.823 6.784 1.418
138 H GLU 78 H GLU 78 4.345 10.092 0.106
139 HA GLU 78 HA GLU 78 2.138 8.313 -0.305
140 HB2 GLU 78 1HB GLU 78 2.594 11.192 -1.121
141 HB3 GLU 78 2HB GLU 78 1.062 10.352 -1.352
142 HG2 GLU 78 1HG GLU 78 1.081 11.648 0.763
143 HG3 GLU 78 2HG GLU 78 0.911 9.916 1.059
144 H ALA 79 H ALA 79 4.120 10.125 -2.699
145 HA ALA 79 HA ALA 79 2.877 9.182 -5.022
146 HB1 ALA 79 1HB ALA 79 5.855 9.591 -4.583
147 HB2 ALA 79 2HB ALA 79 4.705 10.843 -5.055
148 HB3 ALA 79 3HB ALA 79 5.057 9.509 -6.154
149 H VAL 80 H VAL 80 5.149 7.512 -2.898
150 HA VAL 80 HA VAL 80 5.383 5.199 -4.682
151 HB VAL 80 HB VAL 80 6.120 5.496 -1.752
152 HG11 VAL 80 1HG1 VAL 80 6.208 3.287 -3.677
153 HG12 VAL 80 2HG1 VAL 80 6.387 3.257 -1.922
154 HG13 VAL 80 3HG1 VAL 80 7.778 3.622 -2.944
155 HG21 VAL 80 3HG2 VAL 80 7.275 7.097 -3.295
156 HG22 VAL 80 1HG2 VAL 80 7.853 5.721 -4.235
157 HG23 VAL 80 2HG2 VAL 80 8.380 5.932 -2.565
158 H GLN 81 H GLN 81 3.521 6.153 -1.851
159 HA GLN 81 HA GLN 81 2.299 3.617 -1.292
160 HB2 GLN 81 1HB GLN 81 2.273 5.715 0.160
161 HB3 GLN 81 2HB GLN 81 1.010 6.326 -0.906
162 HG2 GLN 81 1HG GLN 81 -0.504 5.168 0.287
163 HG3 GLN 81 2HG GLN 81 0.269 3.676 -0.246
164 HE21 GLN 81 1HE2 GLN 81 1.694 6.171 1.900
165 HE22 GLN 81 2HE2 GLN 81 1.853 5.148 3.244
166 H LYS 82 H LYS 82 1.122 6.419 -3.175
167 HA LYS 82 HA LYS 82 -1.273 5.217 -4.117
168 HB2 LYS 82 1HB LYS 82 0.495 7.434 -5.131
169 HB3 LYS 82 2HB LYS 82 -0.888 6.893 -6.081
170 HG2 LYS 82 1HG LYS 82 -1.706 8.688 -4.745
171 HG3 LYS 82 2HG LYS 82 -2.285 7.225 -3.951
172 HD2 LYS 82 1HD LYS 82 -0.452 7.325 -2.344
173 HD3 LYS 82 2HD LYS 82 0.239 8.716 -3.178
174 HE2 LYS 82 1HE LYS 82 -1.297 9.074 -1.061
175 HE3 LYS 82 2HE LYS 82 -1.429 10.158 -2.444
176 HZ1 LYS 82 3HZ LYS 82 -3.160 7.834 -1.816
177 HZ2 LYS 82 1HZ LYS 82 -3.214 8.673 -3.288
178 HZ3 LYS 82 2HZ LYS 82 -3.606 9.474 -1.842
179 H GLU 83 H GLU 83 1.955 5.403 -5.660
180 HA GLU 83 HA GLU 83 1.237 3.958 -8.006
181 HB2 GLU 83 1HB GLU 83 3.908 4.112 -6.570
182 HB3 GLU 83 2HB GLU 83 3.684 3.477 -8.200
183 HG2 GLU 83 1HG GLU 83 3.143 5.574 -9.085
184 HG3 GLU 83 2HG GLU 83 2.669 6.222 -7.515
185 H LEU 84 H LEU 84 2.412 2.799 -4.848
186 HA LEU 84 HA LEU 84 2.497 0.038 -5.732
187 HB2 LEU 84 1HB LEU 84 2.466 1.284 -2.966
188 HB3 LEU 84 2HB LEU 84 2.665 -0.445 -3.258
189 HG LEU 84 HG LEU 84 4.446 1.689 -4.468
190 HD11 LEU 84 1HD1 LEU 84 4.580 1.472 -1.933
191 HD12 LEU 84 2HD1 LEU 84 6.084 1.176 -2.804
192 HD13 LEU 84 3HD1 LEU 84 5.139 -0.181 -2.194
193 HD21 LEU 84 3HD2 LEU 84 4.273 -1.286 -4.614
194 HD22 LEU 84 1HD2 LEU 84 5.885 -0.577 -4.543
195 HD23 LEU 84 2HD2 LEU 84 4.779 -0.128 -5.842
196 H LEU 85 H LEU 85 0.092 2.102 -4.168
197 HA LEU 85 HA LEU 85 -1.781 -0.046 -3.648
198 HB2 LEU 85 1HB LEU 85 -2.055 2.962 -3.856
199 HB3 LEU 85 2HB LEU 85 -3.454 1.924 -3.587
200 HG LEU 85 HG LEU 85 -0.992 1.752 -1.848
201 HD11 LEU 85 1HD1 LEU 85 -2.071 3.248 -0.263
202 HD12 LEU 85 2HD1 LEU 85 -3.464 3.425 -1.332
203 HD13 LEU 85 3HD1 LEU 85 -1.896 4.079 -1.808
204 HD21 LEU 85 3HD2 LEU 85 -3.378 0.258 -2.051
205 HD22 LEU 85 1HD2 LEU 85 -3.558 1.251 -0.606
206 HD23 LEU 85 2HD2 LEU 85 -2.177 0.171 -0.764
207 H ALA 86 H ALA 86 -1.216 2.180 -6.347
208 HA ALA 86 HA ALA 86 -3.529 1.465 -7.869
209 HB1 ALA 86 1HB ALA 86 -0.997 2.075 -9.316
210 HB2 ALA 86 2HB ALA 86 -1.595 3.312 -8.210
211 HB3 ALA 86 3HB ALA 86 -2.610 2.754 -9.540
212 H GLU 87 H GLU 87 -0.358 -0.007 -7.474
213 HA GLU 87 HA GLU 87 -0.716 -1.953 -9.625
214 HB2 GLU 87 1HB GLU 87 1.532 -1.267 -8.689
215 HB3 GLU 87 2HB GLU 87 1.117 -2.136 -7.212
216 HG2 GLU 87 1HG GLU 87 0.581 -4.084 -8.970
217 HG3 GLU 87 2HG GLU 87 1.782 -3.206 -9.916
218 H TRP 88 H TRP 88 -1.380 -1.805 -6.171
219 HA TRP 88 HA TRP 88 -2.093 -4.595 -5.894
220 HB2 TRP 88 1HB TRP 88 -3.005 -2.207 -4.258
221 HB3 TRP 88 2HB TRP 88 -3.132 -3.898 -3.780
222 HD1 TRP 88 HD TRP 88 0.021 -3.864 -5.442
223 HE1 TRP 88 1HE TRP 88 1.988 -3.477 -3.805
224 HE3 TRP 88 3HE TRP 88 -2.526 -2.100 -1.386
225 HZ2 TRP 88 2HZ TRP 88 2.413 -2.541 -1.147
226 HZ3 TRP 88 3HZ TRP 88 -1.321 -1.469 0.683
227 HH2 TRP 88 HH TRP 88 1.147 -1.692 0.809
228 H LYS 89 H LYS 89 -3.756 -1.660 -6.861
229 HA LYS 89 HA LYS 89 -6.415 -2.853 -6.780
230 HB2 LYS 89 1HB LYS 89 -5.898 -0.368 -6.551
231 HB3 LYS 89 2HB LYS 89 -5.570 -0.366 -8.285
232 HG2 LYS 89 1HG LYS 89 -7.956 -1.624 -8.295
233 HG3 LYS 89 2HG LYS 89 -8.158 -0.637 -6.848
234 HD2 LYS 89 1HD LYS 89 -8.947 0.683 -8.694
235 HD3 LYS 89 2HD LYS 89 -7.383 1.351 -8.223
236 HE2 LYS 89 1HE LYS 89 -6.901 -0.732 -10.113
237 HE3 LYS 89 2HE LYS 89 -8.166 0.306 -10.769
238 HZ1 LYS 89 3HZ LYS 89 -6.443 1.573 -11.388
239 HZ2 LYS 89 1HZ LYS 89 -5.379 0.887 -10.259
240 HZ3 LYS 89 2HZ LYS 89 -6.458 2.107 -9.775
241 H ARG 90 H ARG 90 -3.984 -2.221 -9.320
242 HA ARG 90 HA ARG 90 -5.638 -2.962 -11.511
243 HB2 ARG 90 1HB ARG 90 -2.748 -2.649 -11.020
244 HB3 ARG 90 2HB ARG 90 -3.126 -3.850 -12.253
245 HG2 ARG 90 1HG ARG 90 -2.906 -1.751 -13.384
246 HG3 ARG 90 2HG ARG 90 -4.632 -2.103 -13.328
247 HD2 ARG 90 1HD ARG 90 -4.517 0.144 -12.635
248 HD3 ARG 90 2HD ARG 90 -4.608 -0.739 -11.112
249 HE ARG 90 HE ARG 90 -2.455 0.065 -10.623
250 HH11 ARG 90 1HH2 ARG 90 -3.075 0.076 -14.015
251 HH12 ARG 90 2HH2 ARG 90 -1.557 0.806 -14.422
252 HH21 ARG 90 1HH1 ARG 90 -0.475 1.018 -11.135
253 HH22 ARG 90 2HH1 ARG 90 -0.087 1.343 -12.791
254 H THR 91 H THR 91 -3.566 -4.921 -9.374
255 HA THR 91 HA THR 91 -4.610 -7.385 -10.688
256 HB THR 91 HB THR 91 -2.807 -8.525 -9.722
257 HG1 THR 91 1HG THR 91 -1.875 -7.918 -7.831
258 HG21 THR 91 3HG2 THR 91 -1.368 -5.940 -9.629
259 HG22 THR 91 1HG2 THR 91 -2.260 -6.258 -11.117
260 HG23 THR 91 2HG2 THR 91 -1.021 -7.389 -10.573
261 H GLY 92 H GLY 92 -4.501 -5.765 -7.529
262 HA2 GLY 92 1HA GLY 92 -6.536 -5.835 -6.123
263 HA3 GLY 92 2HA GLY 92 -6.811 -7.476 -6.705
Start of MODEL 12
1 H LYS 61 H LYS 61 -11.563 0.288 1.858
2 HA LYS 61 HA LYS 61 -10.231 -1.367 3.911
3 HB2 LYS 61 1HB LYS 61 -12.423 -1.860 2.420
4 HB3 LYS 61 2HB LYS 61 -11.200 -2.569 1.364
5 HG2 LYS 61 1HG LYS 61 -11.689 -4.381 2.736
6 HG3 LYS 61 2HG LYS 61 -10.340 -3.660 3.614
7 HD2 LYS 61 1HD LYS 61 -11.905 -2.452 5.069
8 HD3 LYS 61 2HD LYS 61 -13.271 -3.116 4.172
9 HE2 LYS 61 1HE LYS 61 -12.256 -5.431 4.758
10 HE3 LYS 61 2HE LYS 61 -11.331 -4.552 5.977
11 HZ1 LYS 61 3HZ LYS 61 -13.862 -5.489 6.277
12 HZ2 LYS 61 1HZ LYS 61 -14.108 -3.843 5.949
13 HZ3 LYS 61 2HZ LYS 61 -13.121 -4.310 7.251
14 H ILE 62 H ILE 62 -8.049 -1.642 3.748
15 HA ILE 62 HA ILE 62 -6.826 -1.508 1.023
16 HB ILE 62 HB ILE 62 -5.540 -1.072 3.731
17 HG12 ILE 62 1HG1 ILE 62 -6.203 0.917 1.538
18 HG13 ILE 62 2HG1 ILE 62 -7.174 0.694 2.993
19 HG21 ILE 62 1HG2 ILE 62 -4.535 -1.046 0.888
20 HG22 ILE 62 2HG2 ILE 62 -3.835 -1.844 2.297
21 HG23 ILE 62 3HG2 ILE 62 -3.734 -0.091 2.136
22 HD11 ILE 62 3HD1 ILE 62 -5.174 2.506 2.831
23 HD12 ILE 62 1HD1 ILE 62 -4.264 1.114 3.418
24 HD13 ILE 62 2HD1 ILE 62 -5.635 1.723 4.342
25 H THR 63 H THR 63 -5.667 -3.235 0.287
26 HA THR 63 HA THR 63 -5.329 -5.579 2.131
27 HB THR 63 HB THR 63 -5.176 -6.686 -0.328
28 HG1 THR 63 1HG THR 63 -5.972 -4.271 -0.825
29 HG21 THR 63 3HG2 THR 63 -7.619 -6.075 1.344
30 HG22 THR 63 1HG2 THR 63 -6.642 -7.544 1.352
31 HG23 THR 63 2HG2 THR 63 -7.660 -7.171 -0.038
32 H PHE 64 H PHE 64 -3.223 -5.965 2.597
33 HA PHE 64 HA PHE 64 -1.166 -4.814 0.801
34 HB2 PHE 64 1HB PHE 64 -0.867 -5.975 3.583
35 HB3 PHE 64 2HB PHE 64 0.355 -5.071 2.688
36 HD1 PHE 64 1HD PHE 64 -0.190 -2.686 1.987
37 HD2 PHE 64 2HD PHE 64 -2.482 -4.842 4.898
38 HE1 PHE 64 1HE PHE 64 -1.130 -0.550 2.819
39 HE2 PHE 64 2HE PHE 64 -3.421 -2.707 5.742
40 HZ PHE 64 HZ PHE 64 -2.747 -0.560 4.696
41 HA PRO 65 HA PRO 65 -0.282 -8.867 -0.983
42 HB2 PRO 65 1HB PRO 65 2.541 -7.959 -0.729
43 HB3 PRO 65 2HB PRO 65 1.684 -8.617 -2.133
44 HG2 PRO 65 1HG PRO 65 2.249 -6.005 -1.861
45 HG3 PRO 65 2HG PRO 65 0.826 -6.599 -2.724
46 HD2 PRO 65 1HD PRO 65 0.972 -5.207 -0.128
47 HD3 PRO 65 2HD PRO 65 -0.407 -5.407 -1.227
48 H SER 66 H SER 66 0.822 -10.843 -0.347
49 HA SER 66 HA SER 66 0.979 -11.308 2.490
50 HB2 SER 66 1HB SER 66 0.773 -12.895 0.264
51 HB3 SER 66 2HB SER 66 2.445 -13.174 0.746
52 HG SER 66 HG SER 66 0.992 -13.166 2.944
53 H ASP 67 H ASP 67 3.120 -9.650 0.550
54 HA ASP 67 HA ASP 67 5.415 -10.412 2.322
55 HB2 ASP 67 1HB ASP 67 5.294 -9.856 -0.621
56 HB3 ASP 67 2HB ASP 67 6.771 -9.480 0.267
57 H ILE 68 H ILE 68 3.243 -8.067 2.130
58 HA ILE 68 HA ILE 68 5.258 -5.872 2.431
59 HB ILE 68 HB ILE 68 2.386 -5.817 1.517
60 HG12 ILE 68 1HG1 ILE 68 4.041 -6.282 -0.238
61 HG13 ILE 68 2HG1 ILE 68 3.376 -4.665 -0.448
62 HG21 ILE 68 1HG2 ILE 68 2.449 -3.940 2.913
63 HG22 ILE 68 2HG2 ILE 68 2.926 -3.269 1.353
64 HG23 ILE 68 3HG2 ILE 68 4.151 -3.624 2.573
65 HD11 ILE 68 3HD1 ILE 68 5.485 -4.032 1.097
66 HD12 ILE 68 1HD1 ILE 68 5.602 -4.140 -0.658
67 HD13 ILE 68 2HD1 ILE 68 6.126 -5.491 0.344
68 H ASP 69 H ASP 69 5.438 -5.004 4.367
69 HA ASP 69 HA ASP 69 3.601 -5.822 6.526
70 HB2 ASP 69 1HB ASP 69 6.058 -5.809 6.899
71 HB3 ASP 69 2HB ASP 69 6.071 -4.069 6.636
72 HA PRO 70 HA PRO 70 1.185 -2.094 6.058
73 HB2 PRO 70 1HB PRO 70 0.059 -1.990 8.571
74 HB3 PRO 70 2HB PRO 70 -0.511 -3.040 7.260
75 HG2 PRO 70 1HG PRO 70 1.172 -3.693 9.615
76 HG3 PRO 70 2HG PRO 70 -0.069 -4.661 8.803
77 HD2 PRO 70 1HD PRO 70 2.616 -5.077 8.457
78 HD3 PRO 70 2HD PRO 70 1.404 -5.467 7.220
79 H GLN 71 H GLN 71 3.187 -2.384 8.991
80 HA GLN 71 HA GLN 71 3.152 0.491 9.506
81 HB2 GLN 71 1HB GLN 71 5.318 -1.298 10.556
82 HB3 GLN 71 2HB GLN 71 4.461 0.012 11.369
83 HG2 GLN 71 1HG GLN 71 2.393 -1.677 10.929
84 HG3 GLN 71 2HG GLN 71 3.706 -2.845 11.075
85 HE21 GLN 71 1HE2 GLN 71 2.498 0.108 12.777
86 HE22 GLN 71 2HE2 GLN 71 2.852 -0.472 14.333
87 H VAL 72 H VAL 72 5.168 -1.696 7.639
88 HA VAL 72 HA VAL 72 7.248 0.345 7.280
89 HB VAL 72 HB VAL 72 6.836 -2.186 5.668
90 HG11 VAL 72 1HG1 VAL 72 9.558 -1.577 6.050
91 HG12 VAL 72 2HG1 VAL 72 8.781 -0.043 5.660
92 HG13 VAL 72 3HG1 VAL 72 8.632 -1.412 4.559
93 HG21 VAL 72 3HG2 VAL 72 6.940 -2.603 8.151
94 HG22 VAL 72 1HG2 VAL 72 8.517 -1.813 8.165
95 HG23 VAL 72 2HG2 VAL 72 8.289 -3.309 7.259
96 H PHE 73 H PHE 73 4.285 -0.635 5.738
97 HA PHE 73 HA PHE 73 4.831 0.583 3.161
98 HB2 PHE 73 1HB PHE 73 3.094 -1.227 3.697
99 HB3 PHE 73 2HB PHE 73 2.113 0.067 4.382
100 HD1 PHE 73 1HD PHE 73 4.170 -0.529 1.287
101 HD2 PHE 73 2HD PHE 73 0.532 1.005 2.975
102 HE1 PHE 73 1HE PHE 73 3.370 0.072 -0.982
103 HE2 PHE 73 2HE PHE 73 -0.268 1.607 0.707
104 HZ PHE 73 HZ PHE 73 1.152 1.142 -1.273
105 H TYR 74 H TYR 74 2.750 1.568 5.918
106 HA TYR 74 HA TYR 74 2.107 4.134 4.870
107 HB2 TYR 74 1HB TYR 74 2.515 3.477 7.808
108 HB3 TYR 74 2HB TYR 74 1.539 4.788 7.151
109 HD1 TYR 74 2HD TYR 74 -0.132 3.757 5.145
110 HD2 TYR 74 1HD TYR 74 1.250 1.756 8.685
111 HE1 TYR 74 2HE TYR 74 -2.103 2.251 5.066
112 HE2 TYR 74 1HE TYR 74 -0.720 0.255 8.609
113 HH TYR 74 HH TYR 74 -3.366 0.810 6.407
114 H GLU 75 H GLU 75 5.093 2.926 5.997
115 HA GLU 75 HA GLU 75 6.188 5.527 6.770
116 HB2 GLU 75 1HB GLU 75 6.927 2.820 7.104
117 HB3 GLU 75 2HB GLU 75 8.199 3.555 6.129
118 HG2 GLU 75 1HG GLU 75 8.417 5.375 7.784
119 HG3 GLU 75 2HG GLU 75 7.150 4.634 8.763
120 H LEU 76 H LEU 76 5.461 4.107 3.813
121 HA LEU 76 HA LEU 76 7.800 5.202 2.400
122 HB2 LEU 76 1HB LEU 76 5.305 3.901 1.280
123 HB3 LEU 76 2HB LEU 76 6.795 4.225 0.398
124 HG LEU 76 HG LEU 76 6.541 2.395 2.803
125 HD11 LEU 76 1HD1 LEU 76 6.752 0.581 1.276
126 HD12 LEU 76 2HD1 LEU 76 7.214 1.651 -0.050
127 HD13 LEU 76 3HD1 LEU 76 5.555 1.651 0.548
128 HD21 LEU 76 3HD2 LEU 76 8.746 3.108 2.923
129 HD22 LEU 76 1HD2 LEU 76 8.839 3.449 1.195
130 HD23 LEU 76 2HD2 LEU 76 8.921 1.784 1.771
131 HA PRO 77 HA PRO 77 6.084 9.182 1.417
132 HB2 PRO 77 1HB PRO 77 6.718 8.778 -1.437
133 HB3 PRO 77 2HB PRO 77 7.320 10.009 -0.317
134 HG2 PRO 77 1HG PRO 77 8.776 7.886 -1.233
135 HG3 PRO 77 2HG PRO 77 9.114 8.782 0.253
136 HD2 PRO 77 1HD PRO 77 8.071 6.055 -0.063
137 HD3 PRO 77 2HD PRO 77 8.779 6.841 1.363
138 H GLU 78 H GLU 78 4.275 10.177 0.260
139 HA GLU 78 HA GLU 78 2.059 8.414 -0.172
140 HB2 GLU 78 1HB GLU 78 2.571 11.285 -0.235
141 HB3 GLU 78 2HB GLU 78 1.437 10.789 -1.492
142 HG2 GLU 78 1HG GLU 78 0.079 9.606 0.197
143 HG3 GLU 78 2HG GLU 78 1.207 10.110 1.456
144 H ALA 79 H ALA 79 4.058 10.257 -2.521
145 HA ALA 79 HA ALA 79 2.752 9.402 -4.862
146 HB1 ALA 79 1HB ALA 79 4.445 11.063 -5.098
147 HB2 ALA 79 2HB ALA 79 5.080 9.645 -5.931
148 HB3 ALA 79 3HB ALA 79 5.656 10.049 -4.313
149 H VAL 80 H VAL 80 5.146 7.718 -2.879
150 HA VAL 80 HA VAL 80 5.405 5.468 -4.730
151 HB VAL 80 HB VAL 80 6.185 5.815 -1.817
152 HG11 VAL 80 1HG1 VAL 80 6.116 3.512 -1.956
153 HG12 VAL 80 2HG1 VAL 80 7.721 3.788 -2.635
154 HG13 VAL 80 3HG1 VAL 80 6.347 3.505 -3.705
155 HG21 VAL 80 3HG2 VAL 80 8.443 6.064 -2.709
156 HG22 VAL 80 1HG2 VAL 80 7.385 7.236 -3.493
157 HG23 VAL 80 2HG2 VAL 80 7.861 5.769 -4.347
158 H GLN 81 H GLN 81 3.538 6.292 -1.880
159 HA GLN 81 HA GLN 81 2.384 3.723 -1.354
160 HB2 GLN 81 1HB GLN 81 2.342 5.883 0.066
161 HB3 GLN 81 2HB GLN 81 0.955 6.340 -0.916
162 HG2 GLN 81 1HG GLN 81 -0.292 5.134 0.528
163 HG3 GLN 81 2HG GLN 81 0.417 3.700 -0.220
164 HE21 GLN 81 1HE2 GLN 81 1.052 6.092 2.387
165 HE22 GLN 81 2HE2 GLN 81 1.933 5.022 3.353
166 H LYS 82 H LYS 82 1.205 6.492 -3.278
167 HA LYS 82 HA LYS 82 -1.228 5.287 -4.156
168 HB2 LYS 82 1HB LYS 82 0.462 7.585 -5.004
169 HB3 LYS 82 2HB LYS 82 -0.685 6.963 -6.189
170 HG2 LYS 82 1HG LYS 82 -1.814 8.684 -4.937
171 HG3 LYS 82 2HG LYS 82 -2.480 7.140 -4.407
172 HD2 LYS 82 1HD LYS 82 -0.764 7.184 -2.526
173 HD3 LYS 82 2HD LYS 82 -0.429 8.855 -2.988
174 HE2 LYS 82 1HE LYS 82 -2.763 9.466 -2.600
175 HE3 LYS 82 2HE LYS 82 -3.165 7.789 -2.230
176 HZ1 LYS 82 3HZ LYS 82 -1.084 8.300 -0.581
177 HZ2 LYS 82 1HZ LYS 82 -2.719 8.351 -0.135
178 HZ3 LYS 82 2HZ LYS 82 -1.917 9.781 -0.578
179 H GLU 83 H GLU 83 1.944 5.518 -5.819
180 HA GLU 83 HA GLU 83 1.163 4.100 -8.145
181 HB2 GLU 83 1HB GLU 83 3.869 4.208 -6.778
182 HB3 GLU 83 2HB GLU 83 3.598 3.595 -8.409
183 HG2 GLU 83 1HG GLU 83 2.324 6.146 -8.203
184 HG3 GLU 83 2HG GLU 83 3.970 6.305 -7.588
185 H LEU 84 H LEU 84 2.403 2.866 -5.040
186 HA LEU 84 HA LEU 84 2.426 0.118 -5.975
187 HB2 LEU 84 1HB LEU 84 2.474 1.292 -3.177
188 HB3 LEU 84 2HB LEU 84 2.683 -0.424 -3.535
189 HG LEU 84 HG LEU 84 4.419 1.795 -4.661
190 HD11 LEU 84 1HD1 LEU 84 4.706 1.463 -2.206
191 HD12 LEU 84 2HD1 LEU 84 6.138 0.994 -3.122
192 HD13 LEU 84 3HD1 LEU 84 5.044 -0.243 -2.503
193 HD21 LEU 84 3HD2 LEU 84 4.728 0.110 -6.193
194 HD22 LEU 84 1HD2 LEU 84 4.206 -1.148 -5.073
195 HD23 LEU 84 2HD2 LEU 84 5.836 -0.484 -4.956
196 H LEU 85 H LEU 85 0.096 2.166 -4.275
197 HA LEU 85 HA LEU 85 -1.772 0.034 -3.719
198 HB2 LEU 85 1HB LEU 85 -2.023 3.044 -3.914
199 HB3 LEU 85 2HB LEU 85 -3.425 2.021 -3.603
200 HG LEU 85 HG LEU 85 -0.911 1.797 -1.943
201 HD11 LEU 85 1HD1 LEU 85 -2.049 3.281 -0.294
202 HD12 LEU 85 2HD1 LEU 85 -3.295 3.618 -1.496
203 HD13 LEU 85 3HD1 LEU 85 -1.631 4.126 -1.783
204 HD21 LEU 85 3HD2 LEU 85 -3.488 1.371 -0.658
205 HD22 LEU 85 1HD2 LEU 85 -2.115 0.276 -0.786
206 HD23 LEU 85 2HD2 LEU 85 -3.311 0.341 -2.076
207 H ALA 86 H ALA 86 -1.286 2.254 -6.434
208 HA ALA 86 HA ALA 86 -3.652 1.526 -7.879
209 HB1 ALA 86 1HB ALA 86 -1.104 2.263 -9.290
210 HB2 ALA 86 2HB ALA 86 -1.914 3.465 -8.285
211 HB3 ALA 86 3HB ALA 86 -2.757 2.749 -9.657
212 H GLU 87 H GLU 87 -0.470 0.071 -7.571
213 HA GLU 87 HA GLU 87 -0.864 -1.823 -9.767
214 HB2 GLU 87 1HB GLU 87 1.411 -1.193 -9.031
215 HB3 GLU 87 2HB GLU 87 1.087 -1.879 -7.440
216 HG2 GLU 87 1HG GLU 87 1.658 -3.926 -8.177
217 HG3 GLU 87 2HG GLU 87 0.426 -3.833 -9.436
218 H TRP 88 H TRP 88 -1.331 -1.853 -6.254
219 HA TRP 88 HA TRP 88 -1.993 -4.658 -6.055
220 HB2 TRP 88 1HB TRP 88 -2.921 -2.337 -4.336
221 HB3 TRP 88 2HB TRP 88 -3.037 -4.042 -3.912
222 HD1 TRP 88 HD TRP 88 0.107 -4.130 -5.500
223 HE1 TRP 88 1HE TRP 88 2.067 -3.721 -3.869
224 HE3 TRP 88 3HE TRP 88 -2.411 -2.052 -1.567
225 HZ2 TRP 88 2HZ TRP 88 2.511 -2.649 -1.270
226 HZ3 TRP 88 3HZ TRP 88 -1.191 -1.347 0.472
227 HH2 TRP 88 HH TRP 88 1.268 -1.641 0.622
228 H LYS 89 H LYS 89 -3.818 -1.742 -6.808
229 HA LYS 89 HA LYS 89 -6.425 -3.026 -6.742
230 HB2 LYS 89 1HB LYS 89 -6.652 -0.731 -6.529
231 HB3 LYS 89 2HB LYS 89 -5.342 -0.391 -7.662
232 HG2 LYS 89 1HG LYS 89 -6.700 -0.827 -9.546
233 HG3 LYS 89 2HG LYS 89 -7.908 -1.682 -8.588
234 HD2 LYS 89 1HD LYS 89 -8.857 0.269 -7.785
235 HD3 LYS 89 2HD LYS 89 -7.355 1.183 -7.927
236 HE2 LYS 89 1HE LYS 89 -8.974 0.213 -10.298
237 HE3 LYS 89 2HE LYS 89 -9.092 1.837 -9.621
238 HZ1 LYS 89 3HZ LYS 89 -7.511 1.491 -11.561
239 HZ2 LYS 89 1HZ LYS 89 -6.499 0.691 -10.459
240 HZ3 LYS 89 2HZ LYS 89 -6.904 2.321 -10.208
241 H ARG 90 H ARG 90 -3.997 -2.432 -9.270
242 HA ARG 90 HA ARG 90 -5.650 -3.138 -11.469
243 HB2 ARG 90 1HB ARG 90 -3.080 -2.256 -11.206
244 HB3 ARG 90 2HB ARG 90 -2.797 -3.952 -11.597
245 HG2 ARG 90 1HG ARG 90 -4.616 -3.482 -13.460
246 HG3 ARG 90 2HG ARG 90 -4.082 -1.815 -13.251
247 HD2 ARG 90 1HD ARG 90 -2.520 -2.464 -14.813
248 HD3 ARG 90 2HD ARG 90 -1.676 -3.003 -13.364
249 HE ARG 90 HE ARG 90 -2.235 -5.270 -13.913
250 HH11 ARG 90 1HH2 ARG 90 -3.613 -2.933 -16.057
251 HH12 ARG 90 2HH2 ARG 90 -3.997 -4.096 -17.279
252 HH21 ARG 90 1HH1 ARG 90 -2.737 -6.790 -15.502
253 HH22 ARG 90 2HH1 ARG 90 -3.503 -6.273 -16.968
254 H THR 91 H THR 91 -3.573 -5.129 -9.351
255 HA THR 91 HA THR 91 -4.662 -7.562 -10.692
256 HB THR 91 HB THR 91 -2.753 -8.650 -10.046
257 HG1 THR 91 1HG THR 91 -2.451 -8.791 -7.992
258 HG21 THR 91 3HG2 THR 91 -1.596 -5.960 -9.386
259 HG22 THR 91 1HG2 THR 91 -2.182 -6.280 -11.020
260 HG23 THR 91 2HG2 THR 91 -0.894 -7.272 -10.333
261 H GLY 92 H GLY 92 -4.390 -6.031 -7.492
262 HA2 GLY 92 1HA GLY 92 -6.299 -6.120 -5.952
263 HA3 GLY 92 2HA GLY 92 -6.723 -7.688 -6.638
Start of MODEL 13
1 H LYS 61 H LYS 61 -12.137 -0.492 1.694
2 HA LYS 61 HA LYS 61 -10.749 -1.830 3.940
3 HB2 LYS 61 1HB LYS 61 -11.966 -2.858 1.365
4 HB3 LYS 61 2HB LYS 61 -11.120 -3.889 2.516
5 HG2 LYS 61 1HG LYS 61 -13.433 -2.119 3.332
6 HG3 LYS 61 2HG LYS 61 -13.669 -3.770 2.761
7 HD2 LYS 61 1HD LYS 61 -11.579 -3.781 4.730
8 HD3 LYS 61 2HD LYS 61 -12.968 -2.917 5.386
9 HE2 LYS 61 1HE LYS 61 -14.435 -4.801 4.810
10 HE3 LYS 61 2HE LYS 61 -13.066 -5.664 4.108
11 HZ1 LYS 61 3HZ LYS 61 -13.309 -6.484 6.281
12 HZ2 LYS 61 1HZ LYS 61 -13.497 -4.934 6.943
13 HZ3 LYS 61 2HZ LYS 61 -11.983 -5.424 6.349
14 H ILE 62 H ILE 62 -8.540 -1.970 3.911
15 HA ILE 62 HA ILE 62 -7.160 -1.604 1.295
16 HB ILE 62 HB ILE 62 -6.080 -1.404 4.121
17 HG12 ILE 62 1HG1 ILE 62 -6.570 0.806 2.107
18 HG13 ILE 62 2HG1 ILE 62 -7.738 0.374 3.356
19 HG21 ILE 62 1HG2 ILE 62 -4.144 -0.314 2.901
20 HG22 ILE 62 2HG2 ILE 62 -4.860 -0.891 1.397
21 HG23 ILE 62 3HG2 ILE 62 -4.314 -2.045 2.613
22 HD11 ILE 62 3HD1 ILE 62 -4.902 1.351 3.776
23 HD12 ILE 62 1HD1 ILE 62 -5.925 0.726 5.069
24 HD13 ILE 62 2HD1 ILE 62 -6.390 2.193 4.206
25 H THR 63 H THR 63 -5.716 -3.143 0.548
26 HA THR 63 HA THR 63 -5.456 -5.659 2.155
27 HB THR 63 HB THR 63 -5.494 -6.878 -0.033
28 HG1 THR 63 1HG THR 63 -4.948 -5.082 -1.331
29 HG21 THR 63 3HG2 THR 63 -7.544 -7.001 1.086
30 HG22 THR 63 1HG2 THR 63 -8.014 -6.314 -0.469
31 HG23 THR 63 2HG2 THR 63 -7.837 -5.268 0.940
32 H PHE 64 H PHE 64 -3.353 -5.900 2.684
33 HA PHE 64 HA PHE 64 -1.292 -4.686 0.932
34 HB2 PHE 64 1HB PHE 64 -1.022 -5.901 3.696
35 HB3 PHE 64 2HB PHE 64 0.226 -5.007 2.829
36 HD1 PHE 64 1HD PHE 64 -0.323 -2.587 2.116
37 HD2 PHE 64 2HD PHE 64 -2.576 -4.764 5.051
38 HE1 PHE 64 1HE PHE 64 -1.216 -0.453 3.009
39 HE2 PHE 64 2HE PHE 64 -3.473 -2.632 5.944
40 HZ PHE 64 HZ PHE 64 -2.793 -0.475 4.923
41 HA PRO 65 HA PRO 65 -0.318 -8.661 -0.975
42 HB2 PRO 65 1HB PRO 65 2.478 -7.691 -0.627
43 HB3 PRO 65 2HB PRO 65 1.680 -8.354 -2.065
44 HG2 PRO 65 1HG PRO 65 2.145 -5.737 -1.763
45 HG3 PRO 65 2HG PRO 65 0.735 -6.360 -2.628
46 HD2 PRO 65 1HD PRO 65 0.854 -5.011 -0.000
47 HD3 PRO 65 2HD PRO 65 -0.517 -5.210 -1.110
48 H SER 66 H SER 66 0.687 -10.663 -0.345
49 HA SER 66 HA SER 66 0.866 -11.171 2.473
50 HB2 SER 66 1HB SER 66 1.873 -12.791 0.120
51 HB3 SER 66 2HB SER 66 1.740 -13.384 1.774
52 HG SER 66 HG SER 66 -0.412 -13.336 1.633
53 H ASP 67 H ASP 67 3.030 -9.520 0.553
54 HA ASP 67 HA ASP 67 5.311 -10.344 2.313
55 HB2 ASP 67 1HB ASP 67 5.250 -9.617 -0.612
56 HB3 ASP 67 2HB ASP 67 6.735 -9.487 0.332
57 H ILE 68 H ILE 68 3.157 -7.979 2.137
58 HA ILE 68 HA ILE 68 5.177 -5.802 2.508
59 HB ILE 68 HB ILE 68 2.316 -5.722 1.574
60 HG12 ILE 68 1HG1 ILE 68 4.021 -6.088 -0.161
61 HG13 ILE 68 2HG1 ILE 68 3.313 -4.483 -0.324
62 HG21 ILE 68 1HG2 ILE 68 2.822 -3.160 1.539
63 HG22 ILE 68 2HG2 ILE 68 4.022 -3.557 2.769
64 HG23 ILE 68 3HG2 ILE 68 2.319 -3.913 3.052
65 HD11 ILE 68 3HD1 ILE 68 6.075 -5.262 0.442
66 HD12 ILE 68 1HD1 ILE 68 5.391 -3.882 1.300
67 HD13 ILE 68 2HD1 ILE 68 5.508 -3.856 -0.457
68 H ASP 69 H ASP 69 5.387 -5.017 4.469
69 HA ASP 69 HA ASP 69 3.506 -5.824 6.600
70 HB2 ASP 69 1HB ASP 69 6.033 -5.865 6.890
71 HB3 ASP 69 2HB ASP 69 5.983 -4.105 6.867
72 HA PRO 70 HA PRO 70 1.247 -1.997 6.180
73 HB2 PRO 70 1HB PRO 70 0.221 -1.814 8.742
74 HB3 PRO 70 2HB PRO 70 -0.468 -2.807 7.445
75 HG2 PRO 70 1HG PRO 70 1.246 -3.601 9.731
76 HG3 PRO 70 2HG PRO 70 -0.083 -4.475 8.955
77 HD2 PRO 70 1HD PRO 70 2.537 -5.086 8.519
78 HD3 PRO 70 2HD PRO 70 1.275 -5.341 7.296
79 H GLN 71 H GLN 71 3.334 -2.333 9.049
80 HA GLN 71 HA GLN 71 3.415 0.548 9.531
81 HB2 GLN 71 1HB GLN 71 5.256 -1.642 10.543
82 HB3 GLN 71 2HB GLN 71 5.133 -0.006 11.191
83 HG2 GLN 71 1HG GLN 71 2.619 -0.542 11.514
84 HG3 GLN 71 2HG GLN 71 3.098 -2.228 11.309
85 HE21 GLN 71 1HE2 GLN 71 5.428 -2.505 12.680
86 HE22 GLN 71 2HE2 GLN 71 5.261 -2.040 14.304
