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 |
|
|
458650 |
2knx   |
16482 | cing | 1-original | 5 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 H1 GLY 1 HT1 GLY 1 -18.060 4.053 7.127
2 H2 GLY 1 HT2 GLY 1 -19.541 4.795 7.465
3 H3 GLY 1 HT3 GLY 1 -18.103 5.490 8.020
4 HA2 GLY 1 HA1 GLY 1 -19.346 5.627 5.406
5 HA3 GLY 1 HA2 GLY 1 -18.323 6.799 6.224
6 H SER 2 HN SER 2 -16.152 6.833 5.824
7 HA SER 2 HA SER 2 -14.209 6.488 4.694
8 HB2 SER 2 HB2 SER 2 -14.877 3.628 4.161
9 HB3 SER 2 HB1 SER 2 -13.361 4.346 4.706
10 HG SER 2 HG SER 2 -14.460 4.733 6.740
11 H GLU 3 HN GLU 3 -15.303 7.820 3.025
12 HA GLU 3 HA GLU 3 -16.326 6.461 0.694
13 HB2 GLU 3 HB2 GLU 3 -17.251 8.628 1.372
14 HB3 GLU 3 HB1 GLU 3 -15.677 9.379 1.151
15 HG2 GLU 3 HG2 GLU 3 -17.244 9.798 -0.707
16 HG3 GLU 3 HG1 GLU 3 -15.756 8.997 -1.210
17 H GLY 4 HN GLY 4 -15.171 5.761 -0.980
18 HA2 GLY 4 HA2 GLY 4 -13.401 5.386 -2.391
19 HA3 GLY 4 HA1 GLY 4 -13.006 7.081 -2.152
20 H LYS 5 HN LYS 5 -13.097 4.817 0.500
21 HA LYS 5 HA LYS 5 -10.330 5.382 1.095
22 HB2 LYS 5 HB2 LYS 5 -12.630 4.201 2.505
23 HB3 LYS 5 HB1 LYS 5 -11.073 3.499 2.925
24 HG2 LYS 5 HG2 LYS 5 -11.839 6.405 3.106
25 HG3 LYS 5 HG1 LYS 5 -11.610 5.284 4.450
26 HD2 LYS 5 HD2 LYS 5 -9.232 4.986 3.350
27 HD3 LYS 5 HD1 LYS 5 -9.590 6.581 2.685
28 HE2 LYS 5 HE2 LYS 5 -8.683 7.300 4.619
29 HE3 LYS 5 HE1 LYS 5 -10.293 6.967 5.257
30 HZ1 LYS 5 HZ1 LYS 5 -8.976 5.848 6.735
31 HZ2 LYS 5 HZ2 LYS 5 -7.812 5.431 5.581
32 HZ3 LYS 5 HZ3 LYS 5 -9.289 4.609 5.626
33 H THR 6 HN THR 6 -12.007 2.244 1.177
34 HA THR 6 HA THR 6 -9.684 0.746 0.694
35 HB THR 6 HB THR 6 -11.410 -1.066 0.024
36 HG1 THR 6 HG1 THR 6 -13.527 -0.527 0.748
37 HG21 THR 6 HG21 THR 6 -11.252 0.231 2.710
38 HG22 THR 6 HG22 THR 6 -10.584 -1.309 2.169
39 HG23 THR 6 HG23 THR 6 -12.321 -1.143 2.425
40 H CYS 7 HN CYS 7 -8.605 0.263 -1.095
41 HA CYS 7 HA CYS 7 -7.945 0.295 -3.271
42 HB2 CYS 7 HB2 CYS 7 -10.792 -0.318 -4.020
43 HB3 CYS 7 HB1 CYS 7 -9.311 -0.882 -4.782
44 H GLY 8 HN GLY 8 -7.847 2.724 -2.848
45 HA2 GLY 8 HA2 GLY 8 -9.851 4.394 -4.017
46 HA3 GLY 8 HA1 GLY 8 -8.244 4.895 -3.511
47 HA PRO 9 HA PRO 9 -8.452 5.346 -8.137
48 HB2 PRO 9 HB2 PRO 9 -6.478 7.297 -8.083
49 HB3 PRO 9 HB1 PRO 9 -8.216 7.607 -8.086
50 HG2 PRO 9 HG2 PRO 9 -6.300 7.557 -5.797
51 HG3 PRO 9 HG1 PRO 9 -7.670 8.644 -6.093
52 HD2 PRO 9 HD2 PRO 9 -7.839 6.636 -4.330
53 HD3 PRO 9 HD1 PRO 9 -9.223 7.089 -5.347
54 H SER 10 HN SER 10 -5.627 5.341 -5.990
55 HA SER 10 HA SER 10 -4.204 3.693 -7.975
56 HB2 SER 10 HB2 SER 10 -2.253 4.580 -6.248
57 HB3 SER 10 HB1 SER 10 -2.642 5.320 -7.800
58 HG SER 10 HG SER 10 -2.720 6.916 -6.261
59 H SER 11 HN SER 11 -5.658 2.043 -6.839
60 HA SER 11 HA SER 11 -4.824 1.216 -4.206
61 HB2 SER 11 HB2 SER 11 -6.460 -0.574 -4.468
62 HB3 SER 11 HB1 SER 11 -7.167 0.965 -4.964
63 HG SER 11 HG SER 11 -6.473 -1.259 -6.495
64 H PHE 12 HN PHE 12 -3.153 -0.049 -3.777
65 HA PHE 12 HA PHE 12 -1.941 -1.594 -5.951
66 HB2 PHE 12 HB2 PHE 12 -0.340 -0.206 -4.867
67 HB3 PHE 12 HB1 PHE 12 -0.909 -0.670 -3.269
68 HD1 PHE 12 HD2 PHE 12 0.624 -2.145 -6.328
69 HD2 PHE 12 HD1 PHE 12 0.237 -2.279 -2.092
70 HE1 PHE 12 HE2 PHE 12 2.335 -3.910 -6.232
71 HE2 PHE 12 HE1 PHE 12 1.946 -4.046 -1.989
72 HZ PHE 12 HZ PHE 12 2.999 -4.863 -4.059
73 H SER 13 HN SER 13 -1.590 -3.805 -5.798
74 HA SER 13 HA SER 13 -3.217 -5.152 -3.760
75 HB2 SER 13 HB2 SER 13 -4.054 -5.926 -5.753
76 HB3 SER 13 HB1 SER 13 -2.511 -5.769 -6.587
77 HG SER 13 HG SER 13 -2.126 -7.778 -6.139
78 H CYS 14 HN CYS 14 -2.354 -6.495 -2.315
79 HA CYS 14 HA CYS 14 0.490 -6.634 -2.040
80 HB2 CYS 14 HB2 CYS 14 -0.649 -6.513 0.003
81 HB3 CYS 14 HB1 CYS 14 -1.851 -7.697 -0.487
82 HA PRO 15 HA PRO 15 1.149 -10.246 -4.561
83 HB2 PRO 15 HB2 PRO 15 3.521 -11.029 -3.394
84 HB3 PRO 15 HB1 PRO 15 3.382 -9.791 -4.645
85 HG2 PRO 15 HG2 PRO 15 3.601 -9.475 -1.680
86 HG3 PRO 15 HG1 PRO 15 4.378 -8.536 -2.968
87 HD2 PRO 15 HD2 PRO 15 2.241 -7.602 -1.655
88 HD3 PRO 15 HD1 PRO 15 2.463 -7.297 -3.389
89 H GLY 16 HN GLY 16 1.248 -12.548 -4.366
90 HA2 GLY 16 HA2 GLY 16 0.669 -14.563 -3.434
91 HA3 GLY 16 HA1 GLY 16 1.373 -13.955 -1.943
92 H THR 17 HN THR 17 -1.222 -12.169 -3.356
93 HA THR 17 HA THR 17 -3.434 -13.469 -2.254
94 HB THR 17 HB THR 17 -2.448 -13.043 -0.086
95 HG1 THR 17 HG1 THR 17 -4.493 -11.134 -0.483
96 HG21 THR 17 HG21 THR 17 -2.165 -10.236 -1.064
97 HG22 THR 17 HG22 THR 17 -0.972 -11.275 -0.285
98 HG23 THR 17 HG23 THR 17 -2.298 -10.596 0.657
99 H HIS 18 HN HIS 18 -5.365 -11.928 -2.063
100 HA HIS 18 HA HIS 18 -5.078 -9.858 -4.132
101 HB2 HIS 18 HB2 HIS 18 -7.403 -10.215 -4.688
102 HB3 HIS 18 HB1 HIS 18 -6.561 -11.762 -4.701
103 HD1 HIS 18 HD1 HIS 18 -9.336 -9.949 -3.042
104 HD2 HIS 18 HD2 HIS 18 -7.205 -13.479 -2.540
105 HE1 HIS 18 HE1 HIS 18 -10.667 -11.356 -1.421
106 H VAL 19 HN VAL 19 -4.290 -8.756 -1.946
107 HA VAL 19 HA VAL 19 -6.633 -7.438 -0.742
108 HB VAL 19 HB VAL 19 -5.716 -7.670 1.269
109 HG11 VAL 19 HG11 VAL 19 -3.567 -9.096 -0.253
110 HG12 VAL 19 HG12 VAL 19 -4.867 -9.769 0.730
111 HG13 VAL 19 HG13 VAL 19 -3.516 -8.943 1.502
112 HG21 VAL 19 HG21 VAL 19 -3.599 -6.640 1.907
113 HG22 VAL 19 HG22 VAL 19 -4.554 -5.557 0.896
114 HG23 VAL 19 HG23 VAL 19 -3.182 -6.425 0.208
115 H CYS 20 HN CYS 20 -7.004 -5.406 -1.311
116 HA CYS 20 HA CYS 20 -5.012 -3.991 -2.868
117 HB2 CYS 20 HB2 CYS 20 -6.724 -2.739 -3.719
118 HB3 CYS 20 HB1 CYS 20 -7.646 -4.148 -3.217
119 H VAL 21 HN VAL 21 -4.570 -1.694 -2.451
120 HA VAL 21 HA VAL 21 -4.935 -0.688 0.219
121 HB VAL 21 HB VAL 21 -3.072 -2.062 0.757
122 HG11 VAL 21 HG11 VAL 21 -0.901 -1.424 -0.739
123 HG12 VAL 21 HG12 VAL 21 -2.186 -1.354 -1.944
124 HG13 VAL 21 HG13 VAL 21 -1.931 -2.829 -1.012
125 HG21 VAL 21 HG21 VAL 21 -1.306 -0.438 1.296
126 HG22 VAL 21 HG22 VAL 21 -2.915 0.172 1.680
127 HG23 VAL 21 HG23 VAL 21 -2.080 0.737 0.233
128 HA PRO 22 HA PRO 22 -5.023 2.828 -2.616
129 HB2 PRO 22 HB2 PRO 22 -5.189 4.252 -0.008
130 HB3 PRO 22 HB1 PRO 22 -6.209 4.409 -1.442
131 HG2 PRO 22 HG2 PRO 22 -7.090 3.124 0.719
132 HG3 PRO 22 HG1 PRO 22 -7.474 2.540 -0.911
133 HD2 PRO 22 HD2 PRO 22 -5.487 1.496 1.058
134 HD3 PRO 22 HD1 PRO 22 -6.516 0.610 -0.085
135 H GLU 23 HN GLU 23 -3.489 4.289 -3.270
136 HA GLU 23 HA GLU 23 -0.843 3.965 -2.615
137 HB2 GLU 23 HB2 GLU 23 -2.350 5.704 -4.267
138 HB3 GLU 23 HB1 GLU 23 -1.248 6.711 -3.339
139 HG2 GLU 23 HG2 GLU 23 -0.090 4.287 -4.550
140 HG3 GLU 23 HG1 GLU 23 -0.604 5.554 -5.663
141 H ARG 24 HN ARG 24 -3.234 5.976 -1.043
142 HA ARG 24 HA ARG 24 -1.524 7.604 0.476
143 HB2 ARG 24 HB2 ARG 24 -3.922 8.052 0.241
144 HB3 ARG 24 HB1 ARG 24 -4.295 6.591 1.145
145 HG2 ARG 24 HG2 ARG 24 -4.550 8.438 2.614
146 HG3 ARG 24 HG1 ARG 24 -3.085 7.578 3.092
147 HD2 ARG 24 HD2 ARG 24 -2.617 9.921 3.141
148 HD3 ARG 24 HD1 ARG 24 -1.770 9.224 1.761
149 HE ARG 24 HE ARG 24 -3.078 10.480 0.357
150 HH11 ARG 24 HH11 ARG 24 -4.464 10.532 3.560
151 HH12 ARG 24 HH12 ARG 24 -5.627 11.754 3.172
152 HH21 ARG 24 HH21 ARG 24 -4.607 12.088 -0.153
153 HH22 ARG 24 HH22 ARG 24 -5.709 12.637 1.065
154 H TRP 25 HN TRP 25 -2.611 4.319 0.882
155 HA TRP 25 HA TRP 25 -1.505 4.121 3.565
156 HB2 TRP 25 HB2 TRP 25 -2.962 2.165 1.788
157 HB3 TRP 25 HB1 TRP 25 -2.283 1.715 3.349
158 HD1 TRP 25 HD1 TRP 25 -4.093 5.053 2.747
159 HE1 TRP 25 HE1 TRP 25 -6.213 5.102 4.205
160 HE3 TRP 25 HE3 TRP 25 -3.953 0.270 4.545
161 HZ2 TRP 25 HZ2 TRP 25 -7.637 3.346 5.896
162 HZ3 TRP 25 HZ3 TRP 25 -5.730 -0.467 6.079
163 HH2 TRP 25 HH2 TRP 25 -7.533 1.041 6.740
164 H LEU 26 HN LEU 26 -0.546 3.582 0.321
165 HA LEU 26 HA LEU 26 1.282 1.490 0.590
166 HB2 LEU 26 HB2 LEU 26 0.887 3.739 -1.296
167 HB3 LEU 26 HB1 LEU 26 2.468 2.987 -1.304
168 HG LEU 26 HG LEU 26 0.963 2.055 -3.013
169 HD11 LEU 26 HD11 LEU 26 2.760 0.741 -1.625
170 HD12 LEU 26 HD12 LEU 26 1.707 -0.093 -2.769
171 HD13 LEU 26 HD13 LEU 26 1.347 -0.140 -1.043
172 HD21 LEU 26 HD21 LEU 26 -1.182 1.803 -2.488
173 HD22 LEU 26 HD22 LEU 26 -0.848 1.913 -0.762
174 HD23 LEU 26 HD23 LEU 26 -0.707 0.364 -1.589
175 H CYS 27 HN CYS 27 3.043 1.337 1.799
176 HA CYS 27 HA CYS 27 4.830 1.880 3.104
177 HB2 CYS 27 HB2 CYS 27 5.554 4.292 1.582
178 HB3 CYS 27 HB1 CYS 27 6.502 2.854 1.929
179 H ASP 28 HN ASP 28 2.599 2.736 4.275
180 HA ASP 28 HA ASP 28 3.075 5.515 5.094
181 HB2 ASP 28 HB2 ASP 28 0.791 5.461 5.991
182 HB3 ASP 28 HB1 ASP 28 0.813 5.023 4.286
183 H GLY 29 HN GLY 29 3.529 2.318 6.119
184 HA2 GLY 29 HA2 GLY 29 4.967 2.142 8.127
185 HA3 GLY 29 HA1 GLY 29 3.834 3.230 8.913
186 H ASP 30 HN ASP 30 1.552 1.825 7.573
187 HA ASP 30 HA ASP 30 1.333 -0.332 9.531
188 HB2 ASP 30 HB2 ASP 30 -0.434 1.586 8.956
189 HB3 ASP 30 HB1 ASP 30 -0.947 0.400 7.760
190 H LYS 31 HN LYS 31 2.359 -2.092 8.708
191 HA LYS 31 HA LYS 31 2.454 -2.889 6.042
192 HB2 LYS 31 HB2 LYS 31 2.969 -4.165 8.655
193 HB3 LYS 31 HB1 LYS 31 2.656 -5.265 7.321
194 HG2 LYS 31 HG2 LYS 31 4.439 -4.078 6.035
195 HG3 LYS 31 HG1 LYS 31 4.820 -3.189 7.510
196 HD2 LYS 31 HD2 LYS 31 6.289 -5.136 7.185
197 HD3 LYS 31 HD1 LYS 31 5.333 -5.255 8.662
198 HE2 LYS 31 HE2 LYS 31 4.313 -7.117 7.968
199 HE3 LYS 31 HE1 LYS 31 3.994 -6.442 6.372
200 HZ1 LYS 31 HZ1 LYS 31 6.526 -7.702 7.274
201 HZ2 LYS 31 HZ2 LYS 31 6.296 -6.978 5.763
202 HZ3 LYS 31 HZ3 LYS 31 5.411 -8.357 6.184
203 H ASP 32 HN ASP 32 0.404 -2.695 5.105
204 HA ASP 32 HA ASP 32 -1.851 -4.146 6.128
205 HB2 ASP 32 HB2 ASP 32 -1.471 -2.856 3.417
206 HB3 ASP 32 HB1 ASP 32 -3.001 -3.380 4.112
207 H CYS 33 HN CYS 33 0.644 -4.690 3.743
208 HA CYS 33 HA CYS 33 -0.625 -7.036 2.642
209 HB2 CYS 33 HB2 CYS 33 0.750 -5.702 1.172
210 HB3 CYS 33 HB1 CYS 33 2.123 -5.841 2.261
211 H ALA 34 HN ALA 34 -0.034 -9.163 2.974
212 HA ALA 34 HA ALA 34 0.578 -10.040 5.481
213 HB1 ALA 34 HB1 ALA 34 1.599 -11.779 3.340
214 HB2 ALA 34 HB2 ALA 34 -0.077 -11.258 3.168
215 HB3 ALA 34 HB3 ALA 34 0.436 -12.114 4.622
216 H ASP 35 HN ASP 35 2.870 -9.277 2.904
217 HA ASP 35 HA ASP 35 5.062 -9.768 4.811
218 HB2 ASP 35 HB2 ASP 35 5.061 -9.929 1.792
219 HB3 ASP 35 HB1 ASP 35 6.514 -10.024 2.782
220 H GLY 36 HN GLY 36 3.467 -7.318 4.527
221 HA2 GLY 36 HA2 GLY 36 3.775 -5.044 4.414
222 HA3 GLY 36 HA1 GLY 36 5.443 -5.408 4.822
223 H ALA 37 HN ALA 37 3.917 -6.510 1.865
224 HA ALA 37 HA ALA 37 5.952 -5.644 0.187
225 HB1 ALA 37 HB1 ALA 37 3.065 -6.024 -0.595
226 HB2 ALA 37 HB2 ALA 37 4.232 -7.332 -0.396
227 HB3 ALA 37 HB3 ALA 37 4.474 -6.117 -1.652
228 H ASP 38 HN ASP 38 2.847 -4.074 0.910
229 HA ASP 38 HA ASP 38 3.088 -1.882 -0.787
230 HB2 ASP 38 HB2 ASP 38 1.639 -0.717 1.025
231 HB3 ASP 38 HB1 ASP 38 0.981 -2.118 0.187
232 H GLU 39 HN GLU 39 4.635 -2.546 2.255
233 HA GLU 39 HA GLU 39 5.651 0.185 2.450
234 HB2 GLU 39 HB2 GLU 39 6.184 -2.111 4.332
235 HB3 GLU 39 HB1 GLU 39 6.404 -0.395 4.642
236 HG2 GLU 39 HG2 GLU 39 3.707 -0.759 3.919
237 HG3 GLU 39 HG1 GLU 39 4.109 -2.025 5.077