87 H VAL 72 H VAL 72 5.364 -1.722 7.665
88 HA VAL 72 HA VAL 72 7.446 0.313 7.246
89 HB VAL 72 HB VAL 72 7.048 -2.371 5.895
90 HG11 VAL 72 1HG1 VAL 72 9.323 -0.373 5.915
91 HG12 VAL 72 2HG1 VAL 72 8.417 -0.949 4.517
92 HG13 VAL 72 3HG1 VAL 72 9.504 -2.041 5.373
93 HG21 VAL 72 3HG2 VAL 72 8.362 -1.475 8.425
94 HG22 VAL 72 1HG2 VAL 72 9.192 -2.705 7.474
95 HG23 VAL 72 2HG2 VAL 72 7.558 -3.000 8.065
96 H PHE 73 H PHE 73 4.485 -0.713 5.743
97 HA PHE 73 HA PHE 73 5.056 0.373 3.106
98 HB2 PHE 73 1HB PHE 73 3.355 -1.390 3.501
99 HB3 PHE 73 2HB PHE 73 2.411 -0.246 4.456
100 HD1 PHE 73 2HD PHE 73 3.986 -0.619 1.074
101 HD2 PHE 73 1HD PHE 73 0.803 1.086 3.401
102 HE1 PHE 73 2HE PHE 73 2.926 0.232 -1.000
103 HE2 PHE 73 1HE PHE 73 -0.258 1.938 1.326
104 HZ PHE 73 HZ PHE 73 0.803 1.511 -0.874
105 H TYR 74 H TYR 74 2.937 1.458 5.781
106 HA TYR 74 HA TYR 74 2.343 3.985 4.612
107 HB2 TYR 74 1HB TYR 74 2.368 3.033 7.483
108 HB3 TYR 74 2HB TYR 74 1.934 4.691 7.066
109 HD1 TYR 74 2HD TYR 74 0.253 4.800 4.920
110 HD2 TYR 74 1HD TYR 74 0.596 1.541 7.701
111 HE1 TYR 74 2HE TYR 74 -2.034 4.053 4.329
112 HE2 TYR 74 1HE TYR 74 -1.693 0.796 7.108
113 HH TYR 74 HH TYR 74 -3.731 2.692 4.915
114 H GLU 75 H GLU 75 5.275 2.835 5.954
115 HA GLU 75 HA GLU 75 6.316 5.438 6.764
116 HB2 GLU 75 1HB GLU 75 7.258 2.656 6.674
117 HB3 GLU 75 2HB GLU 75 8.510 3.830 6.266
118 HG2 GLU 75 1HG GLU 75 8.126 5.043 8.333
119 HG3 GLU 75 2HG GLU 75 6.743 4.018 8.721
120 H LEU 76 H LEU 76 5.580 4.130 3.790
121 HA LEU 76 HA LEU 76 7.880 5.311 2.358
122 HB2 LEU 76 1HB LEU 76 5.427 3.794 1.419
123 HB3 LEU 76 2HB LEU 76 6.679 4.393 0.335
124 HG LEU 76 HG LEU 76 7.198 2.513 2.656
125 HD11 LEU 76 1HD1 LEU 76 7.587 0.863 0.734
126 HD12 LEU 76 2HD1 LEU 76 6.727 2.014 -0.287
127 HD13 LEU 76 3HD1 LEU 76 5.908 1.271 1.088
128 HD21 LEU 76 3HD2 LEU 76 9.329 3.186 2.271
129 HD22 LEU 76 1HD2 LEU 76 8.882 4.009 0.777
130 HD23 LEU 76 2HD2 LEU 76 9.218 2.279 0.763
131 HA PRO 77 HA PRO 77 5.946 9.209 1.551
132 HB2 PRO 77 1HB PRO 77 6.605 9.492 -1.162
133 HB3 PRO 77 2HB PRO 77 7.603 9.997 0.211
134 HG2 PRO 77 1HG PRO 77 7.823 7.609 -1.502
135 HG3 PRO 77 2HG PRO 77 9.080 8.504 -0.639
136 HD2 PRO 77 1HD PRO 77 8.144 6.076 0.186
137 HD3 PRO 77 2HD PRO 77 8.792 7.288 1.305
138 H GLU 78 H GLU 78 4.154 10.197 0.347
139 HA GLU 78 HA GLU 78 2.011 8.411 -0.198
140 HB2 GLU 78 1HB GLU 78 0.870 10.404 -1.144
141 HB3 GLU 78 2HB GLU 78 1.623 10.742 0.414
142 HG2 GLU 78 1HG GLU 78 3.687 11.378 -1.173
143 HG3 GLU 78 2HG GLU 78 2.375 11.705 -2.303
144 H ALA 79 H ALA 79 4.061 10.236 -2.523
145 HA ALA 79 HA ALA 79 2.832 9.362 -4.880
146 HB1 ALA 79 1HB ALA 79 4.576 10.950 -5.133
147 HB2 ALA 79 2HB ALA 79 5.223 9.481 -5.864
148 HB3 ALA 79 3HB ALA 79 5.723 9.954 -4.240
149 H VAL 80 H VAL 80 5.082 7.623 -2.791
150 HA VAL 80 HA VAL 80 5.303 5.346 -4.618
151 HB VAL 80 HB VAL 80 6.130 5.820 -1.746
152 HG11 VAL 80 1HG1 VAL 80 7.387 3.568 -2.210
153 HG12 VAL 80 2HG1 VAL 80 6.117 3.311 -3.408
154 HG13 VAL 80 3HG1 VAL 80 5.696 3.514 -1.707
155 HG21 VAL 80 3HG2 VAL 80 7.416 6.891 -3.619
156 HG22 VAL 80 1HG2 VAL 80 7.723 5.282 -4.272
157 HG23 VAL 80 2HG2 VAL 80 8.373 5.732 -2.695
158 H GLN 81 H GLN 81 3.426 6.250 -1.787
159 HA GLN 81 HA GLN 81 2.197 3.715 -1.266
160 HB2 GLN 81 1HB GLN 81 2.147 5.733 0.242
161 HB3 GLN 81 2HB GLN 81 0.987 6.466 -0.863
162 HG2 GLN 81 1HG GLN 81 -0.720 5.165 -0.128
163 HG3 GLN 81 2HG GLN 81 0.286 3.719 -0.064
164 HE21 GLN 81 1HE2 GLN 81 2.310 4.614 1.735
165 HE22 GLN 81 2HE2 GLN 81 1.606 4.893 3.251
166 H LYS 82 H LYS 82 1.052 6.520 -3.166
167 HA LYS 82 HA LYS 82 -1.356 5.315 -4.106
168 HB2 LYS 82 1HB LYS 82 0.385 7.573 -5.067
169 HB3 LYS 82 2HB LYS 82 -0.977 7.030 -6.044
170 HG2 LYS 82 1HG LYS 82 -1.849 8.777 -4.685
171 HG3 LYS 82 2HG LYS 82 -2.403 7.292 -3.916
172 HD2 LYS 82 1HD LYS 82 -0.526 7.413 -2.320
173 HD3 LYS 82 2HD LYS 82 0.045 8.889 -3.098
174 HE2 LYS 82 1HE LYS 82 -2.798 8.934 -2.302
175 HE3 LYS 82 2HE LYS 82 -1.657 8.846 -0.959
176 HZ1 LYS 82 3HZ LYS 82 -2.292 11.055 -2.584
177 HZ2 LYS 82 1HZ LYS 82 -0.649 10.686 -2.783
178 HZ3 LYS 82 2HZ LYS 82 -1.267 10.992 -1.231
179 H GLU 83 H GLU 83 1.849 5.586 -5.698
180 HA GLU 83 HA GLU 83 1.127 4.190 -8.058
181 HB2 GLU 83 1HB GLU 83 3.805 4.301 -6.633
182 HB3 GLU 83 2HB GLU 83 3.572 3.704 -8.277
183 HG2 GLU 83 1HG GLU 83 2.894 5.842 -9.069
184 HG3 GLU 83 2HG GLU 83 2.668 6.461 -7.434
185 H LEU 84 H LEU 84 2.258 2.928 -4.924
186 HA LEU 84 HA LEU 84 2.351 0.193 -5.900
187 HB2 LEU 84 1HB LEU 84 2.311 1.351 -3.096
188 HB3 LEU 84 2HB LEU 84 2.478 -0.372 -3.435
189 HG LEU 84 HG LEU 84 4.334 1.783 -4.490
190 HD11 LEU 84 1HD1 LEU 84 4.744 -0.263 -2.286
191 HD12 LEU 84 2HD1 LEU 84 4.544 1.472 -2.045
192 HD13 LEU 84 3HD1 LEU 84 5.964 0.858 -2.889
193 HD21 LEU 84 3HD2 LEU 84 4.032 -1.146 -4.926
194 HD22 LEU 84 1HD2 LEU 84 5.679 -0.549 -4.725
195 HD23 LEU 84 2HD2 LEU 84 4.659 0.094 -6.012
196 H LEU 85 H LEU 85 -0.066 2.198 -4.261
197 HA LEU 85 HA LEU 85 -1.912 0.029 -3.788
198 HB2 LEU 85 1HB LEU 85 -2.238 3.032 -3.976
199 HB3 LEU 85 2HB LEU 85 -3.620 1.967 -3.721
200 HG LEU 85 HG LEU 85 -1.162 1.835 -1.967
201 HD11 LEU 85 1HD1 LEU 85 -3.685 3.426 -1.427
202 HD12 LEU 85 2HD1 LEU 85 -2.164 4.143 -1.958
203 HD13 LEU 85 3HD1 LEU 85 -2.256 3.322 -0.399
204 HD21 LEU 85 3HD2 LEU 85 -3.524 0.292 -2.201
205 HD22 LEU 85 1HD2 LEU 85 -3.719 1.261 -0.741
206 HD23 LEU 85 2HD2 LEU 85 -2.319 0.208 -0.919
207 H ALA 86 H ALA 86 -1.359 2.257 -6.486
208 HA ALA 86 HA ALA 86 -3.669 1.488 -8.013
209 HB1 ALA 86 1HB ALA 86 -2.858 3.172 -9.276
210 HB2 ALA 86 2HB ALA 86 -1.546 2.114 -9.797
211 HB3 ALA 86 3HB ALA 86 -1.340 3.143 -8.379
212 H GLU 87 H GLU 87 -0.418 0.166 -7.680
213 HA GLU 87 HA GLU 87 -0.704 -1.774 -9.835
214 HB2 GLU 87 1HB GLU 87 1.498 -0.975 -8.825
215 HB3 GLU 87 2HB GLU 87 1.123 -1.982 -7.426
216 HG2 GLU 87 1HG GLU 87 0.737 -3.848 -9.250
217 HG3 GLU 87 2HG GLU 87 1.769 -2.810 -10.236
218 H TRP 88 H TRP 88 -1.297 -1.763 -6.350
219 HA TRP 88 HA TRP 88 -1.939 -4.570 -6.127
220 HB2 TRP 88 1HB TRP 88 -2.929 -2.214 -4.488
221 HB3 TRP 88 2HB TRP 88 -3.073 -3.909 -4.033
222 HD1 TRP 88 HD TRP 88 0.131 -3.963 -5.555
223 HE1 TRP 88 1HE TRP 88 2.038 -3.580 -3.858
224 HE3 TRP 88 3HE TRP 88 -2.512 -1.993 -1.644
225 HZ2 TRP 88 2HZ TRP 88 2.405 -2.567 -1.230
226 HZ3 TRP 88 3HZ TRP 88 -1.348 -1.328 0.444
227 HH2 TRP 88 HH TRP 88 1.105 -1.612 0.650
228 H LYS 89 H LYS 89 -3.650 -1.735 -7.206
229 HA LYS 89 HA LYS 89 -6.296 -2.931 -7.107
230 HB2 LYS 89 1HB LYS 89 -6.172 -0.524 -7.071
231 HB3 LYS 89 2HB LYS 89 -5.193 -0.497 -8.537
232 HG2 LYS 89 1HG LYS 89 -7.051 -1.299 -9.871
233 HG3 LYS 89 2HG LYS 89 -8.028 -1.565 -8.426
234 HD2 LYS 89 1HD LYS 89 -8.754 0.516 -9.379
235 HD3 LYS 89 2HD LYS 89 -7.801 0.918 -7.950
236 HE2 LYS 89 1HE LYS 89 -5.916 1.548 -9.250
237 HE3 LYS 89 2HE LYS 89 -6.556 0.775 -10.699
238 HZ1 LYS 89 3HZ LYS 89 -7.434 2.723 -11.226
239 HZ2 LYS 89 1HZ LYS 89 -6.984 3.404 -9.741
240 HZ3 LYS 89 2HZ LYS 89 -8.469 2.591 -9.885
241 H ARG 90 H ARG 90 -3.784 -2.604 -9.614
242 HA ARG 90 HA ARG 90 -5.381 -3.562 -11.759
243 HB2 ARG 90 1HB ARG 90 -3.253 -2.434 -12.135
244 HB3 ARG 90 2HB ARG 90 -2.396 -3.679 -11.233
245 HG2 ARG 90 1HG ARG 90 -2.117 -4.074 -13.590
246 HG3 ARG 90 2HG ARG 90 -3.126 -5.349 -12.925
247 HD2 ARG 90 1HD ARG 90 -5.042 -4.566 -13.976
248 HD3 ARG 90 2HD ARG 90 -4.461 -2.902 -14.016
249 HE ARG 90 HE ARG 90 -3.259 -3.400 -16.021
250 HH11 ARG 90 1HH2 ARG 90 -4.720 -6.173 -14.567
251 HH12 ARG 90 2HH2 ARG 90 -4.497 -7.178 -15.959
252 HH21 ARG 90 1HH1 ARG 90 -2.961 -4.702 -17.835
253 HH22 ARG 90 2HH1 ARG 90 -3.501 -6.347 -17.807
254 H THR 91 H THR 91 -3.256 -5.238 -9.427
255 HA THR 91 HA THR 91 -4.107 -7.860 -10.511
256 HB THR 91 HB THR 91 -2.415 -8.799 -9.197
257 HG1 THR 91 1HG THR 91 -2.247 -8.261 -7.187
258 HG21 THR 91 3HG2 THR 91 -1.513 -5.927 -9.546
259 HG22 THR 91 1HG2 THR 91 -1.451 -7.168 -10.796
260 HG23 THR 91 2HG2 THR 91 -0.460 -7.327 -9.346
261 H GLY 92 H GLY 92 -4.454 -5.910 -7.575
262 HA2 GLY 92 1HA GLY 92 -6.439 -5.832 -6.218
263 HA3 GLY 92 2HA GLY 92 -6.989 -7.322 -6.986
Start of MODEL 14
1 H LYS 61 H LYS 61 -11.783 0.219 1.700
2 HA LYS 61 HA LYS 61 -10.455 -1.277 3.870
3 HB2 LYS 61 1HB LYS 61 -11.620 -2.215 1.231
4 HB3 LYS 61 2HB LYS 61 -11.044 -3.266 2.525
5 HG2 LYS 61 1HG LYS 61 -12.735 -2.417 4.045
6 HG3 LYS 61 2HG LYS 61 -13.252 -1.217 2.860
7 HD2 LYS 61 1HD LYS 61 -13.603 -3.333 1.319
8 HD3 LYS 61 2HD LYS 61 -13.688 -4.184 2.862
9 HE2 LYS 61 1HE LYS 61 -15.394 -2.413 3.577
10 HE3 LYS 61 2HE LYS 61 -15.455 -1.937 1.881
11 HZ1 LYS 61 3HZ LYS 61 -17.155 -3.602 2.559
12 HZ2 LYS 61 1HZ LYS 61 -15.902 -4.714 2.818
13 HZ3 LYS 61 2HZ LYS 61 -16.175 -4.093 1.261
14 H ILE 62 H ILE 62 -8.245 -1.526 3.827
15 HA ILE 62 HA ILE 62 -6.884 -1.291 1.180
16 HB ILE 62 HB ILE 62 -5.723 -0.960 3.960
17 HG12 ILE 62 1HG1 ILE 62 -6.412 1.146 1.886
18 HG13 ILE 62 2HG1 ILE 62 -7.407 0.789 3.298
19 HG21 ILE 62 1HG2 ILE 62 -4.633 -0.531 1.165
20 HG22 ILE 62 2HG2 ILE 62 -4.011 -1.623 2.403
21 HG23 ILE 62 3HG2 ILE 62 -3.861 0.122 2.610
22 HD11 ILE 62 3HD1 ILE 62 -4.515 1.706 3.364
23 HD12 ILE 62 1HD1 ILE 62 -5.503 1.335 4.777
24 HD13 ILE 62 2HD1 ILE 62 -5.919 2.703 3.745
25 H THR 63 H THR 63 -5.716 -3.005 0.437
26 HA THR 63 HA THR 63 -5.405 -5.379 2.248
27 HB THR 63 HB THR 63 -5.558 -6.749 0.176
28 HG1 THR 63 1HG THR 63 -4.903 -4.998 -1.215
29 HG21 THR 63 3HG2 THR 63 -7.873 -6.772 0.165
30 HG22 THR 63 1HG2 THR 63 -7.994 -5.012 0.158
31 HG23 THR 63 2HG2 THR 63 -7.577 -5.862 1.646
32 H PHE 64 H PHE 64 -3.314 -5.819 2.677
33 HA PHE 64 HA PHE 64 -1.247 -4.654 0.898
34 HB2 PHE 64 1HB PHE 64 -0.912 -5.941 3.619
35 HB3 PHE 64 2HB PHE 64 0.279 -4.971 2.752
36 HD1 PHE 64 1HD PHE 64 -0.313 -2.531 2.216
37 HD2 PHE 64 2HD PHE 64 -2.499 -4.923 5.035
38 HE1 PHE 64 1HE PHE 64 -1.251 -0.473 3.234
39 HE2 PHE 64 2HE PHE 64 -3.435 -2.866 6.054
40 HZ PHE 64 HZ PHE 64 -2.813 -0.640 5.154
41 HA PRO 65 HA PRO 65 -0.488 -8.684 -1.012
42 HB2 PRO 65 1HB PRO 65 2.353 -7.833 -0.781
43 HB3 PRO 65 2HB PRO 65 1.465 -8.443 -2.187
44 HG2 PRO 65 1HG PRO 65 2.078 -5.847 -1.867
45 HG3 PRO 65 2HG PRO 65 0.630 -6.397 -2.719
46 HD2 PRO 65 1HD PRO 65 0.842 -5.064 -0.097
47 HD3 PRO 65 2HD PRO 65 -0.559 -5.220 -1.175
48 H SER 66 H SER 66 0.554 -10.701 -0.411
49 HA SER 66 HA SER 66 0.768 -11.203 2.411
50 HB2 SER 66 1HB SER 66 0.542 -13.288 1.614
51 HB3 SER 66 2HB SER 66 0.825 -12.717 -0.027
52 HG SER 66 HG SER 66 2.531 -13.977 0.271
53 H ASP 67 H ASP 67 2.901 -9.540 0.472
54 HA ASP 67 HA ASP 67 5.210 -10.366 2.197
55 HB2 ASP 67 1HB ASP 67 5.140 -10.753 -0.464
56 HB3 ASP 67 2HB ASP 67 5.747 -9.096 -0.437
57 H ILE 68 H ILE 68 3.070 -7.993 2.077
58 HA ILE 68 HA ILE 68 5.110 -5.820 2.373
59 HB ILE 68 HB ILE 68 2.203 -5.720 1.583
60 HG12 ILE 68 1HG1 ILE 68 3.771 -6.145 -0.256
61 HG13 ILE 68 2HG1 ILE 68 3.122 -4.514 -0.389
62 HG21 ILE 68 1HG2 ILE 68 2.699 -3.185 1.479
63 HG22 ILE 68 2HG2 ILE 68 4.041 -3.545 2.565
64 HG23 ILE 68 3HG2 ILE 68 2.387 -3.895 3.063
65 HD11 ILE 68 3HD1 ILE 68 5.303 -3.954 1.074
66 HD12 ILE 68 1HD1 ILE 68 5.347 -4.023 -0.687
67 HD13 ILE 68 2HD1 ILE 68 5.889 -5.405 0.265
68 H ASP 69 H ASP 69 5.399 -5.019 4.322
69 HA ASP 69 HA ASP 69 3.613 -5.821 6.536
70 HB2 ASP 69 1HB ASP 69 6.094 -5.893 6.809
71 HB3 ASP 69 2HB ASP 69 6.145 -4.147 6.597
72 HA PRO 70 HA PRO 70 1.320 -2.004 6.215
73 HB2 PRO 70 1HB PRO 70 0.348 -1.865 8.798
74 HB3 PRO 70 2HB PRO 70 -0.353 -2.862 7.511
75 HG2 PRO 70 1HG PRO 70 1.417 -3.640 9.758
76 HG3 PRO 70 2HG PRO 70 0.093 -4.534 8.994
77 HD2 PRO 70 1HD PRO 70 2.734 -5.072 8.512
78 HD3 PRO 70 2HD PRO 70 1.447 -5.382 7.329
79 H GLN 71 H GLN 71 3.496 -2.387 9.011
80 HA GLN 71 HA GLN 71 3.604 0.488 9.535
81 HB2 GLN 71 1HB GLN 71 4.600 -1.935 10.767
82 HB3 GLN 71 2HB GLN 71 5.900 -0.753 10.613
83 HG2 GLN 71 1HG GLN 71 4.683 -0.458 12.743
84 HG3 GLN 71 2HG GLN 71 4.490 0.953 11.700
85 HE21 GLN 71 1HE2 GLN 71 2.771 -1.980 10.849
86 HE22 GLN 71 2HE2 GLN 71 1.229 -1.439 11.306
87 H VAL 72 H VAL 72 5.430 -1.767 7.549
88 HA VAL 72 HA VAL 72 7.536 0.222 7.052
89 HB VAL 72 HB VAL 72 7.006 -2.344 5.529
90 HG11 VAL 72 1HG1 VAL 72 9.416 -2.174 5.024
91 HG12 VAL 72 2HG1 VAL 72 9.503 -0.672 5.942
92 HG13 VAL 72 3HG1 VAL 72 8.550 -0.745 4.461
93 HG21 VAL 72 3HG2 VAL 72 8.932 -2.002 7.836
94 HG22 VAL 72 1HG2 VAL 72 8.400 -3.501 7.075
95 HG23 VAL 72 2HG2 VAL 72 7.283 -2.579 8.081
96 H PHE 73 H PHE 73 4.462 -0.683 5.706
97 HA PHE 73 HA PHE 73 4.948 0.452 3.071
98 HB2 PHE 73 1HB PHE 73 3.278 -1.381 3.644
99 HB3 PHE 73 2HB PHE 73 2.288 -0.129 4.392
100 HD1 PHE 73 2HD PHE 73 4.209 -0.652 1.206
101 HD2 PHE 73 1HD PHE 73 0.633 0.817 3.076
102 HE1 PHE 73 2HE PHE 73 3.295 -0.040 -1.014
103 HE2 PHE 73 1HE PHE 73 -0.278 1.432 0.853
104 HZ PHE 73 HZ PHE 73 1.061 1.006 -1.191
105 H TYR 74 H TYR 74 2.818 1.443 5.787
106 HA TYR 74 HA TYR 74 2.162 3.983 4.682
107 HB2 TYR 74 1HB TYR 74 2.286 3.014 7.549
108 HB3 TYR 74 2HB TYR 74 1.764 4.646 7.136
109 HD1 TYR 74 2HD TYR 74 -0.006 4.698 5.089
110 HD2 TYR 74 1HD TYR 74 0.628 1.406 7.776
111 HE1 TYR 74 2HE TYR 74 -2.274 3.838 4.573
112 HE2 TYR 74 1HE TYR 74 -1.639 0.547 7.259
113 HH TYR 74 HH TYR 74 -3.911 1.779 6.380
114 H GLU 75 H GLU 75 5.116 2.854 5.970
115 HA GLU 75 HA GLU 75 6.141 5.453 6.811
116 HB2 GLU 75 1HB GLU 75 7.169 2.675 6.563
117 HB3 GLU 75 2HB GLU 75 8.366 3.963 6.422
118 HG2 GLU 75 1HG GLU 75 6.366 4.101 8.649
119 HG3 GLU 75 2HG GLU 75 7.723 2.984 8.798
120 H LEU 76 H LEU 76 5.424 4.172 3.815
121 HA LEU 76 HA LEU 76 7.745 5.369 2.438
122 HB2 LEU 76 1HB LEU 76 5.323 3.918 1.343
123 HB3 LEU 76 2HB LEU 76 6.724 4.419 0.396
124 HG LEU 76 HG LEU 76 6.792 2.512 2.752
125 HD11 LEU 76 1HD1 LEU 76 6.364 0.873 1.273
126 HD12 LEU 76 2HD1 LEU 76 7.697 1.416 0.254
127 HD13 LEU 76 3HD1 LEU 76 6.085 2.094 0.032
128 HD21 LEU 76 3HD2 LEU 76 9.143 2.174 1.485
129 HD22 LEU 76 1HD2 LEU 76 8.935 3.358 2.775
130 HD23 LEU 76 2HD2 LEU 76 8.863 3.869 1.088
131 HA PRO 77 HA PRO 77 5.864 9.288 1.501
132 HB2 PRO 77 1HB PRO 77 6.509 8.929 -1.358
133 HB3 PRO 77 2HB PRO 77 7.049 10.185 -0.233
134 HG2 PRO 77 1HG PRO 77 8.615 8.153 -1.154
135 HG3 PRO 77 2HG PRO 77 8.894 9.038 0.350
136 HD2 PRO 77 1HD PRO 77 7.978 6.269 -0.023
137 HD3 PRO 77 2HD PRO 77 8.652 7.058 1.418
138 H GLU 78 H GLU 78 4.022 10.231 0.346
139 HA GLU 78 HA GLU 78 1.864 8.400 -0.106
140 HB2 GLU 78 1HB GLU 78 0.692 10.419 -1.044
141 HB3 GLU 78 2HB GLU 78 1.366 10.659 0.567
142 HG2 GLU 78 1HG GLU 78 3.410 11.654 -0.525
143 HG3 GLU 78 2HG GLU 78 2.550 11.581 -2.062
144 H ALA 79 H ALA 79 3.886 10.255 -2.414
145 HA ALA 79 HA ALA 79 2.604 9.388 -4.774
146 HB1 ALA 79 1HB ALA 79 5.502 9.488 -5.084
147 HB2 ALA 79 2HB ALA 79 4.900 10.862 -4.156
148 HB3 ALA 79 3HB ALA 79 4.270 10.546 -5.773
149 H VAL 80 H VAL 80 5.012 7.750 -2.764
150 HA VAL 80 HA VAL 80 5.333 5.517 -4.629
151 HB VAL 80 HB VAL 80 6.041 5.713 -1.681
152 HG11 VAL 80 1HG1 VAL 80 7.749 3.998 -3.190
153 HG12 VAL 80 2HG1 VAL 80 6.083 3.554 -3.562
154 HG13 VAL 80 3HG1 VAL 80 6.642 3.554 -1.889
155 HG21 VAL 80 3HG2 VAL 80 7.149 7.444 -3.093
156 HG22 VAL 80 1HG2 VAL 80 7.757 6.165 -4.145
157 HG23 VAL 80 2HG2 VAL 80 8.298 6.261 -2.469
158 H GLN 81 H GLN 81 3.433 6.285 -1.781
159 HA GLN 81 HA GLN 81 2.302 3.696 -1.288
160 HB2 GLN 81 1HB GLN 81 2.200 5.840 0.153
161 HB3 GLN 81 2HB GLN 81 0.842 6.301 -0.868
162 HG2 GLN 81 1HG GLN 81 -0.472 5.064 0.479
163 HG3 GLN 81 2HG GLN 81 0.327 3.635 -0.176
164 HE21 GLN 81 1HE2 GLN 81 1.624 6.190 2.011
165 HE22 GLN 81 2HE2 GLN 81 2.040 5.117 3.252
166 H LYS 82 H LYS 82 1.158 6.451 -3.244
167 HA LYS 82 HA LYS 82 -1.255 5.231 -4.159
168 HB2 LYS 82 1HB LYS 82 0.419 7.551 -4.956
169 HB3 LYS 82 2HB LYS 82 -0.674 6.915 -6.185
170 HG2 LYS 82 1HG LYS 82 -1.849 8.626 -4.925
171 HG3 LYS 82 2HG LYS 82 -2.543 7.058 -4.516
172 HD2 LYS 82 1HD LYS 82 -1.036 6.982 -2.510
173 HD3 LYS 82 2HD LYS 82 -0.520 8.626 -2.891
174 HE2 LYS 82 1HE LYS 82 -3.423 8.395 -2.893
175 HE3 LYS 82 2HE LYS 82 -2.739 7.903 -1.345
176 HZ1 LYS 82 3HZ LYS 82 -1.610 10.302 -2.529
177 HZ2 LYS 82 1HZ LYS 82 -2.002 9.969 -0.912
178 HZ3 LYS 82 2HZ LYS 82 -3.220 10.432 -2.002
179 H GLU 83 H GLU 83 1.950 5.469 -5.765
180 HA GLU 83 HA GLU 83 1.193 4.020 -8.091
181 HB2 GLU 83 1HB GLU 83 3.883 4.272 -6.715
182 HB3 GLU 83 2HB GLU 83 3.663 3.518 -8.294
183 HG2 GLU 83 1HG GLU 83 2.286 6.001 -8.372
184 HG3 GLU 83 2HG GLU 83 3.868 6.316 -7.662
185 H LEU 84 H LEU 84 2.430 2.850 -4.960
186 HA LEU 84 HA LEU 84 2.525 0.091 -5.855
187 HB2 LEU 84 1HB LEU 84 2.432 1.273 -3.058
188 HB3 LEU 84 2HB LEU 84 2.746 -0.425 -3.416
189 HG LEU 84 HG LEU 84 4.400 1.858 -4.531
190 HD11 LEU 84 1HD1 LEU 84 6.044 1.405 -2.847
191 HD12 LEU 84 2HD1 LEU 84 5.166 -0.010 -2.277
192 HD13 LEU 84 3HD1 LEU 84 4.510 1.605 -2.002
193 HD21 LEU 84 3HD2 LEU 84 4.480 -1.134 -4.685
194 HD22 LEU 84 1HD2 LEU 84 6.007 -0.255 -4.671
195 HD23 LEU 84 2HD2 LEU 84 4.819 0.061 -5.935
196 H LEU 85 H LEU 85 0.129 2.122 -4.236
197 HA LEU 85 HA LEU 85 -1.739 -0.017 -3.710
198 HB2 LEU 85 1HB LEU 85 -2.040 2.990 -3.977
199 HB3 LEU 85 2HB LEU 85 -3.402 1.936 -3.597
200 HG LEU 85 HG LEU 85 -0.853 1.839 -1.988
201 HD11 LEU 85 1HD1 LEU 85 -1.420 4.089 -1.657
202 HD12 LEU 85 2HD1 LEU 85 -2.278 3.281 -0.346
203 HD13 LEU 85 3HD1 LEU 85 -3.150 3.772 -1.799
204 HD21 LEU 85 3HD2 LEU 85 -3.202 0.319 -2.008
205 HD22 LEU 85 1HD2 LEU 85 -3.403 1.417 -0.643
206 HD23 LEU 85 2HD2 LEU 85 -1.997 0.357 -0.723
207 H ALA 86 H ALA 86 -1.202 2.183 -6.432
208 HA ALA 86 HA ALA 86 -3.535 1.449 -7.923
209 HB1 ALA 86 1HB ALA 86 -2.682 2.820 -9.541
210 HB2 ALA 86 2HB ALA 86 -1.083 2.079 -9.462
211 HB3 ALA 86 3HB ALA 86 -1.553 3.290 -8.269
212 H GLU 87 H GLU 87 -0.359 -0.016 -7.548
213 HA GLU 87 HA GLU 87 -0.706 -1.914 -9.746
214 HB2 GLU 87 1HB GLU 87 1.531 -1.182 -8.744
215 HB3 GLU 87 2HB GLU 87 1.144 -2.214 -7.365
216 HG2 GLU 87 1HG GLU 87 2.266 -3.761 -8.647
217 HG3 GLU 87 2HG GLU 87 0.651 -3.975 -9.324
218 H TRP 88 H TRP 88 -1.243 -1.966 -6.242
219 HA TRP 88 HA TRP 88 -1.910 -4.759 -6.056
220 HB2 TRP 88 1HB TRP 88 -2.967 -2.448 -4.400
221 HB3 TRP 88 2HB TRP 88 -3.008 -4.151 -3.952
222 HD1 TRP 88 HD TRP 88 0.161 -4.029 -5.517
223 HE1 TRP 88 1HE TRP 88 2.077 -3.533 -3.852
224 HE3 TRP 88 3HE TRP 88 -2.523 -2.206 -1.571
225 HZ2 TRP 88 2HZ TRP 88 2.422 -2.499 -1.225
226 HZ3 TRP 88 3HZ TRP 88 -1.375 -1.471 0.496
227 HH2 TRP 88 HH TRP 88 1.092 -1.618 0.675
228 H LYS 89 H LYS 89 -3.685 -1.883 -6.986
229 HA LYS 89 HA LYS 89 -6.291 -3.176 -6.976
230 HB2 LYS 89 1HB LYS 89 -6.242 -0.790 -6.698
231 HB3 LYS 89 2HB LYS 89 -5.284 -0.581 -8.165
232 HG2 LYS 89 1HG LYS 89 -7.091 -1.072 -9.572
233 HG3 LYS 89 2HG LYS 89 -7.969 -1.931 -8.305
234 HD2 LYS 89 1HD LYS 89 -8.598 0.073 -7.219
235 HD3 LYS 89 2HD LYS 89 -7.383 1.021 -8.078
236 HE2 LYS 89 1HE LYS 89 -9.508 -0.390 -9.655
237 HE3 LYS 89 2HE LYS 89 -9.908 1.119 -8.835
238 HZ1 LYS 89 3HZ LYS 89 -7.556 1.708 -9.989
239 HZ2 LYS 89 1HZ LYS 89 -9.072 2.061 -10.663
240 HZ3 LYS 89 2HZ LYS 89 -8.236 0.661 -11.141
241 H ARG 90 H ARG 90 -3.789 -2.577 -9.445
242 HA ARG 90 HA ARG 90 -5.423 -3.323 -11.665
243 HB2 ARG 90 1HB ARG 90 -2.518 -3.033 -11.149
244 HB3 ARG 90 2HB ARG 90 -2.931 -4.164 -12.438
245 HG2 ARG 90 1HG ARG 90 -4.312 -2.429 -13.521
246 HG3 ARG 90 2HG ARG 90 -3.894 -1.295 -12.238
247 HD2 ARG 90 1HD ARG 90 -1.789 -0.943 -13.052
248 HD3 ARG 90 2HD ARG 90 -1.600 -2.620 -13.566
249 HE ARG 90 HE ARG 90 -3.501 -1.051 -15.165
250 HH11 ARG 90 1HH2 ARG 90 -0.286 -2.195 -14.670
251 HH12 ARG 90 2HH2 ARG 90 0.182 -1.993 -16.326
252 HH21 ARG 90 1HH1 ARG 90 -2.910 -0.781 -17.326
253 HH22 ARG 90 2HH1 ARG 90 -1.306 -1.191 -17.830
254 H THR 91 H THR 91 -3.355 -5.244 -9.494
255 HA THR 91 HA THR 91 -4.322 -7.739 -10.792
256 HB THR 91 HB THR 91 -2.599 -8.843 -9.654
257 HG1 THR 91 1HG THR 91 -2.757 -8.441 -7.585
258 HG21 THR 91 3HG2 THR 91 -1.766 -7.019 -11.204
259 HG22 THR 91 1HG2 THR 91 -0.612 -7.535 -9.974
260 HG23 THR 91 2HG2 THR 91 -1.502 -6.026 -9.769
261 H GLY 92 H GLY 92 -4.457 -6.034 -7.685
262 HA2 GLY 92 1HA GLY 92 -6.550 -6.037 -6.396
263 HA3 GLY 92 2HA GLY 92 -6.880 -7.651 -7.028
Start of MODEL 15
1 H LYS 61 H LYS 61 -11.806 0.564 2.602
2 HA LYS 61 HA LYS 61 -11.035 -2.212 2.492
3 HB2 LYS 61 1HB LYS 61 -11.416 -0.114 0.341
4 HB3 LYS 61 2HB LYS 61 -11.061 -1.807 -0.007
5 HG2 LYS 61 1HG LYS 61 -13.108 -2.548 0.868
6 HG3 LYS 61 2HG LYS 61 -13.349 -1.076 1.809
7 HD2 LYS 61 1HD LYS 61 -14.142 0.116 0.007
8 HD3 LYS 61 2HD LYS 61 -13.157 -0.778 -1.150
9 HE2 LYS 61 1HE LYS 61 -15.500 -1.374 -1.471
10 HE3 LYS 61 2HE LYS 61 -14.634 -2.763 -0.817
11 HZ1 LYS 61 3HZ LYS 61 -16.762 -1.236 0.337
12 HZ2 LYS 61 1HZ LYS 61 -15.443 -1.393 1.391
13 HZ3 LYS 61 2HZ LYS 61 -16.189 -2.780 0.753
14 H ILE 62 H ILE 62 -8.933 -2.831 2.810
15 HA ILE 62 HA ILE 62 -6.862 -1.611 1.137
16 HB ILE 62 HB ILE 62 -6.479 -1.677 4.147
17 HG12 ILE 62 1HG1 ILE 62 -6.888 0.678 2.269
18 HG13 ILE 62 2HG1 ILE 62 -8.006 0.148 3.525
19 HG21 ILE 62 1HG2 ILE 62 -4.368 -0.539 3.628
20 HG22 ILE 62 2HG2 ILE 62 -4.751 -0.578 1.909
21 HG23 ILE 62 3HG2 ILE 62 -4.449 -2.081 2.779
22 HD11 ILE 62 3HD1 ILE 62 -5.804 0.398 5.037
23 HD12 ILE 62 1HD1 ILE 62 -6.899 1.750 4.741
24 HD13 ILE 62 2HD1 ILE 62 -5.416 1.592 3.797
25 H THR 63 H THR 63 -5.729 -3.293 0.340
26 HA THR 63 HA THR 63 -5.423 -5.748 2.040
27 HB THR 63 HB THR 63 -5.499 -5.764 -0.978
28 HG1 THR 63 1HG THR 63 -7.738 -6.718 -0.085
29 HG21 THR 63 3HG2 THR 63 -5.647 -8.075 -0.755
30 HG22 THR 63 1HG2 THR 63 -6.338 -7.976 0.864
31 HG23 THR 63 2HG2 THR 63 -4.620 -7.667 0.618
32 H PHE 64 H PHE 64 -3.326 -5.994 2.590
33 HA PHE 64 HA PHE 64 -1.250 -4.747 0.887
34 HB2 PHE 64 1HB PHE 64 -1.058 -6.036 3.625
35 HB3 PHE 64 2HB PHE 64 0.248 -5.189 2.799
36 HD1 PHE 64 1HD PHE 64 -0.269 -2.732 2.055
37 HD2 PHE 64 2HD PHE 64 -2.471 -4.855 5.062
38 HE1 PHE 64 1HE PHE 64 -1.052 -0.576 2.996
39 HE2 PHE 64 2HE PHE 64 -3.261 -2.700 6.005
40 HZ PHE 64 HZ PHE 64 -2.545 -0.560 4.977
41 HA PRO 65 HA PRO 65 -0.328 -8.722 -1.074
42 HB2 PRO 65 1HB PRO 65 2.470 -7.739 -0.805
43 HB3 PRO 65 2HB PRO 65 1.632 -8.391 -2.224
44 HG2 PRO 65 1HG PRO 65 2.105 -5.772 -1.903
45 HG3 PRO 65 2HG PRO 65 0.685 -6.392 -2.754
46 HD2 PRO 65 1HD PRO 65 0.835 -5.059 -0.122
47 HD3 PRO 65 2HD PRO 65 -0.555 -5.268 -1.205
48 H SER 66 H SER 66 0.714 -10.708 -0.457
49 HA SER 66 HA SER 66 0.921 -11.231 2.348
50 HB2 SER 66 1HB SER 66 1.900 -12.774 -0.062
51 HB3 SER 66 2HB SER 66 1.958 -13.396 1.585
52 HG SER 66 HG SER 66 0.027 -13.878 0.222
53 H ASP 67 H ASP 67 3.051 -9.475 0.479
54 HA ASP 67 HA ASP 67 5.328 -10.244 2.272
55 HB2 ASP 67 1HB ASP 67 5.198 -9.956 -0.665
56 HB3 ASP 67 2HB ASP 67 6.586 -9.182 0.103
57 H ILE 68 H ILE 68 3.171 -7.884 2.060
58 HA ILE 68 HA ILE 68 5.201 -5.697 2.324
59 HB ILE 68 HB ILE 68 2.306 -5.633 1.492
60 HG12 ILE 68 1HG1 ILE 68 3.924 -6.068 -0.305
61 HG13 ILE 68 2HG1 ILE 68 3.241 -4.455 -0.483
62 HG21 ILE 68 1HG2 ILE 68 2.929 -3.063 1.329
63 HG22 ILE 68 2HG2 ILE 68 4.052 -3.484 2.623
64 HG23 ILE 68 3HG2 ILE 68 2.322 -3.749 2.836
65 HD11 ILE 68 3HD1 ILE 68 6.014 -5.270 0.218
66 HD12 ILE 68 1HD1 ILE 68 5.386 -3.833 1.023
67 HD13 ILE 68 2HD1 ILE 68 5.450 -3.899 -0.737
68 H ASP 69 H ASP 69 5.466 -4.861 4.267
69 HA ASP 69 HA ASP 69 3.676 -5.653 6.474
70 HB2 ASP 69 1HB ASP 69 6.200 -5.642 6.677
71 HB3 ASP 69 2HB ASP 69 6.130 -3.884 6.608
72 HA PRO 70 HA PRO 70 1.333 -1.859 6.140
73 HB2 PRO 70 1HB PRO 70 0.276 -1.769 8.672
74 HB3 PRO 70 2HB PRO 70 -0.338 -2.816 7.379
75 HG2 PRO 70 1HG PRO 70 1.446 -3.475 9.665
76 HG3 PRO 70 2HG PRO 70 0.136 -4.424 8.941
77 HD2 PRO 70 1HD PRO 70 2.764 -4.932 8.433
78 HD3 PRO 70 2HD PRO 70 1.481 -5.247 7.247
79 H GLN 71 H GLN 71 3.373 -2.254 9.044
80 HA GLN 71 HA GLN 71 3.432 0.595 9.641
81 HB2 GLN 71 1HB GLN 71 3.971 -1.413 11.220
82 HB3 GLN 71 2HB GLN 71 5.570 -1.364 10.475
83 HG2 GLN 71 1HG GLN 71 5.732 1.054 11.081
84 HG3 GLN 71 2HG GLN 71 4.190 0.916 11.925
85 HE21 GLN 71 1HE2 GLN 71 6.564 -1.718 11.911
86 HE22 GLN 71 2HE2 GLN 71 6.972 -1.595 13.554
87 H VAL 72 H VAL 72 5.375 -1.541 7.628
88 HA VAL 72 HA VAL 72 7.385 0.566 7.196
89 HB VAL 72 HB VAL 72 7.035 -2.037 5.683
90 HG11 VAL 72 1HG1 VAL 72 8.485 -0.609 4.470
91 HG12 VAL 72 2HG1 VAL 72 9.565 -1.635 5.413
92 HG13 VAL 72 3HG1 VAL 72 9.233 0.014 5.942
93 HG21 VAL 72 3HG2 VAL 72 7.468 -1.931 8.356
94 HG22 VAL 72 1HG2 VAL 72 9.122 -1.726 7.782
95 HG23 VAL 72 2HG2 VAL 72 8.199 -3.156 7.320
96 H PHE 73 H PHE 73 4.395 -0.512 5.748
97 HA PHE 73 HA PHE 73 4.878 0.637 3.130
98 HB2 PHE 73 1HB PHE 73 3.206 -1.192 3.699
99 HB3 PHE 73 2HB PHE 73 2.214 0.056 4.452
100 HD1 PHE 73 1HD PHE 73 4.092 -0.533 1.254
101 HD2 PHE 73 2HD PHE 73 0.578 1.066 3.142
102 HE1 PHE 73 1HE PHE 73 3.164 0.058 -0.964
103 HE2 PHE 73 2HE PHE 73 -0.343 1.661 0.919
104 HZ PHE 73 HZ PHE 73 0.954 1.158 -1.135
105 H TYR 74 H TYR 74 2.739 1.634 5.831
106 HA TYR 74 HA TYR 74 2.105 4.176 4.723
107 HB2 TYR 74 1HB TYR 74 2.189 3.186 7.583
108 HB3 TYR 74 2HB TYR 74 1.685 4.827 7.179
109 HD1 TYR 74 1HD TYR 74 -0.041 4.875 5.059
110 HD2 TYR 74 2HD TYR 74 0.487 1.628 7.823
111 HE1 TYR 74 1HE TYR 74 -2.308 4.036 4.509
112 HE2 TYR 74 2HE TYR 74 -1.779 0.790 7.272
113 HH TYR 74 HH TYR 74 -3.797 2.428 4.829
114 H GLU 75 H GLU 75 5.024 2.998 6.065
115 HA GLU 75 HA GLU 75 6.079 5.621 6.836
116 HB2 GLU 75 1HB GLU 75 6.724 3.181 7.670
117 HB3 GLU 75 2HB GLU 75 7.834 3.253 6.301
118 HG2 GLU 75 1HG GLU 75 8.473 5.596 7.261
119 HG3 GLU 75 2HG GLU 75 7.744 4.994 8.751
120 H LEU 76 H LEU 76 5.503 4.096 3.912
121 HA LEU 76 HA LEU 76 7.900 5.124 2.549
122 HB2 LEU 76 1HB LEU 76 5.447 3.629 1.610
123 HB3 LEU 76 2HB LEU 76 6.674 4.226 0.492
124 HG LEU 76 HG LEU 76 7.266 2.415 2.850
125 HD11 LEU 76 1HD1 LEU 76 5.824 1.369 1.056
126 HD12 LEU 76 2HD1 LEU 76 7.387 0.586 1.289
127 HD13 LEU 76 3HD1 LEU 76 7.138 1.669 -0.081
128 HD21 LEU 76 3HD2 LEU 76 9.352 3.208 2.397
129 HD22 LEU 76 1HD2 LEU 76 8.877 3.829 0.816
130 HD23 LEU 76 2HD2 LEU 76 9.278 2.123 1.009
131 HA PRO 77 HA PRO 77 6.290 9.094 1.393
132 HB2 PRO 77 1HB PRO 77 6.881 8.547 -1.451
133 HB3 PRO 77 2HB PRO 77 7.505 9.828 -0.402
134 HG2 PRO 77 1HG PRO 77 8.951 7.668 -1.212
135 HG3 PRO 77 2HG PRO 77 9.276 8.596 0.258
136 HD2 PRO 77 1HD PRO 77 8.174 5.876 -0.013
137 HD3 PRO 77 2HD PRO 77 8.918 6.665 1.392
138 H GLU 78 H GLU 78 4.486 10.092 0.239
139 HA GLU 78 HA GLU 78 2.220 8.371 -0.103
140 HB2 GLU 78 1HB GLU 78 2.714 11.236 -0.958
141 HB3 GLU 78 2HB GLU 78 1.148 10.432 -1.065
142 HG2 GLU 78 1HG GLU 78 0.781 10.586 1.170
143 HG3 GLU 78 2HG GLU 78 2.449 10.166 1.563
144 H ALA 79 H ALA 79 4.160 10.154 -2.543
145 HA ALA 79 HA ALA 79 2.820 9.265 -4.837
146 HB1 ALA 79 1HB ALA 79 4.755 10.905 -4.734
147 HB2 ALA 79 2HB ALA 79 4.838 9.748 -6.062
148 HB3 ALA 79 3HB ALA 79 5.834 9.514 -4.625
149 H VAL 80 H VAL 80 5.140 7.538 -2.820
150 HA VAL 80 HA VAL 80 5.337 5.261 -4.657
151 HB VAL 80 HB VAL 80 6.126 5.502 -1.735
152 HG11 VAL 80 1HG1 VAL 80 5.868 3.176 -2.539
153 HG12 VAL 80 2HG1 VAL 80 7.560 3.563 -2.234
154 HG13 VAL 80 3HG1 VAL 80 6.947 3.527 -3.888
155 HG21 VAL 80 3HG2 VAL 80 7.287 7.138 -3.182
156 HG22 VAL 80 1HG2 VAL 80 7.755 5.839 -4.276
157 HG23 VAL 80 2HG2 VAL 80 8.397 5.883 -2.634
158 H GLN 81 H GLN 81 3.520 6.162 -1.786
159 HA GLN 81 HA GLN 81 2.304 3.628 -1.228
160 HB2 GLN 81 1HB GLN 81 2.282 5.692 0.242
161 HB3 GLN 81 2HB GLN 81 1.053 6.357 -0.831
162 HG2 GLN 81 1HG GLN 81 -0.527 5.204 0.275
163 HG3 GLN 81 2HG GLN 81 0.260 3.699 -0.198
164 HE21 GLN 81 1HE2 GLN 81 1.685 6.189 1.944
165 HE22 GLN 81 2HE2 GLN 81 1.746 5.198 3.318
166 H LYS 82 H LYS 82 1.154 6.412 -3.147
167 HA LYS 82 HA LYS 82 -1.279 5.218 -4.037
168 HB2 LYS 82 1HB LYS 82 0.447 7.482 -4.962
169 HB3 LYS 82 2HB LYS 82 -0.853 6.917 -6.011
170 HG2 LYS 82 1HG LYS 82 -1.680 8.710 -4.559
171 HG3 LYS 82 2HG LYS 82 -2.458 7.185 -4.133
172 HD2 LYS 82 1HD LYS 82 -0.958 6.878 -2.252
173 HD3 LYS 82 2HD LYS 82 -0.009 8.289 -2.727
174 HE2 LYS 82 1HE LYS 82 -2.783 9.034 -2.514
175 HE3 LYS 82 2HE LYS 82 -2.278 8.232 -1.028
176 HZ1 LYS 82 3HZ LYS 82 -0.659 9.796 -0.625
177 HZ2 LYS 82 1HZ LYS 82 -1.884 10.753 -1.303
178 HZ3 LYS 82 2HZ LYS 82 -0.554 10.279 -2.250
179 H GLU 83 H GLU 83 1.902 5.451 -5.687
180 HA GLU 83 HA GLU 83 1.122 4.052 -8.025
181 HB2 GLU 83 1HB GLU 83 3.818 4.194 -6.642
182 HB3 GLU 83 2HB GLU 83 3.575 3.515 -8.251
183 HG2 GLU 83 1HG GLU 83 2.303 6.114 -8.025
184 HG3 GLU 83 2HG GLU 83 4.020 6.214 -7.627
185 H LEU 84 H LEU 84 2.334 2.790 -4.915
186 HA LEU 84 HA LEU 84 2.343 0.051 -5.888
187 HB2 LEU 84 1HB LEU 84 2.405 1.193 -3.076
188 HB3 LEU 84 2HB LEU 84 2.558 -0.526 -3.443
189 HG LEU 84 HG LEU 84 4.378 1.637 -4.544
190 HD11 LEU 84 1HD1 LEU 84 4.883 -0.423 -2.376
191 HD12 LEU 84 2HD1 LEU 84 4.658 1.304 -2.105
192 HD13 LEU 84 3HD1 LEU 84 6.060 0.729 -3.003
193 HD21 LEU 84 3HD2 LEU 84 5.701 -0.718 -4.819
194 HD22 LEU 84 1HD2 LEU 84 4.677 -0.035 -6.082
195 HD23 LEU 84 2HD2 LEU 84 4.039 -1.278 -5.005
196 H LEU 85 H LEU 85 -0.000 2.129 -4.240
197 HA LEU 85 HA LEU 85 -1.869 -0.007 -3.676
198 HB2 LEU 85 1HB LEU 85 -2.163 3.000 -3.917
199 HB3 LEU 85 2HB LEU 85 -3.547 1.955 -3.598
200 HG LEU 85 HG LEU 85 -1.045 1.825 -1.911
201 HD11 LEU 85 1HD1 LEU 85 -2.011 4.159 -1.943
202 HD12 LEU 85 2HD1 LEU 85 -2.037 3.386 -0.357
203 HD13 LEU 85 3HD1 LEU 85 -3.514 3.479 -1.319
204 HD21 LEU 85 3HD2 LEU 85 -2.211 0.278 -0.748
205 HD22 LEU 85 1HD2 LEU 85 -3.410 0.305 -2.039
206 HD23 LEU 85 2HD2 LEU 85 -3.609 1.345 -0.630
207 H ALA 86 H ALA 86 -1.353 2.174 -6.426
208 HA ALA 86 HA ALA 86 -3.706 1.395 -7.878
209 HB1 ALA 86 1HB ALA 86 -1.777 2.000 -9.801
210 HB2 ALA 86 2HB ALA 86 -1.282 2.945 -8.396
211 HB3 ALA 86 3HB ALA 86 -2.901 3.146 -9.067
212 H GLU 87 H GLU 87 -0.478 0.022 -7.563
213 HA GLU 87 HA GLU 87 -0.795 -1.916 -9.713
214 HB2 GLU 87 1HB GLU 87 1.422 -1.181 -8.701
215 HB3 GLU 87 2HB GLU 87 1.011 -2.164 -7.294
216 HG2 GLU 87 1HG GLU 87 0.538 -3.978 -9.224
217 HG3 GLU 87 2HG GLU 87 1.767 -3.016 -10.044
218 H TRP 88 H TRP 88 -1.382 -1.934 -6.220
219 HA TRP 88 HA TRP 88 -2.076 -4.725 -6.033
220 HB2 TRP 88 1HB TRP 88 -3.093 -2.416 -4.352
221 HB3 TRP 88 2HB TRP 88 -3.117 -4.121 -3.910
222 HD1 TRP 88 HD TRP 88 0.016 -3.968 -5.535
223 HE1 TRP 88 1HE TRP 88 1.963 -3.454 -3.908
224 HE3 TRP 88 3HE TRP 88 -2.602 -2.188 -1.527
225 HZ2 TRP 88 2HZ TRP 88 2.352 -2.432 -1.283
226 HZ3 TRP 88 3HZ TRP 88 -1.420 -1.453 0.522
227 HH2 TRP 88 HH TRP 88 1.053 -1.572 0.648
228 H LYS 89 H LYS 89 -3.839 -1.803 -6.879
229 HA LYS 89 HA LYS 89 -6.449 -3.156 -6.956
230 HB2 LYS 89 1HB LYS 89 -6.458 -0.847 -6.317
231 HB3 LYS 89 2HB LYS 89 -5.493 -0.389 -7.720
232 HG2 LYS 89 1HG LYS 89 -7.300 -0.892 -9.226
233 HG3 LYS 89 2HG LYS 89 -8.242 -1.640 -7.935
234 HD2 LYS 89 1HD LYS 89 -8.886 0.377 -7.049
235 HD3 LYS 89 2HD LYS 89 -7.371 1.169 -7.483
236 HE2 LYS 89 1HE LYS 89 -9.558 1.811 -8.774
237 HE3 LYS 89 2HE LYS 89 -8.062 1.582 -9.679
238 HZ1 LYS 89 3HZ LYS 89 -8.748 -0.432 -10.489
239 HZ2 LYS 89 1HZ LYS 89 -10.229 0.393 -10.425
240 HZ3 LYS 89 2HZ LYS 89 -9.825 -0.719 -9.206
241 H ARG 90 H ARG 90 -3.797 -2.735 -9.111
242 HA ARG 90 HA ARG 90 -5.426 -2.861 -11.528
243 HB2 ARG 90 1HB ARG 90 -2.552 -2.698 -10.903
244 HB3 ARG 90 2HB ARG 90 -2.905 -3.705 -12.304
245 HG2 ARG 90 1HG ARG 90 -4.308 -1.817 -13.210
246 HG3 ARG 90 2HG ARG 90 -3.717 -0.817 -11.883
247 HD2 ARG 90 1HD ARG 90 -1.390 -1.908 -12.897
248 HD3 ARG 90 2HD ARG 90 -2.355 -1.639 -14.349
249 HE ARG 90 HE ARG 90 -1.151 0.424 -12.724
250 HH11 ARG 90 1HH2 ARG 90 -3.901 -0.445 -14.612
251 HH12 ARG 90 2HH2 ARG 90 -4.285 1.188 -15.047
252 HH21 ARG 90 1HH1 ARG 90 -1.630 2.559 -13.285
253 HH22 ARG 90 2HH1 ARG 90 -2.996 2.888 -14.298
254 H THR 91 H THR 91 -3.386 -5.195 -9.738
255 HA THR 91 HA THR 91 -4.659 -7.370 -11.352
256 HB THR 91 HB THR 91 -2.523 -8.109 -11.425
257 HG1 THR 91 1HG THR 91 -2.846 -9.613 -9.981
258 HG21 THR 91 3HG2 THR 91 -1.941 -6.267 -9.090
259 HG22 THR 91 1HG2 THR 91 -1.704 -5.884 -10.795
260 HG23 THR 91 2HG2 THR 91 -0.726 -7.135 -10.028
261 H GLY 92 H GLY 92 -4.047 -6.353 -7.996
262 HA2 GLY 92 1HA GLY 92 -5.805 -6.674 -6.311
263 HA3 GLY 92 2HA GLY 92 -6.342 -8.092 -7.206
Start of MODEL 16
1 H LYS 61 H LYS 61 -10.537 0.817 4.379
2 HA LYS 61 HA LYS 61 -10.916 -2.059 3.737
3 HB2 LYS 61 1HB LYS 61 -12.529 -0.259 2.514
4 HB3 LYS 61 2HB LYS 61 -11.138 -0.198 1.432
5 HG2 LYS 61 1HG LYS 61 -12.625 -1.926 0.622
6 HG3 LYS 61 2HG LYS 61 -11.209 -2.715 1.319
7 HD2 LYS 61 1HD LYS 61 -12.480 -3.782 2.839
8 HD3 LYS 61 2HD LYS 61 -13.203 -2.262 3.366
9 HE2 LYS 61 1HE LYS 61 -14.856 -2.364 1.596
10 HE3 LYS 61 2HE LYS 61 -14.070 -3.777 0.888
11 HZ1 LYS 61 3HZ LYS 61 -15.127 -5.105 2.292
12 HZ2 LYS 61 1HZ LYS 61 -16.058 -3.777 2.785
13 HZ3 LYS 61 2HZ LYS 61 -14.649 -4.189 3.640
14 H ILE 62 H ILE 62 -8.840 -2.758 3.620
15 HA ILE 62 HA ILE 62 -6.993 -1.489 1.734
16 HB ILE 62 HB ILE 62 -6.131 -1.713 4.637
17 HG12 ILE 62 1HG1 ILE 62 -6.821 0.753 2.998
18 HG13 ILE 62 2HG1 ILE 62 -7.713 0.156 4.394
19 HG21 ILE 62 1HG2 ILE 62 -4.804 -0.551 2.167
20 HG22 ILE 62 2HG2 ILE 62 -4.348 -2.049 2.980
21 HG23 ILE 62 3HG2 ILE 62 -4.134 -0.502 3.796
22 HD11 ILE 62 3HD1 ILE 62 -5.053 1.506 4.303
23 HD12 ILE 62 1HD1 ILE 62 -5.355 0.321 5.575
24 HD13 ILE 62 2HD1 ILE 62 -6.393 1.739 5.426
25 H THR 63 H THR 63 -5.700 -3.030 0.841
26 HA THR 63 HA THR 63 -5.430 -5.648 2.280
27 HB THR 63 HB THR 63 -5.765 -5.294 -0.713
28 HG1 THR 63 1HG THR 63 -7.641 -6.327 1.133
29 HG21 THR 63 3HG2 THR 63 -6.122 -7.749 -0.633
30 HG22 THR 63 1HG2 THR 63 -5.781 -7.725 1.097
31 HG23 THR 63 2HG2 THR 63 -4.518 -7.295 -0.058
32 H PHE 64 H PHE 64 -3.310 -5.939 2.739
33 HA PHE 64 HA PHE 64 -1.278 -4.654 1.002
34 HB2 PHE 64 1HB PHE 64 -0.919 -6.091 3.646
35 HB3 PHE 64 2HB PHE 64 0.290 -5.119 2.813
36 HD1 PHE 64 1HD PHE 64 -0.372 -2.643 2.294
37 HD2 PHE 64 2HD PHE 64 -2.319 -5.096 5.231
38 HE1 PHE 64 1HE PHE 64 -1.219 -0.608 3.429
39 HE2 PHE 64 2HE PHE 64 -3.166 -3.063 6.369
40 HZ PHE 64 HZ PHE 64 -2.614 -0.819 5.470
41 HA PRO 65 HA PRO 65 -0.451 -8.539 -1.165
42 HB2 PRO 65 1HB PRO 65 2.366 -7.603 -0.901
43 HB3 PRO 65 2HB PRO 65 1.494 -8.181 -2.331
44 HG2 PRO 65 1HG PRO 65 1.999 -5.586 -1.907
45 HG3 PRO 65 2HG PRO 65 0.550 -6.152 -2.746
46 HD2 PRO 65 1HD PRO 65 0.783 -4.943 -0.061
47 HD3 PRO 65 2HD PRO 65 -0.634 -5.084 -1.119
48 H SER 66 H SER 66 0.554 -10.575 -0.661
49 HA SER 66 HA SER 66 0.822 -11.236 2.105
50 HB2 SER 66 1HB SER 66 1.729 -12.675 -0.398
51 HB3 SER 66 2HB SER 66 1.811 -13.377 1.215
52 HG SER 66 HG SER 66 -0.132 -13.981 0.354
53 H ASP 67 H ASP 67 2.942 -9.435 0.272
54 HA ASP 67 HA ASP 67 5.253 -10.318 1.970
55 HB2 ASP 67 1HB ASP 67 5.105 -9.660 -0.946
56 HB3 ASP 67 2HB ASP 67 6.585 -9.280 -0.064
57 H ILE 68 H ILE 68 3.117 -7.984 1.995
58 HA ILE 68 HA ILE 68 5.143 -5.804 2.337
59 HB ILE 68 HB ILE 68 2.277 -5.695 1.435
60 HG12 ILE 68 1HG1 ILE 68 3.943 -6.072 -0.330
61 HG13 ILE 68 2HG1 ILE 68 3.273 -4.451 -0.467
62 HG21 ILE 68 1HG2 ILE 68 2.241 -3.855 2.822
63 HG22 ILE 68 2HG2 ILE 68 2.946 -3.119 1.383
64 HG23 ILE 68 3HG2 ILE 68 3.984 -3.612 2.721
65 HD11 ILE 68 3HD1 ILE 68 6.023 -5.303 0.276
66 HD12 ILE 68 1HD1 ILE 68 5.378 -3.895 1.120
67 HD13 ILE 68 2HD1 ILE 68 5.488 -3.894 -0.638
68 H ASP 69 H ASP 69 5.337 -4.955 4.278
69 HA ASP 69 HA ASP 69 3.507 -5.813 6.440
70 HB2 ASP 69 1HB ASP 69 5.951 -5.922 6.813
71 HB3 ASP 69 2HB ASP 69 6.064 -4.181 6.559
72 HA PRO 70 HA PRO 70 1.228 -1.979 6.156
73 HB2 PRO 70 1HB PRO 70 0.215 -1.877 8.718
74 HB3 PRO 70 2HB PRO 70 -0.459 -2.871 7.413
75 HG2 PRO 70 1HG PRO 70 1.314 -3.650 9.666
76 HG3 PRO 70 2HG PRO 70 -0.025 -4.538 8.918
77 HD2 PRO 70 1HD PRO 70 2.589 -5.115 8.400
78 HD3 PRO 70 2HD PRO 70 1.297 -5.362 7.205
79 H GLN 71 H GLN 71 3.373 -2.412 8.970
80 HA GLN 71 HA GLN 71 3.453 0.440 9.583
81 HB2 GLN 71 1HB GLN 71 3.972 -1.569 11.160
82 HB3 GLN 71 2HB GLN 71 5.563 -1.555 10.402
83 HG2 GLN 71 1HG GLN 71 5.339 1.070 10.930
84 HG3 GLN 71 2HG GLN 71 4.314 0.442 12.221
85 HE21 GLN 71 1HE2 GLN 71 5.737 0.681 14.013
86 HE22 GLN 71 2HE2 GLN 71 7.251 -0.080 14.112
87 H VAL 72 H VAL 72 5.333 -1.738 7.556
88 HA VAL 72 HA VAL 72 7.403 0.293 7.107
89 HB VAL 72 HB VAL 72 6.881 -2.283 5.591
90 HG11 VAL 72 1HG1 VAL 72 8.303 -0.715 4.372
91 HG12 VAL 72 2HG1 VAL 72 9.295 -2.030 5.002
92 HG13 VAL 72 3HG1 VAL 72 9.297 -0.460 5.806
93 HG21 VAL 72 3HG2 VAL 72 8.287 -3.396 7.108
94 HG22 VAL 72 1HG2 VAL 72 7.348 -2.346 8.170
95 HG23 VAL 72 2HG2 VAL 72 8.988 -1.892 7.706
96 H PHE 73 H PHE 73 4.344 -0.609 5.739
97 HA PHE 73 HA PHE 73 4.802 0.589 3.128
98 HB2 PHE 73 1HB PHE 73 3.124 -1.255 3.734
99 HB3 PHE 73 2HB PHE 73 2.134 0.025 4.435
100 HD1 PHE 73 1HD PHE 73 4.092 -0.619 1.295
101 HD2 PHE 73 2HD PHE 73 0.520 0.976 3.067
102 HE1 PHE 73 1HE PHE 73 3.223 -0.058 -0.955
103 HE2 PHE 73 2HE PHE 73 -0.344 1.544 0.814
104 HZ PHE 73 HZ PHE 73 1.014 1.028 -1.198
105 H TYR 74 H TYR 74 2.708 1.534 5.889
106 HA TYR 74 HA TYR 74 2.006 4.081 4.842
107 HB2 TYR 74 1HB TYR 74 2.236 3.093 7.697
108 HB3 TYR 74 2HB TYR 74 1.657 4.711 7.304
109 HD1 TYR 74 1HD TYR 74 -0.159 4.693 5.276
110 HD2 TYR 74 2HD TYR 74 0.614 1.466 8.005
111 HE1 TYR 74 1HE TYR 74 -2.421 3.774 4.833
112 HE2 TYR 74 2HE TYR 74 -1.646 0.548 7.560
113 HH TYR 74 HH TYR 74 -3.402 1.106 5.096
114 H GLU 75 H GLU 75 5.027 3.001 6.025
115 HA GLU 75 HA GLU 75 5.971 5.681 6.780
116 HB2 GLU 75 1HB GLU 75 7.221 2.947 6.606
117 HB3 GLU 75 2HB GLU 75 8.229 4.383 6.786
118 HG2 GLU 75 1HG GLU 75 5.880 3.890 8.612
119 HG3 GLU 75 2HG GLU 75 7.462 3.184 8.947
120 H LEU 76 H LEU 76 5.410 4.148 3.862
121 HA LEU 76 HA LEU 76 7.774 5.226 2.486
122 HB2 LEU 76 1HB LEU 76 5.319 3.768 1.480
123 HB3 LEU 76 2HB LEU 76 6.654 4.277 0.445
124 HG LEU 76 HG LEU 76 6.942 2.467 2.860
125 HD11 LEU 76 1HD1 LEU 76 7.304 1.609 0.003
126 HD12 LEU 76 2HD1 LEU 76 5.690 1.627 0.713
127 HD13 LEU 76 3HD1 LEU 76 6.954 0.624 1.424
128 HD21 LEU 76 3HD2 LEU 76 8.818 3.733 0.916
129 HD22 LEU 76 1HD2 LEU 76 9.156 2.069 1.390
130 HD23 LEU 76 2HD2 LEU 76 9.063 3.333 2.615
131 HA PRO 77 HA PRO 77 6.106 9.185 1.365
132 HB2 PRO 77 1HB PRO 77 6.754 8.683 -1.475
133 HB3 PRO 77 2HB PRO 77 7.345 9.957 -0.397
134 HG2 PRO 77 1HG PRO 77 8.824 7.820 -1.218
135 HG3 PRO 77 2HG PRO 77 9.126 8.744 0.260
136 HD2 PRO 77 1HD PRO 77 8.072 6.010 -0.033
137 HD3 PRO 77 2HD PRO 77 8.779 6.811 1.387
138 H GLU 78 H GLU 78 4.295 10.159 0.209
139 HA GLU 78 HA GLU 78 2.086 8.383 -0.214
140 HB2 GLU 78 1HB GLU 78 1.918 10.808 0.454
141 HB3 GLU 78 2HB GLU 78 2.358 11.238 -1.198
142 HG2 GLU 78 1HG GLU 78 0.286 10.771 -1.984
143 HG3 GLU 78 2HG GLU 78 0.186 9.267 -1.070
144 H ALA 79 H ALA 79 4.024 10.284 -2.573
145 HA ALA 79 HA ALA 79 2.733 9.411 -4.908
146 HB1 ALA 79 1HB ALA 79 4.628 11.113 -4.720
147 HB2 ALA 79 2HB ALA 79 4.718 10.023 -6.105
148 HB3 ALA 79 3HB ALA 79 5.735 9.740 -4.691
149 H VAL 80 H VAL 80 5.130 7.746 -2.925
150 HA VAL 80 HA VAL 80 5.400 5.505 -4.786
151 HB VAL 80 HB VAL 80 6.202 5.840 -1.878
152 HG11 VAL 80 1HG1 VAL 80 6.211 3.550 -1.994
153 HG12 VAL 80 2HG1 VAL 80 7.752 3.831 -2.804
154 HG13 VAL 80 3HG1 VAL 80 6.297 3.536 -3.756
155 HG21 VAL 80 3HG2 VAL 80 7.610 7.254 -3.094
156 HG22 VAL 80 1HG2 VAL 80 7.556 6.235 -4.533
157 HG23 VAL 80 2HG2 VAL 80 8.516 5.742 -3.138
158 H GLN 81 H GLN 81 3.537 6.322 -1.924
159 HA GLN 81 HA GLN 81 2.404 3.743 -1.406
160 HB2 GLN 81 1HB GLN 81 2.315 5.904 0.021
161 HB3 GLN 81 2HB GLN 81 0.939 6.347 -0.983
162 HG2 GLN 81 1HG GLN 81 -0.331 5.128 0.420
163 HG3 GLN 81 2HG GLN 81 0.433 3.696 -0.273
164 HE21 GLN 81 1HE2 GLN 81 1.295 6.243 2.144
165 HE22 GLN 81 2HE2 GLN 81 1.988 5.161 3.243
166 H LYS 82 H LYS 82 1.243 6.497 -3.366
167 HA LYS 82 HA LYS 82 -1.167 5.291 -4.273
168 HB2 LYS 82 1HB LYS 82 0.577 7.531 -5.171
169 HB3 LYS 82 2HB LYS 82 -0.525 6.865 -6.374
170 HG2 LYS 82 1HG LYS 82 -1.690 8.649 -5.262
171 HG3 LYS 82 2HG LYS 82 -2.390 7.141 -4.677
172 HD2 LYS 82 1HD LYS 82 -0.889 7.253 -2.690
173 HD3 LYS 82 2HD LYS 82 -0.292 8.812 -3.263
174 HE2 LYS 82 1HE LYS 82 -2.969 8.105 -2.131
175 HE3 LYS 82 2HE LYS 82 -1.977 9.537 -1.851
176 HZ1 LYS 82 3HZ LYS 82 -3.837 10.158 -3.181
177 HZ2 LYS 82 1HZ LYS 82 -3.554 8.901 -4.283
178 HZ3 LYS 82 2HZ LYS 82 -2.459 10.196 -4.175
179 H GLU 83 H GLU 83 2.056 5.402 -5.842
180 HA GLU 83 HA GLU 83 1.313 3.881 -8.125
181 HB2 GLU 83 1HB GLU 83 3.942 4.300 -6.703
182 HB3 GLU 83 2HB GLU 83 3.830 3.250 -8.116
183 HG2 GLU 83 1HG GLU 83 2.548 5.924 -8.343
184 HG3 GLU 83 2HG GLU 83 4.311 5.894 -8.317
185 H LEU 84 H LEU 84 2.359 2.815 -4.904
186 HA LEU 84 HA LEU 84 2.442 0.017 -5.717
187 HB2 LEU 84 1HB LEU 84 2.429 1.330 -2.980
188 HB3 LEU 84 2HB LEU 84 2.631 -0.404 -3.244
189 HG LEU 84 HG LEU 84 4.408 1.723 -4.476
190 HD11 LEU 84 1HD1 LEU 84 5.110 -0.154 -2.212
191 HD12 LEU 84 2HD1 LEU 84 4.550 1.497 -1.941
192 HD13 LEU 84 3HD1 LEU 84 6.050 1.207 -2.820
193 HD21 LEU 84 3HD2 LEU 84 4.170 -1.226 -4.694
194 HD22 LEU 84 1HD2 LEU 84 5.810 -0.608 -4.504
195 HD23 LEU 84 2HD2 LEU 84 4.811 -0.059 -5.849
196 H LEU 85 H LEU 85 0.078 2.127 -4.104
197 HA LEU 85 HA LEU 85 -1.811 0.004 -3.575
198 HB2 LEU 85 1HB LEU 85 -2.062 3.014 -3.782
199 HB3 LEU 85 2HB LEU 85 -3.470 1.989 -3.505
200 HG LEU 85 HG LEU 85 -1.003 1.778 -1.780
201 HD11 LEU 85 1HD1 LEU 85 -2.117 3.273 -0.170
202 HD12 LEU 85 2HD1 LEU 85 -3.418 3.553 -1.329
203 HD13 LEU 85 3HD1 LEU 85 -1.783 4.113 -1.685
204 HD21 LEU 85 3HD2 LEU 85 -3.601 1.338 -0.553
205 HD22 LEU 85 1HD2 LEU 85 -2.222 0.244 -0.655
206 HD23 LEU 85 2HD2 LEU 85 -3.391 0.312 -1.972
207 H ALA 86 H ALA 86 -1.299 2.230 -6.292
208 HA ALA 86 HA ALA 86 -3.634 1.438 -7.761
209 HB1 ALA 86 1HB ALA 86 -2.662 3.422 -8.549
210 HB2 ALA 86 2HB ALA 86 -2.144 2.249 -9.760
211 HB3 ALA 86 3HB ALA 86 -1.029 2.758 -8.490
212 H GLU 87 H GLU 87 -0.382 0.117 -7.473
213 HA GLU 87 HA GLU 87 -0.687 -1.774 -9.679
214 HB2 GLU 87 1HB GLU 87 1.550 -1.046 -8.834
215 HB3 GLU 87 2HB GLU 87 1.212 -1.864 -7.308
216 HG2 GLU 87 1HG GLU 87 0.677 -3.687 -9.458
217 HG3 GLU 87 2HG GLU 87 2.283 -2.994 -9.693
218 H TRP 88 H TRP 88 -1.224 -1.825 -6.188
219 HA TRP 88 HA TRP 88 -1.794 -4.640 -5.974
220 HB2 TRP 88 1HB TRP 88 -2.886 -2.327 -4.340
221 HB3 TRP 88 2HB TRP 88 -2.947 -4.026 -3.881
222 HD1 TRP 88 HD TRP 88 0.261 -3.864 -5.413
223 HE1 TRP 88 1HE TRP 88 2.141 -3.386 -3.703
224 HE3 TRP 88 3HE TRP 88 -2.512 -2.165 -1.475
225 HZ2 TRP 88 2HZ TRP 88 2.430 -2.410 -1.043
226 HZ3 TRP 88 3HZ TRP 88 -1.411 -1.471 0.632
227 HH2 TRP 88 HH TRP 88 1.057 -1.592 0.853
228 H LYS 89 H LYS 89 -3.631 -1.811 -6.916
229 HA LYS 89 HA LYS 89 -6.212 -3.123 -6.879
230 HB2 LYS 89 1HB LYS 89 -6.006 -0.671 -6.705
231 HB3 LYS 89 2HB LYS 89 -5.317 -0.612 -8.329
232 HG2 LYS 89 1HG LYS 89 -7.792 -2.117 -8.328
233 HG3 LYS 89 2HG LYS 89 -8.045 -0.507 -7.652
234 HD2 LYS 89 1HD LYS 89 -6.866 0.458 -9.638
235 HD3 LYS 89 2HD LYS 89 -6.786 -1.163 -10.330
236 HE2 LYS 89 1HE LYS 89 -9.306 -1.278 -10.102
237 HE3 LYS 89 2HE LYS 89 -9.275 0.434 -9.682
238 HZ1 LYS 89 3HZ LYS 89 -7.728 0.216 -11.937
239 HZ2 LYS 89 1HZ LYS 89 -9.302 0.837 -11.850
240 HZ3 LYS 89 2HZ LYS 89 -9.056 -0.799 -12.237
241 H ARG 90 H ARG 90 -3.755 -2.553 -9.420
242 HA ARG 90 HA ARG 90 -5.387 -3.443 -11.577
243 HB2 ARG 90 1HB ARG 90 -2.548 -2.918 -11.125
244 HB3 ARG 90 2HB ARG 90 -2.790 -4.313 -12.176
245 HG2 ARG 90 1HG ARG 90 -2.694 -2.294 -13.535
246 HG3 ARG 90 2HG ARG 90 -4.331 -2.946 -13.579
247 HD2 ARG 90 1HD ARG 90 -5.205 -1.166 -12.457
248 HD3 ARG 90 2HD ARG 90 -3.807 -1.030 -11.389
249 HE ARG 90 HE ARG 90 -2.893 -0.202 -13.898
250 HH11 ARG 90 1HH2 ARG 90 -5.365 0.637 -11.647