238 H SER 40 HN SER 40 6.487 -2.204 0.558
239 HA SER 40 HA SER 40 9.370 -1.731 0.900
240 HB2 SER 40 HB2 SER 40 7.932 -4.268 0.880
241 HB3 SER 40 HB1 SER 40 9.215 -4.212 -0.328
242 HG SER 40 HG SER 40 10.599 -3.478 1.430
243 H ILE 41 HN ILE 41 10.515 -2.600 -1.224
244 HA ILE 41 HA ILE 41 9.746 -0.883 -3.302
245 HB ILE 41 HB ILE 41 11.782 -3.000 -2.960
246 HG12 ILE 41 HG12 ILE 41 12.147 -0.581 -2.502
247 HG13 ILE 41 HG11 ILE 41 13.272 -1.244 -3.680
248 HG21 ILE 41 HG21 ILE 41 10.798 -2.153 -5.669
249 HG22 ILE 41 HG22 ILE 41 11.022 -3.789 -5.049
250 HG23 ILE 41 HG23 ILE 41 12.425 -2.778 -5.399
251 HD11 ILE 41 HD11 ILE 41 12.730 0.676 -4.740
252 HD12 ILE 41 HD12 ILE 41 11.122 0.750 -4.020
253 HD13 ILE 41 HD13 ILE 41 11.435 -0.346 -5.364
254 H ALA 42 HN ALA 42 8.673 -4.044 -2.483
255 HA ALA 42 HA ALA 42 7.929 -5.117 -4.927
256 HB1 ALA 42 HB1 ALA 42 6.094 -5.420 -2.600
257 HB2 ALA 42 HB2 ALA 42 7.744 -6.031 -2.473
258 HB3 ALA 42 HB3 ALA 42 6.677 -6.630 -3.743
259 H ALA 43 HN ALA 43 6.430 -2.583 -3.047
260 HA ALA 43 HA ALA 43 4.067 -2.524 -4.734
261 HB1 ALA 43 HB1 ALA 43 3.091 -1.506 -3.012
262 HB2 ALA 43 HB2 ALA 43 4.353 -0.277 -2.929
263 HB3 ALA 43 HB3 ALA 43 4.570 -1.820 -2.103
264 H GLY 44 HN GLY 44 7.160 -1.030 -4.576
265 HA2 GLY 44 HA2 GLY 44 7.937 0.118 -6.565
266 HA3 GLY 44 HA1 GLY 44 6.331 0.812 -6.725
267 H CYS 45 HN CYS 45 7.931 0.620 -3.631
268 HA CYS 45 HA CYS 45 7.990 3.542 -3.541
269 HB2 CYS 45 HB2 CYS 45 7.396 1.480 -1.644
270 HB3 CYS 45 HB1 CYS 45 8.745 2.431 -1.039
271 H LEU 46 HN LEU 46 9.884 3.239 -5.101
272 HA LEU 46 HA LEU 46 12.382 2.436 -3.888
273 HB2 LEU 46 HB2 LEU 46 12.326 3.933 -6.455
274 HB3 LEU 46 HB1 LEU 46 13.310 2.564 -5.980
275 HG LEU 46 HG LEU 46 10.679 1.584 -6.087
276 HD11 LEU 46 HD11 LEU 46 9.746 3.252 -7.368
277 HD12 LEU 46 HD12 LEU 46 10.328 2.142 -8.608
278 HD13 LEU 46 HD13 LEU 46 11.254 3.591 -8.218
279 HD21 LEU 46 HD21 LEU 46 12.625 1.270 -8.333
280 HD22 LEU 46 HD22 LEU 46 11.562 0.072 -7.595
281 HD23 LEU 46 HD23 LEU 46 13.002 0.622 -6.736
282 H TYR 47 HN TYR 47 10.894 5.451 -5.008
283 HA TYR 47 HA TYR 47 12.988 7.196 -4.535
284 HB2 TYR 47 HB2 TYR 47 11.410 8.950 -4.602
285 HB3 TYR 47 HB1 TYR 47 10.724 7.683 -5.611
286 HD1 TYR 47 HD1 TYR 47 9.431 5.888 -3.786
287 HD2 TYR 47 HD2 TYR 47 9.707 10.127 -3.592
288 HE1 TYR 47 HE1 TYR 47 7.362 5.955 -2.460
289 HE2 TYR 47 HE2 TYR 47 7.639 10.207 -2.263
290 HH TYR 47 HH TYR 47 6.361 7.688 -0.696
291 H ASN 48 HN ASN 48 14.093 7.674 -2.773
292 HA ASN 48 HA ASN 48 12.726 7.931 -0.215
293 HB2 ASN 48 HB2 ASN 48 14.205 5.608 -0.870
294 HB3 ASN 48 HB1 ASN 48 15.188 6.526 0.267
295 HD21 ASN 48 HD21 ASN 48 13.187 4.077 0.187
296 HD22 ASN 48 HD22 ASN 48 12.360 4.256 1.693
297 H SER 49 HN SER 49 16.165 7.622 -1.055
298 HA SER 49 HA SER 49 17.935 9.013 -0.712
299 HB2 SER 49 HB2 SER 49 16.180 11.384 -1.229
300 HB3 SER 49 HB1 SER 49 17.817 11.058 -1.800
301 HG SER 49 HG SER 49 15.399 10.374 -2.902
302 H THR 50 HN THR 50 18.442 8.895 1.417
303 HA THR 50 HA THR 50 18.671 9.521 3.591
304 HB THR 50 HB THR 50 17.423 12.163 2.872
305 HG1 THR 50 HG1 THR 50 18.890 11.830 1.254
306 HG21 THR 50 HG21 THR 50 18.198 12.814 4.831
307 HG22 THR 50 HG22 THR 50 19.835 12.405 4.318
308 HG23 THR 50 HG23 THR 50 18.838 11.198 5.130
Start of MODEL 2
1 H1 GLY 1 HT1 GLY 1 -15.040 4.641 9.592
2 H2 GLY 1 HT2 GLY 1 -13.727 5.672 9.858
3 H3 GLY 1 HT3 GLY 1 -13.636 4.050 10.327
4 HA2 GLY 1 HA1 GLY 1 -12.433 4.697 8.205
5 HA3 GLY 1 HA2 GLY 1 -13.458 3.271 8.163
6 H SER 2 HN SER 2 -12.779 4.549 5.839
7 HA SER 2 HA SER 2 -15.361 5.704 5.026
8 HB2 SER 2 HB2 SER 2 -12.607 6.604 4.148
9 HB3 SER 2 HB1 SER 2 -14.116 7.153 3.420
10 HG SER 2 HG SER 2 -13.146 7.610 6.033
11 H GLU 3 HN GLU 3 -16.295 4.209 3.792
12 HA GLU 3 HA GLU 3 -14.751 2.336 2.240
13 HB2 GLU 3 HB2 GLU 3 -16.949 1.841 3.434
14 HB3 GLU 3 HB1 GLU 3 -17.739 2.724 2.135
15 HG2 GLU 3 HG2 GLU 3 -16.750 1.145 0.514
16 HG3 GLU 3 HG1 GLU 3 -16.081 0.229 1.863
17 H GLY 4 HN GLY 4 -13.831 4.438 1.153
18 HA2 GLY 4 HA2 GLY 4 -15.237 4.663 -1.417
19 HA3 GLY 4 HA1 GLY 4 -14.774 6.133 -0.574
20 H LYS 5 HN LYS 5 -12.773 3.283 -0.464
21 HA LYS 5 HA LYS 5 -11.053 4.227 -2.598
22 HB2 LYS 5 HB2 LYS 5 -9.097 3.939 -0.788
23 HB3 LYS 5 HB1 LYS 5 -9.863 5.484 -1.125
24 HG2 LYS 5 HG2 LYS 5 -11.091 3.793 0.974
25 HG3 LYS 5 HG1 LYS 5 -9.540 4.550 1.339
26 HD2 LYS 5 HD2 LYS 5 -11.236 6.474 0.081
27 HD3 LYS 5 HD1 LYS 5 -12.120 5.712 1.405
28 HE2 LYS 5 HE2 LYS 5 -10.958 7.650 2.238
29 HE3 LYS 5 HE1 LYS 5 -10.216 6.196 2.905
30 HZ1 LYS 5 HZ1 LYS 5 -8.663 7.975 2.051
31 HZ2 LYS 5 HZ2 LYS 5 -9.154 7.541 0.491
32 HZ3 LYS 5 HZ3 LYS 5 -8.384 6.406 1.482
33 H THR 6 HN THR 6 -10.161 2.209 0.168
34 HA THR 6 HA THR 6 -9.383 0.077 0.275
35 HB THR 6 HB THR 6 -10.940 -1.467 -1.332
36 HG1 THR 6 HG1 THR 6 -13.007 -0.468 -1.328
37 HG21 THR 6 HG21 THR 6 -10.868 -0.830 1.384
38 HG22 THR 6 HG22 THR 6 -11.709 -2.174 0.612
39 HG23 THR 6 HG23 THR 6 -12.552 -0.650 0.890
40 H CYS 7 HN CYS 7 -10.486 -0.515 -3.017
41 HA CYS 7 HA CYS 7 -7.673 -0.553 -3.890
42 HB2 CYS 7 HB2 CYS 7 -9.569 -2.433 -5.191
43 HB3 CYS 7 HB1 CYS 7 -7.855 -2.621 -4.850
44 H GLY 8 HN GLY 8 -10.008 1.390 -4.167
45 HA2 GLY 8 HA2 GLY 8 -10.931 1.423 -6.813
46 HA3 GLY 8 HA1 GLY 8 -10.803 2.827 -5.765
47 HA PRO 9 HA PRO 9 -8.064 3.388 -9.555
48 HB2 PRO 9 HB2 PRO 9 -8.416 6.165 -9.267
49 HB3 PRO 9 HB1 PRO 9 -9.222 5.121 -10.439
50 HG2 PRO 9 HG2 PRO 9 -10.195 6.134 -7.814
51 HG3 PRO 9 HG1 PRO 9 -11.099 5.826 -9.308
52 HD2 PRO 9 HD2 PRO 9 -11.259 4.163 -7.223
53 HD3 PRO 9 HD1 PRO 9 -11.247 3.546 -8.890
54 H SER 10 HN SER 10 -5.925 3.741 -9.402
55 HA SER 10 HA SER 10 -3.889 4.374 -8.601
56 HB2 SER 10 HB2 SER 10 -5.050 6.617 -8.282
57 HB3 SER 10 HB1 SER 10 -5.297 6.145 -6.601
58 HG SER 10 HG SER 10 -2.863 6.584 -7.968
59 H SER 11 HN SER 11 -5.472 2.160 -7.503
60 HA SER 11 HA SER 11 -4.484 2.048 -4.741
61 HB2 SER 11 HB2 SER 11 -6.579 0.465 -6.225
62 HB3 SER 11 HB1 SER 11 -5.933 -0.069 -4.673
63 HG SER 11 HG SER 11 -6.758 1.735 -3.709
64 H PHE 12 HN PHE 12 -3.363 0.170 -3.998
65 HA PHE 12 HA PHE 12 -1.910 -1.232 -6.145
66 HB2 PHE 12 HB2 PHE 12 -0.334 0.138 -5.011
67 HB3 PHE 12 HB1 PHE 12 -0.990 -0.284 -3.433
68 HD1 PHE 12 HD2 PHE 12 0.520 -1.987 -6.395
69 HD2 PHE 12 HD1 PHE 12 0.212 -1.754 -2.158
70 HE1 PHE 12 HE2 PHE 12 2.186 -3.785 -6.180
71 HE2 PHE 12 HE1 PHE 12 1.876 -3.554 -1.934
72 HZ PHE 12 HZ PHE 12 2.866 -4.571 -3.947
73 H SER 13 HN SER 13 -1.369 -3.427 -5.808
74 HA SER 13 HA SER 13 -3.028 -4.777 -3.781
75 HB2 SER 13 HB2 SER 13 -4.001 -5.402 -5.819
76 HB3 SER 13 HB1 SER 13 -2.446 -5.483 -6.645
77 HG SER 13 HG SER 13 -2.083 -7.432 -5.817
78 H CYS 14 HN CYS 14 -1.899 -5.808 -2.279
79 HA CYS 14 HA CYS 14 0.897 -6.010 -2.301
80 HB2 CYS 14 HB2 CYS 14 -0.853 -7.808 -0.643
81 HB3 CYS 14 HB1 CYS 14 0.718 -7.139 -0.238
82 HA PRO 15 HA PRO 15 1.559 -9.649 -4.727
83 HB2 PRO 15 HB2 PRO 15 4.044 -10.305 -3.916
84 HB3 PRO 15 HB1 PRO 15 3.726 -8.881 -4.912
85 HG2 PRO 15 HG2 PRO 15 4.161 -9.065 -1.956
86 HG3 PRO 15 HG1 PRO 15 4.817 -7.890 -3.110
87 HD2 PRO 15 HD2 PRO 15 2.680 -7.370 -1.515
88 HD3 PRO 15 HD1 PRO 15 2.896 -6.633 -3.113
89 H GLY 16 HN GLY 16 1.069 -11.761 -4.548
90 HA2 GLY 16 HA2 GLY 16 1.125 -13.906 -3.579
91 HA3 GLY 16 HA1 GLY 16 1.641 -13.185 -2.063
92 H THR 17 HN THR 17 -0.369 -11.250 -1.769
93 HA THR 17 HA THR 17 -2.717 -12.975 -1.340
94 HB THR 17 HB THR 17 -2.074 -12.390 0.802
95 HG1 THR 17 HG1 THR 17 -3.589 -10.985 1.517
96 HG21 THR 17 HG21 THR 17 -1.325 -9.656 -0.196
97 HG22 THR 17 HG22 THR 17 -0.226 -10.936 0.317
98 HG23 THR 17 HG23 THR 17 -1.291 -10.165 1.492
99 H HIS 18 HN HIS 18 -4.806 -11.653 -1.150
100 HA HIS 18 HA HIS 18 -4.935 -9.912 -3.499
101 HB2 HIS 18 HB2 HIS 18 -7.383 -10.317 -3.389
102 HB3 HIS 18 HB1 HIS 18 -6.446 -11.799 -3.552
103 HD1 HIS 18 HD1 HIS 18 -6.220 -10.716 -0.118
104 HD2 HIS 18 HD2 HIS 18 -9.007 -12.765 -2.418
105 HE1 HIS 18 HE1 HIS 18 -7.729 -11.926 1.509
106 H VAL 19 HN VAL 19 -3.964 -8.992 -0.871
107 HA VAL 19 HA VAL 19 -6.076 -7.210 0.049
108 HB VAL 19 HB VAL 19 -4.858 -8.061 1.864
109 HG11 VAL 19 HG11 VAL 19 -2.602 -7.927 0.032
110 HG12 VAL 19 HG12 VAL 19 -2.906 -9.014 1.386
111 HG13 VAL 19 HG13 VAL 19 -2.199 -7.425 1.673
112 HG21 VAL 19 HG21 VAL 19 -4.428 -6.149 2.965
113 HG22 VAL 19 HG22 VAL 19 -4.958 -5.376 1.471
114 HG23 VAL 19 HG23 VAL 19 -3.237 -5.614 1.777
115 H CYS 20 HN CYS 20 -6.250 -5.116 -0.464
116 HA CYS 20 HA CYS 20 -4.170 -3.965 -2.195
117 HB2 CYS 20 HB2 CYS 20 -5.898 -2.522 -3.114
118 HB3 CYS 20 HB1 CYS 20 -6.416 -4.200 -3.216
119 H VAL 21 HN VAL 21 -3.938 -1.572 -2.057
120 HA VAL 21 HA VAL 21 -4.637 -0.348 0.470
121 HB VAL 21 HB VAL 21 -2.597 -1.493 1.103
122 HG11 VAL 21 HG11 VAL 21 -0.995 -1.880 -0.374
123 HG12 VAL 21 HG12 VAL 21 -0.604 -0.161 -0.383
124 HG13 VAL 21 HG13 VAL 21 -1.771 -0.806 -1.537
125 HG21 VAL 21 HG21 VAL 21 -3.125 0.981 1.730
126 HG22 VAL 21 HG22 VAL 21 -1.708 1.332 0.740
127 HG23 VAL 21 HG23 VAL 21 -1.561 0.281 2.148
128 HA PRO 22 HA PRO 22 -4.975 3.013 -2.464
129 HB2 PRO 22 HB2 PRO 22 -5.032 4.676 -0.011
130 HB3 PRO 22 HB1 PRO 22 -6.202 4.577 -1.331
131 HG2 PRO 22 HG2 PRO 22 -6.723 3.501 1.058
132 HG3 PRO 22 HG1 PRO 22 -7.247 2.713 -0.442
133 HD2 PRO 22 HD2 PRO 22 -4.946 2.046 1.347
134 HD3 PRO 22 HD1 PRO 22 -6.056 0.961 0.483
135 H GLU 23 HN GLU 23 -3.666 4.658 -3.260
136 HA GLU 23 HA GLU 23 -0.937 4.500 -2.876
137 HB2 GLU 23 HB2 GLU 23 -2.741 6.146 -4.371
138 HB3 GLU 23 HB1 GLU 23 -1.500 7.169 -3.661
139 HG2 GLU 23 HG2 GLU 23 -0.687 4.668 -5.053
140 HG3 GLU 23 HG1 GLU 23 -1.166 6.070 -6.009
141 H ARG 24 HN ARG 24 -3.268 6.629 -1.284
142 HA ARG 24 HA ARG 24 -1.407 8.238 0.084
143 HB2 ARG 24 HB2 ARG 24 -3.363 8.573 1.711
144 HB3 ARG 24 HB1 ARG 24 -3.601 9.064 0.040
145 HG2 ARG 24 HG2 ARG 24 -4.963 7.206 -0.423
146 HG3 ARG 24 HG1 ARG 24 -4.474 6.379 1.057
147 HD2 ARG 24 HD2 ARG 24 -6.777 7.468 1.037
148 HD3 ARG 24 HD1 ARG 24 -5.732 7.820 2.411
149 HE ARG 24 HE ARG 24 -5.699 10.015 1.773
150 HH11 ARG 24 HH11 ARG 24 -6.834 8.089 -0.905
151 HH12 ARG 24 HH12 ARG 24 -7.254 9.459 -1.876
152 HH21 ARG 24 HH21 ARG 24 -6.250 11.821 0.498
153 HH22 ARG 24 HH22 ARG 24 -6.922 11.580 -1.080
154 H TRP 25 HN TRP 25 -2.608 5.035 0.656
155 HA TRP 25 HA TRP 25 -1.564 4.918 3.364
156 HB2 TRP 25 HB2 TRP 25 -3.012 2.960 1.591
157 HB3 TRP 25 HB1 TRP 25 -2.285 2.460 3.113
158 HD1 TRP 25 HD1 TRP 25 -3.910 5.885 3.021
159 HE1 TRP 25 HE1 TRP 25 -6.075 5.827 4.411
160 HE3 TRP 25 HE3 TRP 25 -4.214 0.848 3.839
161 HZ2 TRP 25 HZ2 TRP 25 -7.697 3.899 5.687
162 HZ3 TRP 25 HZ3 TRP 25 -6.102 -0.022 5.153
163 HH2 TRP 25 HH2 TRP 25 -7.807 1.474 6.059
164 H LEU 26 HN LEU 26 -0.586 4.140 0.139
165 HA LEU 26 HA LEU 26 1.265 2.121 0.514
166 HB2 LEU 26 HB2 LEU 26 0.954 4.350 -1.417
167 HB3 LEU 26 HB1 LEU 26 2.511 3.553 -1.377
168 HG LEU 26 HG LEU 26 0.961 2.668 -3.106
169 HD11 LEU 26 HD11 LEU 26 2.643 1.178 -2.597
170 HD12 LEU 26 HD12 LEU 26 1.196 0.220 -2.286
171 HD13 LEU 26 HD13 LEU 26 2.081 0.943 -0.942
172 HD21 LEU 26 HD21 LEU 26 -0.708 2.180 -0.699
173 HD22 LEU 26 HD22 LEU 26 -0.745 0.988 -1.994
174 HD23 LEU 26 HD23 LEU 26 -1.180 2.662 -2.326
175 H CYS 27 HN CYS 27 3.108 1.964 1.606
176 HA CYS 27 HA CYS 27 4.711 2.562 3.142
177 HB2 CYS 27 HB2 CYS 27 6.445 4.083 2.096
178 HB3 CYS 27 HB1 CYS 27 6.020 2.654 1.163
179 H ASP 28 HN ASP 28 2.663 3.670 4.207
180 HA ASP 28 HA ASP 28 3.208 6.531 4.576
181 HB2 ASP 28 HB2 ASP 28 0.943 6.682 5.485
182 HB3 ASP 28 HB1 ASP 28 0.918 5.947 3.886
183 H GLY 29 HN GLY 29 3.793 3.574 6.025
184 HA2 GLY 29 HA2 GLY 29 5.229 3.741 8.030
185 HA3 GLY 29 HA1 GLY 29 4.033 4.853 8.677
186 H ASP 30 HN ASP 30 1.871 3.097 7.489
187 HA ASP 30 HA ASP 30 1.873 1.115 9.661
188 HB2 ASP 30 HB2 ASP 30 -0.378 2.469 8.173
189 HB3 ASP 30 HB1 ASP 30 -0.634 1.083 9.229
190 H LYS 31 HN LYS 31 2.504 -0.828 8.981
191 HA LYS 31 HA LYS 31 2.494 -1.709 6.319
192 HB2 LYS 31 HB2 LYS 31 2.998 -2.918 8.963
193 HB3 LYS 31 HB1 LYS 31 2.525 -4.044 7.700
194 HG2 LYS 31 HG2 LYS 31 4.350 -3.130 6.286
195 HG3 LYS 31 HG1 LYS 31 4.866 -2.158 7.664
196 HD2 LYS 31 HD2 LYS 31 6.149 -4.257 7.426
197 HD3 LYS 31 HD1 LYS 31 5.292 -4.142 8.963
198 HE2 LYS 31 HE2 LYS 31 3.831 -5.814 8.430
199 HE3 LYS 31 HE1 LYS 31 3.908 -5.480 6.702
200 HZ1 LYS 31 HZ1 LYS 31 6.192 -6.641 8.183
201 HZ2 LYS 31 HZ2 LYS 31 5.933 -6.616 6.512
202 HZ3 LYS 31 HZ3 LYS 31 4.982 -7.606 7.499
203 H ASP 32 HN ASP 32 0.436 -1.359 5.447
204 HA ASP 32 HA ASP 32 -1.878 -2.643 6.594
205 HB2 ASP 32 HB2 ASP 32 -1.688 -1.420 3.842
206 HB3 ASP 32 HB1 ASP 32 -3.124 -1.631 4.839
207 H CYS 33 HN CYS 33 0.463 -3.311 4.100
208 HA CYS 33 HA CYS 33 -1.007 -5.376 2.802
209 HB2 CYS 33 HB2 CYS 33 1.775 -4.331 2.713
210 HB3 CYS 33 HB1 CYS 33 1.520 -5.971 2.135
211 H ALA 34 HN ALA 34 0.133 -7.629 2.637
212 HA ALA 34 HA ALA 34 -0.145 -8.876 5.161
213 HB1 ALA 34 HB1 ALA 34 0.428 -9.722 2.409
214 HB2 ALA 34 HB2 ALA 34 -0.636 -10.437 3.620
215 HB3 ALA 34 HB3 ALA 34 1.096 -10.768 3.662
216 H ASP 35 HN ASP 35 2.705 -8.367 3.088
217 HA ASP 35 HA ASP 35 4.399 -8.804 5.458
218 HB2 ASP 35 HB2 ASP 35 6.200 -9.392 3.845
219 HB3 ASP 35 HB1 ASP 35 4.820 -10.482 3.762
220 H GLY 36 HN GLY 36 3.121 -6.300 4.737
221 HA2 GLY 36 HA2 GLY 36 3.662 -4.070 4.682
222 HA3 GLY 36 HA1 GLY 36 5.297 -4.555 5.102
223 H ALA 37 HN ALA 37 3.690 -5.676 2.209
224 HA ALA 37 HA ALA 37 5.789 -4.988 0.505
225 HB1 ALA 37 HB1 ALA 37 4.188 -6.690 -0.094
226 HB2 ALA 37 HB2 ALA 37 4.196 -5.433 -1.332
227 HB3 ALA 37 HB3 ALA 37 2.889 -5.498 -0.148
228 H ASP 38 HN ASP 38 2.832 -3.237 1.317
229 HA ASP 38 HA ASP 38 3.083 -1.203 -0.610
230 HB2 ASP 38 HB2 ASP 38 1.637 0.121 1.042
231 HB3 ASP 38 HB1 ASP 38 0.971 -1.381 0.412
232 H GLU 39 HN GLU 39 4.733 -1.762 2.371
233 HA GLU 39 HA GLU 39 5.722 0.975 2.510
234 HB2 GLU 39 HB2 GLU 39 6.292 -1.399 4.293
235 HB3 GLU 39 HB1 GLU 39 6.800 0.257 4.593
236 HG2 GLU 39 HG2 GLU 39 3.937 -0.001 4.156
237 HG3 GLU 39 HG1 GLU 39 4.519 -0.928 5.537
238 H SER 40 HN SER 40 6.445 -1.281 0.465
239 HA SER 40 HA SER 40 9.342 -0.803 0.620
240 HB2 SER 40 HB2 SER 40 7.947 -3.340 0.645
241 HB3 SER 40 HB1 SER 40 9.034 -3.232 -0.739
242 HG SER 40 HG SER 40 9.974 -4.040 1.273
243 H ILE 41 HN ILE 41 10.251 -1.724 -1.673
244 HA ILE 41 HA ILE 41 9.275 0.134 -3.598
245 HB ILE 41 HB ILE 41 11.272 -2.106 -3.889
246 HG12 ILE 41 HG12 ILE 41 11.945 -0.375 -2.295
247 HG13 ILE 41 HG11 ILE 41 12.941 -0.312 -3.744
248 HG21 ILE 41 HG21 ILE 41 11.994 -0.968 -5.936
249 HG22 ILE 41 HG22 ILE 41 10.663 0.175 -5.760
250 HG23 ILE 41 HG23 ILE 41 10.326 -1.532 -6.052
251 HD11 ILE 41 HD11 ILE 41 11.444 1.756 -2.548
252 HD12 ILE 41 HD12 ILE 41 10.718 1.407 -4.117
253 HD13 ILE 41 HD13 ILE 41 12.430 1.816 -4.009
254 H ALA 42 HN ALA 42 8.665 -3.210 -2.921
255 HA ALA 42 HA ALA 42 7.823 -4.210 -5.345
256 HB1 ALA 42 HB1 ALA 42 6.183 -4.873 -2.962
257 HB2 ALA 42 HB2 ALA 42 7.910 -5.227 -2.898
258 HB3 ALA 42 HB3 ALA 42 6.911 -5.934 -4.168
259 H ALA 43 HN ALA 43 6.275 -1.855 -3.320
260 HA ALA 43 HA ALA 43 3.770 -2.050 -4.800
261 HB1 ALA 43 HB1 ALA 43 4.077 -1.712 -2.223
262 HB2 ALA 43 HB2 ALA 43 2.765 -0.912 -3.088
263 HB3 ALA 43 HB3 ALA 43 4.227 -0.015 -2.678
264 H GLY 44 HN GLY 44 6.671 -0.482 -5.195
265 HA2 GLY 44 HA2 GLY 44 7.256 1.104 -6.773
266 HA3 GLY 44 HA1 GLY 44 5.552 1.299 -7.154
267 H CYS 45 HN CYS 45 6.983 1.646 -3.955
268 HA CYS 45 HA CYS 45 5.732 4.152 -3.532
269 HB2 CYS 45 HB2 CYS 45 6.245 2.644 -1.678
270 HB3 CYS 45 HB1 CYS 45 7.968 2.817 -1.991
271 H LEU 46 HN LEU 46 8.788 3.210 -4.849
272 HA LEU 46 HA LEU 46 10.422 4.399 -5.890
273 HB2 LEU 46 HB2 LEU 46 8.832 6.907 -5.430
274 HB3 LEU 46 HB1 LEU 46 9.982 6.569 -6.710
275 HG LEU 46 HG LEU 46 7.682 4.750 -6.686
276 HD11 LEU 46 HD11 LEU 46 5.968 6.172 -7.003
277 HD12 LEU 46 HD12 LEU 46 6.978 7.389 -7.785
278 HD13 LEU 46 HD13 LEU 46 6.961 7.255 -6.027
279 HD21 LEU 46 HD21 LEU 46 8.833 4.524 -8.621
280 HD22 LEU 46 HD22 LEU 46 9.403 6.193 -8.607
281 HD23 LEU 46 HD23 LEU 46 7.760 5.827 -9.133
282 H TYR 47 HN TYR 47 11.334 3.777 -3.667
283 HA TYR 47 HA TYR 47 12.653 6.138 -2.608
284 HB2 TYR 47 HB2 TYR 47 10.829 4.385 -0.999
285 HB3 TYR 47 HB1 TYR 47 12.220 5.137 -0.229
286 HD1 TYR 47 HD1 TYR 47 9.132 5.872 -2.129
287 HD2 TYR 47 HD2 TYR 47 12.146 7.388 0.456
288 HE1 TYR 47 HE1 TYR 47 7.828 7.932 -1.830
289 HE2 TYR 47 HE2 TYR 47 10.853 9.457 0.762
290 HH TYR 47 HH TYR 47 7.600 9.763 -0.297
291 H ASN 48 HN ASN 48 14.736 5.660 -2.750
292 HA ASN 48 HA ASN 48 15.803 3.117 -3.138
293 HB2 ASN 48 HB2 ASN 48 17.292 5.448 -1.924
294 HB3 ASN 48 HB1 ASN 48 17.964 4.121 -2.866
295 HD21 ASN 48 HD21 ASN 48 16.078 4.018 -4.910
296 HD22 ASN 48 HD22 ASN 48 16.218 5.452 -5.863
297 H SER 49 HN SER 49 16.112 5.111 -0.192
298 HA SER 49 HA SER 49 15.597 2.872 1.517
299 HB2 SER 49 HB2 SER 49 18.197 3.017 0.644
300 HB3 SER 49 HB1 SER 49 18.270 3.913 2.161
301 HG SER 49 HG SER 49 18.300 1.332 1.890
302 H THR 50 HN THR 50 15.405 3.459 3.725
303 HA THR 50 HA THR 50 15.899 6.170 4.554
304 HB THR 50 HB THR 50 13.451 6.511 5.183
305 HG1 THR 50 HG1 THR 50 13.151 4.438 3.274
306 HG21 THR 50 HG21 THR 50 12.920 7.610 3.233
307 HG22 THR 50 HG22 THR 50 13.708 6.406 2.214
308 HG23 THR 50 HG23 THR 50 14.680 7.538 3.155
Start of MODEL 3
1 H1 GLY 1 HT1 GLY 1 -17.887 0.547 1.955
2 H2 GLY 1 HT2 GLY 1 -18.786 1.148 3.256
3 H3 GLY 1 HT3 GLY 1 -17.700 -0.126 3.497
4 HA2 GLY 1 HA1 GLY 1 -16.391 1.537 4.256
5 HA3 GLY 1 HA2 GLY 1 -15.988 1.607 2.548
6 H SER 2 HN SER 2 -15.535 3.760 2.405
7 HA SER 2 HA SER 2 -17.799 5.582 2.884
8 HB2 SER 2 HB2 SER 2 -15.702 7.268 3.107
9 HB3 SER 2 HB1 SER 2 -16.425 6.441 4.487
10 HG SER 2 HG SER 2 -13.973 6.068 3.284
11 H GLU 3 HN GLU 3 -14.599 5.977 1.387
12 HA GLU 3 HA GLU 3 -15.684 6.112 -1.267
13 HB2 GLU 3 HB2 GLU 3 -14.964 8.473 -1.659
14 HB3 GLU 3 HB1 GLU 3 -16.344 8.314 -0.580
15 HG2 GLU 3 HG2 GLU 3 -14.562 8.397 1.299
16 HG3 GLU 3 HG1 GLU 3 -13.535 9.097 0.049
17 H GLY 4 HN GLY 4 -13.592 4.696 0.223
18 HA2 GLY 4 HA2 GLY 4 -11.689 3.915 -1.218
19 HA3 GLY 4 HA1 GLY 4 -11.227 5.608 -1.295
20 H LYS 5 HN LYS 5 -12.025 3.187 1.204
21 HA LYS 5 HA LYS 5 -9.887 4.319 2.866
22 HB2 LYS 5 HB2 LYS 5 -12.504 3.339 3.437
23 HB3 LYS 5 HB1 LYS 5 -11.345 2.303 4.257
24 HG2 LYS 5 HG2 LYS 5 -11.572 5.294 4.513
25 HG3 LYS 5 HG1 LYS 5 -12.030 4.090 5.718
26 HD2 LYS 5 HD2 LYS 5 -9.974 4.379 6.553
27 HD3 LYS 5 HD1 LYS 5 -9.417 3.437 5.169
28 HE2 LYS 5 HE2 LYS 5 -8.450 5.214 4.213
29 HE3 LYS 5 HE1 LYS 5 -9.834 6.255 4.545
30 HZ1 LYS 5 HZ1 LYS 5 -7.379 6.306 5.795
31 HZ2 LYS 5 HZ2 LYS 5 -8.434 5.643 6.938
32 HZ3 LYS 5 HZ3 LYS 5 -8.770 7.153 6.254
33 H THR 6 HN THR 6 -11.229 1.085 2.151
34 HA THR 6 HA THR 6 -8.887 -0.293 2.949
35 HB THR 6 HB THR 6 -10.269 -1.901 1.085
36 HG1 THR 6 HG1 THR 6 -11.975 -0.443 1.094
37 HG21 THR 6 HG21 THR 6 -9.332 -2.481 3.379
38 HG22 THR 6 HG22 THR 6 -10.850 -3.240 2.901
39 HG23 THR 6 HG23 THR 6 -10.859 -1.877 4.020
40 H CYS 7 HN CYS 7 -10.226 0.386 -0.278
41 HA CYS 7 HA CYS 7 -7.545 0.627 -1.354
42 HB2 CYS 7 HB2 CYS 7 -9.480 -1.430 -2.445
43 HB3 CYS 7 HB1 CYS 7 -7.915 -1.022 -3.138
44 H GLY 8 HN GLY 8 -8.660 2.804 -1.327
45 HA2 GLY 8 HA2 GLY 8 -10.814 3.437 -2.994
46 HA3 GLY 8 HA1 GLY 8 -9.556 4.558 -2.498
47 HA PRO 9 HA PRO 9 -9.397 4.194 -7.133
48 HB2 PRO 9 HB2 PRO 9 -8.482 6.784 -7.401
49 HB3 PRO 9 HB1 PRO 9 -10.181 6.308 -7.460
50 HG2 PRO 9 HG2 PRO 9 -8.604 7.433 -5.184
51 HG3 PRO 9 HG1 PRO 9 -10.265 7.798 -5.687
52 HD2 PRO 9 HD2 PRO 9 -9.756 6.197 -3.600
53 HD3 PRO 9 HD1 PRO 9 -11.117 5.881 -4.698
54 H SER 10 HN SER 10 -7.621 3.627 -8.255
55 HA SER 10 HA SER 10 -5.457 3.124 -8.731
56 HB2 SER 10 HB2 SER 10 -3.892 4.855 -8.621
57 HB3 SER 10 HB1 SER 10 -5.424 5.727 -8.626
58 HG SER 10 HG SER 10 -3.728 5.177 -6.430
59 H SER 11 HN SER 11 -6.472 1.691 -6.660
60 HA SER 11 HA SER 11 -4.697 1.782 -4.387
61 HB2 SER 11 HB2 SER 11 -7.237 0.919 -4.645
62 HB3 SER 11 HB1 SER 11 -6.386 -0.614 -4.837
63 HG SER 11 HG SER 11 -6.139 1.200 -2.668
64 H PHE 12 HN PHE 12 -3.039 0.404 -3.915
65 HA PHE 12 HA PHE 12 -1.949 -1.096 -6.161
66 HB2 PHE 12 HB2 PHE 12 -0.300 0.243 -5.149
67 HB3 PHE 12 HB1 PHE 12 -0.843 -0.157 -3.524
68 HD1 PHE 12 HD2 PHE 12 0.566 -1.837 -6.546
69 HD2 PHE 12 HD1 PHE 12 0.408 -1.631 -2.300
70 HE1 PHE 12 HE2 PHE 12 2.282 -3.595 -6.402
71 HE2 PHE 12 HE1 PHE 12 2.122 -3.389 -2.145
72 HZ PHE 12 HZ PHE 12 3.062 -4.373 -4.199
73 H SER 13 HN SER 13 -1.262 -3.290 -5.964
74 HA SER 13 HA SER 13 -2.822 -4.802 -3.979
75 HB2 SER 13 HB2 SER 13 -3.623 -5.409 -6.112
76 HB3 SER 13 HB1 SER 13 -2.003 -5.443 -6.805
77 HG SER 13 HG SER 13 -1.594 -7.338 -5.765
78 H CYS 14 HN CYS 14 -1.748 -5.923 -2.493
79 HA CYS 14 HA CYS 14 1.100 -5.940 -2.437
80 HB2 CYS 14 HB2 CYS 14 -0.642 -7.667 -0.696
81 HB3 CYS 14 HB1 CYS 14 0.915 -6.951 -0.314
82 HA PRO 15 HA PRO 15 1.752 -9.727 -4.653
83 HB2 PRO 15 HB2 PRO 15 4.324 -10.175 -4.021
84 HB3 PRO 15 HB1 PRO 15 3.844 -8.836 -5.070
85 HG2 PRO 15 HG2 PRO 15 4.539 -8.808 -2.159
86 HG3 PRO 15 HG1 PRO 15 5.011 -7.668 -3.432
87 HD2 PRO 15 HD2 PRO 15 2.974 -7.215 -1.667
88 HD3 PRO 15 HD1 PRO 15 3.041 -6.510 -3.292
89 H GLY 16 HN GLY 16 1.397 -11.836 -4.251
90 HA2 GLY 16 HA2 GLY 16 1.413 -13.868 -3.141
91 HA3 GLY 16 HA1 GLY 16 2.385 -13.130 -1.877
92 H THR 17 HN THR 17 -0.690 -11.835 -2.944
93 HA THR 17 HA THR 17 -2.395 -13.105 -1.143
94 HB THR 17 HB THR 17 -1.195 -12.212 0.692
95 HG1 THR 17 HG1 THR 17 -3.297 -10.369 0.242
96 HG21 THR 17 HG21 THR 17 -1.211 -9.576 -0.748
97 HG22 THR 17 HG22 THR 17 0.186 -10.556 -0.305
98 HG23 THR 17 HG23 THR 17 -0.776 -9.774 0.949
99 H HIS 18 HN HIS 18 -4.478 -11.939 -0.873