251 HH12 ARG 90 2HH2 ARG 90 -5.389 2.310 -12.095
252 HH21 ARG 90 1HH1 ARG 90 -2.905 1.977 -14.491
253 HH22 ARG 90 2HH1 ARG 90 -3.997 3.069 -13.706
254 H THR 91 H THR 91 -3.257 -5.216 -9.341
255 HA THR 91 HA THR 91 -4.017 -7.802 -10.535
256 HB THR 91 HB THR 91 -2.538 -8.775 -8.937
257 HG1 THR 91 1HG THR 91 -3.084 -6.410 -7.530
258 HG21 THR 91 3HG2 THR 91 -0.498 -7.439 -9.150
259 HG22 THR 91 1HG2 THR 91 -1.454 -6.011 -9.546
260 HG23 THR 91 2HG2 THR 91 -1.414 -7.380 -10.657
261 H GLY 92 H GLY 92 -4.679 -5.944 -7.600
262 HA2 GLY 92 1HA GLY 92 -6.907 -5.930 -6.586
263 HA3 GLY 92 2HA GLY 92 -7.167 -7.550 -7.236
Start of MODEL 17
1 H LYS 61 H LYS 61 -10.521 0.807 4.248
2 HA LYS 61 HA LYS 61 -10.886 -2.074 3.625
3 HB2 LYS 61 1HB LYS 61 -12.076 0.156 2.146
4 HB3 LYS 61 2HB LYS 61 -11.072 -0.877 1.127
5 HG2 LYS 61 1HG LYS 61 -12.307 -2.853 1.824
6 HG3 LYS 61 2HG LYS 61 -13.239 -1.904 2.982
7 HD2 LYS 61 1HD LYS 61 -14.745 -1.493 1.361
8 HD3 LYS 61 2HD LYS 61 -13.504 -0.588 0.495
9 HE2 LYS 61 1HE LYS 61 -14.041 -3.562 0.265
10 HE3 LYS 61 2HE LYS 61 -14.382 -2.340 -0.960
11 HZ1 LYS 61 3HZ LYS 61 -11.720 -3.163 0.061
12 HZ2 LYS 61 1HZ LYS 61 -11.968 -1.820 -0.946
13 HZ3 LYS 61 2HZ LYS 61 -12.333 -3.381 -1.508
14 H ILE 62 H ILE 62 -8.809 -2.756 3.515
15 HA ILE 62 HA ILE 62 -6.973 -1.497 1.613
16 HB ILE 62 HB ILE 62 -6.085 -1.681 4.511
17 HG12 ILE 62 1HG1 ILE 62 -6.821 0.773 2.868
18 HG13 ILE 62 2HG1 ILE 62 -7.702 0.167 4.268
19 HG21 ILE 62 1HG2 ILE 62 -4.130 -0.410 3.603
20 HG22 ILE 62 2HG2 ILE 62 -4.823 -0.556 1.990
21 HG23 ILE 62 3HG2 ILE 62 -4.309 -1.999 2.863
22 HD11 ILE 62 3HD1 ILE 62 -4.870 1.223 4.259
23 HD12 ILE 62 1HD1 ILE 62 -5.648 0.469 5.649
24 HD13 ILE 62 2HD1 ILE 62 -6.278 1.982 4.999
25 H THR 63 H THR 63 -5.684 -3.049 0.738
26 HA THR 63 HA THR 63 -5.399 -5.637 2.225
27 HB THR 63 HB THR 63 -5.443 -5.655 -0.755
28 HG1 THR 63 1HG THR 63 -7.422 -4.619 0.705
29 HG21 THR 63 3HG2 THR 63 -5.128 -7.612 0.964
30 HG22 THR 63 1HG2 THR 63 -6.148 -7.858 -0.453
31 HG23 THR 63 2HG2 THR 63 -6.883 -7.515 1.113
32 H PHE 64 H PHE 64 -3.287 -5.922 2.690
33 HA PHE 64 HA PHE 64 -1.249 -4.688 0.917
34 HB2 PHE 64 1HB PHE 64 -0.859 -6.031 3.605
35 HB3 PHE 64 2HB PHE 64 0.303 -5.026 2.747
36 HD1 PHE 64 1HD PHE 64 -0.395 -2.579 2.239
37 HD2 PHE 64 2HD PHE 64 -2.350 -5.077 5.134
38 HE1 PHE 64 1HE PHE 64 -1.313 -0.564 3.357
39 HE2 PHE 64 2HE PHE 64 -3.269 -3.064 6.252
40 HZ PHE 64 HZ PHE 64 -2.748 -0.808 5.367
41 HA PRO 65 HA PRO 65 -0.419 -8.676 -1.058
42 HB2 PRO 65 1HB PRO 65 2.405 -7.766 -0.844
43 HB3 PRO 65 2HB PRO 65 1.513 -8.371 -2.249
44 HG2 PRO 65 1HG PRO 65 2.079 -5.769 -1.888
45 HG3 PRO 65 2HG PRO 65 0.638 -6.336 -2.742
46 HD2 PRO 65 1HD PRO 65 0.834 -5.039 -0.100
47 HD3 PRO 65 2HD PRO 65 -0.570 -5.212 -1.174
48 H SER 66 H SER 66 0.648 -10.679 -0.482
49 HA SER 66 HA SER 66 0.879 -11.236 2.315
50 HB2 SER 66 1HB SER 66 1.567 -13.419 1.649
51 HB3 SER 66 2HB SER 66 0.425 -12.881 0.421
52 HG SER 66 HG SER 66 2.130 -13.577 -0.729
53 H ASP 67 H ASP 67 2.978 -9.444 0.452
54 HA ASP 67 HA ASP 67 5.289 -10.223 2.198
55 HB2 ASP 67 1HB ASP 67 5.093 -9.971 -0.709
56 HB3 ASP 67 2HB ASP 67 6.411 -9.017 -0.027
57 H ILE 68 H ILE 68 3.098 -7.901 2.095
58 HA ILE 68 HA ILE 68 5.090 -5.681 2.373
59 HB ILE 68 HB ILE 68 2.172 -5.654 1.626
60 HG12 ILE 68 1HG1 ILE 68 3.740 -6.034 -0.224
61 HG13 ILE 68 2HG1 ILE 68 3.024 -4.434 -0.353
62 HG21 ILE 68 1HG2 ILE 68 3.922 -3.508 2.753
63 HG22 ILE 68 2HG2 ILE 68 2.202 -3.798 3.007
64 HG23 ILE 68 3HG2 ILE 68 2.761 -3.070 1.500
65 HD11 ILE 68 3HD1 ILE 68 5.205 -3.794 1.091
66 HD12 ILE 68 1HD1 ILE 68 5.213 -3.834 -0.670
67 HD13 ILE 68 2HD1 ILE 68 5.833 -5.206 0.246
68 H ASP 69 H ASP 69 5.403 -4.915 4.328
69 HA ASP 69 HA ASP 69 3.661 -5.770 6.551
70 HB2 ASP 69 1HB ASP 69 6.090 -5.898 6.839
71 HB3 ASP 69 2HB ASP 69 6.223 -4.165 6.562
72 HA PRO 70 HA PRO 70 1.158 -2.001 6.026
73 HB2 PRO 70 1HB PRO 70 0.662 -2.583 8.916
74 HB3 PRO 70 2HB PRO 70 -0.493 -2.193 7.627
75 HG2 PRO 70 1HG PRO 70 -0.163 -4.687 8.515
76 HG3 PRO 70 2HG PRO 70 -0.526 -4.330 6.818
77 HD2 PRO 70 1HD PRO 70 2.009 -5.282 8.031
78 HD3 PRO 70 2HD PRO 70 1.420 -5.449 6.363
79 H GLN 71 H GLN 71 3.249 -2.467 8.888
80 HA GLN 71 HA GLN 71 3.358 0.376 9.513
81 HB2 GLN 71 1HB GLN 71 4.713 -2.101 10.476
82 HB3 GLN 71 2HB GLN 71 5.549 -0.572 10.747
83 HG2 GLN 71 1HG GLN 71 3.644 0.334 11.934
84 HG3 GLN 71 2HG GLN 71 2.663 -1.072 11.521
85 HE21 GLN 71 1HE2 GLN 71 2.357 -2.012 13.586
86 HE22 GLN 71 2HE2 GLN 71 3.630 -2.506 14.593
87 H VAL 72 H VAL 72 5.328 -1.780 7.521
88 HA VAL 72 HA VAL 72 7.357 0.302 7.130
89 HB VAL 72 HB VAL 72 6.939 -2.272 5.582
90 HG11 VAL 72 1HG1 VAL 72 8.490 -1.248 4.269
91 HG12 VAL 72 2HG1 VAL 72 9.609 -1.712 5.552
92 HG13 VAL 72 3HG1 VAL 72 8.926 -0.086 5.522
93 HG21 VAL 72 3HG2 VAL 72 9.008 -1.880 7.724
94 HG22 VAL 72 1HG2 VAL 72 8.281 -3.379 7.142
95 HG23 VAL 72 2HG2 VAL 72 7.361 -2.301 8.192
96 H PHE 73 H PHE 73 4.358 -0.664 5.676
97 HA PHE 73 HA PHE 73 4.830 0.529 3.076
98 HB2 PHE 73 1HB PHE 73 3.126 -1.286 3.687
99 HB3 PHE 73 2HB PHE 73 2.151 0.008 4.381
100 HD1 PHE 73 1HD PHE 73 4.128 -0.610 1.237
101 HD2 PHE 73 2HD PHE 73 0.520 0.902 3.008
102 HE1 PHE 73 1HE PHE 73 3.259 -0.040 -1.012
103 HE2 PHE 73 2HE PHE 73 -0.344 1.476 0.757
104 HZ PHE 73 HZ PHE 73 1.029 1.007 -1.252
105 H TYR 74 H TYR 74 2.790 1.547 5.846
106 HA TYR 74 HA TYR 74 2.127 4.098 4.756
107 HB2 TYR 74 1HB TYR 74 2.350 3.176 7.638
108 HB3 TYR 74 2HB TYR 74 1.740 4.766 7.181
109 HD1 TYR 74 1HD TYR 74 -0.060 4.618 5.137
110 HD2 TYR 74 2HD TYR 74 0.750 1.547 8.029
111 HE1 TYR 74 1HE TYR 74 -2.302 3.641 4.728
112 HE2 TYR 74 2HE TYR 74 -1.491 0.568 7.620
113 HH TYR 74 HH TYR 74 -3.875 2.206 5.645
114 H GLU 75 H GLU 75 5.098 2.940 5.985
115 HA GLU 75 HA GLU 75 6.142 5.555 6.774
116 HB2 GLU 75 1HB GLU 75 6.879 2.927 7.259
117 HB3 GLU 75 2HB GLU 75 8.110 3.482 6.124
118 HG2 GLU 75 1HG GLU 75 8.986 4.089 8.228
119 HG3 GLU 75 2HG GLU 75 8.258 5.583 7.638
120 H LEU 76 H LEU 76 5.492 4.115 3.816
121 HA LEU 76 HA LEU 76 7.825 5.246 2.423
122 HB2 LEU 76 1HB LEU 76 5.352 3.905 1.295
123 HB3 LEU 76 2HB LEU 76 6.834 4.262 0.409
124 HG LEU 76 HG LEU 76 6.612 2.418 2.807
125 HD11 LEU 76 1HD1 LEU 76 7.467 0.827 0.856
126 HD12 LEU 76 2HD1 LEU 76 6.647 2.013 -0.160
127 HD13 LEU 76 3HD1 LEU 76 5.746 1.139 1.077
128 HD21 LEU 76 3HD2 LEU 76 8.895 3.544 1.233
129 HD22 LEU 76 1HD2 LEU 76 9.013 1.870 1.779
130 HD23 LEU 76 2HD2 LEU 76 8.799 3.168 2.954
131 HA PRO 77 HA PRO 77 6.056 9.202 1.454
132 HB2 PRO 77 1HB PRO 77 6.699 8.845 -1.398
133 HB3 PRO 77 2HB PRO 77 7.297 10.058 -0.256
134 HG2 PRO 77 1HG PRO 77 8.748 7.935 -1.216
135 HG3 PRO 77 2HG PRO 77 9.112 8.842 0.257
136 HD2 PRO 77 1HD PRO 77 8.107 6.105 -0.013
137 HD3 PRO 77 2HD PRO 77 8.789 6.925 1.406
138 H GLU 78 H GLU 78 4.237 10.173 0.292
139 HA GLU 78 HA GLU 78 2.051 8.378 -0.154
140 HB2 GLU 78 1HB GLU 78 2.118 11.143 -1.328
141 HB3 GLU 78 2HB GLU 78 0.777 10.292 -0.562
142 HG2 GLU 78 1HG GLU 78 2.509 10.371 1.516
143 HG3 GLU 78 2HG GLU 78 2.984 11.847 0.675
144 H ALA 79 H ALA 79 4.009 10.281 -2.489
145 HA ALA 79 HA ALA 79 2.728 9.406 -4.829
146 HB1 ALA 79 1HB ALA 79 5.429 9.471 -5.528
147 HB2 ALA 79 2HB ALA 79 5.325 10.565 -4.148
148 HB3 ALA 79 3HB ALA 79 4.317 10.840 -5.571
149 H VAL 80 H VAL 80 5.104 7.745 -2.820
150 HA VAL 80 HA VAL 80 5.401 5.499 -4.673
151 HB VAL 80 HB VAL 80 6.206 5.946 -1.785
152 HG11 VAL 80 1HG1 VAL 80 7.628 3.791 -2.425
153 HG12 VAL 80 2HG1 VAL 80 6.260 3.491 -3.497
154 HG13 VAL 80 3HG1 VAL 80 6.002 3.639 -1.758
155 HG21 VAL 80 3HG2 VAL 80 7.423 7.159 -3.629
156 HG22 VAL 80 1HG2 VAL 80 7.866 5.589 -4.298
157 HG23 VAL 80 2HG2 VAL 80 8.446 6.062 -2.702
158 H GLN 81 H GLN 81 3.508 6.304 -1.825
159 HA GLN 81 HA GLN 81 2.375 3.721 -1.318
160 HB2 GLN 81 1HB GLN 81 2.276 5.863 0.121
161 HB3 GLN 81 2HB GLN 81 0.924 6.334 -0.904
162 HG2 GLN 81 1HG GLN 81 -0.407 5.101 0.425
163 HG3 GLN 81 2HG GLN 81 0.401 3.667 -0.209
164 HE21 GLN 81 1HE2 GLN 81 1.457 6.266 2.078
165 HE22 GLN 81 2HE2 GLN 81 1.952 5.188 3.283
166 H LYS 82 H LYS 82 1.192 6.485 -3.247
167 HA LYS 82 HA LYS 82 -1.206 5.261 -4.167
168 HB2 LYS 82 1HB LYS 82 0.495 7.554 -5.024
169 HB3 LYS 82 2HB LYS 82 -0.663 6.927 -6.197
170 HG2 LYS 82 1HG LYS 82 -1.721 8.692 -4.880
171 HG3 LYS 82 2HG LYS 82 -2.462 7.141 -4.483
172 HD2 LYS 82 1HD LYS 82 -0.999 6.956 -2.495
173 HD3 LYS 82 2HD LYS 82 -0.288 8.525 -2.883
174 HE2 LYS 82 1HE LYS 82 -3.008 9.048 -2.937
175 HE3 LYS 82 2HE LYS 82 -2.853 7.907 -1.602
176 HZ1 LYS 82 3HZ LYS 82 -2.540 10.132 -0.798
177 HZ2 LYS 82 1HZ LYS 82 -1.334 10.434 -1.953
178 HZ3 LYS 82 2HZ LYS 82 -1.059 9.305 -0.712
179 H GLU 83 H GLU 83 2.007 5.476 -5.759
180 HA GLU 83 HA GLU 83 1.269 4.011 -8.079
181 HB2 GLU 83 1HB GLU 83 3.942 4.249 -6.665
182 HB3 GLU 83 2HB GLU 83 3.740 3.468 -8.234
183 HG2 GLU 83 1HG GLU 83 2.669 5.619 -9.047
184 HG3 GLU 83 2HG GLU 83 3.189 6.362 -7.537
185 H LEU 84 H LEU 84 2.440 2.855 -4.918
186 HA LEU 84 HA LEU 84 2.510 0.090 -5.804
187 HB2 LEU 84 1HB LEU 84 2.451 1.288 -3.015
188 HB3 LEU 84 2HB LEU 84 2.730 -0.418 -3.364
189 HG LEU 84 HG LEU 84 4.421 1.837 -4.482
190 HD11 LEU 84 1HD1 LEU 84 5.155 -0.084 -2.259
191 HD12 LEU 84 2HD1 LEU 84 4.569 1.555 -1.967
192 HD13 LEU 84 3HD1 LEU 84 6.083 1.300 -2.834
193 HD21 LEU 84 3HD2 LEU 84 5.969 -0.335 -4.657
194 HD22 LEU 84 1HD2 LEU 84 4.812 0.076 -5.924
195 HD23 LEU 84 2HD2 LEU 84 4.403 -1.144 -4.718
196 H LEU 85 H LEU 85 0.107 2.154 -4.219
197 HA LEU 85 HA LEU 85 -1.753 0.002 -3.687
198 HB2 LEU 85 1HB LEU 85 -2.032 3.010 -3.898
199 HB3 LEU 85 2HB LEU 85 -3.432 1.973 -3.624
200 HG LEU 85 HG LEU 85 -0.972 1.770 -1.891
201 HD11 LEU 85 1HD1 LEU 85 -2.530 3.173 -0.287
202 HD12 LEU 85 2HD1 LEU 85 -3.198 3.775 -1.805
203 HD13 LEU 85 3HD1 LEU 85 -1.485 3.994 -1.446
204 HD21 LEU 85 3HD2 LEU 85 -3.339 0.293 -2.088
205 HD22 LEU 85 1HD2 LEU 85 -3.601 1.348 -0.701
206 HD23 LEU 85 2HD2 LEU 85 -2.210 0.268 -0.734
207 H ALA 86 H ALA 86 -1.236 2.208 -6.417
208 HA ALA 86 HA ALA 86 -3.568 1.441 -7.893
209 HB1 ALA 86 1HB ALA 86 -2.767 3.144 -9.134
210 HB2 ALA 86 2HB ALA 86 -1.528 2.051 -9.749
211 HB3 ALA 86 3HB ALA 86 -1.201 3.046 -8.331
212 H GLU 87 H GLU 87 -0.346 0.045 -7.585
213 HA GLU 87 HA GLU 87 -0.687 -1.879 -9.756
214 HB2 GLU 87 1HB GLU 87 1.547 -1.148 -8.809
215 HB3 GLU 87 2HB GLU 87 1.162 -2.075 -7.358
216 HG2 GLU 87 1HG GLU 87 0.704 -4.016 -9.088
217 HG3 GLU 87 2HG GLU 87 1.754 -3.054 -10.130
218 H TRP 88 H TRP 88 -1.328 -1.825 -6.295
219 HA TRP 88 HA TRP 88 -1.943 -4.635 -6.045
220 HB2 TRP 88 1HB TRP 88 -2.971 -2.286 -4.425
221 HB3 TRP 88 2HB TRP 88 -3.054 -3.981 -3.949
222 HD1 TRP 88 HD TRP 88 0.135 -3.861 -5.536
223 HE1 TRP 88 1HE TRP 88 2.049 -3.407 -3.852
224 HE3 TRP 88 3HE TRP 88 -2.557 -2.142 -1.557
225 HZ2 TRP 88 2HZ TRP 88 2.385 -2.437 -1.198
226 HZ3 TRP 88 3HZ TRP 88 -1.420 -1.462 0.534
227 HH2 TRP 88 HH TRP 88 1.047 -1.610 0.721
228 H LYS 89 H LYS 89 -3.746 -1.775 -7.007
229 HA LYS 89 HA LYS 89 -6.345 -3.063 -6.921
230 HB2 LYS 89 1HB LYS 89 -6.026 -0.582 -6.791
231 HB3 LYS 89 2HB LYS 89 -5.516 -0.598 -8.479
232 HG2 LYS 89 1HG LYS 89 -7.708 -1.660 -9.074
233 HG3 LYS 89 2HG LYS 89 -8.214 -1.455 -7.397
234 HD2 LYS 89 1HD LYS 89 -8.761 0.694 -7.778
235 HD3 LYS 89 2HD LYS 89 -7.143 1.030 -8.394
236 HE2 LYS 89 1HE LYS 89 -8.915 1.477 -10.089
237 HE3 LYS 89 2HE LYS 89 -7.783 0.229 -10.611
238 HZ1 LYS 89 3HZ LYS 89 -9.447 -1.200 -10.772
239 HZ2 LYS 89 1HZ LYS 89 -10.544 0.025 -10.356
240 HZ3 LYS 89 2HZ LYS 89 -9.872 -0.958 -9.145
241 H ARG 90 H ARG 90 -3.914 -2.536 -9.483
242 HA ARG 90 HA ARG 90 -5.575 -3.447 -11.619
243 HB2 ARG 90 1HB ARG 90 -2.801 -2.752 -11.245
244 HB3 ARG 90 2HB ARG 90 -2.908 -4.254 -12.164
245 HG2 ARG 90 1HG ARG 90 -4.426 -1.711 -12.814
246 HG3 ARG 90 2HG ARG 90 -2.966 -2.258 -13.638
247 HD2 ARG 90 1HD ARG 90 -4.670 -4.484 -13.650
248 HD3 ARG 90 2HD ARG 90 -5.716 -3.115 -14.022
249 HE ARG 90 HE ARG 90 -3.443 -2.792 -15.635
250 HH11 ARG 90 1HH2 ARG 90 -5.920 -5.120 -15.067
251 HH12 ARG 90 2HH2 ARG 90 -5.912 -5.724 -16.691
252 HH21 ARG 90 1HH1 ARG 90 -3.416 -3.569 -17.760
253 HH22 ARG 90 2HH1 ARG 90 -4.494 -4.846 -18.214
254 H THR 91 H THR 91 -3.306 -5.189 -9.478
255 HA THR 91 HA THR 91 -4.184 -7.774 -10.633
256 HB THR 91 HB THR 91 -2.395 -8.739 -9.483
257 HG1 THR 91 1HG THR 91 -1.861 -8.182 -7.499
258 HG21 THR 91 3HG2 THR 91 -1.154 -6.049 -9.362
259 HG22 THR 91 1HG2 THR 91 -1.856 -6.505 -10.915
260 HG23 THR 91 2HG2 THR 91 -0.604 -7.509 -10.184
261 H GLY 92 H GLY 92 -4.383 -5.974 -7.591
262 HA2 GLY 92 1HA GLY 92 -6.389 -6.011 -6.211
263 HA3 GLY 92 2HA GLY 92 -6.783 -7.590 -6.889
Start of MODEL 18
1 H LYS 61 H LYS 61 -12.427 -0.878 1.839
2 HA LYS 61 HA LYS 61 -10.953 -2.106 4.103
3 HB2 LYS 61 1HB LYS 61 -12.737 -3.053 2.024
4 HB3 LYS 61 2HB LYS 61 -11.236 -3.977 2.020
5 HG2 LYS 61 1HG LYS 61 -12.729 -3.416 4.587
6 HG3 LYS 61 2HG LYS 61 -13.130 -4.800 3.573
7 HD2 LYS 61 1HD LYS 61 -10.795 -5.588 3.716
8 HD3 LYS 61 2HD LYS 61 -10.392 -4.211 4.739
9 HE2 LYS 61 1HE LYS 61 -12.724 -5.787 5.640
10 HE3 LYS 61 2HE LYS 61 -11.181 -6.639 5.704
11 HZ1 LYS 61 3HZ LYS 61 -10.340 -4.498 6.802
12 HZ2 LYS 61 1HZ LYS 61 -11.283 -5.558 7.731
13 HZ3 LYS 61 2HZ LYS 61 -11.981 -4.154 7.076
14 H ILE 62 H ILE 62 -8.728 -2.138 4.020
15 HA ILE 62 HA ILE 62 -7.435 -1.716 1.369
16 HB ILE 62 HB ILE 62 -6.351 -1.459 4.192
17 HG12 ILE 62 1HG1 ILE 62 -6.789 0.641 2.048
18 HG13 ILE 62 2HG1 ILE 62 -7.930 0.325 3.355
19 HG21 ILE 62 1HG2 ILE 62 -5.053 -1.272 1.476
20 HG22 ILE 62 2HG2 ILE 62 -4.492 -2.137 2.905
21 HG23 ILE 62 3HG2 ILE 62 -4.403 -0.378 2.849
22 HD11 ILE 62 3HD1 ILE 62 -6.397 1.030 5.019
23 HD12 ILE 62 1HD1 ILE 62 -6.221 2.219 3.728
24 HD13 ILE 62 2HD1 ILE 62 -5.027 0.935 3.914
25 H THR 63 H THR 63 -5.884 -3.179 0.608
26 HA THR 63 HA THR 63 -5.566 -5.714 2.170
27 HB THR 63 HB THR 63 -6.005 -5.464 -0.820
28 HG1 THR 63 1HG THR 63 -7.617 -6.389 1.316
29 HG21 THR 63 3HG2 THR 63 -6.146 -7.992 -0.613
30 HG22 THR 63 1HG2 THR 63 -5.480 -7.814 1.010
31 HG23 THR 63 2HG2 THR 63 -4.537 -7.307 -0.391
32 H PHE 64 H PHE 64 -3.455 -5.874 2.669
33 HA PHE 64 HA PHE 64 -1.436 -4.688 0.850
34 HB2 PHE 64 1HB PHE 64 -1.072 -5.887 3.611
35 HB3 PHE 64 2HB PHE 64 0.127 -4.967 2.706
36 HD1 PHE 64 1HD PHE 64 -0.290 -2.548 2.202
37 HD2 PHE 64 2HD PHE 64 -2.796 -4.799 4.859
38 HE1 PHE 64 1HE PHE 64 -1.180 -0.434 3.141
39 HE2 PHE 64 2HE PHE 64 -3.695 -2.686 5.800
40 HZ PHE 64 HZ PHE 64 -2.887 -0.504 4.942
41 HA PRO 65 HA PRO 65 -0.486 -8.701 -1.010
42 HB2 PRO 65 1HB PRO 65 2.313 -7.734 -0.699
43 HB3 PRO 65 2HB PRO 65 1.501 -8.414 -2.120
44 HG2 PRO 65 1HG PRO 65 1.977 -5.795 -1.864
45 HG3 PRO 65 2HG PRO 65 0.553 -6.427 -2.701
46 HD2 PRO 65 1HD PRO 65 0.712 -5.042 -0.094
47 HD3 PRO 65 2HD PRO 65 -0.674 -5.246 -1.187
48 H SER 66 H SER 66 0.561 -10.688 -0.389
49 HA SER 66 HA SER 66 0.747 -11.203 2.432
50 HB2 SER 66 1HB SER 66 0.942 -12.698 -0.043
51 HB3 SER 66 2HB SER 66 2.182 -13.211 1.097
52 HG SER 66 HG SER 66 -0.485 -13.634 1.141
53 H ASP 67 H ASP 67 2.894 -9.519 0.513
54 HA ASP 67 HA ASP 67 5.181 -10.317 2.280
55 HB2 ASP 67 1HB ASP 67 4.997 -10.082 -0.637
56 HB3 ASP 67 2HB ASP 67 6.352 -9.186 0.052
57 H ILE 68 H ILE 68 3.028 -7.947 2.059
58 HA ILE 68 HA ILE 68 5.056 -5.767 2.365
59 HB ILE 68 HB ILE 68 2.174 -5.708 1.499
60 HG12 ILE 68 1HG1 ILE 68 3.828 -6.108 -0.273
61 HG13 ILE 68 2HG1 ILE 68 3.128 -4.502 -0.445
62 HG21 ILE 68 1HG2 ILE 68 2.806 -3.126 1.382
63 HG22 ILE 68 2HG2 ILE 68 3.868 -3.573 2.718
64 HG23 ILE 68 3HG2 ILE 68 2.128 -3.839 2.846
65 HD11 ILE 68 3HD1 ILE 68 5.243 -3.873 1.103
66 HD12 ILE 68 1HD1 ILE 68 5.335 -3.916 -0.656
67 HD13 ILE 68 2HD1 ILE 68 5.901 -5.291 0.290
68 H ASP 69 H ASP 69 5.315 -4.949 4.308
69 HA ASP 69 HA ASP 69 3.453 -5.705 6.482
70 HB2 ASP 69 1HB ASP 69 5.980 -5.827 6.737
71 HB3 ASP 69 2HB ASP 69 5.988 -4.066 6.717
72 HA PRO 70 HA PRO 70 1.310 -1.811 6.083
73 HB2 PRO 70 1HB PRO 70 0.313 -1.627 8.667
74 HB3 PRO 70 2HB PRO 70 -0.434 -2.539 7.344
75 HG2 PRO 70 1HG PRO 70 1.187 -3.498 9.621
76 HG3 PRO 70 2HG PRO 70 -0.136 -4.292 8.753
77 HD2 PRO 70 1HD PRO 70 2.511 -4.939 8.407
78 HD3 PRO 70 2HD PRO 70 1.268 -5.186 7.163
79 H GLN 71 H GLN 71 3.426 -2.262 8.916
80 HA GLN 71 HA GLN 71 3.620 0.614 9.426
81 HB2 GLN 71 1HB GLN 71 4.566 -1.848 10.671
82 HB3 GLN 71 2HB GLN 71 5.838 -0.628 10.597
83 HG2 GLN 71 1HG GLN 71 4.595 -0.327 12.665
84 HG3 GLN 71 2HG GLN 71 4.239 1.025 11.590
85 HE21 GLN 71 1HE2 GLN 71 2.808 -1.994 10.658
86 HE22 GLN 71 2HE2 GLN 71 1.235 -1.659 11.202
87 H VAL 72 H VAL 72 5.427 -1.735 7.517
88 HA VAL 72 HA VAL 72 7.582 0.205 7.035
89 HB VAL 72 HB VAL 72 7.038 -2.409 5.595
90 HG11 VAL 72 1HG1 VAL 72 9.347 -0.483 5.747
91 HG12 VAL 72 2HG1 VAL 72 8.594 -1.196 4.320
92 HG13 VAL 72 3HG1 VAL 72 9.619 -2.182 5.363
93 HG21 VAL 72 3HG2 VAL 72 8.209 -3.554 7.238
94 HG22 VAL 72 1HG2 VAL 72 7.434 -2.327 8.238
95 HG23 VAL 72 2HG2 VAL 72 9.111 -2.122 7.738
96 H PHE 73 H PHE 73 4.535 -0.691 5.631
97 HA PHE 73 HA PHE 73 5.088 0.421 2.990
98 HB2 PHE 73 1HB PHE 73 3.435 -1.392 3.366
99 HB3 PHE 73 2HB PHE 73 2.466 -0.286 4.337
100 HD1 PHE 73 2HD PHE 73 4.077 -0.517 0.958
101 HD2 PHE 73 1HD PHE 73 0.794 0.961 3.301
102 HE1 PHE 73 2HE PHE 73 2.988 0.333 -1.100
103 HE2 PHE 73 1HE PHE 73 -0.295 1.812 1.240
104 HZ PHE 73 HZ PHE 73 0.810 1.500 -0.959
105 H TYR 74 H TYR 74 2.909 1.405 5.662
106 HA TYR 74 HA TYR 74 2.285 3.945 4.548
107 HB2 TYR 74 1HB TYR 74 2.291 2.938 7.397
108 HB3 TYR 74 2HB TYR 74 1.832 4.595 7.009
109 HD1 TYR 74 1HD TYR 74 0.167 4.711 4.841
110 HD2 TYR 74 2HD TYR 74 0.545 1.417 7.572
111 HE1 TYR 74 1HE TYR 74 -2.100 3.931 4.214
112 HE2 TYR 74 2HE TYR 74 -1.723 0.637 6.945
113 HH TYR 74 HH TYR 74 -3.805 2.549 4.836
114 H GLU 75 H GLU 75 5.208 2.819 5.945
115 HA GLU 75 HA GLU 75 6.201 5.440 6.772
116 HB2 GLU 75 1HB GLU 75 7.048 2.706 6.971
117 HB3 GLU 75 2HB GLU 75 8.339 3.638 6.214
118 HG2 GLU 75 1HG GLU 75 8.332 5.237 8.044
119 HG3 GLU 75 2HG GLU 75 6.930 4.450 8.772
120 H LEU 76 H LEU 76 5.546 4.104 3.798
121 HA LEU 76 HA LEU 76 7.892 5.227 2.414
122 HB2 LEU 76 1HB LEU 76 5.407 3.877 1.327
123 HB3 LEU 76 2HB LEU 76 6.833 4.307 0.382
124 HG LEU 76 HG LEU 76 6.816 2.417 2.755
125 HD11 LEU 76 1HD1 LEU 76 7.383 1.678 -0.111
126 HD12 LEU 76 2HD1 LEU 76 5.726 1.713 0.492
127 HD13 LEU 76 3HD1 LEU 76 6.910 0.632 1.228
128 HD21 LEU 76 3HD2 LEU 76 9.143 1.931 1.560
129 HD22 LEU 76 1HD2 LEU 76 8.987 3.242 2.729
130 HD23 LEU 76 2HD2 LEU 76 8.944 3.592 1.001
131 HA PRO 77 HA PRO 77 6.149 9.209 1.478
132 HB2 PRO 77 1HB PRO 77 6.772 8.814 -1.385
133 HB3 PRO 77 2HB PRO 77 7.348 10.064 -0.271
134 HG2 PRO 77 1HG PRO 77 8.862 7.989 -1.175
135 HG3 PRO 77 2HG PRO 77 9.156 8.865 0.333
136 HD2 PRO 77 1HD PRO 77 8.155 6.122 -0.049
137 HD3 PRO 77 2HD PRO 77 8.858 6.886 1.392
138 H GLU 78 H GLU 78 4.334 10.208 0.340
139 HA GLU 78 HA GLU 78 2.101 8.458 -0.064
140 HB2 GLU 78 1HB GLU 78 2.283 11.243 -1.199
141 HB3 GLU 78 2HB GLU 78 0.873 10.409 -0.543
142 HG2 GLU 78 1HG GLU 78 3.127 11.749 0.900
143 HG3 GLU 78 2HG GLU 78 1.399 11.766 1.259
144 H ALA 79 H ALA 79 4.012 10.338 -2.462
145 HA ALA 79 HA ALA 79 2.683 9.471 -4.776
146 HB1 ALA 79 1HB ALA 79 4.710 11.096 -4.499
147 HB2 ALA 79 2HB ALA 79 4.577 10.158 -5.987
148 HB3 ALA 79 3HB ALA 79 5.690 9.646 -4.718
149 H VAL 80 H VAL 80 5.006 7.754 -2.767
150 HA VAL 80 HA VAL 80 5.269 5.499 -4.619
151 HB VAL 80 HB VAL 80 6.040 5.885 -1.711
152 HG11 VAL 80 1HG1 VAL 80 7.475 3.775 -2.331
153 HG12 VAL 80 2HG1 VAL 80 6.228 3.517 -3.552
154 HG13 VAL 80 3HG1 VAL 80 5.794 3.567 -1.844
155 HG21 VAL 80 3HG2 VAL 80 7.403 7.216 -3.187
156 HG22 VAL 80 1HG2 VAL 80 7.566 5.883 -4.329
157 HG23 VAL 80 2HG2 VAL 80 8.354 5.794 -2.753
158 H GLN 81 H GLN 81 3.384 6.364 -1.789
159 HA GLN 81 HA GLN 81 2.175 3.817 -1.272
160 HB2 GLN 81 1HB GLN 81 2.108 5.817 0.245
161 HB3 GLN 81 2HB GLN 81 0.958 6.560 -0.860
162 HG2 GLN 81 1HG GLN 81 -0.757 5.273 -0.125
163 HG3 GLN 81 2HG GLN 81 0.233 3.813 -0.105
164 HE21 GLN 81 1HE2 GLN 81 2.279 4.646 1.698
165 HE22 GLN 81 2HE2 GLN 81 1.590 4.892 3.225
166 H LYS 82 H LYS 82 1.033 6.620 -3.169
167 HA LYS 82 HA LYS 82 -1.376 5.440 -4.119
168 HB2 LYS 82 1HB LYS 82 0.371 7.710 -4.947
169 HB3 LYS 82 2HB LYS 82 -0.806 7.120 -6.121
170 HG2 LYS 82 1HG LYS 82 -1.838 8.886 -4.805
171 HG3 LYS 82 2HG LYS 82 -2.587 7.350 -4.373
172 HD2 LYS 82 1HD LYS 82 -1.391 7.212 -2.330
173 HD3 LYS 82 2HD LYS 82 -0.237 8.450 -2.830
174 HE2 LYS 82 1HE LYS 82 -1.921 9.310 -1.198
175 HE3 LYS 82 2HE LYS 82 -1.971 10.163 -2.739
176 HZ1 LYS 82 3HZ LYS 82 -4.126 9.668 -2.748
177 HZ2 LYS 82 1HZ LYS 82 -3.972 8.539 -1.492
178 HZ3 LYS 82 2HZ LYS 82 -3.670 8.069 -3.096
179 H GLU 83 H GLU 83 1.834 5.653 -5.701
180 HA GLU 83 HA GLU 83 1.087 4.231 -8.044
181 HB2 GLU 83 1HB GLU 83 3.781 4.386 -6.658
182 HB3 GLU 83 2HB GLU 83 3.529 3.784 -8.297
183 HG2 GLU 83 1HG GLU 83 2.766 5.919 -9.063
184 HG3 GLU 83 2HG GLU 83 2.643 6.538 -7.417
185 H LEU 84 H LEU 84 2.282 3.030 -4.912
186 HA LEU 84 HA LEU 84 2.401 0.292 -5.856
187 HB2 LEU 84 1HB LEU 84 2.368 1.471 -3.063
188 HB3 LEU 84 2HB LEU 84 2.571 -0.250 -3.391
189 HG LEU 84 HG LEU 84 4.356 1.938 -4.500
190 HD11 LEU 84 1HD1 LEU 84 6.029 1.117 -2.909
191 HD12 LEU 84 2HD1 LEU 84 4.886 -0.076 -2.294
192 HD13 LEU 84 3HD1 LEU 84 4.587 1.644 -2.042
193 HD21 LEU 84 3HD2 LEU 84 4.085 -0.983 -4.935
194 HD22 LEU 84 1HD2 LEU 84 5.734 -0.409 -4.681
195 HD23 LEU 84 2HD2 LEU 84 4.761 0.255 -5.995
196 H LEU 85 H LEU 85 -0.042 2.258 -4.202
197 HA LEU 85 HA LEU 85 -1.856 0.071 -3.707
198 HB2 LEU 85 1HB LEU 85 -2.287 3.056 -4.054
199 HB3 LEU 85 2HB LEU 85 -3.606 1.946 -3.686
200 HG LEU 85 HG LEU 85 -1.105 2.049 -1.995
201 HD11 LEU 85 1HD1 LEU 85 -2.445 3.519 -0.453