100 HA HIS 18 HA HIS 18 -5.001 -10.330 -3.262
101 HB2 HIS 18 HB2 HIS 18 -6.941 -11.719 -1.402
102 HB3 HIS 18 HB1 HIS 18 -7.359 -10.902 -2.906
103 HD1 HIS 18 HD1 HIS 18 -6.834 -14.189 -1.685
104 HD2 HIS 18 HD2 HIS 18 -5.747 -12.169 -5.149
105 HE1 HIS 18 HE1 HIS 18 -6.313 -15.965 -3.409
106 H VAL 19 HN VAL 19 -3.698 -9.021 -1.161
107 HA VAL 19 HA VAL 19 -5.812 -7.286 -0.063
108 HB VAL 19 HB VAL 19 -4.578 -8.213 1.748
109 HG11 VAL 19 HG11 VAL 19 -1.926 -7.359 1.432
110 HG12 VAL 19 HG12 VAL 19 -2.385 -8.117 -0.092
111 HG13 VAL 19 HG13 VAL 19 -2.538 -9.011 1.419
112 HG21 VAL 19 HG21 VAL 19 -4.795 -5.528 1.384
113 HG22 VAL 19 HG22 VAL 19 -3.068 -5.695 1.700
114 HG23 VAL 19 HG23 VAL 19 -4.241 -6.295 2.873
115 H CYS 20 HN CYS 20 -5.825 -5.154 -0.544
116 HA CYS 20 HA CYS 20 -3.584 -4.122 -2.150
117 HB2 CYS 20 HB2 CYS 20 -5.405 -2.622 -3.206
118 HB3 CYS 20 HB1 CYS 20 -5.301 -4.300 -3.725
119 H VAL 21 HN VAL 21 -3.216 -1.823 -2.023
120 HA VAL 21 HA VAL 21 -4.335 -0.542 0.371
121 HB VAL 21 HB VAL 21 -2.184 -1.419 1.048
122 HG11 VAL 21 HG11 VAL 21 -0.635 -1.724 -0.515
123 HG12 VAL 21 HG12 VAL 21 -0.270 -0.005 -0.367
124 HG13 VAL 21 HG13 VAL 21 -1.397 -0.564 -1.602
125 HG21 VAL 21 HG21 VAL 21 -2.934 0.887 1.763
126 HG22 VAL 21 HG22 VAL 21 -1.800 1.525 0.571
127 HG23 VAL 21 HG23 VAL 21 -1.209 0.550 1.917
128 HA PRO 22 HA PRO 22 -4.971 2.817 -2.488
129 HB2 PRO 22 HB2 PRO 22 -5.032 4.549 -0.102
130 HB3 PRO 22 HB1 PRO 22 -6.290 4.250 -1.305
131 HG2 PRO 22 HG2 PRO 22 -6.453 3.272 1.192
132 HG3 PRO 22 HG1 PRO 22 -7.083 2.386 -0.207
133 HD2 PRO 22 HD2 PRO 22 -4.557 1.958 1.328
134 HD3 PRO 22 HD1 PRO 22 -5.668 0.767 0.630
135 H GLU 23 HN GLU 23 -3.828 4.557 -3.354
136 HA GLU 23 HA GLU 23 -1.073 4.596 -3.085
137 HB2 GLU 23 HB2 GLU 23 -3.011 5.983 -4.606
138 HB3 GLU 23 HB1 GLU 23 -1.983 7.206 -3.874
139 HG2 GLU 23 HG2 GLU 23 -0.381 5.070 -4.921
140 HG3 GLU 23 HG1 GLU 23 -1.476 5.679 -6.161
141 H ARG 24 HN ARG 24 -3.507 6.337 -1.281
142 HA ARG 24 HA ARG 24 -1.741 8.206 -0.056
143 HB2 ARG 24 HB2 ARG 24 -4.325 8.279 -0.243
144 HB3 ARG 24 HB1 ARG 24 -4.309 7.252 1.184
145 HG2 ARG 24 HG2 ARG 24 -2.947 8.997 2.334
146 HG3 ARG 24 HG1 ARG 24 -3.199 10.036 0.930
147 HD2 ARG 24 HD2 ARG 24 -5.461 8.806 2.487
148 HD3 ARG 24 HD1 ARG 24 -4.778 10.384 2.876
149 HE ARG 24 HE ARG 24 -5.369 10.607 0.250
150 HH11 ARG 24 HH11 ARG 24 -7.222 9.581 3.023
151 HH12 ARG 24 HH12 ARG 24 -8.731 10.129 2.374
152 HH21 ARG 24 HH21 ARG 24 -7.353 11.327 -0.606
153 HH22 ARG 24 HH22 ARG 24 -8.806 11.119 0.314
154 H TRP 25 HN TRP 25 -2.653 4.919 0.570
155 HA TRP 25 HA TRP 25 -1.377 4.920 3.199
156 HB2 TRP 25 HB2 TRP 25 -2.986 2.875 1.680
157 HB3 TRP 25 HB1 TRP 25 -2.154 2.492 3.180
158 HD1 TRP 25 HD1 TRP 25 -3.829 5.892 2.919
159 HE1 TRP 25 HE1 TRP 25 -5.897 5.922 4.454
160 HE3 TRP 25 HE3 TRP 25 -3.985 0.940 4.168
161 HZ2 TRP 25 HZ2 TRP 25 -7.394 4.086 5.994
162 HZ3 TRP 25 HZ3 TRP 25 -5.763 0.156 5.675
163 HH2 TRP 25 HH2 TRP 25 -7.433 1.698 6.570
164 H LEU 26 HN LEU 26 -0.259 4.794 0.167
165 HA LEU 26 HA LEU 26 1.384 2.450 0.261
166 HB2 LEU 26 HB2 LEU 26 0.901 4.686 -1.579
167 HB3 LEU 26 HB1 LEU 26 2.530 4.046 -1.630
168 HG LEU 26 HG LEU 26 0.976 3.058 -3.310
169 HD11 LEU 26 HD11 LEU 26 2.592 1.569 -1.361
170 HD12 LEU 26 HD12 LEU 26 2.681 1.612 -3.121
171 HD13 LEU 26 HD13 LEU 26 1.479 0.598 -2.324
172 HD21 LEU 26 HD21 LEU 26 -0.446 1.155 -2.090
173 HD22 LEU 26 HD22 LEU 26 -1.102 2.746 -2.468
174 HD23 LEU 26 HD23 LEU 26 -0.515 2.398 -0.843
175 H CYS 27 HN CYS 27 3.138 2.224 1.442
176 HA CYS 27 HA CYS 27 4.806 2.743 2.926
177 HB2 CYS 27 HB2 CYS 27 6.657 4.058 1.804
178 HB3 CYS 27 HB1 CYS 27 6.101 2.628 0.944
179 H ASP 28 HN ASP 28 3.153 3.970 4.226
180 HA ASP 28 HA ASP 28 3.917 6.811 4.404
181 HB2 ASP 28 HB2 ASP 28 1.446 6.216 5.791
182 HB3 ASP 28 HB1 ASP 28 1.761 7.406 4.535
183 H GLY 29 HN GLY 29 3.994 3.804 5.975
184 HA2 GLY 29 HA2 GLY 29 5.519 3.778 7.926
185 HA3 GLY 29 HA1 GLY 29 4.605 5.148 8.534
186 H ASP 30 HN ASP 30 3.148 2.349 6.999
187 HA ASP 30 HA ASP 30 2.466 1.092 9.501
188 HB2 ASP 30 HB2 ASP 30 0.669 3.008 8.284
189 HB3 ASP 30 HB1 ASP 30 -0.074 1.413 8.350
190 H LYS 31 HN LYS 31 3.400 -0.752 8.626
191 HA LYS 31 HA LYS 31 3.030 -1.810 6.099
192 HB2 LYS 31 HB2 LYS 31 3.819 -2.899 8.732
193 HB3 LYS 31 HB1 LYS 31 3.287 -4.074 7.540
194 HG2 LYS 31 HG2 LYS 31 4.948 -3.044 5.954
195 HG3 LYS 31 HG1 LYS 31 5.577 -2.145 7.335
196 HD2 LYS 31 HD2 LYS 31 6.859 -4.194 6.916
197 HD3 LYS 31 HD1 LYS 31 6.067 -4.223 8.492
198 HE2 LYS 31 HE2 LYS 31 4.738 -5.953 7.933
199 HE3 LYS 31 HE1 LYS 31 4.492 -5.365 6.290
200 HZ1 LYS 31 HZ1 LYS 31 6.733 -6.177 5.746
201 HZ2 LYS 31 HZ2 LYS 31 5.701 -7.422 6.240
202 HZ3 LYS 31 HZ3 LYS 31 6.872 -6.823 7.304
203 H ASP 32 HN ASP 32 0.927 -1.645 5.368
204 HA ASP 32 HA ASP 32 -1.182 -3.041 6.825
205 HB2 ASP 32 HB2 ASP 32 -1.495 -1.611 4.189
206 HB3 ASP 32 HB1 ASP 32 -2.729 -1.958 5.396
207 H CYS 33 HN CYS 33 0.784 -3.317 3.959
208 HA CYS 33 HA CYS 33 -0.710 -5.300 2.621
209 HB2 CYS 33 HB2 CYS 33 2.031 -4.189 2.449
210 HB3 CYS 33 HB1 CYS 33 1.811 -5.801 1.783
211 H ALA 34 HN ALA 34 0.760 -7.457 2.129
212 HA ALA 34 HA ALA 34 0.469 -9.010 4.499
213 HB1 ALA 34 HB1 ALA 34 0.049 -10.369 2.746
214 HB2 ALA 34 HB2 ALA 34 1.781 -10.683 2.856
215 HB3 ALA 34 HB3 ALA 34 1.169 -9.520 1.680
216 H ASP 35 HN ASP 35 3.320 -8.224 2.505
217 HA ASP 35 HA ASP 35 4.989 -8.687 4.890
218 HB2 ASP 35 HB2 ASP 35 5.696 -9.064 1.972
219 HB3 ASP 35 HB1 ASP 35 6.833 -9.223 3.307
220 H GLY 36 HN GLY 36 3.728 -6.217 4.381
221 HA2 GLY 36 HA2 GLY 36 4.231 -3.978 4.388
222 HA3 GLY 36 HA1 GLY 36 5.905 -4.452 4.634
223 H ALA 37 HN ALA 37 4.029 -5.439 1.849
224 HA ALA 37 HA ALA 37 5.942 -4.697 -0.024
225 HB1 ALA 37 HB1 ALA 37 3.176 -4.622 -0.999
226 HB2 ALA 37 HB2 ALA 37 3.609 -6.084 -0.113
227 HB3 ALA 37 HB3 ALA 37 4.543 -5.602 -1.529
228 H ASP 38 HN ASP 38 3.002 -2.959 0.967
229 HA ASP 38 HA ASP 38 3.242 -0.786 -0.764
230 HB2 ASP 38 HB2 ASP 38 1.827 0.431 0.873
231 HB3 ASP 38 HB1 ASP 38 1.205 -1.169 0.491
232 H GLU 39 HN GLU 39 4.935 -1.548 2.170
233 HA GLU 39 HA GLU 39 6.030 1.124 2.447
234 HB2 GLU 39 HB2 GLU 39 6.984 -1.263 3.991
235 HB3 GLU 39 HB1 GLU 39 6.908 0.420 4.489
236 HG2 GLU 39 HG2 GLU 39 4.569 -1.434 4.127
237 HG3 GLU 39 HG1 GLU 39 5.256 -0.901 5.659
238 H SER 40 HN SER 40 6.639 -1.131 0.261
239 HA SER 40 HA SER 40 9.524 -0.562 0.237
240 HB2 SER 40 HB2 SER 40 8.152 -3.162 0.169
241 HB3 SER 40 HB1 SER 40 9.384 -2.956 -1.076
242 HG SER 40 HG SER 40 10.912 -2.743 0.447
243 H ILE 41 HN ILE 41 10.463 -1.037 -2.013
244 HA ILE 41 HA ILE 41 9.225 0.642 -3.882
245 HB ILE 41 HB ILE 41 11.444 -1.368 -4.137
246 HG12 ILE 41 HG12 ILE 41 12.763 0.718 -4.546
247 HG13 ILE 41 HG11 ILE 41 11.302 1.648 -4.236
248 HG21 ILE 41 HG21 ILE 41 10.295 0.357 -6.325
249 HG22 ILE 41 HG22 ILE 41 10.400 -1.403 -6.295
250 HG23 ILE 41 HG23 ILE 41 11.869 -0.434 -6.408
251 HD11 ILE 41 HD11 ILE 41 12.320 -0.285 -2.203
252 HD12 ILE 41 HD12 ILE 41 11.305 1.141 -1.984
253 HD13 ILE 41 HD13 ILE 41 13.021 1.326 -2.348
254 H ALA 42 HN ALA 42 8.801 -2.721 -3.208
255 HA ALA 42 HA ALA 42 7.914 -3.780 -5.586
256 HB1 ALA 42 HB1 ALA 42 8.118 -4.796 -3.176
257 HB2 ALA 42 HB2 ALA 42 7.008 -5.493 -4.356
258 HB3 ALA 42 HB3 ALA 42 6.398 -4.414 -3.100
259 H ALA 43 HN ALA 43 6.344 -1.470 -3.521
260 HA ALA 43 HA ALA 43 3.800 -1.729 -4.906
261 HB1 ALA 43 HB1 ALA 43 2.860 -0.630 -3.161
262 HB2 ALA 43 HB2 ALA 43 4.246 0.440 -2.945
263 HB3 ALA 43 HB3 ALA 43 4.310 -1.218 -2.346
264 H GLY 44 HN GLY 44 6.662 0.164 -5.067
265 HA2 GLY 44 HA2 GLY 44 6.988 1.422 -7.130
266 HA3 GLY 44 HA1 GLY 44 5.320 1.954 -6.991
267 H CYS 45 HN CYS 45 6.942 1.919 -3.998
268 HA CYS 45 HA CYS 45 6.715 4.710 -3.676
269 HB2 CYS 45 HB2 CYS 45 6.894 2.772 -1.906
270 HB3 CYS 45 HB1 CYS 45 8.618 3.112 -2.003
271 H LEU 46 HN LEU 46 9.302 2.644 -4.753
272 HA LEU 46 HA LEU 46 11.266 3.061 -5.794
273 HB2 LEU 46 HB2 LEU 46 10.236 5.891 -5.958
274 HB3 LEU 46 HB1 LEU 46 11.615 5.260 -6.837
275 HG LEU 46 HG LEU 46 9.014 3.864 -7.188
276 HD11 LEU 46 HD11 LEU 46 8.382 6.221 -7.303
277 HD12 LEU 46 HD12 LEU 46 8.299 5.453 -8.889
278 HD13 LEU 46 HD13 LEU 46 9.656 6.507 -8.490
279 HD21 LEU 46 HD21 LEU 46 10.020 4.051 -9.613
280 HD22 LEU 46 HD22 LEU 46 10.628 2.861 -8.462
281 HD23 LEU 46 HD23 LEU 46 11.512 4.365 -8.726
282 H TYR 47 HN TYR 47 11.108 6.295 -4.345
283 HA TYR 47 HA TYR 47 13.688 6.398 -3.482
284 HB2 TYR 47 HB2 TYR 47 13.109 8.255 -2.139
285 HB3 TYR 47 HB1 TYR 47 11.984 8.267 -3.489
286 HD1 TYR 47 HD1 TYR 47 9.626 7.591 -3.131
287 HD2 TYR 47 HD2 TYR 47 12.354 7.990 0.106
288 HE1 TYR 47 HE1 TYR 47 7.737 7.680 -1.558
289 HE2 TYR 47 HE2 TYR 47 10.475 8.077 1.689
290 HH TYR 47 HH TYR 47 7.698 7.042 1.308
291 H ASN 48 HN ASN 48 14.726 4.914 -2.392
292 HA ASN 48 HA ASN 48 15.062 3.135 -0.940
293 HB2 ASN 48 HB2 ASN 48 14.970 5.746 0.443
294 HB3 ASN 48 HB1 ASN 48 15.010 4.325 1.481
295 HD21 ASN 48 HD21 ASN 48 17.081 5.851 1.771
296 HD22 ASN 48 HD22 ASN 48 18.483 5.241 0.967
297 H SER 49 HN SER 49 13.051 4.777 1.422
298 HA SER 49 HA SER 49 11.279 4.071 2.656
299 HB2 SER 49 HB2 SER 49 10.513 2.729 0.052
300 HB3 SER 49 HB1 SER 49 9.437 2.960 1.430
301 HG SER 49 HG SER 49 10.767 5.119 0.180
302 H THR 50 HN THR 50 13.734 2.401 2.483
303 HA THR 50 HA THR 50 14.521 0.418 3.268
304 HB THR 50 HB THR 50 11.899 -0.286 4.489
305 HG1 THR 50 HG1 THR 50 13.448 1.954 5.279
306 HG21 THR 50 HG21 THR 50 13.239 -0.733 6.452
307 HG22 THR 50 HG22 THR 50 14.672 -0.104 5.639
308 HG23 THR 50 HG23 THR 50 13.897 -1.574 5.049
Start of MODEL 4
1 H1 GLY 1 HT1 GLY 1 -14.016 2.897 7.242
2 H2 GLY 1 HT2 GLY 1 -13.757 3.529 5.695
3 H3 GLY 1 HT3 GLY 1 -14.271 1.928 5.879
4 HA2 GLY 1 HA1 GLY 1 -16.305 2.738 5.485
5 HA3 GLY 1 HA2 GLY 1 -16.222 3.199 7.178
6 H SER 2 HN SER 2 -15.432 4.373 3.921
7 HA SER 2 HA SER 2 -16.679 6.892 4.429
8 HB2 SER 2 HB2 SER 2 -14.184 6.852 5.431
9 HB3 SER 2 HB1 SER 2 -13.811 7.292 3.765
10 HG SER 2 HG SER 2 -15.603 8.637 5.509
11 H GLU 3 HN GLU 3 -17.773 6.012 2.557
12 HA GLU 3 HA GLU 3 -18.232 5.935 0.331
13 HB2 GLU 3 HB2 GLU 3 -16.925 8.302 0.738
14 HB3 GLU 3 HB1 GLU 3 -15.934 7.566 -0.514
15 HG2 GLU 3 HG2 GLU 3 -17.598 8.952 -1.534
16 HG3 GLU 3 HG1 GLU 3 -17.956 7.263 -1.891
17 H GLY 4 HN GLY 4 -16.372 4.003 1.509
18 HA2 GLY 4 HA2 GLY 4 -15.168 2.194 0.762
19 HA3 GLY 4 HA1 GLY 4 -15.565 2.697 -0.874
20 H LYS 5 HN LYS 5 -13.316 3.169 1.797
21 HA LYS 5 HA LYS 5 -11.393 4.357 -0.086
22 HB2 LYS 5 HB2 LYS 5 -10.234 5.255 1.845
23 HB3 LYS 5 HB1 LYS 5 -11.932 5.709 1.912
24 HG2 LYS 5 HG2 LYS 5 -12.179 3.615 3.415
25 HG3 LYS 5 HG1 LYS 5 -10.430 3.757 3.601
26 HD2 LYS 5 HD2 LYS 5 -12.213 6.125 4.035
27 HD3 LYS 5 HD1 LYS 5 -11.973 4.933 5.313
28 HE2 LYS 5 HE2 LYS 5 -10.385 6.666 5.667
29 HE3 LYS 5 HE1 LYS 5 -9.503 5.276 5.036
30 HZ1 LYS 5 HZ1 LYS 5 -9.232 7.731 4.075
31 HZ2 LYS 5 HZ2 LYS 5 -10.473 7.182 3.066
32 HZ3 LYS 5 HZ3 LYS 5 -9.005 6.345 3.132
33 H THR 6 HN THR 6 -11.905 1.551 -0.062
34 HA THR 6 HA THR 6 -9.626 0.367 1.315
35 HB THR 6 HB THR 6 -10.730 -1.681 -0.100
36 HG1 THR 6 HG1 THR 6 -12.996 -1.373 0.046
37 HG21 THR 6 HG21 THR 6 -11.386 -2.504 1.881
38 HG22 THR 6 HG22 THR 6 -12.229 -1.024 2.341
39 HG23 THR 6 HG23 THR 6 -10.477 -1.131 2.512
40 H CYS 7 HN CYS 7 -10.781 0.995 -1.959
41 HA CYS 7 HA CYS 7 -8.061 0.782 -2.944
42 HB2 CYS 7 HB2 CYS 7 -10.272 -0.912 -4.123
43 HB3 CYS 7 HB1 CYS 7 -8.632 -0.780 -4.745
44 H GLY 8 HN GLY 8 -8.623 3.102 -3.059
45 HA2 GLY 8 HA2 GLY 8 -10.631 4.142 -4.708
46 HA3 GLY 8 HA1 GLY 8 -9.138 4.969 -4.289
47 HA PRO 9 HA PRO 9 -9.265 4.368 -8.924
48 HB2 PRO 9 HB2 PRO 9 -7.754 6.672 -9.293
49 HB3 PRO 9 HB1 PRO 9 -9.515 6.579 -9.385
50 HG2 PRO 9 HG2 PRO 9 -7.776 7.455 -7.122
51 HG3 PRO 9 HG1 PRO 9 -9.327 8.117 -7.669
52 HD2 PRO 9 HD2 PRO 9 -9.171 6.555 -5.503
53 HD3 PRO 9 HD1 PRO 9 -10.551 6.448 -6.616
54 H SER 10 HN SER 10 -6.774 4.924 -6.550
55 HA SER 10 HA SER 10 -4.852 3.536 -8.300
56 HB2 SER 10 HB2 SER 10 -3.126 4.835 -6.802
57 HB3 SER 10 HB1 SER 10 -3.883 5.642 -8.174
58 HG SER 10 HG SER 10 -4.959 5.765 -5.562
59 H SER 11 HN SER 11 -5.562 1.549 -7.356
60 HA SER 11 HA SER 11 -4.796 1.185 -4.540
61 HB2 SER 11 HB2 SER 11 -6.140 -1.124 -5.457
62 HB3 SER 11 HB1 SER 11 -6.749 0.105 -4.350
63 HG SER 11 HG SER 11 -8.027 0.768 -5.868
64 H PHE 12 HN PHE 12 -3.170 -0.132 -3.997
65 HA PHE 12 HA PHE 12 -1.782 -1.538 -6.169
66 HB2 PHE 12 HB2 PHE 12 -0.280 -0.036 -5.142
67 HB3 PHE 12 HB1 PHE 12 -0.860 -0.424 -3.527
68 HD1 PHE 12 HD2 PHE 12 0.707 -2.169 -6.436
69 HD2 PHE 12 HD1 PHE 12 0.504 -1.698 -2.211
70 HE1 PHE 12 HE2 PHE 12 2.528 -3.803 -6.171
71 HE2 PHE 12 HE1 PHE 12 2.322 -3.334 -1.938
72 HZ PHE 12 HZ PHE 12 3.338 -4.387 -3.918
73 H SER 13 HN SER 13 -1.040 -3.676 -5.863
74 HA SER 13 HA SER 13 -2.542 -5.166 -3.814
75 HB2 SER 13 HB2 SER 13 -3.211 -5.688 -6.130
76 HB3 SER 13 HB1 SER 13 -1.548 -6.136 -6.503
77 HG SER 13 HG SER 13 -3.158 -7.848 -5.854
78 H CYS 14 HN CYS 14 -1.425 -6.259 -2.330
79 HA CYS 14 HA CYS 14 1.408 -6.099 -2.235
80 HB2 CYS 14 HB2 CYS 14 -0.240 -7.985 -0.567
81 HB3 CYS 14 HB1 CYS 14 1.262 -7.183 -0.141
82 HA PRO 15 HA PRO 15 2.388 -9.685 -4.662
83 HB2 PRO 15 HB2 PRO 15 4.955 -10.035 -3.859
84 HB3 PRO 15 HB1 PRO 15 4.464 -8.739 -4.955
85 HG2 PRO 15 HG2 PRO 15 4.958 -8.638 -2.003
86 HG3 PRO 15 HG1 PRO 15 5.470 -7.496 -3.260
87 HD2 PRO 15 HD2 PRO 15 3.331 -7.040 -1.681
88 HD3 PRO 15 HD1 PRO 15 3.399 -6.487 -3.365
89 H GLY 16 HN GLY 16 2.231 -11.848 -4.416
90 HA2 GLY 16 HA2 GLY 16 2.566 -13.923 -3.352
91 HA3 GLY 16 HA1 GLY 16 2.943 -13.073 -1.862
92 H THR 17 HN THR 17 0.686 -11.426 -1.679
93 HA THR 17 HA THR 17 -1.415 -13.437 -1.206
94 HB THR 17 HB THR 17 -0.747 -12.618 0.896
95 HG1 THR 17 HG1 THR 17 -2.889 -10.904 0.210
96 HG21 THR 17 HG21 THR 17 -0.716 -9.883 -0.332
97 HG22 THR 17 HG22 THR 17 0.625 -10.769 0.393
98 HG23 THR 17 HG23 THR 17 -0.684 -10.166 1.408
99 H HIS 18 HN HIS 18 -3.666 -12.368 -1.067
100 HA HIS 18 HA HIS 18 -3.979 -10.694 -3.460
101 HB2 HIS 18 HB2 HIS 18 -6.144 -12.280 -2.083
102 HB3 HIS 18 HB1 HIS 18 -6.167 -11.605 -3.710
103 HD1 HIS 18 HD1 HIS 18 -3.093 -12.825 -4.135
104 HD2 HIS 18 HD2 HIS 18 -6.630 -14.809 -3.231
105 HE1 HIS 18 HE1 HIS 18 -2.777 -15.220 -4.887
106 H VAL 19 HN VAL 19 -3.204 -9.136 -1.491
107 HA VAL 19 HA VAL 19 -5.665 -7.950 -0.384
108 HB VAL 19 HB VAL 19 -4.434 -8.441 1.513
109 HG11 VAL 19 HG11 VAL 19 -1.861 -7.675 1.444
110 HG12 VAL 19 HG12 VAL 19 -2.102 -8.116 -0.246
111 HG13 VAL 19 HG13 VAL 19 -2.417 -9.294 1.026
112 HG21 VAL 19 HG21 VAL 19 -4.876 -5.881 1.069
113 HG22 VAL 19 HG22 VAL 19 -3.114 -5.808 1.103
114 HG23 VAL 19 HG23 VAL 19 -3.998 -6.424 2.499
115 H CYS 20 HN CYS 20 -6.047 -5.778 -0.638
116 HA CYS 20 HA CYS 20 -4.296 -4.397 -2.560
117 HB2 CYS 20 HB2 CYS 20 -6.315 -4.642 -3.678
118 HB3 CYS 20 HB1 CYS 20 -7.269 -4.472 -2.213
119 H VAL 21 HN VAL 21 -4.015 -2.124 -2.333
120 HA VAL 21 HA VAL 21 -4.758 -0.926 0.223
121 HB VAL 21 HB VAL 21 -2.637 -1.833 0.810
122 HG11 VAL 21 HG11 VAL 21 -1.923 -1.092 -1.950
123 HG12 VAL 21 HG12 VAL 21 -1.433 -2.481 -0.980
124 HG13 VAL 21 HG13 VAL 21 -0.648 -0.920 -0.744
125 HG21 VAL 21 HG21 VAL 21 -3.064 0.951 0.702
126 HG22 VAL 21 HG22 VAL 21 -1.369 0.676 0.305
127 HG23 VAL 21 HG23 VAL 21 -2.035 0.050 1.813
128 HA PRO 22 HA PRO 22 -5.329 2.463 -2.625
129 HB2 PRO 22 HB2 PRO 22 -5.941 4.383 -0.817
130 HB3 PRO 22 HB1 PRO 22 -7.078 3.110 -1.276
131 HG2 PRO 22 HG2 PRO 22 -5.323 3.304 1.140
132 HG3 PRO 22 HG1 PRO 22 -7.011 2.777 1.022
133 HD2 PRO 22 HD2 PRO 22 -4.926 1.042 1.198
134 HD3 PRO 22 HD1 PRO 22 -6.431 0.658 0.343
135 H GLU 23 HN GLU 23 -4.143 4.185 -3.393
136 HA GLU 23 HA GLU 23 -1.455 4.372 -2.896
137 HB2 GLU 23 HB2 GLU 23 -3.181 5.581 -4.629
138 HB3 GLU 23 HB1 GLU 23 -2.697 6.942 -3.628
139 HG2 GLU 23 HG2 GLU 23 -0.449 6.732 -4.227
140 HG3 GLU 23 HG1 GLU 23 -0.678 5.100 -4.851
141 H ARG 24 HN ARG 24 -4.062 6.141 -1.306
142 HA ARG 24 HA ARG 24 -2.528 8.001 0.108
143 HB2 ARG 24 HB2 ARG 24 -5.162 7.574 -0.117
144 HB3 ARG 24 HB1 ARG 24 -4.904 6.824 1.453
145 HG2 ARG 24 HG2 ARG 24 -4.219 8.825 2.432
146 HG3 ARG 24 HG1 ARG 24 -3.907 9.587 0.871
147 HD2 ARG 24 HD2 ARG 24 -6.069 10.165 0.575
148 HD3 ARG 24 HD1 ARG 24 -6.674 8.683 1.313
149 HE ARG 24 HE ARG 24 -6.206 11.204 2.611
150 HH11 ARG 24 HH11 ARG 24 -6.482 7.757 3.072
151 HH12 ARG 24 HH12 ARG 24 -6.914 7.888 4.744
152 HH21 ARG 24 HH21 ARG 24 -6.774 11.381 4.810
153 HH22 ARG 24 HH22 ARG 24 -7.081 9.946 5.731
154 H TRP 25 HN TRP 25 -3.061 4.612 0.624
155 HA TRP 25 HA TRP 25 -1.832 4.702 3.273
156 HB2 TRP 25 HB2 TRP 25 -3.292 2.578 1.726
157 HB3 TRP 25 HB1 TRP 25 -2.343 2.173 3.151
158 HD1 TRP 25 HD1 TRP 25 -4.115 5.478 3.377
159 HE1 TRP 25 HE1 TRP 25 -6.130 5.273 4.965
160 HE3 TRP 25 HE3 TRP 25 -4.212 0.395 3.913
161 HZ2 TRP 25 HZ2 TRP 25 -7.570 3.227 6.272
162 HZ3 TRP 25 HZ3 TRP 25 -5.940 -0.607 5.349
163 HH2 TRP 25 HH2 TRP 25 -7.583 0.781 6.505
164 H LEU 26 HN LEU 26 -1.045 4.030 -0.001
165 HA LEU 26 HA LEU 26 0.968 2.140 0.200
166 HB2 LEU 26 HB2 LEU 26 0.331 4.347 -1.668
167 HB3 LEU 26 HB1 LEU 26 1.963 3.717 -1.741
168 HG LEU 26 HG LEU 26 0.452 2.667 -3.385
169 HD11 LEU 26 HD11 LEU 26 1.525 0.698 -3.233
170 HD12 LEU 26 HD12 LEU 26 1.010 0.424 -1.569
171 HD13 LEU 26 HD13 LEU 26 2.375 1.488 -1.905
172 HD21 LEU 26 HD21 LEU 26 -1.145 2.197 -0.955
173 HD22 LEU 26 HD22 LEU 26 -1.052 0.850 -2.086
174 HD23 LEU 26 HD23 LEU 26 -1.656 2.415 -2.627
175 H CYS 27 HN CYS 27 2.843 2.098 1.226
176 HA CYS 27 HA CYS 27 4.471 2.803 2.690
177 HB2 CYS 27 HB2 CYS 27 6.021 4.504 1.452
178 HB3 CYS 27 HB1 CYS 27 5.835 2.872 0.826
179 H ASP 28 HN ASP 28 2.454 3.881 3.810
180 HA ASP 28 HA ASP 28 2.893 6.773 4.045
181 HB2 ASP 28 HB2 ASP 28 0.683 6.829 5.128
182 HB3 ASP 28 HB1 ASP 28 0.599 6.094 3.531
183 H GLY 29 HN GLY 29 3.664 3.884 5.577
184 HA2 GLY 29 HA2 GLY 29 5.226 4.182 7.472
185 HA3 GLY 29 HA1 GLY 29 4.043 5.290 8.148
186 H ASP 30 HN ASP 30 1.846 3.457 7.209
187 HA ASP 30 HA ASP 30 2.040 1.574 9.455
188 HB2 ASP 30 HB2 ASP 30 0.075 3.377 8.907
189 HB3 ASP 30 HB1 ASP 30 -0.572 1.936 8.127
190 H LYS 31 HN LYS 31 2.355 -0.499 9.024
191 HA LYS 31 HA LYS 31 2.576 -1.548 6.439
192 HB2 LYS 31 HB2 LYS 31 2.693 -2.574 9.178
193 HB3 LYS 31 HB1 LYS 31 2.114 -3.757 8.018
194 HG2 LYS 31 HG2 LYS 31 4.194 -3.006 6.641
195 HG3 LYS 31 HG1 LYS 31 4.772 -2.428 8.205
196 HD2 LYS 31 HD2 LYS 31 4.743 -4.581 9.138
197 HD3 LYS 31 HD1 LYS 31 3.719 -5.217 7.849
198 HE2 LYS 31 HE2 LYS 31 5.459 -5.566 6.460
199 HE3 LYS 31 HE1 LYS 31 6.298 -4.104 6.977
200 HZ1 LYS 31 HZ1 LYS 31 6.136 -6.512 8.690
201 HZ2 LYS 31 HZ2 LYS 31 7.191 -5.197 8.830
202 HZ3 LYS 31 HZ3 LYS 31 7.375 -6.296 7.558
203 H ASP 32 HN ASP 32 0.621 -0.951 5.358
204 HA ASP 32 HA ASP 32 -1.891 -2.051 6.247
205 HB2 ASP 32 HB2 ASP 32 -1.284 -0.850 3.542
206 HB3 ASP 32 HB1 ASP 32 -2.855 -1.006 4.319
207 H CYS 33 HN CYS 33 0.658 -2.899 4.040
208 HA CYS 33 HA CYS 33 -0.809 -4.954 2.677
209 HB2 CYS 33 HB2 CYS 33 1.878 -3.786 2.574
210 HB3 CYS 33 HB1 CYS 33 1.864 -5.520 2.284
211 H ALA 34 HN ALA 34 -0.299 -7.242 2.803
212 HA ALA 34 HA ALA 34 -0.381 -8.277 5.386
213 HB1 ALA 34 HB1 ALA 34 -0.229 -10.422 4.415
214 HB2 ALA 34 HB2 ALA 34 0.650 -9.810 3.013
215 HB3 ALA 34 HB3 ALA 34 -1.056 -9.417 3.225
216 H ASP 35 HN ASP 35 2.340 -7.624 3.276
217 HA ASP 35 HA ASP 35 4.155 -8.346 5.481
218 HB2 ASP 35 HB2 ASP 35 4.275 -9.016 2.586
219 HB3 ASP 35 HB1 ASP 35 5.796 -8.613 3.378
220 H GLY 36 HN GLY 36 2.894 -5.771 4.805
221 HA2 GLY 36 HA2 GLY 36 3.471 -3.554 4.689
222 HA3 GLY 36 HA1 GLY 36 5.059 -4.063 5.233
223 H ALA 37 HN ALA 37 3.844 -5.376 2.273
224 HA ALA 37 HA ALA 37 6.022 -4.671 0.734
225 HB1 ALA 37 HB1 ALA 37 4.987 -5.875 -0.827
226 HB2 ALA 37 HB2 ALA 37 3.607 -4.776 -0.863
227 HB3 ALA 37 HB3 ALA 37 3.669 -6.075 0.328
228 H ASP 38 HN ASP 38 2.965 -2.938 1.139
229 HA ASP 38 HA ASP 38 3.371 -0.932 -0.756
230 HB2 ASP 38 HB2 ASP 38 1.861 0.441 0.836
231 HB3 ASP 38 HB1 ASP 38 1.206 -1.026 0.119
232 H GLU 39 HN GLU 39 4.865 -1.447 2.304
233 HA GLU 39 HA GLU 39 5.830 1.285 2.525
234 HB2 GLU 39 HB2 GLU 39 6.521 -1.122 4.216
235 HB3 GLU 39 HB1 GLU 39 6.843 0.561 4.603
236 HG2 GLU 39 HG2 GLU 39 4.037 0.050 4.079
237 HG3 GLU 39 HG1 GLU 39 4.671 -0.912 5.412
238 H SER 40 HN SER 40 6.631 -0.964 0.446
239 HA SER 40 HA SER 40 9.504 -0.367 0.604
240 HB2 SER 40 HB2 SER 40 8.278 -2.931 0.798
241 HB3 SER 40 HB1 SER 40 9.140 -2.859 -0.737
242 HG SER 40 HG SER 40 10.264 -3.455 1.407
243 H ILE 41 HN ILE 41 10.285 -1.578 -1.751
244 HA ILE 41 HA ILE 41 9.386 0.343 -3.679
245 HB ILE 41 HB ILE 41 11.297 -1.976 -3.900
246 HG12 ILE 41 HG12 ILE 41 12.930 -0.029 -4.154
247 HG13 ILE 41 HG11 ILE 41 11.619 1.002 -3.596
248 HG21 ILE 41 HG21 ILE 41 11.976 -1.004 -6.065
249 HG22 ILE 41 HG22 ILE 41 10.625 0.124 -5.954
250 HG23 ILE 41 HG23 ILE 41 10.318 -1.608 -6.078
251 HD11 ILE 41 HD11 ILE 41 11.652 0.110 -1.468
252 HD12 ILE 41 HD12 ILE 41 13.360 0.135 -1.905
253 HD13 ILE 41 HD13 ILE 41 12.450 -1.373 -1.991
254 H ALA 42 HN ALA 42 8.559 -2.911 -2.866
255 HA ALA 42 HA ALA 42 7.643 -3.987 -5.221
256 HB1 ALA 42 HB1 ALA 42 6.022 -4.284 -2.724
257 HB2 ALA 42 HB2 ALA 42 7.654 -4.947 -2.815
258 HB3 ALA 42 HB3 ALA 42 6.417 -5.489 -3.950
259 H ALA 43 HN ALA 43 6.161 -1.509 -3.243
260 HA ALA 43 HA ALA 43 3.691 -1.531 -4.744
261 HB1 ALA 43 HB1 ALA 43 3.772 0.804 -3.228
262 HB2 ALA 43 HB2 ALA 43 4.631 -0.399 -2.264
263 HB3 ALA 43 HB3 ALA 43 2.982 -0.715 -2.804
264 H GLY 44 HN GLY 44 6.742 0.097 -4.851
265 HA2 GLY 44 HA2 GLY 44 7.418 1.173 -6.891
266 HA3 GLY 44 HA1 GLY 44 5.752 1.674 -7.130
267 H CYS 45 HN CYS 45 7.219 1.969 -3.991
268 HA CYS 45 HA CYS 45 6.818 4.821 -4.053