202 HD12 LEU 85 2HD1 LEU 85 -3.629 3.706 -1.747
203 HD13 LEU 85 3HD1 LEU 85 -1.984 4.304 -1.964
204 HD21 LEU 85 3HD2 LEU 85 -3.919 0.986 -1.667
205 HD22 LEU 85 1HD2 LEU 85 -2.877 1.278 -0.276
206 HD23 LEU 85 2HD2 LEU 85 -2.394 0.116 -1.506
207 H ALA 86 H ALA 86 -1.229 2.158 -6.475
208 HA ALA 86 HA ALA 86 -3.516 1.348 -8.017
209 HB1 ALA 86 1HB ALA 86 -2.443 2.408 -9.866
210 HB2 ALA 86 2HB ALA 86 -0.842 2.176 -9.163
211 HB3 ALA 86 3HB ALA 86 -1.958 3.341 -8.450
212 H GLU 87 H GLU 87 -0.266 0.026 -7.596
213 HA GLU 87 HA GLU 87 -0.525 -1.956 -9.718
214 HB2 GLU 87 1HB GLU 87 1.681 -1.177 -8.790
215 HB3 GLU 87 2HB GLU 87 1.296 -2.016 -7.288
216 HG2 GLU 87 1HG GLU 87 1.003 -4.127 -8.661
217 HG3 GLU 87 2HG GLU 87 1.674 -3.241 -10.031
218 H TRP 88 H TRP 88 -1.092 -1.944 -6.218
219 HA TRP 88 HA TRP 88 -1.716 -4.742 -5.974
220 HB2 TRP 88 1HB TRP 88 -2.812 -2.402 -4.387
221 HB3 TRP 88 2HB TRP 88 -2.868 -4.096 -3.904
222 HD1 TRP 88 HD TRP 88 0.344 -3.982 -5.409
223 HE1 TRP 88 1HE TRP 88 2.215 -3.453 -3.700
224 HE3 TRP 88 3HE TRP 88 -2.447 -2.149 -1.547
225 HZ2 TRP 88 2HZ TRP 88 2.491 -2.395 -1.078
226 HZ3 TRP 88 3HZ TRP 88 -1.356 -1.384 0.542
227 HH2 TRP 88 HH TRP 88 1.109 -1.506 0.778
228 H LYS 89 H LYS 89 -3.579 -1.887 -6.849
229 HA LYS 89 HA LYS 89 -6.152 -3.219 -6.896
230 HB2 LYS 89 1HB LYS 89 -5.947 -0.774 -6.647
231 HB3 LYS 89 2HB LYS 89 -5.244 -0.669 -8.262
232 HG2 LYS 89 1HG LYS 89 -7.256 -1.250 -9.317
233 HG3 LYS 89 2HG LYS 89 -7.916 -1.992 -7.858
234 HD2 LYS 89 1HD LYS 89 -8.681 -0.011 -7.045
235 HD3 LYS 89 2HD LYS 89 -7.250 0.869 -7.579
236 HE2 LYS 89 1HE LYS 89 -9.524 -0.035 -9.372
237 HE3 LYS 89 2HE LYS 89 -9.263 1.614 -8.806
238 HZ1 LYS 89 3HZ LYS 89 -7.688 0.040 -10.726
239 HZ2 LYS 89 1HZ LYS 89 -6.926 1.264 -9.830
240 HZ3 LYS 89 2HZ LYS 89 -8.239 1.643 -10.842
241 H ARG 90 H ARG 90 -3.614 -2.677 -9.331
242 HA ARG 90 HA ARG 90 -5.231 -3.422 -11.568
243 HB2 ARG 90 1HB ARG 90 -2.245 -3.533 -11.073
244 HB3 ARG 90 2HB ARG 90 -2.950 -4.070 -12.597
245 HG2 ARG 90 1HG ARG 90 -3.913 -1.879 -12.992
246 HG3 ARG 90 2HG ARG 90 -3.403 -1.324 -11.397
247 HD2 ARG 90 1HD ARG 90 -1.041 -1.633 -12.038
248 HD3 ARG 90 2HD ARG 90 -1.546 -2.200 -13.630
249 HE ARG 90 HE ARG 90 -1.474 0.576 -12.746
250 HH11 ARG 90 1HH2 ARG 90 -2.934 -1.771 -14.807
251 HH12 ARG 90 2HH2 ARG 90 -3.432 -0.612 -15.995
252 HH21 ARG 90 1HH1 ARG 90 -2.111 2.101 -14.288
253 HH22 ARG 90 2HH1 ARG 90 -2.966 1.580 -15.702
254 H THR 91 H THR 91 -3.143 -5.349 -9.410
255 HA THR 91 HA THR 91 -4.104 -7.844 -10.706
256 HB THR 91 HB THR 91 -2.454 -8.966 -9.421
257 HG1 THR 91 1HG THR 91 -3.021 -8.030 -7.424
258 HG21 THR 91 3HG2 THR 91 -0.916 -6.452 -9.522
259 HG22 THR 91 1HG2 THR 91 -1.752 -6.859 -11.020
260 HG23 THR 91 2HG2 THR 91 -0.603 -7.996 -10.315
261 H GLY 92 H GLY 92 -4.294 -6.139 -7.609
262 HA2 GLY 92 1HA GLY 92 -6.264 -6.121 -6.216
263 HA3 GLY 92 2HA GLY 92 -6.833 -7.566 -7.052
Start of MODEL 19
1 H LYS 61 H LYS 61 -12.059 -0.528 2.491
2 HA LYS 61 HA LYS 61 -10.612 -2.271 4.399
3 HB2 LYS 61 1HB LYS 61 -12.772 -2.991 3.281
4 HB3 LYS 61 2HB LYS 61 -11.885 -3.041 1.758
5 HG2 LYS 61 1HG LYS 61 -10.194 -4.521 3.153
6 HG3 LYS 61 2HG LYS 61 -11.609 -4.802 4.168
7 HD2 LYS 61 1HD LYS 61 -11.529 -5.231 1.167
8 HD3 LYS 61 2HD LYS 61 -11.376 -6.513 2.369
9 HE2 LYS 61 1HE LYS 61 -13.627 -6.663 2.335
10 HE3 LYS 61 2HE LYS 61 -13.656 -5.102 3.157
11 HZ1 LYS 61 3HZ LYS 61 -13.586 -5.474 0.211
12 HZ2 LYS 61 1HZ LYS 61 -13.700 -3.995 1.034
13 HZ3 LYS 61 2HZ LYS 61 -14.979 -5.111 1.114
14 H ILE 62 H ILE 62 -8.427 -2.280 4.176
15 HA ILE 62 HA ILE 62 -7.277 -1.865 1.458
16 HB ILE 62 HB ILE 62 -5.993 -1.669 4.196
17 HG12 ILE 62 1HG1 ILE 62 -6.663 0.481 2.159
18 HG13 ILE 62 2HG1 ILE 62 -7.637 0.131 3.587
19 HG21 ILE 62 1HG2 ILE 62 -4.154 -0.563 2.765
20 HG22 ILE 62 2HG2 ILE 62 -4.935 -1.334 1.385
21 HG23 ILE 62 3HG2 ILE 62 -4.276 -2.320 2.689
22 HD11 ILE 62 3HD1 ILE 62 -4.774 1.115 3.515
23 HD12 ILE 62 1HD1 ILE 62 -5.556 0.523 4.980
24 HD13 ILE 62 2HD1 ILE 62 -6.181 1.956 4.164
25 H THR 63 H THR 63 -5.698 -3.289 0.651
26 HA THR 63 HA THR 63 -5.403 -5.890 2.106
27 HB THR 63 HB THR 63 -5.753 -5.530 -0.887
28 HG1 THR 63 1HG THR 63 -7.510 -5.827 1.171
29 HG21 THR 63 3HG2 THR 63 -4.335 -7.437 -0.282
30 HG22 THR 63 1HG2 THR 63 -5.901 -8.005 -0.864
31 HG23 THR 63 2HG2 THR 63 -5.552 -7.995 0.865
32 H PHE 64 H PHE 64 -3.283 -5.996 2.653
33 HA PHE 64 HA PHE 64 -1.279 -4.767 0.847
34 HB2 PHE 64 1HB PHE 64 -0.918 -5.923 3.626
35 HB3 PHE 64 2HB PHE 64 0.271 -4.989 2.721
36 HD1 PHE 64 1HD PHE 64 -0.273 -2.594 2.092
37 HD2 PHE 64 2HD PHE 64 -2.609 -4.842 4.905
38 HE1 PHE 64 1HE PHE 64 -1.229 -0.487 2.976
39 HE2 PHE 64 2HE PHE 64 -3.569 -2.734 5.790
40 HZ PHE 64 HZ PHE 64 -2.881 -0.555 4.824
41 HA PRO 65 HA PRO 65 -0.209 -8.751 -0.980
42 HB2 PRO 65 1HB PRO 65 2.574 -7.755 -0.628
43 HB3 PRO 65 2HB PRO 65 1.783 -8.427 -2.064
44 HG2 PRO 65 1HG PRO 65 2.241 -5.802 -1.754
45 HG3 PRO 65 2HG PRO 65 0.857 -6.438 -2.650
46 HD2 PRO 65 1HD PRO 65 0.900 -5.069 -0.037
47 HD3 PRO 65 2HD PRO 65 -0.447 -5.307 -1.167
48 H SER 66 H SER 66 0.848 -10.715 -0.340
49 HA SER 66 HA SER 66 0.974 -11.267 2.472
50 HB2 SER 66 1HB SER 66 1.673 -12.711 -0.039
51 HB3 SER 66 2HB SER 66 2.372 -13.309 1.463
52 HG SER 66 HG SER 66 0.381 -14.279 1.166
53 H ASP 67 H ASP 67 3.121 -9.465 0.665
54 HA ASP 67 HA ASP 67 5.363 -10.201 2.512
55 HB2 ASP 67 1HB ASP 67 6.927 -9.599 0.688
56 HB3 ASP 67 2HB ASP 67 5.878 -10.945 0.240
57 H ILE 68 H ILE 68 3.171 -7.862 2.251
58 HA ILE 68 HA ILE 68 5.170 -5.656 2.566
59 HB ILE 68 HB ILE 68 2.298 -5.629 1.655
60 HG12 ILE 68 1HG1 ILE 68 3.970 -6.041 -0.094
61 HG13 ILE 68 2HG1 ILE 68 3.273 -4.437 -0.291
62 HG21 ILE 68 1HG2 ILE 68 2.248 -3.751 3.004
63 HG22 ILE 68 2HG2 ILE 68 2.888 -3.050 1.518
64 HG23 ILE 68 3HG2 ILE 68 3.980 -3.459 2.842
65 HD11 ILE 68 3HD1 ILE 68 5.487 -3.864 -0.490
66 HD12 ILE 68 1HD1 ILE 68 6.037 -5.217 0.498
67 HD13 ILE 68 2HD1 ILE 68 5.366 -3.780 1.267
68 H ASP 69 H ASP 69 5.389 -4.835 4.501
69 HA ASP 69 HA ASP 69 3.513 -5.603 6.655
70 HB2 ASP 69 1HB ASP 69 5.912 -5.839 7.078
71 HB3 ASP 69 2HB ASP 69 6.146 -4.119 6.771
72 HA PRO 70 HA PRO 70 1.239 -1.739 5.911
73 HB2 PRO 70 1HB PRO 70 0.502 -2.189 8.766
74 HB3 PRO 70 2HB PRO 70 -0.533 -1.830 7.374
75 HG2 PRO 70 1HG PRO 70 -0.330 -4.289 8.425
76 HG3 PRO 70 2HG PRO 70 -0.624 -4.002 6.704
77 HD2 PRO 70 1HD PRO 70 1.816 -5.008 8.039
78 HD3 PRO 70 2HD PRO 70 1.298 -5.186 6.349
79 H GLN 71 H GLN 71 3.219 -2.297 8.812
80 HA GLN 71 HA GLN 71 3.424 0.544 9.475
81 HB2 GLN 71 1HB GLN 71 3.848 -1.682 10.934
82 HB3 GLN 71 2HB GLN 71 5.501 -1.396 10.391
83 HG2 GLN 71 1HG GLN 71 5.395 0.909 11.262
84 HG3 GLN 71 2HG GLN 71 3.737 0.632 11.798
85 HE21 GLN 71 1HE2 GLN 71 5.684 1.318 13.725
86 HE22 GLN 71 2HE2 GLN 71 6.005 -0.032 14.702
87 H VAL 72 H VAL 72 5.303 -1.729 7.545
88 HA VAL 72 HA VAL 72 7.456 0.238 7.165
89 HB VAL 72 HB VAL 72 6.971 -2.330 5.625
90 HG11 VAL 72 1HG1 VAL 72 9.242 -2.164 4.983
91 HG12 VAL 72 2HG1 VAL 72 9.597 -0.973 6.234
92 HG13 VAL 72 3HG1 VAL 72 8.637 -0.516 4.830
93 HG21 VAL 72 3HG2 VAL 72 8.304 -3.480 7.251
94 HG22 VAL 72 1HG2 VAL 72 7.094 -2.585 8.169
95 HG23 VAL 72 2HG2 VAL 72 8.743 -1.973 8.055
96 H PHE 73 H PHE 73 4.445 -0.648 5.690
97 HA PHE 73 HA PHE 73 5.003 0.512 3.073
98 HB2 PHE 73 1HB PHE 73 3.346 -1.312 3.468
99 HB3 PHE 73 2HB PHE 73 2.369 -0.183 4.402
100 HD1 PHE 73 2HD PHE 73 3.990 -0.558 1.048
101 HD2 PHE 73 1HD PHE 73 0.754 1.116 3.321
102 HE1 PHE 73 2HE PHE 73 2.938 0.250 -1.043
103 HE2 PHE 73 1HE PHE 73 -0.299 1.924 1.225
104 HZ PHE 73 HZ PHE 73 0.798 1.492 -0.955
105 H TYR 74 H TYR 74 2.799 1.462 5.735
106 HA TYR 74 HA TYR 74 2.174 4.012 4.647
107 HB2 TYR 74 1HB TYR 74 2.174 2.981 7.488
108 HB3 TYR 74 2HB TYR 74 1.697 4.634 7.105
109 HD1 TYR 74 1HD TYR 74 0.045 4.737 4.922
110 HD2 TYR 74 2HD TYR 74 0.449 1.443 7.652
111 HE1 TYR 74 1HE TYR 74 -2.215 3.937 4.293
112 HE2 TYR 74 2HE TYR 74 -1.809 0.641 7.020
113 HH TYR 74 HH TYR 74 -3.323 1.177 4.537
114 H GLU 75 H GLU 75 5.100 2.896 6.036
115 HA GLU 75 HA GLU 75 6.054 5.546 6.862
116 HB2 GLU 75 1HB GLU 75 7.087 2.764 6.837
117 HB3 GLU 75 2HB GLU 75 8.299 4.030 6.640
118 HG2 GLU 75 1HG GLU 75 7.859 4.966 8.729
119 HG3 GLU 75 2HG GLU 75 6.224 4.307 8.793
120 H LEU 76 H LEU 76 5.458 4.128 3.925
121 HA LEU 76 HA LEU 76 7.831 5.203 2.550
122 HB2 LEU 76 1HB LEU 76 5.358 3.810 1.490
123 HB3 LEU 76 2HB LEU 76 6.767 4.243 0.522
124 HG LEU 76 HG LEU 76 6.833 2.423 2.946
125 HD11 LEU 76 1HD1 LEU 76 7.154 0.610 1.325
126 HD12 LEU 76 2HD1 LEU 76 7.036 1.759 -0.008
127 HD13 LEU 76 3HD1 LEU 76 5.629 1.437 1.007
128 HD21 LEU 76 3HD2 LEU 76 8.877 3.605 1.122
129 HD22 LEU 76 1HD2 LEU 76 9.107 1.922 1.595
130 HD23 LEU 76 2HD2 LEU 76 9.008 3.179 2.828
131 HA PRO 77 HA PRO 77 6.111 9.159 1.502
132 HB2 PRO 77 1HB PRO 77 6.775 8.762 -1.336
133 HB3 PRO 77 2HB PRO 77 7.387 9.974 -0.200
134 HG2 PRO 77 1HG PRO 77 8.789 7.794 -1.136
135 HG3 PRO 77 2HG PRO 77 9.189 8.740 0.303
136 HD2 PRO 77 1HD PRO 77 8.161 6.011 0.137
137 HD3 PRO 77 2HD PRO 77 8.822 6.883 1.535
138 H GLU 78 H GLU 78 4.316 10.128 0.309
139 HA GLU 78 HA GLU 78 2.106 8.356 -0.141
140 HB2 GLU 78 1HB GLU 78 2.478 11.215 -1.083
141 HB3 GLU 78 2HB GLU 78 0.944 10.354 -0.955
142 HG2 GLU 78 1HG GLU 78 0.846 11.270 1.122
143 HG3 GLU 78 2HG GLU 78 1.982 9.992 1.557
144 H ALA 79 H ALA 79 4.151 10.167 -2.468
145 HA ALA 79 HA ALA 79 2.871 9.329 -4.821
146 HB1 ALA 79 1HB ALA 79 5.858 9.681 -4.408
147 HB2 ALA 79 2HB ALA 79 4.722 10.984 -4.757
148 HB3 ALA 79 3HB ALA 79 5.016 9.726 -5.957
149 H VAL 80 H VAL 80 5.138 7.570 -2.769
150 HA VAL 80 HA VAL 80 5.395 5.327 -4.633
151 HB VAL 80 HB VAL 80 6.177 5.749 -1.737
152 HG11 VAL 80 1HG1 VAL 80 6.129 3.277 -3.421
153 HG12 VAL 80 2HG1 VAL 80 5.860 3.456 -1.688
154 HG13 VAL 80 3HG1 VAL 80 7.499 3.520 -2.338
155 HG21 VAL 80 3HG2 VAL 80 7.408 6.780 -3.811
156 HG22 VAL 80 1HG2 VAL 80 7.994 5.134 -4.058
157 HG23 VAL 80 2HG2 VAL 80 8.361 5.986 -2.557
158 H GLN 81 H GLN 81 3.486 6.182 -1.812
159 HA GLN 81 HA GLN 81 2.264 3.638 -1.330
160 HB2 GLN 81 1HB GLN 81 2.181 5.596 0.225
161 HB3 GLN 81 2HB GLN 81 1.077 6.395 -0.892
162 HG2 GLN 81 1HG GLN 81 -0.685 5.090 -0.286
163 HG3 GLN 81 2HG GLN 81 0.307 3.638 -0.163
164 HE21 GLN 81 1HE2 GLN 81 2.233 4.538 1.751
165 HE22 GLN 81 2HE2 GLN 81 1.442 4.814 3.224
166 H LYS 82 H LYS 82 1.186 6.441 -3.262
167 HA LYS 82 HA LYS 82 -1.239 5.271 -4.209
168 HB2 LYS 82 1HB LYS 82 0.515 7.537 -5.042
169 HB3 LYS 82 2HB LYS 82 -0.682 6.958 -6.199
170 HG2 LYS 82 1HG LYS 82 -1.691 8.721 -4.873
171 HG3 LYS 82 2HG LYS 82 -2.433 7.189 -4.412
172 HD2 LYS 82 1HD LYS 82 -1.005 7.038 -2.444
173 HD3 LYS 82 2HD LYS 82 -0.126 8.487 -2.934
174 HE2 LYS 82 1HE LYS 82 -2.233 9.795 -2.769
175 HE3 LYS 82 2HE LYS 82 -3.067 8.347 -2.206
176 HZ1 LYS 82 3HZ LYS 82 -2.415 9.622 -0.319
177 HZ2 LYS 82 1HZ LYS 82 -0.816 9.746 -0.871
178 HZ3 LYS 82 2HZ LYS 82 -1.428 8.241 -0.373
179 H GLU 83 H GLU 83 1.981 5.469 -5.794
180 HA GLU 83 HA GLU 83 1.222 4.059 -8.137
181 HB2 GLU 83 1HB GLU 83 3.888 4.297 -6.723
182 HB3 GLU 83 2HB GLU 83 3.701 3.477 -8.273
183 HG2 GLU 83 1HG GLU 83 2.359 6.031 -8.353
184 HG3 GLU 83 2HG GLU 83 4.034 6.249 -7.843
185 H LEU 84 H LEU 84 2.341 2.816 -4.988
186 HA LEU 84 HA LEU 84 2.406 0.074 -5.946
187 HB2 LEU 84 1HB LEU 84 2.354 1.236 -3.142
188 HB3 LEU 84 2HB LEU 84 2.507 -0.488 -3.481
189 HG LEU 84 HG LEU 84 4.389 1.643 -4.536
190 HD11 LEU 84 1HD1 LEU 84 6.005 0.699 -2.918
191 HD12 LEU 84 2HD1 LEU 84 4.746 -0.361 -2.286
192 HD13 LEU 84 3HD1 LEU 84 4.605 1.388 -2.099
193 HD21 LEU 84 3HD2 LEU 84 4.045 -1.272 -4.971
194 HD22 LEU 84 1HD2 LEU 84 5.703 -0.731 -4.702
195 HD23 LEU 84 2HD2 LEU 84 4.758 -0.052 -6.027
196 H LEU 85 H LEU 85 -0.005 2.120 -4.343
197 HA LEU 85 HA LEU 85 -1.891 -0.037 -3.924
198 HB2 LEU 85 1HB LEU 85 -2.178 2.977 -4.050
199 HB3 LEU 85 2HB LEU 85 -3.574 1.923 -3.836
200 HG LEU 85 HG LEU 85 -1.150 1.721 -2.049
201 HD11 LEU 85 1HD1 LEU 85 -2.031 4.041 -1.957
202 HD12 LEU 85 2HD1 LEU 85 -2.317 3.172 -0.449
203 HD13 LEU 85 3HD1 LEU 85 -3.635 3.402 -1.599
204 HD21 LEU 85 3HD2 LEU 85 -2.362 0.132 -0.995
205 HD22 LEU 85 1HD2 LEU 85 -3.498 0.201 -2.342
206 HD23 LEU 85 2HD2 LEU 85 -3.772 1.187 -0.907
207 H ALA 86 H ALA 86 -1.260 2.228 -6.578
208 HA ALA 86 HA ALA 86 -3.571 1.562 -8.129
209 HB1 ALA 86 1HB ALA 86 -1.418 2.113 -9.900
210 HB2 ALA 86 2HB ALA 86 -1.166 3.114 -8.470
211 HB3 ALA 86 3HB ALA 86 -2.681 3.223 -9.367
212 H GLU 87 H GLU 87 -0.413 0.050 -7.747
213 HA GLU 87 HA GLU 87 -0.831 -1.855 -9.935
214 HB2 GLU 87 1HB GLU 87 1.456 -1.233 -9.180
215 HB3 GLU 87 2HB GLU 87 1.121 -1.961 -7.609
216 HG2 GLU 87 1HG GLU 87 0.963 -4.145 -8.532
217 HG3 GLU 87 2HG GLU 87 0.842 -3.524 -10.178
218 H TRP 88 H TRP 88 -1.314 -1.816 -6.432
219 HA TRP 88 HA TRP 88 -1.984 -4.606 -6.161
220 HB2 TRP 88 1HB TRP 88 -2.927 -2.225 -4.535
221 HB3 TRP 88 2HB TRP 88 -3.089 -3.911 -4.058
222 HD1 TRP 88 HD TRP 88 0.109 -3.983 -5.622
223 HE1 TRP 88 1HE TRP 88 2.031 -3.605 -3.932
224 HE3 TRP 88 3HE TRP 88 -2.509 -2.036 -1.686
225 HZ2 TRP 88 2HZ TRP 88 2.411 -2.593 -1.307
226 HZ3 TRP 88 3HZ TRP 88 -1.335 -1.370 0.394
227 HH2 TRP 88 HH TRP 88 1.124 -1.646 0.585
228 H LYS 89 H LYS 89 -3.865 -1.681 -6.817
229 HA LYS 89 HA LYS 89 -6.447 -3.004 -6.864
230 HB2 LYS 89 1HB LYS 89 -6.138 -0.560 -6.474
231 HB3 LYS 89 2HB LYS 89 -5.611 -0.392 -8.148
232 HG2 LYS 89 1HG LYS 89 -7.769 -1.277 -8.931
233 HG3 LYS 89 2HG LYS 89 -8.302 -1.471 -7.261
234 HD2 LYS 89 1HD LYS 89 -8.059 0.960 -6.900
235 HD3 LYS 89 2HD LYS 89 -7.539 1.154 -8.575
236 HE2 LYS 89 1HE LYS 89 -9.665 1.122 -9.321
237 HE3 LYS 89 2HE LYS 89 -10.023 -0.348 -8.416
238 HZ1 LYS 89 3HZ LYS 89 -11.165 1.942 -7.853
239 HZ2 LYS 89 1HZ LYS 89 -9.768 2.145 -6.913
240 HZ3 LYS 89 2HZ LYS 89 -10.786 0.812 -6.641
241 H ARG 90 H ARG 90 -4.019 -2.240 -9.359
242 HA ARG 90 HA ARG 90 -5.673 -2.801 -11.585
243 HB2 ARG 90 1HB ARG 90 -3.192 -1.869 -11.383
244 HB3 ARG 90 2HB ARG 90 -2.772 -3.565 -11.618
245 HG2 ARG 90 1HG ARG 90 -4.645 -3.260 -13.550
246 HG3 ARG 90 2HG ARG 90 -3.964 -1.634 -13.518
247 HD2 ARG 90 1HD ARG 90 -2.656 -2.892 -15.086
248 HD3 ARG 90 2HD ARG 90 -1.670 -2.714 -13.636
249 HE ARG 90 HE ARG 90 -3.124 -5.138 -13.391
250 HH11 ARG 90 1HH2 ARG 90 -0.699 -3.644 -15.330
251 HH12 ARG 90 2HH2 ARG 90 0.091 -5.134 -15.723
252 HH21 ARG 90 1HH1 ARG 90 -2.108 -7.091 -13.893
253 HH22 ARG 90 2HH1 ARG 90 -0.705 -7.086 -14.909
254 H THR 91 H THR 91 -3.630 -4.958 -9.602
255 HA THR 91 HA THR 91 -4.786 -7.282 -11.085
256 HB THR 91 HB THR 91 -2.589 -7.887 -10.961
257 HG1 THR 91 1HG THR 91 -3.365 -8.270 -8.260
258 HG21 THR 91 3HG2 THR 91 -2.355 -6.069 -8.548
259 HG22 THR 91 1HG2 THR 91 -1.888 -5.669 -10.202
260 HG23 THR 91 2HG2 THR 91 -1.008 -6.913 -9.313
261 H GLY 92 H GLY 92 -4.389 -5.952 -7.814
262 HA2 GLY 92 1HA GLY 92 -6.215 -6.096 -6.201
263 HA3 GLY 92 2HA GLY 92 -6.754 -7.573 -6.999
Start of MODEL 20
1 H LYS 61 H LYS 61 -12.189 -0.880 2.163
2 HA LYS 61 HA LYS 61 -10.711 -2.464 4.181
3 HB2 LYS 61 1HB LYS 61 -11.202 -4.382 2.695
4 HB3 LYS 61 2HB LYS 61 -12.669 -3.497 3.112
5 HG2 LYS 61 1HG LYS 61 -12.022 -2.144 0.896
6 HG3 LYS 61 2HG LYS 61 -11.232 -3.669 0.500
7 HD2 LYS 61 1HD LYS 61 -14.119 -3.457 1.391
8 HD3 LYS 61 2HD LYS 61 -13.617 -3.517 -0.297
9 HE2 LYS 61 1HE LYS 61 -12.269 -5.635 1.027
10 HE3 LYS 61 2HE LYS 61 -13.952 -5.699 1.548
11 HZ1 LYS 61 3HZ LYS 61 -13.968 -6.908 -0.400
12 HZ2 LYS 61 1HZ LYS 61 -12.847 -5.897 -1.174
13 HZ3 LYS 61 2HZ LYS 61 -14.445 -5.369 -0.941
14 H ILE 62 H ILE 62 -8.502 -2.341 4.063
15 HA ILE 62 HA ILE 62 -7.268 -1.829 1.406
16 HB ILE 62 HB ILE 62 -6.083 -1.726 4.197
17 HG12 ILE 62 1HG1 ILE 62 -6.713 0.502 2.237
18 HG13 ILE 62 2HG1 ILE 62 -7.752 0.063 3.593
19 HG21 ILE 62 1HG2 ILE 62 -4.945 -1.271 1.440
20 HG22 ILE 62 2HG2 ILE 62 -4.289 -2.255 2.749
21 HG23 ILE 62 3HG2 ILE 62 -4.238 -0.495 2.857
22 HD11 ILE 62 3HD1 ILE 62 -6.415 1.838 4.423
23 HD12 ILE 62 1HD1 ILE 62 -4.955 1.197 3.672
24 HD13 ILE 62 2HD1 ILE 62 -5.661 0.380 5.067
25 H THR 63 H THR 63 -5.698 -3.228 0.560
26 HA THR 63 HA THR 63 -5.407 -5.868 1.943
27 HB THR 63 HB THR 63 -5.258 -6.719 -0.533
28 HG1 THR 63 1HG THR 63 -6.158 -5.436 -2.000
29 HG21 THR 63 3HG2 THR 63 -7.028 -7.565 0.747
30 HG22 THR 63 1HG2 THR 63 -7.871 -6.738 -0.563
31 HG23 THR 63 2HG2 THR 63 -7.724 -5.965 1.015
32 H PHE 64 H PHE 64 -3.295 -5.986 2.537
33 HA PHE 64 HA PHE 64 -1.254 -4.706 0.808
34 HB2 PHE 64 1HB PHE 64 -0.998 -5.910 3.576
35 HB3 PHE 64 2HB PHE 64 0.268 -5.036 2.717
36 HD1 PHE 64 1HD PHE 64 -0.240 -2.615 1.982
37 HD2 PHE 64 2HD PHE 64 -2.565 -4.753 4.893
38 HE1 PHE 64 1HE PHE 64 -1.132 -0.467 2.848
39 HE2 PHE 64 2HE PHE 64 -3.457 -2.607 5.758
40 HZ PHE 64 HZ PHE 64 -2.741 -0.465 4.734
41 HA PRO 65 HA PRO 65 -0.150 -8.635 -1.116
42 HB2 PRO 65 1HB PRO 65 2.620 -7.623 -0.670
43 HB3 PRO 65 2HB PRO 65 1.883 -8.295 -2.135
44 HG2 PRO 65 1HG PRO 65 2.279 -5.677 -1.826
45 HG3 PRO 65 2HG PRO 65 0.887 -6.323 -2.704
46 HD2 PRO 65 1HD PRO 65 0.966 -4.997 -0.057
47 HD3 PRO 65 2HD PRO 65 -0.386 -5.180 -1.195
48 H SER 66 H SER 66 0.792 -10.636 -0.489
49 HA SER 66 HA SER 66 0.927 -11.238 2.306
50 HB2 SER 66 1HB SER 66 1.109 -12.652 -0.186
51 HB3 SER 66 2HB SER 66 2.421 -13.172 0.868
52 HG SER 66 HG SER 66 -0.319 -12.990 1.605
53 H ASP 67 H ASP 67 3.119 -9.481 0.522
54 HA ASP 67 HA ASP 67 5.352 -10.320 2.338
55 HB2 ASP 67 1HB ASP 67 6.926 -10.098 0.606
56 HB3 ASP 67 2HB ASP 67 5.563 -10.901 -0.175
57 H ILE 68 H ILE 68 3.231 -7.943 2.161
58 HA ILE 68 HA ILE 68 5.277 -5.788 2.526
59 HB ILE 68 HB ILE 68 2.448 -5.678 1.514
60 HG12 ILE 68 1HG1 ILE 68 4.233 -6.106 -0.140
61 HG13 ILE 68 2HG1 ILE 68 3.510 -4.522 -0.380
62 HG21 ILE 68 1HG2 ILE 68 4.128 -3.547 2.786
63 HG22 ILE 68 2HG2 ILE 68 2.392 -3.829 2.919
64 HG23 ILE 68 3HG2 ILE 68 3.061 -3.115 1.451
65 HD11 ILE 68 3HD1 ILE 68 6.260 -5.228 0.427
66 HD12 ILE 68 1HD1 ILE 68 5.550 -3.884 1.320
67 HD13 ILE 68 2HD1 ILE 68 5.666 -3.808 -0.435
68 H ASP 69 H ASP 69 5.432 -4.920 4.445
69 HA ASP 69 HA ASP 69 3.542 -5.705 6.577
70 HB2 ASP 69 1HB ASP 69 5.899 -5.850 7.115
71 HB3 ASP 69 2HB ASP 69 6.153 -4.177 6.636
72 HA PRO 70 HA PRO 70 1.285 -1.884 6.147
73 HB2 PRO 70 1HB PRO 70 0.146 -1.759 8.650
74 HB3 PRO 70 2HB PRO 70 -0.451 -2.777 7.327
75 HG2 PRO 70 1HG PRO 70 1.176 -3.511 9.693
76 HG3 PRO 70 2HG PRO 70 -0.079 -4.431 8.847
77 HD2 PRO 70 1HD PRO 70 2.610 -4.910 8.549
78 HD3 PRO 70 2HD PRO 70 1.401 -5.283 7.302
79 H GLN 71 H GLN 71 3.290 -2.251 9.074
80 HA GLN 71 HA GLN 71 3.317 0.630 9.606
81 HB2 GLN 71 1HB GLN 71 4.961 -1.689 10.665
82 HB3 GLN 71 2HB GLN 71 5.223 -0.021 11.170
83 HG2 GLN 71 1HG GLN 71 2.431 -0.498 11.366
84 HG3 GLN 71 2HG GLN 71 3.238 -1.883 12.101
85 HE21 GLN 71 1HE2 GLN 71 4.360 1.532 12.001
86 HE22 GLN 71 2HE2 GLN 71 4.395 1.728 13.687
87 H VAL 72 H VAL 72 5.257 -1.597 7.724
88 HA VAL 72 HA VAL 72 7.376 0.409 7.350
89 HB VAL 72 HB VAL 72 6.916 -2.204 5.886
90 HG11 VAL 72 1HG1 VAL 72 9.617 -1.642 5.918
91 HG12 VAL 72 2HG1 VAL 72 8.896 -0.046 5.704
92 HG13 VAL 72 3HG1 VAL 72 8.533 -1.338 4.560
93 HG21 VAL 72 3HG2 VAL 72 8.332 -1.496 8.450
94 HG22 VAL 72 1HG2 VAL 72 8.894 -2.853 7.474
95 HG23 VAL 72 2HG2 VAL 72 7.255 -2.853 8.126
96 H PHE 73 H PHE 73 4.391 -0.544 5.853
97 HA PHE 73 HA PHE 73 4.939 0.572 3.229
98 HB2 PHE 73 1HB PHE 73 3.236 -1.204 3.704
99 HB3 PHE 73 2HB PHE 73 2.288 -0.004 4.581
100 HD1 PHE 73 2HD PHE 73 3.989 -0.453 1.266
101 HD2 PHE 73 1HD PHE 73 0.649 1.174 3.420
102 HE1 PHE 73 2HE PHE 73 2.973 0.292 -0.865
103 HE2 PHE 73 1HE PHE 73 -0.365 1.923 1.283
104 HZ PHE 73 HZ PHE 73 0.802 1.484 -0.860
105 H TYR 74 H TYR 74 2.797 1.635 5.890
106 HA TYR 74 HA TYR 74 2.217 4.175 4.754
107 HB2 TYR 74 1HB TYR 74 2.327 3.327 7.665
108 HB3 TYR 74 2HB TYR 74 1.711 4.889 7.130
109 HD1 TYR 74 1HD TYR 74 0.019 4.589 4.963
110 HD2 TYR 74 2HD TYR 74 0.703 1.736 8.105
111 HE1 TYR 74 1HE TYR 74 -2.190 3.561 4.514
112 HE2 TYR 74 2HE TYR 74 -1.508 0.710 7.653
113 HH TYR 74 HH TYR 74 -3.748 1.569 6.604
114 H GLU 75 H GLU 75 5.150 3.010 6.043
115 HA GLU 75 HA GLU 75 6.178 5.644 6.820
116 HB2 GLU 75 1HB GLU 75 6.905 3.322 7.734
117 HB3 GLU 75 2HB GLU 75 7.857 3.205 6.253
118 HG2 GLU 75 1HG GLU 75 9.443 4.290 7.478
119 HG3 GLU 75 2HG GLU 75 8.500 5.725 7.071
120 H LEU 76 H LEU 76 5.512 4.184 3.897
121 HA LEU 76 HA LEU 76 7.878 5.224 2.488
122 HB2 LEU 76 1HB LEU 76 5.385 3.792 1.537
123 HB3 LEU 76 2HB LEU 76 6.683 4.315 0.462
124 HG LEU 76 HG LEU 76 7.032 2.437 2.819
125 HD11 LEU 76 1HD1 LEU 76 6.550 2.026 -0.110
126 HD12 LEU 76 2HD1 LEU 76 5.955 1.092 1.260
127 HD13 LEU 76 3HD1 LEU 76 7.627 0.910 0.729
128 HD21 LEU 76 3HD2 LEU 76 8.873 3.808 0.925
129 HD22 LEU 76 1HD2 LEU 76 9.217 2.110 1.255
130 HD23 LEU 76 2HD2 LEU 76 9.159 3.272 2.580
131 HA PRO 77 HA PRO 77 6.182 9.180 1.403
132 HB2 PRO 77 1HB PRO 77 6.810 8.712 -1.441
133 HB3 PRO 77 2HB PRO 77 7.423 9.962 -0.347
134 HG2 PRO 77 1HG PRO 77 8.863 7.807 -1.225
135 HG3 PRO 77 2HG PRO 77 9.212 8.736 0.239
136 HD2 PRO 77 1HD PRO 77 8.150 6.006 -0.006
137 HD3 PRO 77 2HD PRO 77 8.869 6.825 1.396
138 H GLU 78 H GLU 78 4.367 10.143 0.237
139 HA GLU 78 HA GLU 78 2.141 8.376 -0.160
140 HB2 GLU 78 1HB GLU 78 2.693 11.273 -0.532
141 HB3 GLU 78 2HB GLU 78 1.353 10.604 -1.463
142 HG2 GLU 78 1HG GLU 78 0.212 9.882 0.487
143 HG3 GLU 78 2HG GLU 78 1.646 10.080 1.497
144 H ALA 79 H ALA 79 4.175 10.143 -2.533
145 HA ALA 79 HA ALA 79 2.870 9.280 -4.863
146 HB1 ALA 79 1HB ALA 79 4.923 9.737 -6.046
147 HB2 ALA 79 2HB ALA 79 5.881 9.502 -4.583
148 HB3 ALA 79 3HB ALA 79 4.818 10.902 -4.727
149 H VAL 80 H VAL 80 5.124 7.524 -2.790
150 HA VAL 80 HA VAL 80 5.331 5.260 -4.638
151 HB VAL 80 HB VAL 80 6.036 5.411 -1.689
152 HG11 VAL 80 1HG1 VAL 80 5.965 3.129 -2.382
153 HG12 VAL 80 2HG1 VAL 80 7.665 3.587 -2.450
154 HG13 VAL 80 3HG1 VAL 80 6.715 3.501 -3.933
155 HG21 VAL 80 3HG2 VAL 80 7.791 5.864 -4.122
156 HG22 VAL 80 1HG2 VAL 80 8.300 5.947 -2.436
157 HG23 VAL 80 2HG2 VAL 80 7.179 7.146 -3.078
158 H GLN 81 H GLN 81 3.450 6.159 -1.804
159 HA GLN 81 HA GLN 81 2.208 3.627 -1.308
160 HB2 GLN 81 1HB GLN 81 2.131 5.626 0.217
161 HB3 GLN 81 2HB GLN 81 1.001 6.380 -0.905
162 HG2 GLN 81 1HG GLN 81 -0.731 5.053 -0.258
163 HG3 GLN 81 2HG GLN 81 0.289 3.624 -0.102
164 HE21 GLN 81 1HE2 GLN 81 2.208 4.592 1.771
165 HE22 GLN 81 2HE2 GLN 81 1.429 4.907 3.241
166 H LYS 82 H LYS 82 1.203 6.409 -3.307
167 HA LYS 82 HA LYS 82 -1.236 5.263 -4.249
168 HB2 LYS 82 1HB LYS 82 0.548 7.502 -5.076
169 HB3 LYS 82 2HB LYS 82 -0.592 6.901 -6.278
170 HG2 LYS 82 1HG LYS 82 -1.664 8.689 -5.045
171 HG3 LYS 82 2HG LYS 82 -2.429 7.169 -4.585
172 HD2 LYS 82 1HD LYS 82 -1.469 7.170 -2.470
173 HD3 LYS 82 2HD LYS 82 -0.089 8.142 -2.983
174 HE2 LYS 82 1HE LYS 82 -1.272 10.142 -2.850
175 HE3 LYS 82 2HE LYS 82 -2.832 9.353 -3.080
176 HZ1 LYS 82 3HZ LYS 82 -1.259 9.692 -0.648
177 HZ2 LYS 82 1HZ LYS 82 -2.106 8.232 -0.810
178 HZ3 LYS 82 2HZ LYS 82 -2.944 9.710 -0.865
179 H GLU 83 H GLU 83 2.004 5.374 -5.789
180 HA GLU 83 HA GLU 83 1.264 3.931 -8.120
181 HB2 GLU 83 1HB GLU 83 3.912 4.118 -6.661
182 HB3 GLU 83 2HB GLU 83 3.726 3.309 -8.216
183 HG2 GLU 83 1HG GLU 83 2.660 5.497 -9.040
184 HG3 GLU 83 2HG GLU 83 3.311 6.230 -7.575
185 H LEU 84 H LEU 84 2.343 2.727 -4.941
186 HA LEU 84 HA LEU 84 2.377 -0.029 -5.853
187 HB2 LEU 84 1HB LEU 84 2.328 1.186 -3.074
188 HB3 LEU 84 2HB LEU 84 2.458 -0.548 -3.377
189 HG LEU 84 HG LEU 84 4.367 1.538 -4.474
190 HD11 LEU 84 1HD1 LEU 84 5.973 0.592 -2.836
191 HD12 LEU 84 2HD1 LEU 84 4.685 -0.411 -2.171
192 HD13 LEU 84 3HD1 LEU 84 4.593 1.347 -2.039
193 HD21 LEU 84 3HD2 LEU 84 4.023 -1.403 -4.799
194 HD22 LEU 84 1HD2 LEU 84 5.677 -0.817 -4.618
195 HD23 LEU 84 2HD2 LEU 84 4.666 -0.214 -5.932
196 H LEU 85 H LEU 85 -0.018 2.046 -4.259
197 HA LEU 85 HA LEU 85 -1.926 -0.091 -3.842
198 HB2 LEU 85 1HB LEU 85 -2.173 2.925 -3.971
199 HB3 LEU 85 2HB LEU 85 -3.583 1.889 -3.758
200 HG LEU 85 HG LEU 85 -1.157 1.652 -1.973
201 HD11 LEU 85 1HD1 LEU 85 -2.301 3.120 -0.375
202 HD12 LEU 85 2HD1 LEU 85 -3.623 3.359 -1.516
203 HD13 LEU 85 3HD1 LEU 85 -2.016 3.984 -1.886
204 HD21 LEU 85 3HD2 LEU 85 -2.389 0.071 -0.935
205 HD22 LEU 85 1HD2 LEU 85 -3.539 0.173 -2.266
206 HD23 LEU 85 2HD2 LEU 85 -3.774 1.152 -0.820
207 H ALA 86 H ALA 86 -1.278 2.181 -6.482
208 HA ALA 86 HA ALA 86 -3.584 1.539 -8.049
209 HB1 ALA 86 1HB ALA 86 -2.548 3.395 -8.938
210 HB2 ALA 86 2HB ALA 86 -1.782 2.172 -9.953
211 HB3 ALA 86 3HB ALA 86 -0.933 2.806 -8.544
212 H GLU 87 H GLU 87 -0.442 0.006 -7.646
213 HA GLU 87 HA GLU 87 -0.807 -1.868 -9.862
214 HB2 GLU 87 1HB GLU 87 1.447 -1.221 -8.964
215 HB3 GLU 87 2HB GLU 87 1.053 -2.070 -7.469
216 HG2 GLU 87 1HG GLU 87 1.264 -4.144 -8.428
217 HG3 GLU 87 2HG GLU 87 0.684 -3.592 -9.999
218 H TRP 88 H TRP 88 -1.328 -1.933 -6.353
219 HA TRP 88 HA TRP 88 -2.090 -4.719 -6.237
220 HB2 TRP 88 1HB TRP 88 -2.958 -2.438 -4.436
221 HB3 TRP 88 2HB TRP 88 -3.072 -4.155 -4.064
222 HD1 TRP 88 HD TRP 88 0.034 -4.306 -5.642
223 HE1 TRP 88 1HE TRP 88 2.020 -3.918 -4.035
224 HE3 TRP 88 3HE TRP 88 -2.393 -2.091 -1.728
225 HZ2 TRP 88 2HZ TRP 88 2.514 -2.800 -1.466
226 HZ3 TRP 88 3HZ TRP 88 -1.137 -1.379 0.285
227 HH2 TRP 88 HH TRP 88 1.311 -1.734 0.423
228 H LYS 89 H LYS 89 -3.748 -1.715 -6.962
229 HA LYS 89 HA LYS 89 -6.421 -2.862 -6.890
230 HB2 LYS 89 1HB LYS 89 -5.946 -0.427 -6.557
231 HB3 LYS 89 2HB LYS 89 -5.459 -0.327 -8.249
232 HG2 LYS 89 1HG LYS 89 -7.687 -1.034 -8.966
233 HG3 LYS 89 2HG LYS 89 -8.186 -1.241 -7.286
234 HD2 LYS 89 1HD LYS 89 -7.129 1.360 -7.426
235 HD3 LYS 89 2HD LYS 89 -8.113 1.178 -8.879
236 HE2 LYS 89 1HE LYS 89 -9.025 0.598 -6.045
237 HE3 LYS 89 2HE LYS 89 -9.482 2.005 -7.006
238 HZ1 LYS 89 3HZ LYS 89 -11.225 0.526 -7.316
239 HZ2 LYS 89 1HZ LYS 89 -10.205 -0.826 -7.422
240 HZ3 LYS 89 2HZ LYS 89 -10.272 0.288 -8.704
241 H ARG 90 H ARG 90 -4.054 -2.160 -9.488
242 HA ARG 90 HA ARG 90 -5.740 -2.798 -11.653
243 HB2 ARG 90 1HB ARG 90 -3.626 -1.885 -12.226
244 HB3 ARG 90 2HB ARG 90 -2.762 -3.041 -11.208
245 HG2 ARG 90 1HG ARG 90 -3.072 -4.798 -12.715
246 HG3 ARG 90 2HG ARG 90 -4.423 -3.995 -13.509
247 HD2 ARG 90 1HD ARG 90 -1.869 -2.513 -13.604
248 HD3 ARG 90 2HD ARG 90 -1.882 -4.028 -14.507
249 HE ARG 90 HE ARG 90 -4.197 -2.881 -15.359
250 HH11 ARG 90 1HH2 ARG 90 -0.997 -1.689 -14.898
251 HH12 ARG 90 2HH2 ARG 90 -1.107 -0.515 -16.168
252 HH21 ARG 90 1HH1 ARG 90 -4.361 -1.359 -17.024
253 HH22 ARG 90 2HH1 ARG 90 -3.013 -0.328 -17.371
254 H THR 91 H THR 91 -3.774 -4.861 -9.538
255 HA THR 91 HA THR 91 -4.706 -7.307 -10.902
256 HB THR 91 HB THR 91 -3.405 -8.470 -9.149
257 HG1 THR 91 1HG THR 91 -3.081 -5.831 -8.168
258 HG21 THR 91 3HG2 THR 91 -1.878 -8.027 -10.789
259 HG22 THR 91 1HG2 THR 91 -1.209 -6.937 -9.576
260 HG23 THR 91 2HG2 THR 91 -2.273 -6.309 -10.835
261 H GLY 92 H GLY 92 -5.222 -5.575 -7.860
262 HA2 GLY 92 1HA GLY 92 -7.353 -5.462 -6.732
263 HA3 GLY 92 2HA GLY 92 -7.867 -6.899 -7.615
Start of MODEL 21
1 H LYS 61 H LYS 61 -12.231 -0.694 1.952
2 HA LYS 61 HA LYS 61 -10.796 -2.204 4.055
3 HB2 LYS 61 1HB LYS 61 -12.342 -2.926 1.584
4 HB3 LYS 61 2HB LYS 61 -11.184 -4.084 2.241
5 HG2 LYS 61 1HG LYS 61 -13.045 -2.796 4.177
6 HG3 LYS 61 2HG LYS 61 -13.738 -3.987 3.076
7 HD2 LYS 61 1HD LYS 61 -12.161 -5.672 3.797
8 HD3 LYS 61 2HD LYS 61 -11.266 -4.490 4.754
9 HE2 LYS 61 1HE LYS 61 -12.645 -4.790 6.506
10 HE3 LYS 61 2HE LYS 61 -14.053 -4.444 5.503
11 HZ1 LYS 61 3HZ LYS 61 -12.912 -7.020 4.979
12 HZ2 LYS 61 1HZ LYS 61 -14.520 -6.597 5.312
13 HZ3 LYS 61 2HZ LYS 61 -13.430 -6.855 6.588
14 H ILE 62 H ILE 62 -8.578 -2.191 3.958
15 HA ILE 62 HA ILE 62 -7.298 -1.767 1.303
16 HB ILE 62 HB ILE 62 -6.230 -1.516 4.128
17 HG12 ILE 62 1HG1 ILE 62 -6.562 0.572 1.955
18 HG13 ILE 62 2HG1 ILE 62 -7.754 0.292 3.224
19 HG21 ILE 62 1HG2 ILE 62 -4.254 -0.473 2.764
20 HG22 ILE 62 2HG2 ILE 62 -4.886 -1.448 1.437
21 HG23 ILE 62 3HG2 ILE 62 -4.349 -2.227 2.925
22 HD11 ILE 62 3HD1 ILE 62 -5.834 2.109 3.530
23 HD12 ILE 62 1HD1 ILE 62 -4.904 0.697 4.033
24 HD13 ILE 62 2HD1 ILE 62 -6.383 1.129 4.890
25 H THR 63 H THR 63 -5.793 -3.242 0.504
26 HA THR 63 HA THR 63 -5.493 -5.804 2.033
27 HB THR 63 HB THR 63 -5.467 -6.934 -0.216
28 HG1 THR 63 1HG THR 63 -5.918 -5.791 -1.978
29 HG21 THR 63 3HG2 THR 63 -7.897 -6.872 -0.511
30 HG22 THR 63 1HG2 THR 63 -7.988 -5.378 0.424
31 HG23 THR 63 2HG2 THR 63 -7.496 -6.880 1.208
32 H PHE 64 H PHE 64 -3.395 -6.004 2.589
33 HA PHE 64 HA PHE 64 -1.337 -4.720 0.884
34 HB2 PHE 64 1HB PHE 64 -1.094 -5.984 3.628
35 HB3 PHE 64 2HB PHE 64 0.166 -5.076 2.793
36 HD1 PHE 64 1HD PHE 64 -0.256 -2.640 2.214
37 HD2 PHE 64 2HD PHE 64 -2.784 -4.876 4.870
38 HE1 PHE 64 1HE PHE 64 -1.165 -0.522 3.129
39 HE2 PHE 64 2HE PHE 64 -3.695 -2.758 5.786
40 HZ PHE 64 HZ PHE 64 -2.886 -0.582 4.915
41 HA PRO 65 HA PRO 65 -0.280 -8.658 -1.075
42 HB2 PRO 65 1HB PRO 65 2.489 -7.616 -0.708
43 HB3 PRO 65 2HB PRO 65 1.713 -8.289 -2.153
44 HG2 PRO 65 1HG PRO 65 2.103 -5.663 -1.836
45 HG3 PRO 65 2HG PRO 65 0.707 -6.319 -2.700
46 HD2 PRO 65 1HD PRO 65 0.802 -4.991 -0.060
47 HD3 PRO 65 2HD PRO 65 -0.565 -5.207 -1.171
48 H SER 66 H SER 66 0.739 -10.639 -0.449
49 HA SER 66 HA SER 66 0.929 -11.178 2.359
50 HB2 SER 66 1HB SER 66 1.633 -12.668 -0.145
51 HB3 SER 66 2HB SER 66 2.160 -13.296 1.413
52 HG SER 66 HG SER 66 -0.277 -13.362 0.283
53 H ASP 67 H ASP 67 3.079 -9.447 0.474
54 HA ASP 67 HA ASP 67 5.349 -10.242 2.259
55 HB2 ASP 67 1HB ASP 67 6.865 -9.613 0.392
56 HB3 ASP 67 2HB ASP 67 5.803 -10.957 -0.030
57 H ILE 68 H ILE 68 3.189 -7.867 2.037
58 HA ILE 68 HA ILE 68 5.217 -5.694 2.394
59 HB ILE 68 HB ILE 68 2.363 -5.620 1.441
60 HG12 ILE 68 1HG1 ILE 68 4.069 -6.034 -0.282
61 HG13 ILE 68 2HG1 ILE 68 3.383 -4.424 -0.478
62 HG21 ILE 68 1HG2 ILE 68 2.359 -3.776 2.866
63 HG22 ILE 68 2HG2 ILE 68 2.910 -3.060 1.351
64 HG23 ILE 68 3HG2 ILE 68 4.075 -3.452 2.615
65 HD11 ILE 68 3HD1 ILE 68 6.130 -5.223 0.335
66 HD12 ILE 68 1HD1 ILE 68 5.455 -3.805 1.136
67 HD13 ILE 68 2HD1 ILE 68 5.594 -3.839 -0.619
68 H ASP 69 H ASP 69 5.406 -4.875 4.348
69 HA ASP 69 HA ASP 69 3.508 -5.673 6.472
70 HB2 ASP 69 1HB ASP 69 6.048 -5.706 6.763
71 HB3 ASP 69 2HB ASP 69 5.968 -3.948 6.808
72 HA PRO 70 HA PRO 70 1.265 -1.832 6.062
73 HB2 PRO 70 1HB PRO 70 0.188 -1.695 8.607
74 HB3 PRO 70 2HB PRO 70 -0.477 -2.658 7.275
75 HG2 PRO 70 1HG PRO 70 1.176 -3.507 9.584
76 HG3 PRO 70 2HG PRO 70 -0.131 -4.361 8.750
77 HD2 PRO 70 1HD PRO 70 2.508 -4.957 8.376
78 HD3 PRO 70 2HD PRO 70 1.275 -5.203 7.122
79 H GLN 71 H GLN 71 3.312 -2.250 8.952
80 HA GLN 71 HA GLN 71 3.441 0.618 9.488
81 HB2 GLN 71 1HB GLN 71 3.779 -1.250 11.201
82 HB3 GLN 71 2HB GLN 71 5.346 -1.537 10.446
83 HG2 GLN 71 1HG GLN 71 5.061 1.279 10.923
84 HG3 GLN 71 2HG GLN 71 4.684 0.405 12.406
85 HE21 GLN 71 1HE2 GLN 71 6.592 0.460 13.630
86 HE22 GLN 71 2HE2 GLN 71 8.125 0.036 13.038
87 H VAL 72 H VAL 72 5.324 -1.682 7.602
88 HA VAL 72 HA VAL 72 7.480 0.270 7.188
89 HB VAL 72 HB VAL 72 6.959 -2.289 5.654
90 HG11 VAL 72 1HG1 VAL 72 8.860 -0.194 5.404
91 HG12 VAL 72 2HG1 VAL 72 8.829 -1.731 4.541
92 HG13 VAL 72 3HG1 VAL 72 9.714 -1.591 6.060
93 HG21 VAL 72 3HG2 VAL 72 8.330 -3.437 7.257
94 HG22 VAL 72 1HG2 VAL 72 7.124 -2.551 8.192
95 HG23 VAL 72 2HG2 VAL 72 8.768 -1.927 8.058
96 H PHE 73 H PHE 73 4.454 -0.589 5.736
97 HA PHE 73 HA PHE 73 5.040 0.557 3.119
98 HB2 PHE 73 1HB PHE 73 3.397 -1.281 3.496
99 HB3 PHE 73 2HB PHE 73 2.393 -0.158 4.410
100 HD1 PHE 73 2HD PHE 73 4.151 -0.397 1.105
101 HD2 PHE 73 1HD PHE 73 0.719 0.993 3.279
102 HE1 PHE 73 2HE PHE 73 3.133 0.399 -1.006
103 HE2 PHE 73 1HE PHE 73 -0.300 1.790 1.165
104 HZ PHE 73 HZ PHE 73 0.913 1.498 -0.981
105 H TYR 74 H TYR 74 2.806 1.504 5.759
106 HA TYR 74 HA TYR 74 2.170 4.041 4.654
107 HB2 TYR 74 1HB TYR 74 2.216 3.088 7.528
108 HB3 TYR 74 2HB TYR 74 1.674 4.704 7.082
109 HD1 TYR 74 1HD TYR 74 -0.004 4.637 4.905
110 HD2 TYR 74 2HD TYR 74 0.545 1.514 7.803
111 HE1 TYR 74 1HE TYR 74 -2.242 3.726 4.351
112 HE2 TYR 74 2HE TYR 74 -1.691 0.602 7.247
113 HH TYR 74 HH TYR 74 -3.567 0.921 6.100
114 H GLU 75 H GLU 75 5.102 2.953 6.064
115 HA GLU 75 HA GLU 75 6.057 5.602 6.866
116 HB2 GLU 75 1HB GLU 75 7.034 2.835 6.921
117 HB3 GLU 75 2HB GLU 75 8.288 4.006 6.512
118 HG2 GLU 75 1HG GLU 75 6.418 4.423 8.848
119 HG3 GLU 75 2HG GLU 75 7.932 3.533 9.013
120 H LEU 76 H LEU 76 5.440 4.226 3.907
121 HA LEU 76 HA LEU 76 7.811 5.350 2.559
122 HB2 LEU 76 1HB LEU 76 5.385 3.913 1.450
123 HB3 LEU 76 2HB LEU 76 6.807 4.371 0.516
124 HG LEU 76 HG LEU 76 6.843 2.539 2.930
125 HD11 LEU 76 1HD1 LEU 76 6.736 0.735 1.518
126 HD12 LEU 76 2HD1 LEU 76 7.545 1.585 0.202
127 HD13 LEU 76 3HD1 LEU 76 5.834 1.872 0.516
128 HD21 LEU 76 3HD2 LEU 76 9.003 3.345 2.879
129 HD22 LEU 76 1HD2 LEU 76 8.918 3.764 1.169
130 HD23 LEU 76 2HD2 LEU 76 9.163 2.087 1.654
131 HA PRO 77 HA PRO 77 6.001 9.264 1.534
132 HB2 PRO 77 1HB PRO 77 6.729 8.997 -1.288
133 HB3 PRO 77 2HB PRO 77 7.339 10.135 -0.080
134 HG2 PRO 77 1HG PRO 77 8.693 7.943 -1.127
135 HG3 PRO 77 2HG PRO 77 9.155 8.894 0.288
136 HD2 PRO 77 1HD PRO 77 8.162 6.171 0.193
137 HD3 PRO 77 2HD PRO 77 8.780 7.086 1.582
138 H GLU 78 H GLU 78 4.209 10.196 0.275
139 HA GLU 78 HA GLU 78 2.059 8.373 -0.212
140 HB2 GLU 78 1HB GLU 78 0.865 10.309 -1.085
141 HB3 GLU 78 2HB GLU 78 1.769 10.781 0.355
142 HG2 GLU 78 1HG GLU 78 3.661 11.416 -1.305
143 HG3 GLU 78 2HG GLU 78 2.396 11.366 -2.533
144 H ALA 79 H ALA 79 4.203 10.095 -2.515
145 HA ALA 79 HA ALA 79 2.959 9.229 -4.878
146 HB1 ALA 79 1HB ALA 79 4.640 10.654 -5.476
147 HB2 ALA 79 2HB ALA 79 5.597 9.179 -5.606
148 HB3 ALA 79 3HB ALA 79 5.671 10.151 -4.136
149 H VAL 80 H VAL 80 5.211 7.462 -2.790
150 HA VAL 80 HA VAL 80 5.399 5.197 -4.641
151 HB VAL 80 HB VAL 80 6.061 5.149 -1.694
152 HG11 VAL 80 1HG1 VAL 80 7.799 3.560 -2.514
153 HG12 VAL 80 2HG1 VAL 80 7.160 3.747 -4.147
154 HG13 VAL 80 3HG1 VAL 80 6.164 3.020 -2.889
155 HG21 VAL 80 3HG2 VAL 80 7.099 7.165 -2.645
156 HG22 VAL 80 1HG2 VAL 80 7.750 6.215 -3.981
157 HG23 VAL 80 2HG2 VAL 80 8.328 5.938 -2.338
158 H GLN 81 H GLN 81 3.542 6.110 -1.808
159 HA GLN 81 HA GLN 81 2.291 3.587 -1.282
160 HB2 GLN 81 1HB GLN 81 2.261 5.611 0.223
161 HB3 GLN 81 2HB GLN 81 1.103 6.347 -0.883
162 HG2 GLN 81 1HG GLN 81 -0.607 4.987 -0.210
163 HG3 GLN 81 2HG GLN 81 0.452 3.598 0.022
164 HE21 GLN 81 1HE2 GLN 81 2.319 4.536 1.856
165 HE22 GLN 81 2HE2 GLN 81 1.552 4.995 3.296
166 H LYS 82 H LYS 82 1.199 6.398 -3.193
167 HA LYS 82 HA LYS 82 -1.233 5.253 -4.136
168 HB2 LYS 82 1HB LYS 82 0.543 7.502 -4.987
169 HB3 LYS 82 2HB LYS 82 -0.690 6.948 -6.115
170 HG2 LYS 82 1HG LYS 82 -1.681 8.703 -4.804
171 HG3 LYS 82 2HG LYS 82 -2.379 7.189 -4.235
172 HD2 LYS 82 1HD LYS 82 -0.625 7.158 -2.418
173 HD3 LYS 82 2HD LYS 82 -0.153 8.778 -2.930
174 HE2 LYS 82 1HE LYS 82 -1.715 8.995 -1.092
175 HE3 LYS 82 2HE LYS 82 -2.535 9.506 -2.569
176 HZ1 LYS 82 3HZ LYS 82 -3.720 7.521 -2.686
177 HZ2 LYS 82 1HZ LYS 82 -3.765 7.917 -1.038
178 HZ3 LYS 82 2HZ LYS 82 -2.695 6.721 -1.593
179 H GLU 83 H GLU 83 1.973 5.435 -5.735
180 HA GLU 83 HA GLU 83 1.196 4.051 -8.088
181 HB2 GLU 83 1HB GLU 83 3.901 4.085 -6.712
182 HB3 GLU 83 2HB GLU 83 3.616 3.563 -8.372
183 HG2 GLU 83 1HG GLU 83 3.000 5.739 -9.073
184 HG3 GLU 83 2HG GLU 83 2.771 6.296 -7.416
185 H LEU 84 H LEU 84 2.340 2.778 -4.963
186 HA LEU 84 HA LEU 84 2.374 0.048 -5.961
187 HB2 LEU 84 1HB LEU 84 2.412 1.162 -3.136
188 HB3 LEU 84 2HB LEU 84 2.588 -0.552 -3.524
189 HG LEU 84 HG LEU 84 4.392 1.652 -4.570
190 HD11 LEU 84 1HD1 LEU 84 4.769 -0.400 -2.371
191 HD12 LEU 84 2HD1 LEU 84 4.793 1.356 -2.203
192 HD13 LEU 84 3HD1 LEU 84 6.088 0.537 -3.075
193 HD21 LEU 84 3HD2 LEU 84 5.753 -0.647 -4.933
194 HD22 LEU 84 1HD2 LEU 84 4.668 0.013 -6.158
195 HD23 LEU 84 2HD2 LEU 84 4.109 -1.268 -5.083
196 H LEU 85 H LEU 85 0.019 2.089 -4.274
197 HA LEU 85 HA LEU 85 -1.866 -0.057 -3.809
198 HB2 LEU 85 1HB LEU 85 -2.141 2.956 -3.965
199 HB3 LEU 85 2HB LEU 85 -3.544 1.914 -3.733
200 HG LEU 85 HG LEU 85 -1.110 1.717 -1.955
201 HD11 LEU 85 1HD1 LEU 85 -3.599 3.368 -1.436
202 HD12 LEU 85 2HD1 LEU 85 -2.055 4.052 -1.944
203 HD13 LEU 85 3HD1 LEU 85 -2.184 3.226 -0.392
204 HD21 LEU 85 3HD2 LEU 85 -2.328 0.139 -0.887
205 HD22 LEU 85 1HD2 LEU 85 -3.472 0.210 -2.228
206 HD23 LEU 85 2HD2 LEU 85 -3.729 1.208 -0.798
207 H ALA 86 H ALA 86 -1.271 2.193 -6.476
208 HA ALA 86 HA ALA 86 -3.587 1.503 -8.009
209 HB1 ALA 86 1HB ALA 86 -2.554 2.644 -9.803
210 HB2 ALA 86 2HB ALA 86 -0.933 2.227 -9.251
211 HB3 ALA 86 3HB ALA 86 -1.878 3.432 -8.377
212 H GLU 87 H GLU 87 -0.418 0.030 -7.622
213 HA GLU 87 HA GLU 87 -0.791 -1.901 -9.793
214 HB2 GLU 87 1HB GLU 87 1.451 -1.103 -8.759
215 HB3 GLU 87 2HB GLU 87 1.095 -2.236 -7.455
216 HG2 GLU 87 1HG GLU 87 0.852 -4.051 -9.155
217 HG3 GLU 87 2HG GLU 87 1.346 -2.904 -10.401
218 H TRP 88 H TRP 88 -1.273 -1.867 -6.287
219 HA TRP 88 HA TRP 88 -1.913 -4.657 -5.995
220 HB2 TRP 88 1HB TRP 88 -2.921 -2.275 -4.409
221 HB3 TRP 88 2HB TRP 88 -3.031 -3.958 -3.907
222 HD1 TRP 88 HD TRP 88 0.167 -3.914 -5.493
223 HE1 TRP 88 1HE TRP 88 2.083 -3.462 -3.810
224 HE3 TRP 88 3HE TRP 88 -2.501 -2.089 -1.532
225 HZ2 TRP 88 2HZ TRP 88 2.439 -2.464 -1.177
226 HZ3 TRP 88 3HZ TRP 88 -1.344 -1.397 0.549
227 HH2 TRP 88 HH TRP 88 1.122 -1.583 0.731
228 H LYS 89 H LYS 89 -3.856 -1.767 -6.649
229 HA LYS 89 HA LYS 89 -6.404 -3.163 -6.782
230 HB2 LYS 89 1HB LYS 89 -6.000 -0.672 -6.334
231 HB3 LYS 89 2HB LYS 89 -5.748 -0.518 -8.073
232 HG2 LYS 89 1HG LYS 89 -7.964 -1.418 -8.523
233 HG3 LYS 89 2HG LYS 89 -8.220 -1.730 -6.806
234 HD2 LYS 89 1HD LYS 89 -7.634 0.887 -6.657
235 HD3 LYS 89 2HD LYS 89 -8.287 0.851 -8.296
236 HE2 LYS 89 1HE LYS 89 -10.164 1.261 -6.892
237 HE3 LYS 89 2HE LYS 89 -10.267 -0.449 -7.313
238 HZ1 LYS 89 3HZ LYS 89 -9.996 -1.034 -5.202
239 HZ2 LYS 89 1HZ LYS 89 -10.238 0.593 -4.789
240 HZ3 LYS 89 2HZ LYS 89 -8.661 -0.004 -4.995
241 H ARG 90 H ARG 90 -3.883 -2.383 -9.154
242 HA ARG 90 HA ARG 90 -5.516 -2.822 -11.456
243 HB2 ARG 90 1HB ARG 90 -2.581 -2.794 -10.907
244 HB3 ARG 90 2HB ARG 90 -3.108 -3.591 -12.389
245 HG2 ARG 90 1HG ARG 90 -4.211 -1.601 -13.166
246 HG3 ARG 90 2HG ARG 90 -3.991 -0.803 -11.609
247 HD2 ARG 90 1HD ARG 90 -2.276 0.094 -12.976
248 HD3 ARG 90 2HD ARG 90 -1.465 -1.128 -11.999
249 HE ARG 90 HE ARG 90 -1.196 -2.463 -13.953
250 HH11 ARG 90 1HH2 ARG 90 -3.254 0.262 -14.431
251 HH12 ARG 90 2HH2 ARG 90 -3.256 0.125 -16.158
252 HH21 ARG 90 1HH1 ARG 90 -1.187 -2.658 -16.204
253 HH22 ARG 90 2HH1 ARG 90 -2.086 -1.529 -17.162
254 H THR 91 H THR 91 -3.483 -5.062 -9.553
255 HA THR 91 HA THR 91 -4.729 -7.317 -11.072
256 HB THR 91 HB THR 91 -2.386 -7.596 -11.135
257 HG1 THR 91 1HG THR 91 -3.450 -8.979 -8.908
258 HG21 THR 91 3HG2 THR 91 -1.330 -7.521 -8.599
259 HG22 THR 91 1HG2 THR 91 -2.527 -6.230 -8.535
260 HG23 THR 91 2HG2 THR 91 -1.258 -6.194 -9.758
261 H GLY 92 H GLY 92 -4.123 -6.124 -7.778
262 HA2 GLY 92 1HA GLY 92 -5.940 -6.367 -6.116
263 HA3 GLY 92 2HA GLY 92 -6.339 -7.912 -6.864
Start of MODEL 22
1 H LYS 61 H LYS 61 -11.643 0.337 3.184
2 HA LYS 61 HA LYS 61 -10.240 -1.614 4.921
3 HB2 LYS 61 1HB LYS 61 -11.755 -2.301 2.405
4 HB3 LYS 61 2HB LYS 61 -11.494 -3.293 3.841
5 HG2 LYS 61 1HG LYS 61 -12.837 -1.471 5.098
6 HG3 LYS 61 2HG LYS 61 -13.359 -0.949 3.495
7 HD2 LYS 61 1HD LYS 61 -13.679 -3.747 4.621
8 HD3 LYS 61 2HD LYS 61 -14.966 -2.549 4.475
9 HE2 LYS 61 1HE LYS 61 -14.261 -2.473 1.957
10 HE3 LYS 61 2HE LYS 61 -13.516 -4.035 2.298
11 HZ1 LYS 61 3HZ LYS 61 -16.367 -3.287 2.626
12 HZ2 LYS 61 1HZ LYS 61 -15.705 -4.722 3.240
13 HZ3 LYS 61 2HZ LYS 61 -15.716 -4.441 1.564
14 H ILE 62 H ILE 62 -8.126 -1.865 4.482
15 HA ILE 62 HA ILE 62 -7.206 -1.616 1.645
16 HB ILE 62 HB ILE 62 -5.660 -1.348 4.233
17 HG12 ILE 62 1HG1 ILE 62 -6.327 0.718 2.116
18 HG13 ILE 62 2HG1 ILE 62 -7.257 0.512 3.600
19 HG21 ILE 62 1HG2 ILE 62 -3.847 -0.547 2.668
20 HG22 ILE 62 2HG2 ILE 62 -4.826 -1.136 1.326
21 HG23 ILE 62 3HG2 ILE 62 -4.209 -2.267 2.531
22 HD11 ILE 62 3HD1 ILE 62 -4.280 0.850 3.763
23 HD12 ILE 62 1HD1 ILE 62 -5.513 1.254 4.958
24 HD13 ILE 62 2HD1 ILE 62 -5.302 2.267 3.529
25 H THR 63 H THR 63 -5.805 -3.165 0.778
26 HA THR 63 HA THR 63 -5.531 -5.726 2.314
27 HB THR 63 HB THR 63 -5.448 -6.425 -0.370
28 HG1 THR 63 1HG THR 63 -6.685 -4.092 -0.163
29 HG21 THR 63 3HG2 THR 63 -7.615 -6.502 1.724
30 HG22 THR 63 1HG2 THR 63 -6.571 -7.813 1.172
31 HG23 THR 63 2HG2 THR 63 -7.859 -7.212 0.129
32 H PHE 64 H PHE 64 -3.398 -5.966 2.764
33 HA PHE 64 HA PHE 64 -1.414 -4.795 0.899
34 HB2 PHE 64 1HB PHE 64 -0.967 -5.958 3.658
35 HB3 PHE 64 2HB PHE 64 0.170 -4.989 2.722
36 HD1 PHE 64 1HD PHE 64 -0.221 -2.581 2.364
37 HD2 PHE 64 2HD PHE 64 -2.843 -4.948 4.805
38 HE1 PHE 64 1HE PHE 64 -1.188 -0.511 3.329
39 HE2 PHE 64 2HE PHE 64 -3.810 -2.880 5.772
40 HZ PHE 64 HZ PHE 64 -2.983 -0.661 5.035
41 HA PRO 65 HA PRO 65 -0.427 -8.815 -0.912
42 HB2 PRO 65 1HB PRO 65 2.370 -7.827 -0.600
43 HB3 PRO 65 2HB PRO 65 1.569 -8.534 -2.016
44 HG2 PRO 65 1HG PRO 65 2.015 -5.914 -1.809
45 HG3 PRO 65 2HG PRO 65 0.581 -6.566 -2.611
46 HD2 PRO 65 1HD PRO 65 0.783 -5.163 -0.009
47 HD3 PRO 65 2HD PRO 65 -0.609 -5.345 -1.098
48 H SER 66 H SER 66 0.708 -10.783 -0.303
49 HA SER 66 HA SER 66 0.891 -11.249 2.552
50 HB2 SER 66 1HB SER 66 0.787 -12.809 0.173
51 HB3 SER 66 2HB SER 66 2.237 -13.281 1.053
52 HG SER 66 HG SER 66 0.728 -13.285 2.948
53 H ASP 67 H ASP 67 3.030 -9.705 0.505
54 HA ASP 67 HA ASP 67 5.348 -10.537 2.213
55 HB2 ASP 67 1HB ASP 67 5.478 -9.526 -0.640
56 HB3 ASP 67 2HB ASP 67 6.817 -10.146 0.326
57 H ILE 68 H ILE 68 3.224 -8.156 2.036
58 HA ILE 68 HA ILE 68 5.275 -5.998 2.350
59 HB ILE 68 HB ILE 68 2.437 -5.902 1.357
60 HG12 ILE 68 1HG1 ILE 68 4.157 -6.388 -0.330
61 HG13 ILE 68 2HG1 ILE 68 3.500 -4.775 -0.578
62 HG21 ILE 68 1HG2 ILE 68 2.943 -3.372 1.225
63 HG22 ILE 68 2HG2 ILE 68 4.193 -3.700 2.425
64 HG23 ILE 68 3HG2 ILE 68 2.503 -4.041 2.796
65 HD11 ILE 68 3HD1 ILE 68 5.546 -4.091 1.000
66 HD12 ILE 68 1HD1 ILE 68 5.745 -4.286 -0.740
67 HD13 ILE 68 2HD1 ILE 68 6.221 -5.584 0.351
68 H ASP 69 H ASP 69 5.426 -5.066 4.250
69 HA ASP 69 HA ASP 69 3.567 -5.846 6.411
70 HB2 ASP 69 1HB ASP 69 6.042 -5.856 6.777
71 HB3 ASP 69 2HB ASP 69 6.051 -4.111 6.552
72 HA PRO 70 HA PRO 70 1.226 -2.080 5.874
73 HB2 PRO 70 1HB PRO 70 0.018 -1.964 8.339
74 HB3 PRO 70 2HB PRO 70 -0.506 -3.031 7.024
75 HG2 PRO 70 1HG PRO 70 1.121 -3.651 9.430
76 HG3 PRO 70 2HG PRO 70 -0.115 -4.623 8.615
77 HD2 PRO 70 1HD PRO 70 2.567 -5.075 8.316
78 HD3 PRO 70 2HD PRO 70 1.372 -5.457 7.058
79 H GLN 71 H GLN 71 3.182 -2.398 8.837
80 HA GLN 71 HA GLN 71 3.134 0.482 9.365
81 HB2 GLN 71 1HB GLN 71 4.606 -1.877 10.527
82 HB3 GLN 71 2HB GLN 71 5.119 -0.235 10.917
83 HG2 GLN 71 1HG GLN 71 3.178 0.248 12.079
84 HG3 GLN 71 2HG GLN 71 2.210 -0.891 11.141
85 HE21 GLN 71 1HE2 GLN 71 5.062 -1.025 13.363
86 HE22 GLN 71 2HE2 GLN 71 4.538 -2.417 14.181
87 H VAL 72 H VAL 72 5.196 -1.707 7.559
88 HA VAL 72 HA VAL 72 7.289 0.339 7.250
89 HB VAL 72 HB VAL 72 6.921 -2.226 5.681
90 HG11 VAL 72 1HG1 VAL 72 9.634 -1.498 6.107
91 HG12 VAL 72 2HG1 VAL 72 8.785 -0.050 5.566
92 HG13 VAL 72 3HG1 VAL 72 8.745 -1.514 4.585
93 HG21 VAL 72 3HG2 VAL 72 8.456 -1.713 8.251
94 HG22 VAL 72 1HG2 VAL 72 8.506 -3.211 7.320
95 HG23 VAL 72 2HG2 VAL 72 7.007 -2.705 8.098
96 H PHE 73 H PHE 73 4.370 -0.659 5.672
97 HA PHE 73 HA PHE 73 4.929 0.495 3.065
98 HB2 PHE 73 1HB PHE 73 3.217 -1.310 3.620
99 HB3 PHE 73 2HB PHE 73 2.231 -0.034 4.331
100 HD1 PHE 73 2HD PHE 73 4.186 -0.694 1.194
101 HD2 PHE 73 1HD PHE 73 0.659 0.990 2.972