269 HB2 CYS 45 HB2 CYS 45 6.702 2.973 -2.053
270 HB3 CYS 45 HB1 CYS 45 8.294 3.671 -1.771
271 H LEU 46 HN LEU 46 9.622 2.689 -3.561
272 HA LEU 46 HA LEU 46 11.860 3.019 -3.817
273 HB2 LEU 46 HB2 LEU 46 11.255 5.138 -5.846
274 HB3 LEU 46 HB1 LEU 46 12.548 3.954 -5.839
275 HG LEU 46 HG LEU 46 10.144 2.482 -5.951
276 HD11 LEU 46 HD11 LEU 46 10.043 4.230 -8.314
277 HD12 LEU 46 HD12 LEU 46 9.471 4.949 -6.809
278 HD13 LEU 46 HD13 LEU 46 8.739 3.461 -7.409
279 HD21 LEU 46 HD21 LEU 46 11.876 3.088 -8.320
280 HD22 LEU 46 HD22 LEU 46 11.070 1.580 -7.887
281 HD23 LEU 46 HD23 LEU 46 12.478 2.123 -6.973
282 H TYR 47 HN TYR 47 11.872 4.009 -1.664
283 HA TYR 47 HA TYR 47 13.355 6.397 -1.631
284 HB2 TYR 47 HB2 TYR 47 11.875 8.009 -0.794
285 HB3 TYR 47 HB1 TYR 47 10.955 7.228 -2.073
286 HD1 TYR 47 HD1 TYR 47 10.170 4.724 -0.579
287 HD2 TYR 47 HD2 TYR 47 10.141 8.819 0.573
288 HE1 TYR 47 HE1 TYR 47 8.357 4.255 1.017
289 HE2 TYR 47 HE2 TYR 47 8.329 8.363 2.172
290 HH TYR 47 HH TYR 47 6.615 6.767 2.608
291 H ASN 48 HN ASN 48 13.527 3.770 -0.569
292 HA ASN 48 HA ASN 48 14.299 4.386 2.099
293 HB2 ASN 48 HB2 ASN 48 11.617 3.490 1.740
294 HB3 ASN 48 HB1 ASN 48 12.519 2.195 2.521
295 HD21 ASN 48 HD21 ASN 48 12.585 2.273 4.638
296 HD22 ASN 48 HD22 ASN 48 12.408 3.687 5.614
297 H SER 49 HN SER 49 15.846 3.009 2.789
298 HA SER 49 HA SER 49 17.300 1.259 2.843
299 HB2 SER 49 HB2 SER 49 15.624 -0.457 1.075
300 HB3 SER 49 HB1 SER 49 16.488 -0.870 2.556
301 HG SER 49 HG SER 49 14.036 -0.666 2.529
302 H THR 50 HN THR 50 16.785 3.127 0.344
303 HA THR 50 HA THR 50 17.652 3.440 -1.746
304 HB THR 50 HB THR 50 20.063 3.066 -1.888
305 HG1 THR 50 HG1 THR 50 19.876 1.704 0.584
306 HG21 THR 50 HG21 THR 50 20.666 3.953 0.518
307 HG22 THR 50 HG22 THR 50 18.921 4.194 0.601
308 HG23 THR 50 HG23 THR 50 19.859 4.972 -0.674
Start of MODEL 5
1 H1 GLY 1 HT1 GLY 1 -14.722 10.341 -0.996
2 H2 GLY 1 HT2 GLY 1 -14.894 11.086 0.513
3 H3 GLY 1 HT3 GLY 1 -16.200 11.040 -0.560
4 HA2 GLY 1 HA1 GLY 1 -16.864 9.284 0.635
5 HA3 GLY 1 HA2 GLY 1 -15.681 8.435 -0.350
6 H SER 2 HN SER 2 -16.723 8.358 2.583
7 HA SER 2 HA SER 2 -14.084 7.810 3.721
8 HB2 SER 2 HB2 SER 2 -14.942 10.129 4.405
9 HB3 SER 2 HB1 SER 2 -16.170 9.273 5.338
10 HG SER 2 HG SER 2 -13.354 9.041 5.620
11 H GLU 3 HN GLU 3 -15.113 5.680 3.024
12 HA GLU 3 HA GLU 3 -15.863 4.234 5.310
13 HB2 GLU 3 HB2 GLU 3 -18.179 3.557 4.450
14 HB3 GLU 3 HB1 GLU 3 -18.033 5.129 5.226
15 HG2 GLU 3 HG2 GLU 3 -17.939 6.202 3.034
16 HG3 GLU 3 HG1 GLU 3 -18.089 4.625 2.259
17 H GLY 4 HN GLY 4 -16.161 4.385 1.781
18 HA2 GLY 4 HA2 GLY 4 -15.311 1.556 1.680
19 HA3 GLY 4 HA1 GLY 4 -16.340 2.312 0.472
20 H LYS 5 HN LYS 5 -13.391 3.581 1.964
21 HA LYS 5 HA LYS 5 -12.333 4.351 -0.570
22 HB2 LYS 5 HB2 LYS 5 -11.916 5.153 2.013
23 HB3 LYS 5 HB1 LYS 5 -10.448 4.243 1.682
24 HG2 LYS 5 HG2 LYS 5 -11.374 6.263 -0.300
25 HG3 LYS 5 HG1 LYS 5 -10.581 6.804 1.181
26 HD2 LYS 5 HD2 LYS 5 -9.233 4.591 -0.202
27 HD3 LYS 5 HD1 LYS 5 -9.283 6.106 -1.105
28 HE2 LYS 5 HE2 LYS 5 -8.376 5.931 1.759
29 HE3 LYS 5 HE1 LYS 5 -7.274 5.764 0.393
30 HZ1 LYS 5 HZ1 LYS 5 -9.038 8.119 0.710
31 HZ2 LYS 5 HZ2 LYS 5 -7.674 7.959 -0.277
32 HZ3 LYS 5 HZ3 LYS 5 -7.495 8.053 1.402
33 H THR 6 HN THR 6 -12.224 1.450 1.230
34 HA THR 6 HA THR 6 -9.740 0.388 0.713
35 HB THR 6 HB THR 6 -10.789 -1.821 0.816
36 HG1 THR 6 HG1 THR 6 -12.633 -1.315 -0.462
37 HG21 THR 6 HG21 THR 6 -12.546 -0.905 2.793
38 HG22 THR 6 HG22 THR 6 -11.182 0.213 2.784
39 HG23 THR 6 HG23 THR 6 -10.904 -1.515 2.998
40 H CYS 7 HN CYS 7 -8.658 -0.294 -1.019
41 HA CYS 7 HA CYS 7 -8.099 -0.603 -3.198
42 HB2 CYS 7 HB2 CYS 7 -10.867 -1.742 -3.548
43 HB3 CYS 7 HB1 CYS 7 -9.412 -2.153 -4.445
44 H GLY 8 HN GLY 8 -9.438 -0.496 -5.586
45 HA2 GLY 8 HA2 GLY 8 -11.095 0.980 -6.687
46 HA3 GLY 8 HA1 GLY 8 -10.575 2.233 -5.573
47 HA PRO 9 HA PRO 9 -8.470 2.845 -9.729
48 HB2 PRO 9 HB2 PRO 9 -8.359 5.595 -9.202
49 HB3 PRO 9 HB1 PRO 9 -9.538 4.781 -10.232
50 HG2 PRO 9 HG2 PRO 9 -9.782 5.652 -7.392
51 HG3 PRO 9 HG1 PRO 9 -11.003 5.649 -8.677
52 HD2 PRO 9 HD2 PRO 9 -11.025 3.805 -6.746
53 HD3 PRO 9 HD1 PRO 9 -11.441 3.382 -8.422
54 H SER 10 HN SER 10 -7.862 4.548 -6.655
55 HA SER 10 HA SER 10 -4.988 4.461 -7.199
56 HB2 SER 10 HB2 SER 10 -6.066 5.751 -4.737
57 HB3 SER 10 HB1 SER 10 -4.743 6.260 -5.788
58 HG SER 10 HG SER 10 -6.790 7.512 -5.850
59 H SER 11 HN SER 11 -5.697 1.983 -6.818
60 HA SER 11 HA SER 11 -4.981 1.384 -4.022
61 HB2 SER 11 HB2 SER 11 -6.361 -0.598 -4.099
62 HB3 SER 11 HB1 SER 11 -7.345 0.782 -4.587
63 HG SER 11 HG SER 11 -7.652 -0.166 -6.425
64 H PHE 12 HN PHE 12 -3.559 -0.319 -3.662
65 HA PHE 12 HA PHE 12 -2.120 -1.256 -6.056
66 HB2 PHE 12 HB2 PHE 12 -0.544 -0.007 -4.859
67 HB3 PHE 12 HB1 PHE 12 -1.172 -0.529 -3.300
68 HD1 PHE 12 HD2 PHE 12 0.367 -2.040 -6.352
69 HD2 PHE 12 HD1 PHE 12 0.103 -2.003 -2.106
70 HE1 PHE 12 HE2 PHE 12 2.098 -3.785 -6.234
71 HE2 PHE 12 HE1 PHE 12 1.829 -3.751 -1.980
72 HZ PHE 12 HZ PHE 12 2.832 -4.643 -4.043
73 H SER 13 HN SER 13 -1.439 -3.427 -6.129
74 HA SER 13 HA SER 13 -2.927 -5.199 -4.311
75 HB2 SER 13 HB2 SER 13 -3.815 -5.779 -6.337
76 HB3 SER 13 HB1 SER 13 -2.378 -5.288 -7.229
77 HG SER 13 HG SER 13 -2.323 -7.454 -7.331
78 H CYS 14 HN CYS 14 -1.640 -6.014 -2.808
79 HA CYS 14 HA CYS 14 1.138 -6.095 -2.861
80 HB2 CYS 14 HB2 CYS 14 -0.973 -7.396 -1.222
81 HB3 CYS 14 HB1 CYS 14 0.657 -8.036 -1.095
82 HA PRO 15 HA PRO 15 2.188 -9.532 -5.416
83 HB2 PRO 15 HB2 PRO 15 4.487 -10.359 -4.221
84 HB3 PRO 15 HB1 PRO 15 4.384 -8.899 -5.209
85 HG2 PRO 15 HG2 PRO 15 4.316 -9.180 -2.229
86 HG3 PRO 15 HG1 PRO 15 5.187 -7.995 -3.221
87 HD2 PRO 15 HD2 PRO 15 2.868 -7.405 -1.982
88 HD3 PRO 15 HD1 PRO 15 3.305 -6.702 -3.552
89 H GLY 16 HN GLY 16 1.469 -11.567 -5.505
90 HA2 GLY 16 HA2 GLY 16 0.797 -13.667 -4.868
91 HA3 GLY 16 HA1 GLY 16 1.953 -13.536 -3.551
92 H THR 17 HN THR 17 -0.854 -11.467 -4.128
93 HA THR 17 HA THR 17 -2.604 -12.748 -2.337
94 HB THR 17 HB THR 17 -1.148 -12.156 -0.557
95 HG1 THR 17 HG1 THR 17 -2.993 -11.617 0.311
96 HG21 THR 17 HG21 THR 17 -0.545 -9.744 -0.143
97 HG22 THR 17 HG22 THR 17 -0.995 -9.442 -1.821
98 HG23 THR 17 HG23 THR 17 0.320 -10.555 -1.448
99 H HIS 18 HN HIS 18 -4.565 -11.542 -1.967
100 HA HIS 18 HA HIS 18 -5.045 -9.618 -4.103
101 HB2 HIS 18 HB2 HIS 18 -6.517 -11.726 -3.293
102 HB3 HIS 18 HB1 HIS 18 -7.268 -10.455 -2.332
103 HD1 HIS 18 HD1 HIS 18 -9.197 -9.391 -3.494
104 HD2 HIS 18 HD2 HIS 18 -6.353 -10.816 -6.166
105 HE1 HIS 18 HE1 HIS 18 -10.099 -8.920 -5.810
106 H VAL 19 HN VAL 19 -4.186 -9.490 -0.890
107 HA VAL 19 HA VAL 19 -5.806 -7.541 0.241
108 HB VAL 19 HB VAL 19 -4.235 -8.620 1.649
109 HG11 VAL 19 HG11 VAL 19 -2.176 -9.187 1.038
110 HG12 VAL 19 HG12 VAL 19 -1.737 -7.507 0.728
111 HG13 VAL 19 HG13 VAL 19 -2.513 -8.463 -0.534
112 HG21 VAL 19 HG21 VAL 19 -2.748 -6.110 1.704
113 HG22 VAL 19 HG22 VAL 19 -3.789 -6.839 2.928
114 HG23 VAL 19 HG23 VAL 19 -4.496 -5.884 1.625
115 H CYS 20 HN CYS 20 -6.306 -5.595 -0.518
116 HA CYS 20 HA CYS 20 -4.391 -4.189 -2.220
117 HB2 CYS 20 HB2 CYS 20 -6.160 -3.054 -3.176
118 HB3 CYS 20 HB1 CYS 20 -6.933 -4.576 -2.756
119 H VAL 21 HN VAL 21 -4.221 -1.799 -1.938
120 HA VAL 21 HA VAL 21 -4.741 -0.755 0.701
121 HB VAL 21 HB VAL 21 -2.689 -1.923 1.180
122 HG11 VAL 21 HG11 VAL 21 -0.718 -0.650 -0.330
123 HG12 VAL 21 HG12 VAL 21 -1.981 -1.092 -1.479
124 HG13 VAL 21 HG13 VAL 21 -1.249 -2.327 -0.456
125 HG21 VAL 21 HG21 VAL 21 -1.511 -0.203 2.185
126 HG22 VAL 21 HG22 VAL 21 -3.106 0.511 1.948
127 HG23 VAL 21 HG23 VAL 21 -1.790 0.908 0.843
128 HA PRO 22 HA PRO 22 -5.226 2.784 -2.003
129 HB2 PRO 22 HB2 PRO 22 -5.181 4.280 0.555
130 HB3 PRO 22 HB1 PRO 22 -6.405 4.265 -0.719
131 HG2 PRO 22 HG2 PRO 22 -6.821 3.031 1.616
132 HG3 PRO 22 HG1 PRO 22 -7.416 2.349 0.092
133 HD2 PRO 22 HD2 PRO 22 -5.048 1.551 1.731
134 HD3 PRO 22 HD1 PRO 22 -6.192 0.536 0.829
135 H GLU 23 HN GLU 23 -3.935 4.442 -2.771
136 HA GLU 23 HA GLU 23 -1.196 4.281 -2.476
137 HB2 GLU 23 HB2 GLU 23 -3.061 6.022 -3.809
138 HB3 GLU 23 HB1 GLU 23 -1.745 6.971 -3.132
139 HG2 GLU 23 HG2 GLU 23 -0.939 4.531 -4.559
140 HG3 GLU 23 HG1 GLU 23 -1.682 5.786 -5.550
141 H ARG 24 HN ARG 24 -3.495 6.277 -0.694
142 HA ARG 24 HA ARG 24 -1.683 7.920 0.664
143 HB2 ARG 24 HB2 ARG 24 -4.145 8.245 0.640
144 HB3 ARG 24 HB1 ARG 24 -4.318 6.848 1.694
145 HG2 ARG 24 HG2 ARG 24 -2.619 8.256 3.179
146 HG3 ARG 24 HG1 ARG 24 -3.382 9.586 2.306
147 HD2 ARG 24 HD2 ARG 24 -5.568 8.870 3.048
148 HD3 ARG 24 HD1 ARG 24 -4.871 7.448 3.823
149 HE ARG 24 HE ARG 24 -3.585 9.520 5.012
150 HH11 ARG 24 HH11 ARG 24 -6.949 8.728 4.528
151 HH12 ARG 24 HH12 ARG 24 -7.473 9.522 5.975
152 HH21 ARG 24 HH21 ARG 24 -4.271 10.563 6.916
153 HH22 ARG 24 HH22 ARG 24 -5.953 10.564 7.331
154 H TRP 25 HN TRP 25 -2.564 4.598 1.123
155 HA TRP 25 HA TRP 25 -1.244 4.434 3.714
156 HB2 TRP 25 HB2 TRP 25 -2.780 2.450 2.043
157 HB3 TRP 25 HB1 TRP 25 -1.936 1.992 3.519
158 HD1 TRP 25 HD1 TRP 25 -3.750 5.338 3.413
159 HE1 TRP 25 HE1 TRP 25 -5.795 5.227 4.974
160 HE3 TRP 25 HE3 TRP 25 -3.671 0.345 4.501
161 HZ2 TRP 25 HZ2 TRP 25 -7.188 3.279 6.469
162 HZ3 TRP 25 HZ3 TRP 25 -5.393 -0.563 6.003
163 HH2 TRP 25 HH2 TRP 25 -7.116 0.875 6.967
164 H LEU 26 HN LEU 26 -0.639 3.789 0.370
165 HA LEU 26 HA LEU 26 1.311 1.830 0.460
166 HB2 LEU 26 HB2 LEU 26 0.685 4.088 -1.358
167 HB3 LEU 26 HB1 LEU 26 2.259 3.339 -1.536
168 HG LEU 26 HG LEU 26 0.573 2.418 -3.083
169 HD11 LEU 26 HD11 LEU 26 2.468 1.073 -1.657
170 HD12 LEU 26 HD12 LEU 26 1.562 0.416 -3.019
171 HD13 LEU 26 HD13 LEU 26 1.029 0.095 -1.370
172 HD21 LEU 26 HD21 LEU 26 -1.490 2.397 -2.127
173 HD22 LEU 26 HD22 LEU 26 -0.873 1.955 -0.537
174 HD23 LEU 26 HD23 LEU 26 -1.016 0.733 -1.797
175 H CYS 27 HN CYS 27 3.233 1.720 1.399
176 HA CYS 27 HA CYS 27 4.969 2.366 2.761
177 HB2 CYS 27 HB2 CYS 27 6.508 4.017 1.469
178 HB3 CYS 27 HB1 CYS 27 6.208 2.418 0.800
179 H ASP 28 HN ASP 28 3.066 3.468 4.021
180 HA ASP 28 HA ASP 28 3.544 6.353 4.235
181 HB2 ASP 28 HB2 ASP 28 1.432 6.415 5.493
182 HB3 ASP 28 HB1 ASP 28 1.213 5.674 3.912
183 H GLY 29 HN GLY 29 4.287 3.410 5.758
184 HA2 GLY 29 HA2 GLY 29 6.024 3.596 7.496
185 HA3 GLY 29 HA1 GLY 29 5.043 4.863 8.216
186 H ASP 30 HN ASP 30 3.447 2.089 6.913
187 HA ASP 30 HA ASP 30 3.353 0.726 9.479
188 HB2 ASP 30 HB2 ASP 30 1.165 2.365 8.415
189 HB3 ASP 30 HB1 ASP 30 0.678 0.724 8.827
190 H LYS 31 HN LYS 31 3.813 -1.306 8.965
191 HA LYS 31 HA LYS 31 3.592 -2.395 6.385
192 HB2 LYS 31 HB2 LYS 31 4.411 -3.310 9.025
193 HB3 LYS 31 HB1 LYS 31 3.614 -4.576 8.104
194 HG2 LYS 31 HG2 LYS 31 5.315 -3.541 6.251
195 HG3 LYS 31 HG1 LYS 31 6.242 -3.351 7.741
196 HD2 LYS 31 HD2 LYS 31 5.745 -5.761 8.243
197 HD3 LYS 31 HD1 LYS 31 5.064 -5.890 6.620
198 HE2 LYS 31 HE2 LYS 31 7.083 -6.058 5.694
199 HE3 LYS 31 HE1 LYS 31 7.688 -4.665 6.590