102 HE1 PHE 73 2HE PHE 73 3.338 -0.090 -1.056
103 HE2 PHE 73 1HE PHE 73 -0.189 1.594 0.723
104 HZ PHE 73 HZ PHE 73 1.154 1.057 -1.289
105 H TYR 74 H TYR 74 2.797 1.519 5.753
106 HA TYR 74 HA TYR 74 2.154 4.059 4.641
107 HB2 TYR 74 1HB TYR 74 2.302 3.120 7.518
108 HB3 TYR 74 2HB TYR 74 1.754 4.737 7.081
109 HD1 TYR 74 2HD TYR 74 -0.007 4.667 4.975
110 HD2 TYR 74 1HD TYR 74 0.637 1.557 7.873
111 HE1 TYR 74 2HE TYR 74 -2.275 3.771 4.524
112 HE2 TYR 74 1HE TYR 74 -1.631 0.665 7.419
113 HH TYR 74 HH TYR 74 -3.960 2.044 6.342
114 H GLU 75 H GLU 75 5.130 2.936 5.888
115 HA GLU 75 HA GLU 75 6.120 5.564 6.713
116 HB2 GLU 75 1HB GLU 75 6.891 2.941 7.176
117 HB3 GLU 75 2HB GLU 75 8.126 3.532 6.066
118 HG2 GLU 75 1HG GLU 75 8.261 5.603 7.587
119 HG3 GLU 75 2HG GLU 75 7.353 4.649 8.761
120 H LEU 76 H LEU 76 5.457 4.229 3.734
121 HA LEU 76 HA LEU 76 7.808 5.410 2.392
122 HB2 LEU 76 1HB LEU 76 5.430 3.895 1.290
123 HB3 LEU 76 2HB LEU 76 6.804 4.445 0.331
124 HG LEU 76 HG LEU 76 7.005 2.588 2.718
125 HD11 LEU 76 1HD1 LEU 76 5.927 1.857 0.375
126 HD12 LEU 76 2HD1 LEU 76 6.988 0.784 1.286
127 HD13 LEU 76 3HD1 LEU 76 7.630 1.717 -0.066
128 HD21 LEU 76 3HD2 LEU 76 9.124 3.477 2.608
129 HD22 LEU 76 1HD2 LEU 76 8.951 3.948 0.916
130 HD23 LEU 76 2HD2 LEU 76 9.298 2.270 1.334
131 HA PRO 77 HA PRO 77 5.939 9.313 1.389
132 HB2 PRO 77 1HB PRO 77 6.617 8.880 -1.464
133 HB3 PRO 77 2HB PRO 77 7.100 10.194 -0.379
134 HG2 PRO 77 1HG PRO 77 8.766 8.218 -1.176
135 HG3 PRO 77 2HG PRO 77 8.933 9.092 0.352
136 HD2 PRO 77 1HD PRO 77 8.061 6.305 -0.115
137 HD3 PRO 77 2HD PRO 77 8.719 7.066 1.349
138 H GLU 78 H GLU 78 4.103 10.250 0.241
139 HA GLU 78 HA GLU 78 1.923 8.440 -0.208
140 HB2 GLU 78 1HB GLU 78 2.290 11.343 -0.999
141 HB3 GLU 78 2HB GLU 78 0.764 10.465 -1.108
142 HG2 GLU 78 1HG GLU 78 2.045 10.181 1.511
143 HG3 GLU 78 2HG GLU 78 1.658 11.857 1.117
144 H ALA 79 H ALA 79 3.953 10.285 -2.521
145 HA ALA 79 HA ALA 79 2.649 9.446 -4.877
146 HB1 ALA 79 1HB ALA 79 4.666 11.094 -4.517
147 HB2 ALA 79 2HB ALA 79 4.529 10.214 -6.039
148 HB3 ALA 79 3HB ALA 79 5.648 9.655 -4.795
149 H VAL 80 H VAL 80 5.039 7.757 -2.889
150 HA VAL 80 HA VAL 80 5.294 5.527 -4.775
151 HB VAL 80 HB VAL 80 6.171 5.920 -1.898
152 HG11 VAL 80 1HG1 VAL 80 7.562 3.814 -2.458
153 HG12 VAL 80 2HG1 VAL 80 6.396 3.551 -3.755
154 HG13 VAL 80 3HG1 VAL 80 5.857 3.580 -2.077
155 HG21 VAL 80 3HG2 VAL 80 7.228 6.767 -4.377
156 HG22 VAL 80 1HG2 VAL 80 8.228 5.405 -3.869
157 HG23 VAL 80 2HG2 VAL 80 8.036 6.802 -2.810
158 H GLN 81 H GLN 81 3.482 6.304 -1.862
159 HA GLN 81 HA GLN 81 2.351 3.724 -1.346
160 HB2 GLN 81 1HB GLN 81 2.256 5.830 0.116
161 HB3 GLN 81 2HB GLN 81 0.938 6.364 -0.925
162 HG2 GLN 81 1HG GLN 81 -0.472 5.135 0.322
163 HG3 GLN 81 2HG GLN 81 0.343 3.688 -0.268
164 HE21 GLN 81 1HE2 GLN 81 1.713 6.204 1.900
165 HE22 GLN 81 2HE2 GLN 81 1.973 5.153 3.203
166 H LYS 82 H LYS 82 1.237 6.465 -3.315
167 HA LYS 82 HA LYS 82 -1.199 5.288 -4.229
168 HB2 LYS 82 1HB LYS 82 0.544 7.557 -5.041
169 HB3 LYS 82 2HB LYS 82 -0.565 6.942 -6.265
170 HG2 LYS 82 1HG LYS 82 -1.673 8.710 -5.007
171 HG3 LYS 82 2HG LYS 82 -2.434 7.167 -4.621
172 HD2 LYS 82 1HD LYS 82 -0.910 7.019 -2.609
173 HD3 LYS 82 2HD LYS 82 -0.408 8.676 -2.953
174 HE2 LYS 82 1HE LYS 82 -2.206 8.697 -1.297
175 HE3 LYS 82 2HE LYS 82 -2.787 9.395 -2.809
176 HZ1 LYS 82 3HZ LYS 82 -4.434 7.927 -2.620
177 HZ2 LYS 82 1HZ LYS 82 -3.619 7.001 -1.456
178 HZ3 LYS 82 2HZ LYS 82 -3.304 6.757 -3.108
179 H GLU 83 H GLU 83 2.022 5.459 -5.803
180 HA GLU 83 HA GLU 83 1.284 4.015 -8.136
181 HB2 GLU 83 1HB GLU 83 3.932 4.311 -6.699
182 HB3 GLU 83 2HB GLU 83 3.776 3.435 -8.221
183 HG2 GLU 83 1HG GLU 83 2.754 5.481 -9.237
184 HG3 GLU 83 2HG GLU 83 3.085 6.345 -7.735
185 H LEU 84 H LEU 84 2.451 2.842 -4.987
186 HA LEU 84 HA LEU 84 2.533 0.087 -5.890
187 HB2 LEU 84 1HB LEU 84 2.504 1.288 -3.104
188 HB3 LEU 84 2HB LEU 84 2.769 -0.424 -3.444
189 HG LEU 84 HG LEU 84 4.463 1.841 -4.546
190 HD11 LEU 84 1HD1 LEU 84 5.168 -0.191 -2.410
191 HD12 LEU 84 2HD1 LEU 84 4.673 1.466 -2.062
192 HD13 LEU 84 3HD1 LEU 84 6.157 1.160 -2.962
193 HD21 LEU 84 3HD2 LEU 84 5.946 -0.401 -4.809
194 HD22 LEU 84 1HD2 LEU 84 4.850 0.166 -6.069
195 HD23 LEU 84 2HD2 LEU 84 4.336 -1.105 -4.960
196 H LEU 85 H LEU 85 0.146 2.105 -4.200
197 HA LEU 85 HA LEU 85 -1.703 -0.066 -3.717
198 HB2 LEU 85 1HB LEU 85 -2.070 2.940 -3.924
199 HB3 LEU 85 2HB LEU 85 -3.400 1.844 -3.552
200 HG LEU 85 HG LEU 85 -0.835 1.809 -1.966
201 HD11 LEU 85 1HD1 LEU 85 -3.300 3.515 -1.535
202 HD12 LEU 85 2HD1 LEU 85 -1.646 4.079 -1.781
203 HD13 LEU 85 3HD1 LEU 85 -2.076 3.227 -0.297
204 HD21 LEU 85 3HD2 LEU 85 -3.319 1.244 -0.574
205 HD22 LEU 85 1HD2 LEU 85 -1.896 0.221 -0.758
206 HD23 LEU 85 2HD2 LEU 85 -3.154 0.211 -1.991
207 H ALA 86 H ALA 86 -1.155 2.175 -6.396
208 HA ALA 86 HA ALA 86 -3.484 1.450 -7.905
209 HB1 ALA 86 1HB ALA 86 -1.240 2.069 -9.620
210 HB2 ALA 86 2HB ALA 86 -1.266 3.175 -8.248
211 HB3 ALA 86 3HB ALA 86 -2.677 3.037 -9.294
212 H GLU 87 H GLU 87 -0.286 0.045 -7.532
213 HA GLU 87 HA GLU 87 -0.608 -1.870 -9.716
214 HB2 GLU 87 1HB GLU 87 1.643 -1.220 -8.943
215 HB3 GLU 87 2HB GLU 87 1.283 -1.851 -7.336
216 HG2 GLU 87 1HG GLU 87 1.103 -4.103 -8.176
217 HG3 GLU 87 2HG GLU 87 1.193 -3.543 -9.846
218 H TRP 88 H TRP 88 -1.104 -1.877 -6.210
219 HA TRP 88 HA TRP 88 -1.780 -4.668 -5.987
220 HB2 TRP 88 1HB TRP 88 -2.719 -2.305 -4.329
221 HB3 TRP 88 2HB TRP 88 -2.898 -3.997 -3.877
222 HD1 TRP 88 HD TRP 88 0.314 -4.090 -5.402
223 HE1 TRP 88 1HE TRP 88 2.220 -3.738 -3.689
224 HE3 TRP 88 3HE TRP 88 -2.328 -2.128 -1.488
225 HZ2 TRP 88 2HZ TRP 88 2.583 -2.744 -1.051
226 HZ3 TRP 88 3HZ TRP 88 -1.172 -1.486 0.607
227 HH2 TRP 88 HH TRP 88 1.279 -1.794 0.831
228 H LYS 89 H LYS 89 -3.559 -1.743 -6.782
229 HA LYS 89 HA LYS 89 -6.179 -3.024 -6.793
230 HB2 LYS 89 1HB LYS 89 -6.331 -0.738 -6.370
231 HB3 LYS 89 2HB LYS 89 -5.084 -0.335 -7.552
232 HG2 LYS 89 1HG LYS 89 -6.551 -0.660 -9.381
233 HG3 LYS 89 2HG LYS 89 -7.723 -1.534 -8.393
234 HD2 LYS 89 1HD LYS 89 -8.391 0.450 -7.251
235 HD3 LYS 89 2HD LYS 89 -7.010 1.358 -7.869
236 HE2 LYS 89 1HE LYS 89 -9.335 1.698 -9.005
237 HE3 LYS 89 2HE LYS 89 -7.913 1.507 -10.031
238 HZ1 LYS 89 3HZ LYS 89 -8.442 -0.914 -10.085
239 HZ2 LYS 89 1HZ LYS 89 -9.582 0.072 -10.862
240 HZ3 LYS 89 2HZ LYS 89 -9.917 -0.558 -9.320
241 H ARG 90 H ARG 90 -3.763 -2.186 -9.301
242 HA ARG 90 HA ARG 90 -5.439 -2.734 -11.521
243 HB2 ARG 90 1HB ARG 90 -2.627 -2.279 -11.043
244 HB3 ARG 90 2HB ARG 90 -2.825 -3.621 -12.169
245 HG2 ARG 90 1HG ARG 90 -2.755 -1.590 -13.463
246 HG3 ARG 90 2HG ARG 90 -4.414 -2.184 -13.491
247 HD2 ARG 90 1HD ARG 90 -5.184 -0.496 -12.091
248 HD3 ARG 90 2HD ARG 90 -3.606 -0.252 -11.353
249 HE ARG 90 HE ARG 90 -4.164 0.581 -14.171
250 HH11 ARG 90 1HH2 ARG 90 -2.912 1.178 -10.979
251 HH12 ARG 90 2HH2 ARG 90 -2.224 2.702 -11.417
252 HH21 ARG 90 1HH1 ARG 90 -3.261 2.561 -14.710
253 HH22 ARG 90 2HH1 ARG 90 -2.418 3.480 -13.508
254 H THR 91 H THR 91 -3.380 -4.901 -9.568
255 HA THR 91 HA THR 91 -4.512 -7.216 -11.078
256 HB THR 91 HB THR 91 -2.633 -8.400 -10.476
257 HG1 THR 91 1HG THR 91 -1.820 -6.995 -8.283
258 HG21 THR 91 3HG2 THR 91 -1.376 -5.770 -9.782
259 HG22 THR 91 1HG2 THR 91 -2.051 -5.997 -11.396
260 HG23 THR 91 2HG2 THR 91 -0.768 -7.061 -10.819
261 H GLY 92 H GLY 92 -4.199 -5.921 -7.782
262 HA2 GLY 92 1HA GLY 92 -6.119 -6.095 -6.250
263 HA3 GLY 92 2HA GLY 92 -6.546 -7.615 -7.035
Start of MODEL 23
1 H LYS 61 H LYS 61 -11.870 -0.110 3.406
2 HA LYS 61 HA LYS 61 -10.301 -2.195 4.832
3 HB2 LYS 61 1HB LYS 61 -12.630 -2.199 3.114
4 HB3 LYS 61 2HB LYS 61 -11.397 -3.296 2.489
5 HG2 LYS 61 1HG LYS 61 -11.236 -4.394 4.677
6 HG3 LYS 61 2HG LYS 61 -12.423 -3.273 5.343
7 HD2 LYS 61 1HD LYS 61 -14.171 -4.373 4.400
8 HD3 LYS 61 2HD LYS 61 -13.306 -4.632 2.884
9 HE2 LYS 61 1HE LYS 61 -12.034 -6.471 3.905
10 HE3 LYS 61 2HE LYS 61 -12.861 -6.202 5.440
11 HZ1 LYS 61 3HZ LYS 61 -14.396 -6.705 2.974
12 HZ2 LYS 61 1HZ LYS 61 -14.863 -6.940 4.587
13 HZ3 LYS 61 2HZ LYS 61 -13.749 -8.000 3.864
14 H ILE 62 H ILE 62 -8.214 -2.154 4.358
15 HA ILE 62 HA ILE 62 -7.356 -1.723 1.522
16 HB ILE 62 HB ILE 62 -5.875 -1.366 4.140
17 HG12 ILE 62 1HG1 ILE 62 -6.513 0.609 1.929
18 HG13 ILE 62 2HG1 ILE 62 -7.503 0.415 3.376
19 HG21 ILE 62 1HG2 ILE 62 -4.917 -1.248 1.267
20 HG22 ILE 62 2HG2 ILE 62 -4.293 -2.265 2.566
21 HG23 ILE 62 3HG2 ILE 62 -4.031 -0.522 2.607
22 HD11 ILE 62 3HD1 ILE 62 -5.735 2.269 3.454
23 HD12 ILE 62 1HD1 ILE 62 -4.537 0.978 3.523
24 HD13 ILE 62 2HD1 ILE 62 -5.738 1.137 4.804
25 H THR 63 H THR 63 -5.723 -3.162 0.671
26 HA THR 63 HA THR 63 -5.417 -5.733 2.183
27 HB THR 63 HB THR 63 -5.246 -6.468 -0.464
28 HG1 THR 63 1HG THR 63 -6.487 -5.238 -1.620
29 HG21 THR 63 3HG2 THR 63 -7.582 -7.351 -0.091
30 HG22 THR 63 1HG2 THR 63 -7.615 -6.441 1.419
31 HG23 THR 63 2HG2 THR 63 -6.441 -7.737 1.197
32 H PHE 64 H PHE 64 -3.307 -5.942 2.687
33 HA PHE 64 HA PHE 64 -1.274 -4.745 0.892
34 HB2 PHE 64 1HB PHE 64 -0.978 -5.898 3.683
35 HB3 PHE 64 2HB PHE 64 0.265 -5.030 2.783
36 HD1 PHE 64 1HD PHE 64 -0.372 -2.647 1.947
37 HD2 PHE 64 2HD PHE 64 -2.418 -4.708 5.102
38 HE1 PHE 64 1HE PHE 64 -1.255 -0.485 2.780
39 HE2 PHE 64 2HE PHE 64 -3.299 -2.547 5.943
40 HZ PHE 64 HZ PHE 64 -2.717 -0.436 4.779
41 HA PRO 65 HA PRO 65 -0.283 -8.772 -0.889
42 HB2 PRO 65 1HB PRO 65 2.529 -7.857 -0.554
43 HB3 PRO 65 2HB PRO 65 1.712 -8.502 -1.986
44 HG2 PRO 65 1HG PRO 65 2.259 -5.898 -1.684
45 HG3 PRO 65 2HG PRO 65 0.845 -6.484 -2.569
46 HD2 PRO 65 1HD PRO 65 0.966 -5.134 0.059
47 HD3 PRO 65 2HD PRO 65 -0.391 -5.288 -1.078
48 H SER 66 H SER 66 0.747 -10.761 -0.223
49 HA SER 66 HA SER 66 0.876 -11.236 2.612
50 HB2 SER 66 1HB SER 66 0.789 -12.805 0.311
51 HB3 SER 66 2HB SER 66 2.370 -13.152 1.004
52 HG SER 66 HG SER 66 -0.107 -13.850 1.873
53 H ASP 67 H ASP 67 3.039 -9.570 0.718
54 HA ASP 67 HA ASP 67 5.313 -10.354 2.511
55 HB2 ASP 67 1HB ASP 67 5.387 -9.503 -0.393
56 HB3 ASP 67 2HB ASP 67 6.818 -9.687 0.622
57 H ILE 68 H ILE 68 3.166 -8.001 2.357
58 HA ILE 68 HA ILE 68 5.191 -5.810 2.620
59 HB ILE 68 HB ILE 68 2.294 -5.762 1.798
60 HG12 ILE 68 1HG1 ILE 68 3.932 -6.164 0.009
61 HG13 ILE 68 2HG1 ILE 68 3.215 -4.566 -0.163
62 HG21 ILE 68 1HG2 ILE 68 2.924 -3.177 1.665
63 HG22 ILE 68 2HG2 ILE 68 3.991 -3.622 2.997
64 HG23 ILE 68 3HG2 ILE 68 2.253 -3.889 3.132
65 HD11 ILE 68 3HD1 ILE 68 5.410 -3.953 -0.400
66 HD12 ILE 68 1HD1 ILE 68 6.003 -5.323 0.535
67 HD13 ILE 68 2HD1 ILE 68 5.345 -3.912 1.360
68 H ASP 69 H ASP 69 5.488 -4.975 4.545
69 HA ASP 69 HA ASP 69 3.728 -5.751 6.781
70 HB2 ASP 69 1HB ASP 69 6.155 -5.880 7.091
71 HB3 ASP 69 2HB ASP 69 6.303 -4.159 6.738
72 HA PRO 70 HA PRO 70 1.289 -1.984 6.083
73 HB2 PRO 70 1HB PRO 70 0.649 -2.366 8.964
74 HB3 PRO 70 2HB PRO 70 -0.438 -2.136 7.584
75 HG2 PRO 70 1HG PRO 70 -0.038 -4.526 8.776
76 HG3 PRO 70 2HG PRO 70 -0.470 -4.342 7.069
77 HD2 PRO 70 1HD PRO 70 2.094 -5.186 8.258
78 HD3 PRO 70 2HD PRO 70 1.485 -5.424 6.608
79 H GLN 71 H GLN 71 3.400 -2.394 8.928
80 HA GLN 71 HA GLN 71 3.489 0.469 9.503
81 HB2 GLN 71 1HB GLN 71 5.305 -1.794 10.396
82 HB3 GLN 71 2HB GLN 71 5.339 -0.153 11.040
83 HG2 GLN 71 1HG GLN 71 3.488 -0.485 12.312
84 HG3 GLN 71 2HG GLN 71 2.665 -1.383 11.038
85 HE21 GLN 71 1HE2 GLN 71 5.137 -1.736 13.608
86 HE22 GLN 71 2HE2 GLN 71 4.965 -3.418 13.761
87 H VAL 72 H VAL 72 5.376 -1.739 7.522
88 HA VAL 72 HA VAL 72 7.455 0.293 7.081
89 HB VAL 72 HB VAL 72 7.006 -2.313 5.599
90 HG11 VAL 72 1HG1 VAL 72 9.730 -1.613 5.779
91 HG12 VAL 72 2HG1 VAL 72 8.887 -0.127 5.350
92 HG13 VAL 72 3HG1 VAL 72 8.715 -1.561 4.338
93 HG21 VAL 72 3HG2 VAL 72 8.818 -1.741 7.965
94 HG22 VAL 72 1HG2 VAL 72 8.600 -3.293 7.156
95 HG23 VAL 72 2HG2 VAL 72 7.276 -2.587 8.083
96 H PHE 73 H PHE 73 4.437 -0.676 5.649
97 HA PHE 73 HA PHE 73 4.953 0.500 3.032
98 HB2 PHE 73 1HB PHE 73 3.307 -1.370 3.547
99 HB3 PHE 73 2HB PHE 73 2.285 -0.152 4.308
100 HD1 PHE 73 2HD PHE 73 4.228 -0.597 1.119
101 HD2 PHE 73 1HD PHE 73 0.624 0.794 2.996
102 HE1 PHE 73 2HE PHE 73 3.308 0.019 -1.100
103 HE2 PHE 73 1HE PHE 73 -0.296 1.407 0.776
104 HZ PHE 73 HZ PHE 73 1.047 1.023 -1.272
105 H TYR 74 H TYR 74 2.765 1.409 5.731
106 HA TYR 74 HA TYR 74 2.078 3.958 4.677
107 HB2 TYR 74 1HB TYR 74 2.220 2.941 7.526
108 HB3 TYR 74 2HB TYR 74 1.679 4.574 7.144
109 HD1 TYR 74 2HD TYR 74 -0.081 4.582 5.034
110 HD2 TYR 74 1HD TYR 74 0.552 1.370 7.819
111 HE1 TYR 74 2HE TYR 74 -2.350 3.706 4.543
112 HE2 TYR 74 1HE TYR 74 -1.714 0.495 7.327
113 HH TYR 74 HH TYR 74 -3.739 1.061 6.398
114 H GLU 75 H GLU 75 5.054 2.855 5.978
115 HA GLU 75 HA GLU 75 6.006 5.507 6.789
116 HB2 GLU 75 1HB GLU 75 6.908 2.762 6.993
117 HB3 GLU 75 2HB GLU 75 8.202 3.793 6.382
118 HG2 GLU 75 1HG GLU 75 7.995 5.290 8.264
119 HG3 GLU 75 2HG GLU 75 6.540 4.463 8.824
120 H LEU 76 H LEU 76 5.435 4.082 3.835
121 HA LEU 76 HA LEU 76 7.809 5.198 2.492
122 HB2 LEU 76 1HB LEU 76 5.376 3.742 1.426
123 HB3 LEU 76 2HB LEU 76 6.732 4.270 0.429
124 HG LEU 76 HG LEU 76 6.962 2.401 2.806
125 HD11 LEU 76 1HD1 LEU 76 7.565 1.483 0.052
126 HD12 LEU 76 2HD1 LEU 76 5.860 1.749 0.412
127 HD13 LEU 76 3HD1 LEU 76 6.798 0.619 1.385
128 HD21 LEU 76 3HD2 LEU 76 9.216 2.060 1.355
129 HD22 LEU 76 1HD2 LEU 76 9.095 3.242 2.658
130 HD23 LEU 76 2HD2 LEU 76 8.889 3.752 0.982
131 HA PRO 77 HA PRO 77 6.072 9.150 1.449
132 HB2 PRO 77 1HB PRO 77 6.737 8.705 -1.397
133 HB3 PRO 77 2HB PRO 77 7.295 9.976 -0.298
134 HG2 PRO 77 1HG PRO 77 8.826 7.884 -1.141
135 HG3 PRO 77 2HG PRO 77 9.099 8.795 0.349
136 HD2 PRO 77 1HD PRO 77 8.119 6.041 0.020
137 HD3 PRO 77 2HD PRO 77 8.788 6.847 1.455
138 H GLU 78 H GLU 78 4.250 10.109 0.295
139 HA GLU 78 HA GLU 78 2.061 8.315 -0.153
140 HB2 GLU 78 1HB GLU 78 2.550 11.241 -0.547
141 HB3 GLU 78 2HB GLU 78 1.145 10.516 -1.329
142 HG2 GLU 78 1HG GLU 78 0.485 11.326 0.870
143 HG3 GLU 78 2HG GLU 78 0.465 9.563 0.885
144 H ALA 79 H ALA 79 3.994 10.235 -2.501
145 HA ALA 79 HA ALA 79 2.725 9.378 -4.842
146 HB1 ALA 79 1HB ALA 79 5.725 9.498 -4.796
147 HB2 ALA 79 2HB ALA 79 4.806 10.966 -4.458
148 HB3 ALA 79 3HB ALA 79 4.603 10.133 -6.000
149 H VAL 80 H VAL 80 5.047 7.639 -2.830
150 HA VAL 80 HA VAL 80 5.280 5.398 -4.702
151 HB VAL 80 HB VAL 80 6.021 5.542 -1.762
152 HG11 VAL 80 1HG1 VAL 80 5.968 3.403 -3.614
153 HG12 VAL 80 2HG1 VAL 80 6.721 3.416 -2.019
154 HG13 VAL 80 3HG1 VAL 80 7.662 3.861 -3.443
155 HG21 VAL 80 3HG2 VAL 80 8.256 6.141 -2.529
156 HG22 VAL 80 1HG2 VAL 80 7.104 7.307 -3.179
157 HG23 VAL 80 2HG2 VAL 80 7.744 6.031 -4.213
158 H GLN 81 H GLN 81 3.424 6.221 -1.832
159 HA GLN 81 HA GLN 81 2.244 3.652 -1.346
160 HB2 GLN 81 1HB GLN 81 2.205 5.739 0.151
161 HB3 GLN 81 2HB GLN 81 0.887 6.310 -0.870
162 HG2 GLN 81 1HG GLN 81 -0.528 5.087 0.381
163 HG3 GLN 81 2HG GLN 81 0.253 3.634 -0.243
164 HE21 GLN 81 1HE2 GLN 81 1.607 6.127 1.974
165 HE22 GLN 81 2HE2 GLN 81 1.909 5.044 3.243
166 H LYS 82 H LYS 82 1.142 6.460 -3.257
167 HA LYS 82 HA LYS 82 -1.304 5.285 -4.169
168 HB2 LYS 82 1HB LYS 82 0.411 7.588 -4.996
169 HB3 LYS 82 2HB LYS 82 -0.817 7.019 -6.125
170 HG2 LYS 82 1HG LYS 82 -1.780 8.760 -4.717
171 HG3 LYS 82 2HG LYS 82 -2.520 7.213 -4.303
172 HD2 LYS 82 1HD LYS 82 -1.018 6.975 -2.384
173 HD3 LYS 82 2HD LYS 82 -0.201 8.478 -2.816
174 HE2 LYS 82 1HE LYS 82 -1.724 9.195 -1.186
175 HE3 LYS 82 2HE LYS 82 -2.598 9.518 -2.683
176 HZ1 LYS 82 3HZ LYS 82 -2.881 7.063 -1.036
177 HZ2 LYS 82 1HZ LYS 82 -3.755 7.430 -2.444
178 HZ3 LYS 82 2HZ LYS 82 -3.970 8.367 -1.043
179 H GLU 83 H GLU 83 1.894 5.562 -5.770
180 HA GLU 83 HA GLU 83 1.142 4.200 -8.147
181 HB2 GLU 83 1HB GLU 83 3.828 4.383 -6.755
182 HB3 GLU 83 2HB GLU 83 3.606 3.719 -8.373
183 HG2 GLU 83 1HG GLU 83 2.509 6.440 -7.735
184 HG3 GLU 83 2HG GLU 83 4.227 6.259 -8.090
185 H LEU 84 H LEU 84 2.448 2.924 -5.081
186 HA LEU 84 HA LEU 84 2.506 0.195 -6.055
187 HB2 LEU 84 1HB LEU 84 2.482 1.314 -3.231
188 HB3 LEU 84 2HB LEU 84 2.735 -0.387 -3.624
189 HG LEU 84 HG LEU 84 4.458 1.898 -4.629
190 HD11 LEU 84 1HD1 LEU 84 5.050 -0.229 -2.549
191 HD12 LEU 84 2HD1 LEU 84 4.696 1.463 -2.190
192 HD13 LEU 84 3HD1 LEU 84 6.152 1.038 -3.089
193 HD21 LEU 84 3HD2 LEU 84 4.845 0.296 -6.228
194 HD22 LEU 84 1HD2 LEU 84 4.294 -1.019 -5.190
195 HD23 LEU 84 2HD2 LEU 84 5.914 -0.352 -4.984
196 H LEU 85 H LEU 85 0.126 2.209 -4.393
197 HA LEU 85 HA LEU 85 -1.739 0.057 -3.884
198 HB2 LEU 85 1HB LEU 85 -1.998 3.069 -4.020
199 HB3 LEU 85 2HB LEU 85 -3.408 2.039 -3.771
200 HG LEU 85 HG LEU 85 -0.942 1.782 -2.045
201 HD11 LEU 85 1HD1 LEU 85 -3.372 3.521 -1.516
202 HD12 LEU 85 2HD1 LEU 85 -1.772 4.129 -1.939
203 HD13 LEU 85 3HD1 LEU 85 -2.013 3.267 -0.419
204 HD21 LEU 85 3HD2 LEU 85 -3.333 0.324 -2.284
205 HD22 LEU 85 1HD2 LEU 85 -3.557 1.322 -0.848
206 HD23 LEU 85 2HD2 LEU 85 -2.179 0.234 -0.959
207 H ALA 86 H ALA 86 -1.228 2.315 -6.570
208 HA ALA 86 HA ALA 86 -3.583 1.600 -8.035
209 HB1 ALA 86 1HB ALA 86 -2.801 3.117 -9.521
210 HB2 ALA 86 2HB ALA 86 -1.279 2.247 -9.715
211 HB3 ALA 86 3HB ALA 86 -1.478 3.390 -8.386
212 H GLU 87 H GLU 87 -0.394 0.152 -7.742
213 HA GLU 87 HA GLU 87 -0.790 -1.723 -9.957
214 HB2 GLU 87 1HB GLU 87 1.483 -1.035 -9.137
215 HB3 GLU 87 2HB GLU 87 1.157 -1.893 -7.632
216 HG2 GLU 87 1HG GLU 87 0.833 -3.991 -8.909
217 HG3 GLU 87 2HG GLU 87 1.209 -3.128 -10.401
218 H TRP 88 H TRP 88 -1.324 -1.707 -6.480
219 HA TRP 88 HA TRP 88 -1.944 -4.519 -6.230
220 HB2 TRP 88 1HB TRP 88 -2.837 -2.135 -4.580
221 HB3 TRP 88 2HB TRP 88 -3.080 -3.817 -4.121
222 HD1 TRP 88 HD TRP 88 0.136 -4.051 -5.633
223 HE1 TRP 88 1HE TRP 88 2.046 -3.763 -3.925
224 HE3 TRP 88 3HE TRP 88 -2.432 -1.942 -1.744
225 HZ2 TRP 88 2HZ TRP 88 2.448 -2.754 -1.297
226 HZ3 TRP 88 3HZ TRP 88 -1.250 -1.329 0.346
227 HH2 TRP 88 HH TRP 88 1.185 -1.730 0.573
228 H LYS 89 H LYS 89 -3.748 -1.649 -7.131
229 HA LYS 89 HA LYS 89 -6.360 -2.942 -7.045
230 HB2 LYS 89 1HB LYS 89 -6.443 -0.589 -6.830
231 HB3 LYS 89 2HB LYS 89 -5.334 -0.341 -8.179
232 HG2 LYS 89 1HG LYS 89 -6.975 -0.951 -9.785
233 HG3 LYS 89 2HG LYS 89 -8.028 -1.656 -8.557
234 HD2 LYS 89 1HD LYS 89 -8.231 0.659 -7.549
235 HD3 LYS 89 2HD LYS 89 -7.397 1.275 -8.976
236 HE2 LYS 89 1HE LYS 89 -9.995 -0.291 -8.981
237 HE3 LYS 89 2HE LYS 89 -9.831 1.442 -9.274
238 HZ1 LYS 89 3HZ LYS 89 -9.664 0.830 -11.403
239 HZ2 LYS 89 1HZ LYS 89 -9.288 -0.781 -11.029
240 HZ3 LYS 89 2HZ LYS 89 -8.067 0.401 -11.013
241 H ARG 90 H ARG 90 -3.918 -2.357 -9.572
242 HA ARG 90 HA ARG 90 -5.573 -3.153 -11.758
243 HB2 ARG 90 1HB ARG 90 -2.618 -2.994 -11.279
244 HB3 ARG 90 2HB ARG 90 -3.185 -3.892 -12.687
245 HG2 ARG 90 1HG ARG 90 -4.448 -1.931 -13.456
246 HG3 ARG 90 2HG ARG 90 -3.940 -1.030 -12.027
247 HD2 ARG 90 1HD ARG 90 -2.197 -0.333 -13.298
248 HD3 ARG 90 2HD ARG 90 -1.538 -1.947 -13.031
249 HE ARG 90 HE ARG 90 -1.886 -2.330 -15.321
250 HH11 ARG 90 1HH2 ARG 90 -4.120 -0.018 -14.076
251 HH12 ARG 90 2HH2 ARG 90 -4.897 0.251 -15.601
252 HH21 ARG 90 1HH1 ARG 90 -2.890 -1.995 -17.320
253 HH22 ARG 90 2HH1 ARG 90 -4.202 -0.869 -17.436
254 H THR 91 H THR 91 -3.426 -5.011 -9.604
255 HA THR 91 HA THR 91 -4.359 -7.541 -10.851
256 HB THR 91 HB THR 91 -2.617 -8.601 -9.677
257 HG1 THR 91 1HG THR 91 -3.150 -6.605 -7.847
258 HG21 THR 91 3HG2 THR 91 -1.520 -5.794 -9.919
259 HG22 THR 91 1HG2 THR 91 -1.855 -6.805 -11.326
260 HG23 THR 91 2HG2 THR 91 -0.658 -7.317 -10.136
261 H GLY 92 H GLY 92 -4.472 -5.810 -7.762
262 HA2 GLY 92 1HA GLY 92 -6.560 -5.824 -6.450
263 HA3 GLY 92 2HA GLY 92 -6.857 -7.461 -7.036
Start of MODEL 24
1 H LYS 61 H LYS 61 -11.853 0.720 2.498
2 HA LYS 61 HA LYS 61 -11.137 -2.053 2.684
3 HB2 LYS 61 1HB LYS 61 -12.690 -1.083 0.983
4 HB3 LYS 61 2HB LYS 61 -11.300 -0.335 0.195
5 HG2 LYS 61 1HG LYS 61 -10.770 -2.263 -0.837
6 HG3 LYS 61 2HG LYS 61 -10.776 -3.137 0.696
7 HD2 LYS 61 1HD LYS 61 -13.216 -3.392 0.564
8 HD3 LYS 61 2HD LYS 61 -13.241 -2.478 -0.946
9 HE2 LYS 61 1HE LYS 61 -11.967 -4.174 -2.084
10 HE3 LYS 61 2HE LYS 61 -11.648 -5.027 -0.574
11 HZ1 LYS 61 3HZ LYS 61 -13.440 -6.043 -1.880
12 HZ2 LYS 61 1HZ LYS 61 -14.343 -4.614 -1.750
13 HZ3 LYS 61 2HZ LYS 61 -13.976 -5.515 -0.356
14 H ILE 62 H ILE 62 -9.032 -2.791 2.876
15 HA ILE 62 HA ILE 62 -6.990 -1.644 1.103
16 HB ILE 62 HB ILE 62 -6.493 -1.703 4.094
17 HG12 ILE 62 1HG1 ILE 62 -6.928 0.661 2.232
18 HG13 ILE 62 2HG1 ILE 62 -8.020 0.144 3.517
19 HG21 ILE 62 1HG2 ILE 62 -4.333 -1.599 3.501
20 HG22 ILE 62 2HG2 ILE 62 -4.642 -0.120 2.594
21 HG23 ILE 62 3HG2 ILE 62 -4.785 -1.688 1.803
22 HD11 ILE 62 3HD1 ILE 62 -6.860 1.696 4.733
23 HD12 ILE 62 1HD1 ILE 62 -5.423 1.569 3.717
24 HD13 ILE 62 2HD1 ILE 62 -5.743 0.346 4.945
25 H THR 63 H THR 63 -5.718 -3.257 0.375
26 HA THR 63 HA THR 63 -5.474 -5.755 2.022
27 HB THR 63 HB THR 63 -5.544 -7.054 -0.063
28 HG1 THR 63 1HG THR 63 -6.489 -5.444 -1.816
29 HG21 THR 63 3HG2 THR 63 -7.661 -6.270 1.228
30 HG22 THR 63 1HG2 THR 63 -7.868 -6.957 -0.383
31 HG23 THR 63 2HG2 THR 63 -7.920 -5.209 -0.156
32 H PHE 64 H PHE 64 -3.379 -6.037 2.578
33 HA PHE 64 HA PHE 64 -1.276 -4.771 0.921
34 HB2 PHE 64 1HB PHE 64 -1.145 -6.103 3.642
35 HB3 PHE 64 2HB PHE 64 0.208 -5.315 2.837
36 HD1 PHE 64 1HD PHE 64 -0.269 -2.827 2.038
37 HD2 PHE 64 2HD PHE 64 -2.426 -4.871 5.137
38 HE1 PHE 64 1HE PHE 64 -0.961 -0.648 2.996
39 HE2 PHE 64 2HE PHE 64 -3.120 -2.692 6.096
40 HZ PHE 64 HZ PHE 64 -2.384 -0.579 5.026
41 HA PRO 65 HA PRO 65 -0.306 -8.713 -1.101
42 HB2 PRO 65 1HB PRO 65 2.476 -7.696 -0.777
43 HB3 PRO 65 2HB PRO 65 1.668 -8.345 -2.215
44 HG2 PRO 65 1HG PRO 65 2.096 -5.727 -1.872
45 HG3 PRO 65 2HG PRO 65 0.681 -6.355 -2.725
46 HD2 PRO 65 1HD PRO 65 0.823 -5.063 -0.070
47 HD3 PRO 65 2HD PRO 65 -0.560 -5.249 -1.166
48 H SER 66 H SER 66 0.687 -10.709 -0.486
49 HA SER 66 HA SER 66 0.915 -11.259 2.307
50 HB2 SER 66 1HB SER 66 1.214 -13.433 1.656
51 HB3 SER 66 2HB SER 66 0.634 -12.801 0.119
52 HG SER 66 HG SER 66 2.488 -13.490 -0.596
53 H ASP 67 H ASP 67 3.050 -9.496 0.446
54 HA ASP 67 HA ASP 67 5.330 -10.294 2.222
55 HB2 ASP 67 1HB ASP 67 5.219 -9.824 -0.719
56 HB3 ASP 67 2HB ASP 67 6.659 -9.272 0.139
57 H ILE 68 H ILE 68 3.173 -7.938 2.058
58 HA ILE 68 HA ILE 68 5.195 -5.750 2.369
59 HB ILE 68 HB ILE 68 2.321 -5.692 1.485
60 HG12 ILE 68 1HG1 ILE 68 3.996 -6.077 -0.274
61 HG13 ILE 68 2HG1 ILE 68 3.283 -4.477 -0.447
62 HG21 ILE 68 1HG2 ILE 68 3.968 -3.585 2.784
63 HG22 ILE 68 2HG2 ILE 68 2.218 -3.810 2.787
64 HG23 ILE 68 3HG2 ILE 68 3.012 -3.097 1.383
65 HD11 ILE 68 3HD1 ILE 68 6.057 -5.239 0.298
66 HD12 ILE 68 1HD1 ILE 68 5.381 -3.838 1.127
67 HD13 ILE 68 2HD1 ILE 68 5.479 -3.857 -0.631
68 H ASP 69 H ASP 69 5.442 -4.937 4.307
69 HA ASP 69 HA ASP 69 3.640 -5.736 6.503
70 HB2 ASP 69 1HB ASP 69 6.073 -5.805 6.867
71 HB3 ASP 69 2HB ASP 69 6.181 -4.082 6.527
72 HA PRO 70 HA PRO 70 1.287 -1.955 6.168
73 HB2 PRO 70 1HB PRO 70 0.287 -1.828 8.733
74 HB3 PRO 70 2HB PRO 70 -0.367 -2.870 7.457
75 HG2 PRO 70 1HG PRO 70 1.443 -3.547 9.712
76 HG3 PRO 70 2HG PRO 70 0.124 -4.489 8.997
77 HD2 PRO 70 1HD PRO 70 2.752 -4.999 8.472
78 HD3 PRO 70 2HD PRO 70 1.458 -5.320 7.299
79 H GLN 71 H GLN 71 3.401 -2.258 9.038
80 HA GLN 71 HA GLN 71 3.435 0.635 9.483
81 HB2 GLN 71 1HB GLN 71 5.245 -1.563 10.544
82 HB3 GLN 71 2HB GLN 71 5.246 0.110 11.104
83 HG2 GLN 71 1HG GLN 71 2.551 -0.917 11.122
84 HG3 GLN 71 2HG GLN 71 3.607 -2.002 12.028
85 HE21 GLN 71 1HE2 GLN 71 2.877 1.520 11.717
86 HE22 GLN 71 2HE2 GLN 71 3.168 1.871 13.351
87 H VAL 72 H VAL 72 5.351 -1.623 7.602
88 HA VAL 72 HA VAL 72 7.458 0.373 7.166
89 HB VAL 72 HB VAL 72 6.971 -2.184 5.618
90 HG11 VAL 72 1HG1 VAL 72 8.676 -1.302 4.414
91 HG12 VAL 72 2HG1 VAL 72 9.683 -1.745 5.793
92 HG13 VAL 72 3HG1 VAL 72 9.052 -0.105 5.652
93 HG21 VAL 72 3HG2 VAL 72 8.614 -1.731 8.129
94 HG22 VAL 72 1HG2 VAL 72 8.559 -3.230 7.202
95 HG23 VAL 72 2HG2 VAL 72 7.115 -2.655 8.039
96 H PHE 73 H PHE 73 4.433 -0.531 5.732
97 HA PHE 73 HA PHE 73 4.976 0.625 3.114
98 HB2 PHE 73 1HB PHE 73 3.327 -1.231 3.607
99 HB3 PHE 73 2HB PHE 73 2.307 -0.026 4.388
100 HD1 PHE 73 2HD PHE 73 4.224 -0.458 1.188
101 HD2 PHE 73 1HD PHE 73 0.647 0.959 3.101
102 HE1 PHE 73 2HE PHE 73 3.294 0.179 -1.019
103 HE2 PHE 73 1HE PHE 73 -0.283 1.592 0.891
104 HZ PHE 73 HZ PHE 73 1.045 1.204 -1.168
105 H TYR 74 H TYR 74 2.764 1.563 5.779
106 HA TYR 74 HA TYR 74 2.083 4.086 4.668
107 HB2 TYR 74 1HB TYR 74 2.152 3.115 7.535
108 HB3 TYR 74 2HB TYR 74 1.572 4.723 7.098
109 HD1 TYR 74 2HD TYR 74 -0.103 4.681 4.961
110 HD2 TYR 74 1HD TYR 74 0.541 1.449 7.718
111 HE1 TYR 74 2HE TYR 74 -2.305 3.719 4.350
112 HE2 TYR 74 1HE TYR 74 -1.661 0.489 7.106
113 HH TYR 74 HH TYR 74 -3.895 1.485 6.140
114 H GLU 75 H GLU 75 5.020 3.036 6.108
115 HA GLU 75 HA GLU 75 5.941 5.718 6.861
116 HB2 GLU 75 1HB GLU 75 7.187 2.978 6.726
117 HB3 GLU 75 2HB GLU 75 8.195 4.409 6.939
118 HG2 GLU 75 1HG GLU 75 5.782 3.966 8.689
119 HG3 GLU 75 2HG GLU 75 7.319 3.187 9.066
120 H LEU 76 H LEU 76 5.432 4.222 3.934
121 HA LEU 76 HA LEU 76 7.842 5.287 2.616
122 HB2 LEU 76 1HB LEU 76 5.415 3.849 1.513
123 HB3 LEU 76 2HB LEU 76 6.808 4.332 0.548
124 HG LEU 76 HG LEU 76 6.916 2.498 2.955
125 HD11 LEU 76 1HD1 LEU 76 5.791 1.480 0.993
126 HD12 LEU 76 2HD1 LEU 76 7.350 0.722 1.317
127 HD13 LEU 76 3HD1 LEU 76 7.190 1.883 -0.001
128 HD21 LEU 76 3HD2 LEU 76 9.057 3.356 2.884
129 HD22 LEU 76 1HD2 LEU 76 8.951 3.758 1.170
130 HD23 LEU 76 2HD2 LEU 76 9.232 2.090 1.669
131 HA PRO 77 HA PRO 77 6.191 9.234 1.418
132 HB2 PRO 77 1HB PRO 77 6.916 8.674 -1.400
133 HB3 PRO 77 2HB PRO 77 7.445 9.993 -0.343
134 HG2 PRO 77 1HG PRO 77 9.018 7.902 -1.044
135 HG3 PRO 77 2HG PRO 77 9.204 8.820 0.456
136 HD2 PRO 77 1HD PRO 77 8.193 6.071 0.069
137 HD3 PRO 77 2HD PRO 77 8.865 6.845 1.520
138 H GLU 78 H GLU 78 4.420 10.202 0.177
139 HA GLU 78 HA GLU 78 2.193 8.449 -0.218
140 HB2 GLU 78 1HB GLU 78 2.548 11.241 -1.345
141 HB3 GLU 78 2HB GLU 78 1.024 10.408 -1.038
142 HG2 GLU 78 1HG GLU 78 3.022 10.940 1.166
143 HG3 GLU 78 2HG GLU 78 1.778 12.111 0.730
144 H ALA 79 H ALA 79 4.251 10.151 -2.620
145 HA ALA 79 HA ALA 79 2.970 9.226 -4.933
146 HB1 ALA 79 1HB ALA 79 5.124 9.541 -6.085
147 HB2 ALA 79 2HB ALA 79 5.964 9.548 -4.534
148 HB3 ALA 79 3HB ALA 79 4.849 10.853 -4.939
149 H VAL 80 H VAL 80 5.198 7.503 -2.803
150 HA VAL 80 HA VAL 80 5.408 5.190 -4.585
151 HB VAL 80 HB VAL 80 6.109 5.502 -1.648
152 HG11 VAL 80 1HG1 VAL 80 7.697 3.520 -2.744
153 HG12 VAL 80 2HG1 VAL 80 6.136 3.233 -3.513
154 HG13 VAL 80 3HG1 VAL 80 6.264 3.242 -1.754
155 HG21 VAL 80 3HG2 VAL 80 7.473 6.174 -4.195
156 HG22 VAL 80 1HG2 VAL 80 8.463 5.332 -3.002
157 HG23 VAL 80 2HG2 VAL 80 7.692 6.861 -2.586
158 H GLN 81 H GLN 81 3.502 6.174 -1.804
159 HA GLN 81 HA GLN 81 2.242 3.650 -1.267
160 HB2 GLN 81 1HB GLN 81 2.253 5.732 0.201
161 HB3 GLN 81 2HB GLN 81 1.005 6.380 -0.861
162 HG2 GLN 81 1HG GLN 81 -0.538 5.237 0.309
163 HG3 GLN 81 2HG GLN 81 0.215 3.734 -0.223
164 HE21 GLN 81 1HE2 GLN 81 1.690 6.185 1.944
165 HE22 GLN 81 2HE2 GLN 81 1.805 5.154 3.284
166 H LYS 82 H LYS 82 1.146 6.471 -3.185
167 HA LYS 82 HA LYS 82 -1.290 5.303 -4.095
168 HB2 LYS 82 1HB LYS 82 0.467 7.551 -5.002
169 HB3 LYS 82 2HB LYS 82 -0.803 6.987 -6.086
170 HG2 LYS 82 1HG LYS 82 -1.736 8.762 -4.749
171 HG3 LYS 82 2HG LYS 82 -2.433 7.251 -4.166
172 HD2 LYS 82 1HD LYS 82 -1.026 7.217 -2.252
173 HD3 LYS 82 2HD LYS 82 0.050 8.442 -2.925
174 HE2 LYS 82 1HE LYS 82 -1.300 10.161 -2.286
175 HE3 LYS 82 2HE LYS 82 -2.775 9.275 -2.678
176 HZ1 LYS 82 3HZ LYS 82 -2.917 8.417 -0.617
177 HZ2 LYS 82 1HZ LYS 82 -1.991 9.774 -0.194
178 HZ3 LYS 82 2HZ LYS 82 -1.235 8.271 -0.429
179 H GLU 83 H GLU 83 1.893 5.512 -5.739
180 HA GLU 83 HA GLU 83 1.094 4.108 -8.073
181 HB2 GLU 83 1HB GLU 83 3.820 4.192 -6.742
182 HB3 GLU 83 2HB GLU 83 3.515 3.649 -8.393
183 HG2 GLU 83 1HG GLU 83 2.310 6.254 -7.839
184 HG3 GLU 83 2HG GLU 83 4.061 6.263 -7.625
185 H LEU 84 H LEU 84 2.346 2.857 -4.976
186 HA LEU 84 HA LEU 84 2.382 0.124 -5.962
187 HB2 LEU 84 1HB LEU 84 2.462 1.243 -3.142
188 HB3 LEU 84 2HB LEU 84 2.667 -0.465 -3.536
189 HG LEU 84 HG LEU 84 4.397 1.777 -4.628
190 HD11 LEU 84 1HD1 LEU 84 4.970 -0.297 -2.488
191 HD12 LEU 84 2HD1 LEU 84 4.771 1.436 -2.218
192 HD13 LEU 84 3HD1 LEU 84 6.145 0.840 -3.149
193 HD21 LEU 84 3HD2 LEU 84 4.191 -1.162 -5.098
194 HD22 LEU 84 1HD2 LEU 84 5.813 -0.476 -5.012
195 HD23 LEU 84 2HD2 LEU 84 4.665 0.122 -6.209
196 H LEU 85 H LEU 85 0.037 2.147 -4.243
197 HA LEU 85 HA LEU 85 -1.799 -0.015 -3.687
198 HB2 LEU 85 1HB LEU 85 -2.125 2.990 -3.899
199 HB3 LEU 85 2HB LEU 85 -3.500 1.932 -3.589
200 HG LEU 85 HG LEU 85 -0.996 1.802 -1.909
201 HD11 LEU 85 1HD1 LEU 85 -3.431 3.568 -1.549
202 HD12 LEU 85 2HD1 LEU 85 -1.757 4.092 -1.730
203 HD13 LEU 85 3HD1 LEU 85 -2.260 3.237 -0.272
204 HD21 LEU 85 3HD2 LEU 85 -3.556 1.291 -0.630
205 HD22 LEU 85 1HD2 LEU 85 -2.150 0.237 -0.757
206 HD23 LEU 85 2HD2 LEU 85 -3.349 0.265 -2.048
207 H ALA 86 H ALA 86 -1.315 2.187 -6.417
208 HA ALA 86 HA ALA 86 -3.663 1.404 -7.875
209 HB1 ALA 86 1HB ALA 86 -1.771 3.307 -8.260
210 HB2 ALA 86 2HB ALA 86 -2.849 2.753 -9.541
211 HB3 ALA 86 3HB ALA 86 -1.217 2.095 -9.416
212 H GLU 87 H GLU 87 -0.449 0.021 -7.524
213 HA GLU 87 HA GLU 87 -0.773 -1.917 -9.691
214 HB2 GLU 87 1HB GLU 87 1.461 -1.164 -8.769
215 HB3 GLU 87 2HB GLU 87 1.094 -2.073 -7.303
216 HG2 GLU 87 1HG GLU 87 2.338 -3.605 -8.583
217 HG3 GLU 87 2HG GLU 87 0.669 -4.068 -8.916
218 H TRP 88 H TRP 88 -1.255 -1.926 -6.179
219 HA TRP 88 HA TRP 88 -1.925 -4.716 -5.947
220 HB2 TRP 88 1HB TRP 88 -2.933 -2.379 -4.295
221 HB3 TRP 88 2HB TRP 88 -2.991 -4.077 -3.833
222 HD1 TRP 88 HD TRP 88 0.166 -3.998 -5.433
223 HE1 TRP 88 1HE TRP 88 2.102 -3.508 -3.787
224 HE3 TRP 88 3HE TRP 88 -2.466 -2.137 -1.470
225 HZ2 TRP 88 2HZ TRP 88 2.481 -2.467 -1.166
226 HZ3 TRP 88 3HZ TRP 88 -1.293 -1.403 0.585
227 HH2 TRP 88 HH TRP 88 1.176 -1.568 0.743
228 H LYS 89 H LYS 89 -3.766 -1.803 -6.703
229 HA LYS 89 HA LYS 89 -6.363 -3.102 -6.706
230 HB2 LYS 89 1HB LYS 89 -5.889 -0.617 -6.388
231 HB3 LYS 89 2HB LYS 89 -5.607 -0.546 -8.128
232 HG2 LYS 89 1HG LYS 89 -7.918 -1.733 -8.317
233 HG3 LYS 89 2HG LYS 89 -8.158 -1.179 -6.660
234 HD2 LYS 89 1HD LYS 89 -7.508 0.571 -9.049
235 HD3 LYS 89 2HD LYS 89 -9.064 0.475 -8.224
236 HE2 LYS 89 1HE LYS 89 -6.449 1.490 -7.082
237 HE3 LYS 89 2HE LYS 89 -7.917 2.421 -7.376
238 HZ1 LYS 89 3HZ LYS 89 -7.483 0.290 -5.366
239 HZ2 LYS 89 1HZ LYS 89 -9.031 0.841 -5.789
240 HZ3 LYS 89 2HZ LYS 89 -7.909 1.913 -5.097
241 H ARG 90 H ARG 90 -3.964 -2.334 -9.243
242 HA ARG 90 HA ARG 90 -5.625 -2.943 -11.448
243 HB2 ARG 90 1HB ARG 90 -3.035 -2.116 -11.153
244 HB3 ARG 90 2HB ARG 90 -2.794 -3.784 -11.672
245 HG2 ARG 90 1HG ARG 90 -4.634 -3.152 -13.462
246 HG3 ARG 90 2HG ARG 90 -4.080 -1.510 -13.137
247 HD2 ARG 90 1HD ARG 90 -2.265 -3.818 -13.894
248 HD3 ARG 90 2HD ARG 90 -2.842 -2.587 -15.017
249 HE ARG 90 HE ARG 90 -1.473 -1.515 -12.655
250 HH11 ARG 90 1HH2 ARG 90 -1.275 -2.689 -15.892
251 HH12 ARG 90 2HH2 ARG 90 0.196 -1.844 -16.249
252 HH21 ARG 90 1HH1 ARG 90 0.444 -0.409 -13.101
253 HH22 ARG 90 2HH1 ARG 90 1.170 -0.553 -14.666
254 H THR 91 H THR 91 -3.550 -5.073 -9.468
255 HA THR 91 HA THR 91 -4.735 -7.412 -10.905
256 HB THR 91 HB THR 91 -2.798 -8.557 -10.465
257 HG1 THR 91 1HG THR 91 -2.692 -7.055 -8.065
258 HG21 THR 91 3HG2 THR 91 -2.147 -6.369 -11.511
259 HG22 THR 91 1HG2 THR 91 -0.860 -7.109 -10.561
260 HG23 THR 91 2HG2 THR 91 -1.783 -5.762 -9.896
261 H GLY 92 H GLY 92 -4.241 -6.046 -7.667
262 HA2 GLY 92 1HA GLY 92 -6.110 -6.263 -6.039
263 HA3 GLY 92 2HA GLY 92 -6.410 -7.869 -6.700
Start of MODEL 25
1 H LYS 61 H LYS 61 -11.812 0.502 3.392
2 HA LYS 61 HA LYS 61 -11.131 -2.307 3.016
3 HB2 LYS 61 1HB LYS 61 -11.656 -0.082 1.025
4 HB3 LYS 61 2HB LYS 61 -11.448 -1.780 0.596
5 HG2 LYS 61 1HG LYS 61 -13.351 -2.299 2.208
6 HG3 LYS 61 2HG LYS 61 -13.644 -0.561 2.286
7 HD2 LYS 61 1HD LYS 61 -13.980 -0.483 -0.142
8 HD3 LYS 61 2HD LYS 61 -13.627 -2.207 -0.261
9 HE2 LYS 61 1HE LYS 61 -15.888 -2.432 -0.088
10 HE3 LYS 61 2HE LYS 61 -15.584 -2.224 1.636
11 HZ1 LYS 61 3HZ LYS 61 -16.362 -0.115 1.618
12 HZ2 LYS 61 1HZ LYS 61 -17.265 -0.700 0.308
13 HZ3 LYS 61 2HZ LYS 61 -15.848 0.194 0.028
14 H ILE 62 H ILE 62 -9.043 -2.929 3.088
15 HA ILE 62 HA ILE 62 -7.097 -1.660 1.316
16 HB ILE 62 HB ILE 62 -6.425 -1.786 4.274
17 HG12 ILE 62 1HG1 ILE 62 -7.050 0.621 2.524
18 HG13 ILE 62 2HG1 ILE 62 -8.021 0.045 3.875
19 HG21 ILE 62 1HG2 ILE 62 -4.964 -0.652 1.866
20 HG22 ILE 62 2HG2 ILE 62 -4.539 -2.131 2.726
21 HG23 ILE 62 3HG2 ILE 62 -4.395 -0.572 3.532
22 HD11 ILE 62 3HD1 ILE 62 -6.728 1.808 4.788
23 HD12 ILE 62 1HD1 ILE 62 -5.262 1.258 3.972
24 HD13 ILE 62 2HD1 ILE 62 -5.925 0.329 5.318
25 H THR 63 H THR 63 -5.795 -3.224 0.514
26 HA THR 63 HA THR 63 -5.513 -5.770 2.072
27 HB THR 63 HB THR 63 -5.545 -5.730 -0.934
28 HG1 THR 63 1HG THR 63 -7.507 -4.792 0.308
29 HG21 THR 63 3HG2 THR 63 -6.532 -7.826 1.004
30 HG22 THR 63 1HG2 THR 63 -4.840 -7.719 0.518
31 HG23 THR 63 2HG2 THR 63 -6.087 -8.034 -0.690
32 H PHE 64 H PHE 64 -3.408 -5.967 2.629
33 HA PHE 64 HA PHE 64 -1.349 -4.703 0.917
34 HB2 PHE 64 1HB PHE 64 -1.099 -6.014 3.640
35 HB3 PHE 64 2HB PHE 64 0.174 -5.130 2.804
36 HD1 PHE 64 1HD PHE 64 -0.394 -2.670 2.105
37 HD2 PHE 64 2HD PHE 64 -2.521 -4.883 5.108
38 HE1 PHE 64 1HE PHE 64 -1.213 -0.546 3.088
39 HE2 PHE 64 2HE PHE 64 -3.345 -2.759 6.089
40 HZ PHE 64 HZ PHE 64 -2.690 -0.592 5.081
41 HA PRO 65 HA PRO 65 -0.381 -8.642 -1.093
42 HB2 PRO 65 1HB PRO 65 2.411 -7.658 -0.769
43 HB3 PRO 65 2HB PRO 65 1.592 -8.288 -2.208
44 HG2 PRO 65 1HG PRO 65 2.054 -5.675 -1.839
45 HG3 PRO 65 2HG PRO 65 0.645 -6.283 -2.715
46 HD2 PRO 65 1HD PRO 65 0.766 -4.996 -0.061
47 HD3 PRO 65 2HD PRO 65 -0.613 -5.187 -1.163
48 H SER 66 H SER 66 0.644 -10.645 -0.495
49 HA SER 66 HA SER 66 0.850 -11.204 2.304
50 HB2 SER 66 1HB SER 66 0.521 -12.763 0.167
51 HB3 SER 66 2HB SER 66 2.268 -12.933 0.325
52 HG SER 66 HG SER 66 0.333 -13.365 2.365
53 H ASP 67 H ASP 67 2.995 -9.445 0.454
54 HA ASP 67 HA ASP 67 5.267 -10.263 2.229
55 HB2 ASP 67 1HB ASP 67 6.740 -10.279 0.478
56 HB3 ASP 67 2HB ASP 67 5.280 -10.672 -0.429
57 H ILE 68 H ILE 68 3.121 -7.900 2.063
58 HA ILE 68 HA ILE 68 5.152 -5.724 2.394
59 HB ILE 68 HB ILE 68 2.279 -5.628 1.499
60 HG12 ILE 68 1HG1 ILE 68 3.935 -6.046 -0.265
61 HG13 ILE 68 2HG1 ILE 68 3.270 -4.424 -0.431
62 HG21 ILE 68 1HG2 ILE 68 2.782 -3.087 1.419
63 HG22 ILE 68 2HG2 ILE 68 4.057 -3.453 2.581
64 HG23 ILE 68 3HG2 ILE 68 2.375 -3.803 2.978
65 HD11 ILE 68 3HD1 ILE 68 6.020 -5.271 0.324
66 HD12 ILE 68 1HD1 ILE 68 5.383 -3.842 1.134
67 HD13 ILE 68 2HD1 ILE 68 5.490 -3.883 -0.623
68 H ASP 69 H ASP 69 5.388 -4.899 4.329
69 HA ASP 69 HA ASP 69 3.555 -5.686 6.511
70 HB2 ASP 69 1HB ASP 69 5.971 -5.843 6.912
71 HB3 ASP 69 2HB ASP 69 6.159 -4.130 6.552
72 HA PRO 70 HA PRO 70 1.320 -1.832 6.201
73 HB2 PRO 70 1HB PRO 70 0.316 -1.689 8.760
74 HB3 PRO 70 2HB PRO 70 -0.359 -2.715 7.482
75 HG2 PRO 70 1HG PRO 70 1.439 -3.435 9.736
76 HG3 PRO 70 2HG PRO 70 0.088 -4.341 9.032
77 HD2 PRO 70 1HD PRO 70 2.690 -4.938 8.486
78 HD3 PRO 70 2HD PRO 70 1.382 -5.204 7.314
79 H GLN 71 H GLN 71 3.447 -2.240 9.041
80 HA GLN 71 HA GLN 71 3.573 0.635 9.555
81 HB2 GLN 71 1HB GLN 71 3.992 -1.253 11.262
82 HB3 GLN 71 2HB GLN 71 5.573 -1.429 10.499
83 HG2 GLN 71 1HG GLN 71 6.097 0.914 10.972
84 HG3 GLN 71 2HG GLN 71 4.491 1.153 11.662
85 HE21 GLN 71 1HE2 GLN 71 5.158 1.556 13.846
86 HE22 GLN 71 2HE2 GLN 71 5.939 0.388 14.799
87 H VAL 72 H VAL 72 5.430 -1.653 7.630
88 HA VAL 72 HA VAL 72 7.533 0.345 7.154
89 HB VAL 72 HB VAL 72 7.073 -2.266 5.685
90 HG11 VAL 72 1HG1 VAL 72 9.707 -1.945 5.649
91 HG12 VAL 72 2HG1 VAL 72 9.280 -0.247 5.847
92 HG13 VAL 72 3HG1 VAL 72 8.686 -1.150 4.454
93 HG21 VAL 72 3HG2 VAL 72 7.233 -2.716 8.086
94 HG22 VAL 72 1HG2 VAL 72 8.665 -1.691 8.205
95 HG23 VAL 72 2HG2 VAL 72 8.735 -3.202 7.299
96 H PHE 73 H PHE 73 4.501 -0.614 5.748
97 HA PHE 73 HA PHE 73 5.020 0.470 3.096
98 HB2 PHE 73 1HB PHE 73 3.353 -1.330 3.571
99 HB3 PHE 73 2HB PHE 73 2.396 -0.164 4.482
100 HD1 PHE 73 1HD PHE 73 4.021 -0.565 1.125
101 HD2 PHE 73 2HD PHE 73 0.719 1.022 3.374
102 HE1 PHE 73 1HE PHE 73 2.945 0.188 -0.976
103 HE2 PHE 73 2HE PHE 73 -0.349 1.779 1.268
104 HZ PHE 73 HZ PHE 73 0.771 1.359 -0.905
105 H TYR 74 H TYR 74 2.873 1.504 5.763
106 HA TYR 74 HA TYR 74 2.245 4.034 4.621
107 HB2 TYR 74 1HB TYR 74 2.273 3.085 7.494
108 HB3 TYR 74 2HB TYR 74 1.741 4.705 7.044
109 HD1 TYR 74 2HD TYR 74 0.076 4.656 4.865
110 HD2 TYR 74 1HD TYR 74 0.594 1.503 7.738
111 HE1 TYR 74 2HE TYR 74 -2.157 3.754 4.282
112 HE2 TYR 74 1HE TYR 74 -1.639 0.602 7.153
113 HH TYR 74 HH TYR 74 -3.440 0.837 5.890
114 H GLU 75 H GLU 75 5.164 2.921 6.037
115 HA GLU 75 HA GLU 75 6.149 5.543 6.869
116 HB2 GLU 75 1HB GLU 75 7.143 2.768 6.798
117 HB3 GLU 75 2HB GLU 75 8.381 3.987 6.492
118 HG2 GLU 75 1HG GLU 75 7.684 5.186 8.549
119 HG3 GLU 75 2HG GLU 75 6.500 3.917 8.870
120 H LEU 76 H LEU 76 5.533 4.212 3.877
121 HA LEU 76 HA LEU 76 7.895 5.374 2.548
122 HB2 LEU 76 1HB LEU 76 5.476 3.894 1.492
123 HB3 LEU 76 2HB LEU 76 6.776 4.500 0.465
124 HG LEU 76 HG LEU 76 7.194 2.593 2.784
125 HD11 LEU 76 1HD1 LEU 76 7.258 0.809 1.232
126 HD12 LEU 76 2HD1 LEU 76 7.352 1.902 -0.149
127 HD13 LEU 76 3HD1 LEU 76 5.844 1.746 0.751
128 HD21 LEU 76 3HD2 LEU 76 9.277 3.553 2.454
129 HD22 LEU 76 1HD2 LEU 76 8.955 3.926 0.762
130 HD23 LEU 76 2HD2 LEU 76 9.350 2.276 1.239
131 HA PRO 77 HA PRO 77 6.079 9.316 1.557
132 HB2 PRO 77 1HB PRO 77 6.804 8.895 -1.289
133 HB3 PRO 77 2HB PRO 77 7.272 10.201 -0.188
134 HG2 PRO 77 1HG PRO 77 8.957 8.243 -0.960
135 HG3 PRO 77 2HG PRO 77 9.075 9.075 0.597
136 HD2 PRO 77 1HD PRO 77 8.171 6.309 0.020
137 HD3 PRO 77 2HD PRO 77 8.845 7.004 1.510
138 H GLU 78 H GLU 78 4.261 10.263 0.358
139 HA GLU 78 HA GLU 78 2.088 8.451 -0.077
140 HB2 GLU 78 1HB GLU 78 2.323 11.272 -1.150
141 HB3 GLU 78 2HB GLU 78 0.845 10.383 -0.783
142 HG2 GLU 78 1HG GLU 78 1.498 10.303 1.607
143 HG3 GLU 78 2HG GLU 78 2.945 11.239 1.230
144 H ALA 79 H ALA 79 4.097 10.255 -2.459
145 HA ALA 79 HA ALA 79 2.802 9.359 -4.781
146 HB1 ALA 79 1HB ALA 79 5.711 9.311 -5.081
147 HB2 ALA 79 2HB ALA 79 5.149 10.754 -4.236
148 HB3 ALA 79 3HB ALA 79 4.525 10.373 -5.841
149 H VAL 80 H VAL 80 5.085 7.627 -2.716
150 HA VAL 80 HA VAL 80 5.329 5.363 -4.553
151 HB VAL 80 HB VAL 80 5.971 5.510 -1.593
152 HG11 VAL 80 1HG1 VAL 80 6.631 3.368 -1.812
153 HG12 VAL 80 2HG1 VAL 80 7.642 3.789 -3.194
154 HG13 VAL 80 3HG1 VAL 80 5.949 3.362 -3.438
155 HG21 VAL 80 3HG2 VAL 80 7.581 6.962 -2.234
156 HG22 VAL 80 1HG2 VAL 80 7.251 6.684 -3.944
157 HG23 VAL 80 2HG2 VAL 80 8.334 5.603 -3.067
158 H GLN 81 H GLN 81 3.396 6.236 -1.749
159 HA GLN 81 HA GLN 81 2.175 3.699 -1.262
160 HB2 GLN 81 1HB GLN 81 2.046 5.738 0.220
161 HB3 GLN 81 2HB GLN 81 0.894 6.423 -0.922
162 HG2 GLN 81 1HG GLN 81 -0.795 5.105 -0.188
163 HG3 GLN 81 2HG GLN 81 0.234 3.675 -0.116
164 HE21 GLN 81 1HE2 GLN 81 2.219 4.546 1.702
165 HE22 GLN 81 2HE2 GLN 81 1.507 4.836 3.210
166 H LYS 82 H LYS 82 1.147 6.445 -3.299
167 HA LYS 82 HA LYS 82 -1.251 5.252 -4.275
168 HB2 LYS 82 1HB LYS 82 0.524 7.496 -5.119
169 HB3 LYS 82 2HB LYS 82 -0.643 6.889 -6.295
170 HG2 LYS 82 1HG LYS 82 -1.645 8.704 -4.990
171 HG3 LYS 82 2HG LYS 82 -2.451 7.179 -4.619
172 HD2 LYS 82 1HD LYS 82 -1.351 6.968 -2.537
173 HD3 LYS 82 2HD LYS 82 -0.126 8.161 -2.968
174 HE2 LYS 82 1HE LYS 82 -1.582 9.964 -2.662
175 HE3 LYS 82 2HE LYS 82 -3.019 8.963 -2.869
176 HZ1 LYS 82 3HZ LYS 82 -1.147 8.791 -0.572
177 HZ2 LYS 82 1HZ LYS 82 -2.586 7.913 -0.763
178 HZ3 LYS 82 2HZ LYS 82 -2.641 9.597 -0.548
179 H GLU 83 H GLU 83 2.010 5.401 -5.779
180 HA GLU 83 HA GLU 83 1.292 3.927 -8.101
181 HB2 GLU 83 1HB GLU 83 3.947 4.151 -6.653
182 HB3 GLU 83 2HB GLU 83 3.759 3.375 -8.225
183 HG2 GLU 83 1HG GLU 83 2.449 5.930 -8.291
184 HG3 GLU 83 2HG GLU 83 4.094 6.145 -7.690
185 H LEU 84 H LEU 84 2.392 2.788 -4.909
186 HA LEU 84 HA LEU 84 2.473 0.019 -5.769
187 HB2 LEU 84 1HB LEU 84 2.339 1.245 -2.992
188 HB3 LEU 84 2HB LEU 84 2.601 -0.472 -3.311
189 HG LEU 84 HG LEU 84 4.372 1.769 -4.341
190 HD11 LEU 84 1HD1 LEU 84 4.574 1.481 -1.898
191 HD12 LEU 84 2HD1 LEU 84 6.024 0.912 -2.725
192 HD13 LEU 84 3HD1 LEU 84 4.841 -0.249 -2.125
193 HD21 LEU 84 3HD2 LEU 84 5.831 -0.488 -4.559
194 HD22 LEU 84 1HD2 LEU 84 4.789 0.095 -5.857
195 HD23 LEU 84 2HD2 LEU 84 4.219 -1.173 -4.771
196 H LEU 85 H LEU 85 0.023 2.090 -4.248
197 HA LEU 85 HA LEU 85 -1.855 -0.071 -3.812
198 HB2 LEU 85 1HB LEU 85 -2.151 2.936 -4.009
199 HB3 LEU 85 2HB LEU 85 -3.549 1.884 -3.809
200 HG LEU 85 HG LEU 85 -1.171 1.712 -1.961
201 HD11 LEU 85 1HD1 LEU 85 -2.132 4.050 -2.013
202 HD12 LEU 85 2HD1 LEU 85 -2.253 3.246 -0.449
203 HD13 LEU 85 3HD1 LEU 85 -3.669 3.358 -1.494
204 HD21 LEU 85 3HD2 LEU 85 -2.423 0.162 -0.891
205 HD22 LEU 85 1HD2 LEU 85 -3.506 0.191 -2.282
206 HD23 LEU 85 2HD2 LEU 85 -3.834 1.218 -0.890
207 H ALA 86 H ALA 86 -1.198 2.153 -6.487
208 HA ALA 86 HA ALA 86 -3.462 1.482 -8.086
209 HB1 ALA 86 1HB ALA 86 -2.485 3.139 -9.273
210 HB2 ALA 86 2HB ALA 86 -1.320 1.948 -9.851
211 HB3 ALA 86 3HB ALA 86 -0.957 2.913 -8.421
212 H GLU 87 H GLU 87 -0.337 -0.074 -7.604
213 HA GLU 87 HA GLU 87 -0.724 -2.022 -9.753
214 HB2 GLU 87 1HB GLU 87 1.540 -1.383 -8.901
215 HB3 GLU 87 2HB GLU 87 1.140 -2.148 -7.361
216 HG2 GLU 87 1HG GLU 87 0.765 -4.297 -8.544
217 HG3 GLU 87 2HG GLU 87 1.233 -3.527 -10.061
218 H TRP 88 H TRP 88 -1.384 -1.882 -6.291
219 HA TRP 88 HA TRP 88 -2.060 -4.676 -6.004
220 HB2 TRP 88 1HB TRP 88 -3.046 -2.291 -4.407
221 HB3 TRP 88 2HB TRP 88 -3.153 -3.979 -3.916
222 HD1 TRP 88 HD TRP 88 0.027 -3.961 -5.501
223 HE1 TRP 88 1HE TRP 88 1.955 -3.516 -3.835
224 HE3 TRP 88 3HE TRP 88 -2.609 -2.073 -1.550
225 HZ2 TRP 88 2HZ TRP 88 2.329 -2.495 -1.209
226 HZ3 TRP 88 3HZ TRP 88 -1.438 -1.373 0.519
227 HH2 TRP 88 HH TRP 88 1.026 -1.585 0.694
228 H LYS 89 H LYS 89 -3.841 -1.769 -6.903
229 HA LYS 89 HA LYS 89 -6.445 -3.067 -6.913
230 HB2 LYS 89 1HB LYS 89 -7.158 -0.941 -7.061
231 HB3 LYS 89 2HB LYS 89 -5.477 -0.423 -7.088
232 HG2 LYS 89 1HG LYS 89 -5.462 -0.708 -9.571
233 HG3 LYS 89 2HG LYS 89 -7.180 -1.118 -9.504
234 HD2 LYS 89 1HD LYS 89 -7.335 1.157 -8.160
235 HD3 LYS 89 2HD LYS 89 -5.838 1.515 -9.024
236 HE2 LYS 89 1HE LYS 89 -6.999 0.913 -11.166
237 HE3 LYS 89 2HE LYS 89 -8.500 0.746 -10.255
238 HZ1 LYS 89 3HZ LYS 89 -8.576 2.913 -11.003
239 HZ2 LYS 89 1HZ LYS 89 -6.915 3.171 -10.784
240 HZ3 LYS 89 2HZ LYS 89 -7.947 3.104 -9.436
241 H ARG 90 H ARG 90 -3.953 -2.445 -9.387
242 HA ARG 90 HA ARG 90 -5.598 -3.171 -11.610
243 HB2 ARG 90 1HB ARG 90 -2.728 -2.768 -11.119
244 HB3 ARG 90 2HB ARG 90 -3.057 -3.999 -12.338
245 HG2 ARG 90 1HG ARG 90 -4.504 -2.424 -13.558
246 HG3 ARG 90 2HG ARG 90 -4.201 -1.190 -12.334
247 HD2 ARG 90 1HD ARG 90 -2.647 -0.648 -14.011
248 HD3 ARG 90 2HD ARG 90 -1.687 -1.599 -12.878
249 HE ARG 90 HE ARG 90 -2.907 -3.221 -14.972
250 HH11 ARG 90 1HH2 ARG 90 -0.287 -1.189 -14.031
251 HH12 ARG 90 2HH2 ARG 90 0.832 -1.883 -15.158
252 HH21 ARG 90 1HH1 ARG 90 -1.459 -4.146 -16.444
253 HH22 ARG 90 2HH1 ARG 90 0.167 -3.556 -16.524
254 H THR 91 H THR 91 -3.448 -5.116 -9.522
255 HA THR 91 HA THR 91 -4.451 -7.589 -10.841
256 HB THR 91 HB THR 91 -2.657 -8.705 -9.837
257 HG1 THR 91 1HG THR 91 -1.778 -6.935 -8.025
258 HG21 THR 91 3HG2 THR 91 -1.443 -5.957 -9.782
259 HG22 THR 91 1HG2 THR 91 -2.018 -6.632 -11.306
260 HG23 THR 91 2HG2 THR 91 -0.756 -7.461 -10.394
261 H GLY 92 H GLY 92 -4.439 -5.977 -7.679
262 HA2 GLY 92 1HA GLY 92 -6.502 -6.051 -6.320
263 HA3 GLY 92 2HA GLY 92 -6.777 -7.683 -6.927
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