200 HZ1 LYS 31 HZ1 LYS 31 7.558 -7.473 7.546
201 HZ2 LYS 31 HZ2 LYS 31 8.000 -6.158 8.515
202 HZ3 LYS 31 HZ3 LYS 31 8.954 -6.586 7.185
203 H ASP 32 HN ASP 32 1.414 -1.936 5.753
204 HA ASP 32 HA ASP 32 -0.773 -3.202 7.143
205 HB2 ASP 32 HB2 ASP 32 -0.952 -2.113 4.344
206 HB3 ASP 32 HB1 ASP 32 -2.195 -2.164 5.590
207 H CYS 33 HN CYS 33 1.344 -3.910 4.492
208 HA CYS 33 HA CYS 33 -0.224 -6.074 3.432
209 HB2 CYS 33 HB2 CYS 33 1.464 -4.612 2.169
210 HB3 CYS 33 HB1 CYS 33 2.707 -5.587 2.944
211 H ALA 34 HN ALA 34 0.655 -8.303 3.308
212 HA ALA 34 HA ALA 34 1.114 -9.380 5.850
213 HB1 ALA 34 HB1 ALA 34 2.072 -11.007 3.602
214 HB2 ALA 34 HB2 ALA 34 0.421 -10.409 3.434
215 HB3 ALA 34 HB3 ALA 34 0.871 -11.373 4.841
216 H ASP 35 HN ASP 35 3.332 -8.491 3.266
217 HA ASP 35 HA ASP 35 5.580 -8.986 5.107
218 HB2 ASP 35 HB2 ASP 35 5.409 -9.402 2.124
219 HB3 ASP 35 HB1 ASP 35 6.950 -9.274 2.967
220 H GLY 36 HN GLY 36 3.964 -6.560 4.721
221 HA2 GLY 36 HA2 GLY 36 4.289 -4.296 4.559
222 HA3 GLY 36 HA1 GLY 36 5.996 -4.644 4.768
223 H ALA 37 HN ALA 37 4.324 -6.030 2.065
224 HA ALA 37 HA ALA 37 6.061 -5.175 0.125
225 HB1 ALA 37 HB1 ALA 37 3.126 -5.519 -0.430
226 HB2 ALA 37 HB2 ALA 37 4.185 -6.882 -0.066
227 HB3 ALA 37 HB3 ALA 37 4.494 -5.878 -1.483
228 H ASP 38 HN ASP 38 3.092 -3.556 1.199
229 HA ASP 38 HA ASP 38 3.111 -1.469 -0.665
230 HB2 ASP 38 HB2 ASP 38 1.805 -0.224 1.167
231 HB3 ASP 38 HB1 ASP 38 1.118 -1.723 0.552
232 H GLU 39 HN GLU 39 5.077 -2.023 2.118
233 HA GLU 39 HA GLU 39 5.962 0.746 2.250
234 HB2 GLU 39 HB2 GLU 39 6.791 -1.676 3.856
235 HB3 GLU 39 HB1 GLU 39 7.339 -0.032 4.148
236 HG2 GLU 39 HG2 GLU 39 4.428 -0.383 4.076
237 HG3 GLU 39 HG1 GLU 39 5.255 -1.196 5.402
238 H SER 40 HN SER 40 6.558 -1.387 0.036
239 HA SER 40 HA SER 40 9.430 -0.772 -0.100
240 HB2 SER 40 HB2 SER 40 8.145 -3.368 -0.088
241 HB3 SER 40 HB1 SER 40 9.076 -3.129 -1.566
242 HG SER 40 HG SER 40 10.619 -3.784 -0.249
243 H ILE 41 HN ILE 41 10.255 -1.124 -2.423
244 HA ILE 41 HA ILE 41 8.907 0.652 -4.127
245 HB ILE 41 HB ILE 41 11.143 -1.299 -4.595
246 HG12 ILE 41 HG12 ILE 41 12.503 0.684 -4.770
247 HG13 ILE 41 HG11 ILE 41 11.081 1.716 -4.746
248 HG21 ILE 41 HG21 ILE 41 11.447 -0.210 -6.827
249 HG22 ILE 41 HG22 ILE 41 9.846 0.501 -6.629
250 HG23 ILE 41 HG23 ILE 41 10.029 -1.251 -6.703
251 HD11 ILE 41 HD11 ILE 41 12.313 1.700 -2.619
252 HD12 ILE 41 HD12 ILE 41 11.975 -0.024 -2.462
253 HD13 ILE 41 HD13 ILE 41 10.650 1.140 -2.452
254 H ALA 42 HN ALA 42 8.610 -2.763 -3.654
255 HA ALA 42 HA ALA 42 7.582 -3.650 -6.061
256 HB1 ALA 42 HB1 ALA 42 8.030 -4.836 -3.729
257 HB2 ALA 42 HB2 ALA 42 6.954 -5.530 -4.942
258 HB3 ALA 42 HB3 ALA 42 6.284 -4.630 -3.580
259 H ALA 43 HN ALA 43 6.138 -1.570 -3.700
260 HA ALA 43 HA ALA 43 3.483 -1.861 -4.867
261 HB1 ALA 43 HB1 ALA 43 4.320 -1.449 -2.298
262 HB2 ALA 43 HB2 ALA 43 2.683 -1.182 -2.897
263 HB3 ALA 43 HB3 ALA 43 3.815 0.166 -2.796
264 H GLY 44 HN GLY 44 5.995 -0.414 -6.037
265 HA2 GLY 44 HA2 GLY 44 5.942 1.196 -7.751
266 HA3 GLY 44 HA1 GLY 44 4.444 1.826 -7.085
267 H CYS 45 HN CYS 45 6.135 1.583 -4.403
268 HA CYS 45 HA CYS 45 6.728 4.347 -4.249
269 HB2 CYS 45 HB2 CYS 45 6.315 2.386 -2.407
270 HB3 CYS 45 HB1 CYS 45 8.063 2.566 -2.307
271 H LEU 46 HN LEU 46 8.912 5.196 -3.628
272 HA LEU 46 HA LEU 46 11.127 3.711 -4.829
273 HB2 LEU 46 HB2 LEU 46 10.438 6.558 -5.561
274 HB3 LEU 46 HB1 LEU 46 11.857 5.678 -6.098
275 HG LEU 46 HG LEU 46 9.511 4.170 -6.772
276 HD11 LEU 46 HD11 LEU 46 8.449 5.697 -8.325
277 HD12 LEU 46 HD12 LEU 46 9.527 6.997 -7.817
278 HD13 LEU 46 HD13 LEU 46 8.354 6.330 -6.682
279 HD21 LEU 46 HD21 LEU 46 10.467 4.168 -8.938
280 HD22 LEU 46 HD22 LEU 46 11.812 4.129 -7.797
281 HD23 LEU 46 HD23 LEU 46 11.388 5.636 -8.610
282 H TYR 47 HN TYR 47 10.382 6.896 -3.403
283 HA TYR 47 HA TYR 47 12.854 7.386 -2.265
284 HB2 TYR 47 HB2 TYR 47 11.735 8.978 -0.815
285 HB3 TYR 47 HB1 TYR 47 11.021 9.046 -2.420
286 HD1 TYR 47 HD1 TYR 47 8.832 7.743 -2.785
287 HD2 TYR 47 HD2 TYR 47 10.388 8.665 1.063
288 HE1 TYR 47 HE1 TYR 47 6.602 7.400 -1.810
289 HE2 TYR 47 HE2 TYR 47 8.162 8.325 2.051
290 HH TYR 47 HH TYR 47 5.567 6.913 0.293
291 H ASN 48 HN ASN 48 13.791 5.614 -1.308
292 HA ASN 48 HA ASN 48 12.401 4.255 0.858
293 HB2 ASN 48 HB2 ASN 48 14.134 3.344 -1.039
294 HB3 ASN 48 HB1 ASN 48 15.219 3.563 0.330
295 HD21 ASN 48 HD21 ASN 48 15.562 1.630 1.158
296 HD22 ASN 48 HD22 ASN 48 14.347 0.470 1.560
297 H SER 49 HN SER 49 14.088 3.636 2.724
298 HA SER 49 HA SER 49 15.280 6.164 3.659
299 HB2 SER 49 HB2 SER 49 13.403 4.290 5.004
300 HB3 SER 49 HB1 SER 49 14.681 4.991 5.996
301 HG SER 49 HG SER 49 13.021 6.565 4.333
302 H THR 50 HN THR 50 15.356 2.629 3.906
303 HA THR 50 HA THR 50 17.705 2.400 5.412
304 HB THR 50 HB THR 50 17.202 0.346 3.332
305 HG1 THR 50 HG1 THR 50 15.314 1.041 5.319
306 HG21 THR 50 HG21 THR 50 17.248 -1.150 5.316
307 HG22 THR 50 HG22 THR 50 17.583 0.267 6.311
308 HG23 THR 50 HG23 THR 50 18.729 -0.226 5.064
Start of MODEL 6
1 H1 GLY 1 HT1 GLY 1 -8.930 5.103 9.758
2 H2 GLY 1 HT2 GLY 1 -9.355 5.416 11.365
3 H3 GLY 1 HT3 GLY 1 -8.385 6.513 10.519
4 HA2 GLY 1 HA1 GLY 1 -11.272 5.996 10.249
5 HA3 GLY 1 HA2 GLY 1 -10.446 7.532 10.466
6 H SER 2 HN SER 2 -12.017 5.613 8.278
7 HA SER 2 HA SER 2 -11.538 7.351 6.111
8 HB2 SER 2 HB2 SER 2 -9.853 4.912 6.283
9 HB3 SER 2 HB1 SER 2 -10.558 5.273 4.708
10 HG SER 2 HG SER 2 -8.814 6.862 6.264
11 H GLU 3 HN GLU 3 -12.028 3.824 6.332
12 HA GLU 3 HA GLU 3 -13.742 2.482 5.672
13 HB2 GLU 3 HB2 GLU 3 -15.387 4.976 6.140
14 HB3 GLU 3 HB1 GLU 3 -16.038 3.356 5.934
15 HG2 GLU 3 HG2 GLU 3 -14.202 4.224 8.155
16 HG3 GLU 3 HG1 GLU 3 -15.951 4.046 8.282
17 H GLY 4 HN GLY 4 -13.589 1.874 3.610
18 HA2 GLY 4 HA2 GLY 4 -14.689 1.934 1.452
19 HA3 GLY 4 HA1 GLY 4 -14.701 3.687 1.566
20 H LYS 5 HN LYS 5 -13.712 3.821 -0.492
21 HA LYS 5 HA LYS 5 -11.940 4.169 -1.871
22 HB2 LYS 5 HB2 LYS 5 -10.919 4.565 0.733
23 HB3 LYS 5 HB1 LYS 5 -9.721 3.610 -0.129
24 HG2 LYS 5 HG2 LYS 5 -9.228 5.953 -0.366
25 HG3 LYS 5 HG1 LYS 5 -9.710 5.287 -1.928
26 HD2 LYS 5 HD2 LYS 5 -11.146 6.994 -2.051
27 HD3 LYS 5 HD1 LYS 5 -12.097 6.137 -0.837
28 HE2 LYS 5 HE2 LYS 5 -11.523 7.567 0.810
29 HE3 LYS 5 HE1 LYS 5 -9.877 7.760 0.211
30 HZ1 LYS 5 HZ1 LYS 5 -12.285 9.047 -0.958
31 HZ2 LYS 5 HZ2 LYS 5 -10.691 9.260 -1.483
32 HZ3 LYS 5 HZ3 LYS 5 -11.158 9.812 0.046
33 H THR 6 HN THR 6 -10.425 1.819 0.317
34 HA THR 6 HA THR 6 -9.428 -0.184 -0.070
35 HB THR 6 HB THR 6 -10.828 -1.751 -1.557
36 HG1 THR 6 HG1 THR 6 -12.608 -0.996 -2.412
37 HG21 THR 6 HG21 THR 6 -12.125 -2.320 0.192
38 HG22 THR 6 HG22 THR 6 -12.647 -0.662 0.489
39 HG23 THR 6 HG23 THR 6 -11.060 -1.199 1.041
40 H CYS 7 HN CYS 7 -10.783 -0.058 -3.335
41 HA CYS 7 HA CYS 7 -8.028 0.115 -4.364
42 HB2 CYS 7 HB2 CYS 7 -10.334 -1.171 -5.819
43 HB3 CYS 7 HB1 CYS 7 -8.615 -1.310 -6.170
44 H GLY 8 HN GLY 8 -8.561 2.493 -4.128
45 HA2 GLY 8 HA2 GLY 8 -10.469 3.792 -5.703
46 HA3 GLY 8 HA1 GLY 8 -8.967 4.510 -5.142
47 HA PRO 9 HA PRO 9 -8.993 4.510 -9.827
48 HB2 PRO 9 HB2 PRO 9 -7.302 6.737 -9.800
49 HB3 PRO 9 HB1 PRO 9 -9.050 6.767 -10.034
50 HG2 PRO 9 HG2 PRO 9 -7.457 7.262 -7.564
51 HG3 PRO 9 HG1 PRO 9 -8.948 8.046 -8.118
52 HD2 PRO 9 HD2 PRO 9 -8.985 6.225 -6.161
53 HD3 PRO 9 HD1 PRO 9 -10.288 6.303 -7.367
54 H SER 10 HN SER 10 -6.556 4.584 -7.334
55 HA SER 10 HA SER 10 -4.755 3.092 -9.102
56 HB2 SER 10 HB2 SER 10 -2.860 4.390 -7.848
57 HB3 SER 10 HB1 SER 10 -3.669 5.149 -9.219
58 HG SER 10 HG SER 10 -4.537 5.526 -6.554
59 H SER 11 HN SER 11 -5.363 1.204 -8.007
60 HA SER 11 HA SER 11 -4.649 1.069 -5.159
61 HB2 SER 11 HB2 SER 11 -6.120 -0.769 -4.936
62 HB3 SER 11 HB1 SER 11 -6.974 0.361 -5.989
63 HG SER 11 HG SER 11 -6.760 -0.978 -7.628
64 H PHE 12 HN PHE 12 -3.586 -0.901 -4.404
65 HA PHE 12 HA PHE 12 -1.914 -2.196 -6.443
66 HB2 PHE 12 HB2 PHE 12 -0.413 -0.615 -5.532
67 HB3 PHE 12 HB1 PHE 12 -1.015 -0.861 -3.898
68 HD1 PHE 12 HD2 PHE 12 0.731 -2.677 -6.643
69 HD2 PHE 12 HD1 PHE 12 0.152 -2.218 -2.452
70 HE1 PHE 12 HE2 PHE 12 2.531 -4.301 -6.220
71 HE2 PHE 12 HE1 PHE 12 1.950 -3.841 -2.023
72 HZ PHE 12 HZ PHE 12 3.142 -4.886 -3.905
73 H SER 13 HN SER 13 -1.612 -4.345 -6.171
74 HA SER 13 HA SER 13 -2.929 -5.568 -3.850
75 HB2 SER 13 HB2 SER 13 -3.539 -7.359 -5.185
76 HB3 SER 13 HB1 SER 13 -3.600 -6.034 -6.344
77 HG SER 13 HG SER 13 -2.444 -7.690 -7.272
78 H CYS 14 HN CYS 14 -1.637 -6.316 -2.330
79 HA CYS 14 HA CYS 14 1.103 -6.411 -2.350
80 HB2 CYS 14 HB2 CYS 14 -0.823 -6.932 -0.507
81 HB3 CYS 14 HB1 CYS 14 -0.167 -8.542 -0.751
82 HA PRO 15 HA PRO 15 2.396 -9.695 -5.024
83 HB2 PRO 15 HB2 PRO 15 4.520 -10.585 -3.427
84 HB3 PRO 15 HB1 PRO 15 4.609 -9.340 -4.673
85 HG2 PRO 15 HG2 PRO 15 4.331 -9.053 -1.720
86 HG3 PRO 15 HG1 PRO 15 5.232 -8.047 -2.869
87 HD2 PRO 15 HD2 PRO 15 2.901 -7.238 -1.854
88 HD3 PRO 15 HD1 PRO 15 3.324 -6.902 -3.544
89 H GLY 16 HN GLY 16 1.708 -11.739 -5.244
90 HA2 GLY 16 HA2 GLY 16 0.812 -13.788 -4.716
91 HA3 GLY 16 HA1 GLY 16 1.925 -13.781 -3.356
92 H THR 17 HN THR 17 -0.434 -11.264 -3.635
93 HA THR 17 HA THR 17 -2.228 -12.603 -1.755
94 HB THR 17 HB THR 17 -1.706 -9.790 -1.080
95 HG1 THR 17 HG1 THR 17 0.264 -10.330 -0.006
96 HG21 THR 17 HG21 THR 17 -1.519 -12.186 0.707
97 HG22 THR 17 HG22 THR 17 -3.058 -11.450 0.261
98 HG23 THR 17 HG23 THR 17 -1.853 -10.510 1.142
99 H HIS 18 HN HIS 18 -4.352 -11.858 -1.793
100 HA HIS 18 HA HIS 18 -5.048 -10.349 -4.185
101 HB2 HIS 18 HB2 HIS 18 -6.206 -12.523 -2.826
102 HB3 HIS 18 HB1 HIS 18 -7.329 -11.181 -2.624
103 HD1 HIS 18 HD1 HIS 18 -8.452 -10.245 -4.805
104 HD2 HIS 18 HD2 HIS 18 -5.987 -13.539 -5.383
105 HE1 HIS 18 HE1 HIS 18 -8.943 -11.099 -7.135
106 H VAL 19 HN VAL 19 -4.276 -9.507 -1.130
107 HA VAL 19 HA VAL 19 -6.351 -7.816 -0.292
108 HB VAL 19 HB VAL 19 -4.682 -8.366 1.299
109 HG11 VAL 19 HG11 VAL 19 -2.705 -8.886 0.359
110 HG12 VAL 19 HG12 VAL 19 -2.310 -7.218 0.775
111 HG13 VAL 19 HG13 VAL 19 -2.826 -7.620 -0.863
112 HG21 VAL 19 HG21 VAL 19 -4.139 -5.485 0.603
113 HG22 VAL 19 HG22 VAL 19 -4.032 -6.247 2.190
114 HG23 VAL 19 HG23 VAL 19 -5.603 -6.044 1.414
115 H CYS 20 HN CYS 20 -6.431 -5.483 -0.313
116 HA CYS 20 HA CYS 20 -5.191 -4.301 -2.713
117 HB2 CYS 20 HB2 CYS 20 -7.802 -4.801 -2.557
118 HB3 CYS 20 HB1 CYS 20 -7.794 -3.262 -1.704
119 H VAL 21 HN VAL 21 -4.805 -2.009 -2.635
120 HA VAL 21 HA VAL 21 -5.045 -0.605 -0.137
121 HB VAL 21 HB VAL 21 -3.079 -1.820 0.451
122 HG11 VAL 21 HG11 VAL 21 -2.401 -1.443 -2.363
123 HG12 VAL 21 HG12 VAL 21 -1.942 -2.727 -1.245
124 HG13 VAL 21 HG13 VAL 21 -1.044 -1.209 -1.261
125 HG21 VAL 21 HG21 VAL 21 -3.021 0.502 1.101
126 HG22 VAL 21 HG22 VAL 21 -2.335 0.954 -0.460
127 HG23 VAL 21 HG23 VAL 21 -1.397 -0.028 0.664
128 HA PRO 22 HA PRO 22 -5.384 2.497 -3.381
129 HB2 PRO 22 HB2 PRO 22 -5.465 4.345 -1.070
130 HB3 PRO 22 HB1 PRO 22 -6.629 4.132 -2.381
131 HG2 PRO 22 HG2 PRO 22 -7.152 3.265 0.095
132 HG3 PRO 22 HG1 PRO 22 -7.687 2.363 -1.335
133 HD2 PRO 22 HD2 PRO 22 -5.381 1.826 0.494
134 HD3 PRO 22 HD1 PRO 22 -6.506 0.683 -0.268
135 H GLU 23 HN GLU 23 -3.964 3.920 -4.326
136 HA GLU 23 HA GLU 23 -1.274 3.783 -3.842
137 HB2 GLU 23 HB2 GLU 23 -2.798 5.006 -5.716
138 HB3 GLU 23 HB1 GLU 23 -2.203 6.409 -4.839
139 HG2 GLU 23 HG2 GLU 23 0.025 5.927 -5.346
140 HG3 GLU 23 HG1 GLU 23 -0.348 4.267 -5.806
141 H ARG 24 HN ARG 24 -3.599 5.981 -2.376
142 HA ARG 24 HA ARG 24 -1.810 7.779 -1.188
143 HB2 ARG 24 HB2 ARG 24 -4.406 7.833 -1.340
144 HB3 ARG 24 HB1 ARG 24 -4.352 6.929 0.167
145 HG2 ARG 24 HG2 ARG 24 -2.953 8.768 1.123
146 HG3 ARG 24 HG1 ARG 24 -3.267 9.685 -0.352
147 HD2 ARG 24 HD2 ARG 24 -5.056 10.470 0.740
148 HD3 ARG 24 HD1 ARG 24 -5.781 8.903 0.380
149 HE ARG 24 HE ARG 24 -5.656 8.386 2.601
150 HH11 ARG 24 HH11 ARG 24 -3.522 11.073 1.965
151 HH12 ARG 24 HH12 ARG 24 -3.156 11.339 3.637
152 HH21 ARG 24 HH21 ARG 24 -5.175 8.734 4.800
153 HH22 ARG 24 HH22 ARG 24 -4.093 10.011 5.246
154 H TRP 25 HN TRP 25 -2.837 4.574 -0.274
155 HA TRP 25 HA TRP 25 -1.532 4.715 2.318
156 HB2 TRP 25 HB2 TRP 25 -3.020 2.502 0.897
157 HB3 TRP 25 HB1 TRP 25 -2.282 2.315 2.484
158 HD1 TRP 25 HD1 TRP 25 -4.000 5.618 1.766
159 HE1 TRP 25 HE1 TRP 25 -6.169 5.758 3.144
160 HE3 TRP 25 HE3 TRP 25 -4.179 0.809 3.491
161 HZ2 TRP 25 HZ2 TRP 25 -7.748 4.055 4.749
162 HZ3 TRP 25 HZ3 TRP 25 -6.050 0.145 4.944
163 HH2 TRP 25 HH2 TRP 25 -7.797 1.736 5.559
164 H LEU 26 HN LEU 26 -0.815 3.743 -0.899
165 HA LEU 26 HA LEU 26 1.093 1.748 -0.475
166 HB2 LEU 26 HB2 LEU 26 0.501 3.686 -2.644
167 HB3 LEU 26 HB1 LEU 26 2.064 2.898 -2.681
168 HG LEU 26 HG LEU 26 0.454 1.722 -4.077
169 HD11 LEU 26 HD11 LEU 26 0.645 -0.240 -1.924
170 HD12 LEU 26 HD12 LEU 26 2.159 0.596 -2.265
171 HD13 LEU 26 HD13 LEU 26 1.320 -0.269 -3.553
172 HD21 LEU 26 HD21 LEU 26 -1.287 0.405 -2.497
173 HD22 LEU 26 HD22 LEU 26 -1.670 1.895 -3.357
174 HD23 LEU 26 HD23 LEU 26 -1.200 1.951 -1.660
175 H CYS 27 HN CYS 27 2.844 1.876 0.749
176 HA CYS 27 HA CYS 27 4.646 2.714 1.875
177 HB2 CYS 27 HB2 CYS 27 5.563 2.455 -0.380
178 HB3 CYS 27 HB1 CYS 27 5.042 4.082 -0.790
179 H ASP 28 HN ASP 28 2.621 3.995 2.863
180 HA ASP 28 HA ASP 28 3.149 6.875 2.675
181 HB2 ASP 28 HB2 ASP 28 0.952 7.122 3.820
182 HB3 ASP 28 HB1 ASP 28 0.838 6.283 2.277
183 H GLY 29 HN GLY 29 3.680 4.174 4.672
184 HA2 GLY 29 HA2 GLY 29 5.301 4.595 6.486
185 HA3 GLY 29 HA1 GLY 29 4.298 5.963 6.940
186 H ASP 30 HN ASP 30 2.931 2.909 5.950
187 HA ASP 30 HA ASP 30 2.543 2.000 8.670
188 HB2 ASP 30 HB2 ASP 30 0.457 3.412 7.160
189 HB3 ASP 30 HB1 ASP 30 -0.059 1.855 7.801
190 H LYS 31 HN LYS 31 2.944 -0.108 8.574
191 HA LYS 31 HA LYS 31 3.046 -1.588 6.189
192 HB2 LYS 31 HB2 LYS 31 3.461 -2.087 9.024
193 HB3 LYS 31 HB1 LYS 31 2.737 -3.468 8.216
194 HG2 LYS 31 HG2 LYS 31 4.684 -2.882 6.465
195 HG3 LYS 31 HG1 LYS 31 5.433 -2.318 7.960
196 HD2 LYS 31 HD2 LYS 31 5.067 -4.488 8.992
197 HD3 LYS 31 HD1 LYS 31 4.239 -5.059 7.542
198 HE2 LYS 31 HE2 LYS 31 6.736 -5.669 7.929
199 HE3 LYS 31 HE1 LYS 31 6.190 -5.199 6.321
200 HZ1 LYS 31 HZ1 LYS 31 8.312 -4.144 7.205
201 HZ2 LYS 31 HZ2 LYS 31 7.313 -3.220 8.209
202 HZ3 LYS 31 HZ3 LYS 31 7.161 -3.104 6.528
203 H ASP 32 HN ASP 32 0.981 -1.162 5.211
204 HA ASP 32 HA ASP 32 -1.400 -2.239 6.448
205 HB2 ASP 32 HB2 ASP 32 -1.173 -1.383 3.569
206 HB3 ASP 32 HB1 ASP 32 -2.594 -1.366 4.608
207 H CYS 33 HN CYS 33 1.049 -3.252 4.237
208 HA CYS 33 HA CYS 33 -0.424 -5.471 3.144
209 HB2 CYS 33 HB2 CYS 33 2.129 -4.163 2.696
210 HB3 CYS 33 HB1 CYS 33 2.306 -5.913 2.719
211 H ALA 34 HN ALA 34 0.538 -7.715 3.321
212 HA ALA 34 HA ALA 34 0.533 -8.542 6.020
213 HB1 ALA 34 HB1 ALA 34 1.705 -10.282 3.902
214 HB2 ALA 34 HB2 ALA 34 0.000 -9.843 3.798
215 HB3 ALA 34 HB3 ALA 34 0.607 -10.693 5.219
216 H ASP 35 HN ASP 35 3.089 -7.919 3.694
217 HA ASP 35 HA ASP 35 5.062 -8.189 5.864
218 HB2 ASP 35 HB2 ASP 35 5.074 -9.294 3.115
219 HB3 ASP 35 HB1 ASP 35 6.592 -8.594 3.669
220 H GLY 36 HN GLY 36 3.596 -5.837 5.091
221 HA2 GLY 36 HA2 GLY 36 3.951 -3.614 4.656
222 HA3 GLY 36 HA1 GLY 36 5.628 -3.932 5.060
223 H ALA 37 HN ALA 37 4.185 -5.635 2.400
224 HA ALA 37 HA ALA 37 6.108 -4.997 0.541
225 HB1 ALA 37 HB1 ALA 37 4.838 -6.112 -0.992
226 HB2 ALA 37 HB2 ALA 37 3.335 -5.354 -0.466
227 HB3 ALA 37 HB3 ALA 37 4.046 -6.657 0.487
228 H ASP 38 HN ASP 38 3.035 -3.331 1.135
229 HA ASP 38 HA ASP 38 3.194 -1.466 -0.941
230 HB2 ASP 38 HB2 ASP 38 1.662 -0.082 0.478
231 HB3 ASP 38 HB1 ASP 38 1.129 -1.745 0.260
232 H GLU 39 HN GLU 39 4.909 -1.676 2.048
233 HA GLU 39 HA GLU 39 5.785 1.096 1.949
234 HB2 GLU 39 HB2 GLU 39 6.668 -1.070 3.857
235 HB3 GLU 39 HB1 GLU 39 6.852 0.666 4.056
236 HG2 GLU 39 HG2 GLU 39 4.087 -0.168 3.688
237 HG3 GLU 39 HG1 GLU 39 4.852 -0.868 5.113
238 H SER 40 HN SER 40 6.569 -1.300 0.062
239 HA SER 40 HA SER 40 9.442 -0.664 0.087
240 HB2 SER 40 HB2 SER 40 8.243 -3.215 0.461
241 HB3 SER 40 HB1 SER 40 9.027 -3.225 -1.117
242 HG SER 40 HG SER 40 10.129 -3.058 1.416
243 H ILE 41 HN ILE 41 10.461 -1.263 -2.100
244 HA ILE 41 HA ILE 41 9.287 0.292 -4.103
245 HB ILE 41 HB ILE 41 11.475 -1.771 -4.214
246 HG12 ILE 41 HG12 ILE 41 12.771 0.401 -4.745
247 HG13 ILE 41 HG11 ILE 41 11.338 1.231 -4.151
248 HG21 ILE 41 HG21 ILE 41 11.999 -0.880 -6.480
249 HG22 ILE 41 HG22 ILE 41 10.449 -0.039 -6.456
250 HG23 ILE 41 HG23 ILE 41 10.497 -1.802 -6.403
251 HD11 ILE 41 HD11 ILE 41 11.674 0.551 -1.991
252 HD12 ILE 41 HD12 ILE 41 13.334 0.727 -2.561
253 HD13 ILE 41 HD13 ILE 41 12.599 -0.873 -2.468
254 H ALA 42 HN ALA 42 8.773 -3.004 -3.228
255 HA ALA 42 HA ALA 42 7.959 -4.178 -5.592
256 HB1 ALA 42 HB1 ALA 42 6.964 -5.823 -4.308
257 HB2 ALA 42 HB2 ALA 42 6.435 -4.683 -3.070
258 HB3 ALA 42 HB3 ALA 42 8.137 -5.136 -3.184
259 H ALA 43 HN ALA 43 6.254 -1.923 -3.524
260 HA ALA 43 HA ALA 43 3.783 -2.173 -5.015
261 HB1 ALA 43 HB1 ALA 43 2.884 -1.417 -3.137
262 HB2 ALA 43 HB2 ALA 43 3.781 0.095 -3.284
263 HB3 ALA 43 HB3 ALA 43 4.498 -1.278 -2.440
264 H GLY 44 HN GLY 44 6.634 -0.234 -5.070
265 HA2 GLY 44 HA2 GLY 44 7.084 1.002 -7.111
266 HA3 GLY 44 HA1 GLY 44 5.388 1.455 -7.142
267 H CYS 45 HN CYS 45 7.281 1.510 -4.201
268 HA CYS 45 HA CYS 45 6.700 4.308 -3.850
269 HB2 CYS 45 HB2 CYS 45 6.628 2.754 -1.948
270 HB3 CYS 45 HB1 CYS 45 8.342 2.427 -2.142
271 H LEU 46 HN LEU 46 9.426 2.374 -4.823
272 HA LEU 46 HA LEU 46 11.404 2.946 -5.797
273 HB2 LEU 46 HB2 LEU 46 10.685 5.851 -5.566
274 HB3 LEU 46 HB1 LEU 46 11.717 5.072 -6.749
275 HG LEU 46 HG LEU 46 9.008 4.040 -6.875
276 HD11 LEU 46 HD11 LEU 46 9.391 6.969 -6.757
277 HD12 LEU 46 HD12 LEU 46 7.979 5.989 -6.362
278 HD13 LEU 46 HD13 LEU 46 8.359 6.348 -8.046
279 HD21 LEU 46 HD21 LEU 46 9.358 4.165 -9.146
280 HD22 LEU 46 HD22 LEU 46 11.012 4.038 -8.549
281 HD23 LEU 46 HD23 LEU 46 10.363 5.608 -9.022
282 H TYR 47 HN TYR 47 10.764 5.686 -3.594
283 HA TYR 47 HA TYR 47 13.423 5.423 -2.489
284 HB2 TYR 47 HB2 TYR 47 13.117 7.520 -1.550
285 HB3 TYR 47 HB1 TYR 47 12.091 7.617 -2.974
286 HD1 TYR 47 HD1 TYR 47 9.577 6.821 -2.517
287 HD2 TYR 47 HD2 TYR 47 12.254 8.288 0.441
288 HE1 TYR 47 HE1 TYR 47 7.663 7.428 -1.098
289 HE2 TYR 47 HE2 TYR 47 10.350 8.901 1.871
290 HH TYR 47 HH TYR 47 7.778 7.946 2.020
291 H ASN 48 HN ASN 48 13.498 5.782 0.035
292 HA ASN 48 HA ASN 48 11.937 3.579 1.187
293 HB2 ASN 48 HB2 ASN 48 13.696 3.659 3.002
294 HB3 ASN 48 HB1 ASN 48 14.281 3.194 1.408
295 HD21 ASN 48 HD21 ASN 48 14.705 5.243 4.019
296 HD22 ASN 48 HD22 ASN 48 15.826 6.347 3.305
297 H SER 49 HN SER 49 10.951 3.790 3.228
298 HA SER 49 HA SER 49 10.808 6.428 4.441
299 HB2 SER 49 HB2 SER 49 9.015 6.279 2.634
300 HB3 SER 49 HB1 SER 49 8.248 5.045 3.635
301 HG SER 49 HG SER 49 7.896 6.537 5.211
302 H THR 50 HN THR 50 11.834 3.824 5.221
303 HA THR 50 HA THR 50 9.993 2.705 7.127
304 HB THR 50 HB THR 50 12.966 2.212 6.973
305 HG1 THR 50 HG1 THR 50 12.667 1.144 5.204
306 HG21 THR 50 HG21 THR 50 10.778 0.986 8.426
307 HG22 THR 50 HG22 THR 50 12.521 0.821 8.641
308 HG23 THR 50 HG23 THR 50 11.682 -0.169 7.447
Start of MODEL 7
1 H1 GLY 1 HT1 GLY 1 -12.404 3.332 6.620
2 H2 GLY 1 HT2 GLY 1 -11.114 4.297 6.105
3 H3 GLY 1 HT3 GLY 1 -12.618 4.419 5.341
4 HA2 GLY 1 HA1 GLY 1 -12.689 4.877 8.192
5 HA3 GLY 1 HA2 GLY 1 -11.759 6.061 7.287
6 H SER 2 HN SER 2 -13.127 6.314 4.965
7 HA SER 2 HA SER 2 -15.769 7.267 5.860
8 HB2 SER 2 HB2 SER 2 -14.768 8.518 3.422
9 HB3 SER 2 HB1 SER 2 -15.367 9.265 4.903
10 HG SER 2 HG SER 2 -12.758 8.537 4.197
11 H GLU 3 HN GLU 3 -14.273 6.772 2.673
12 HA GLU 3 HA GLU 3 -16.635 5.188 1.912
13 HB2 GLU 3 HB2 GLU 3 -16.293 5.914 -0.355
14 HB3 GLU 3 HB1 GLU 3 -16.272 7.332 0.682
15 HG2 GLU 3 HG2 GLU 3 -14.254 7.893 -0.021
16 HG3 GLU 3 HG1 GLU 3 -13.615 6.299 0.373
17 H GLY 4 HN GLY 4 -15.518 4.146 -0.491
18 HA2 GLY 4 HA2 GLY 4 -14.269 1.819 0.502
19 HA3 GLY 4 HA1 GLY 4 -14.395 2.269 -1.192
20 H LYS 5 HN LYS 5 -12.511 2.802 1.753
21 HA LYS 5 HA LYS 5 -10.325 3.991 0.293
22 HB2 LYS 5 HB2 LYS 5 -10.687 3.210 3.182
23 HB3 LYS 5 HB1 LYS 5 -9.183 3.871 2.558
24 HG2 LYS 5 HG2 LYS 5 -11.867 5.236 2.533
25 HG3 LYS 5 HG1 LYS 5 -10.524 5.592 3.620
26 HD2 LYS 5 HD2 LYS 5 -10.508 5.903 0.617
27 HD3 LYS 5 HD1 LYS 5 -10.635 7.210 1.794
28 HE2 LYS 5 HE2 LYS 5 -8.421 7.325 1.892
29 HE3 LYS 5 HE1 LYS 5 -8.365 5.666 2.485
30 HZ1 LYS 5 HZ1 LYS 5 -8.713 5.267 -0.130
31 HZ2 LYS 5 HZ2 LYS 5 -7.195 5.339 0.613
32 HZ3 LYS 5 HZ3 LYS 5 -7.820 6.704 -0.165
33 H THR 6 HN THR 6 -11.352 0.898 0.471
34 HA THR 6 HA THR 6 -9.102 -0.607 1.159
35 HB THR 6 HB THR 6 -10.234 -2.157 -0.749
36 HG1 THR 6 HG1 THR 6 -12.229 -1.579 -1.181
37 HG21 THR 6 HG21 THR 6 -10.132 -2.384 1.853
38 HG22 THR 6 HG22 THR 6 -11.304 -3.305 0.909
39 HG23 THR 6 HG23 THR 6 -11.807 -1.840 1.753
40 H CYS 7 HN CYS 7 -10.222 -0.266 -2.199
41 HA CYS 7 HA CYS 7 -7.404 -0.192 -3.033
42 HB2 CYS 7 HB2 CYS 7 -9.851 -0.929 -4.652
43 HB3 CYS 7 HB1 CYS 7 -8.188 -0.981 -5.222
44 H GLY 8 HN GLY 8 -10.498 0.987 -4.373
45 HA2 GLY 8 HA2 GLY 8 -11.099 3.120 -5.041
46 HA3 GLY 8 HA1 GLY 8 -9.596 3.717 -4.356
47 HA PRO 9 HA PRO 9 -9.585 3.923 -9.101
48 HB2 PRO 9 HB2 PRO 9 -8.481 6.473 -9.035
49 HB3 PRO 9 HB1 PRO 9 -10.192 6.108 -9.272
50 HG2 PRO 9 HG2 PRO 9 -8.748 6.907 -6.783
51 HG3 PRO 9 HG1 PRO 9 -10.358 7.386 -7.351
52 HD2 PRO 9 HD2 PRO 9 -10.056 5.567 -5.416
53 HD3 PRO 9 HD1 PRO 9 -11.332 5.400 -6.641
54 H SER 10 HN SER 10 -7.255 5.196 -6.731
55 HA SER 10 HA SER 10 -5.081 4.065 -8.365
56 HB2 SER 10 HB2 SER 10 -5.190 6.449 -6.535
57 HB3 SER 10 HB1 SER 10 -3.653 5.674 -6.915
58 HG SER 10 HG SER 10 -3.692 6.711 -8.728
59 H SER 11 HN SER 11 -5.142 1.983 -7.505
60 HA SER 11 HA SER 11 -4.213 1.793 -4.720
61 HB2 SER 11 HB2 SER 11 -5.596 -0.600 -5.310
62 HB3 SER 11 HB1 SER 11 -6.055 0.655 -4.161
63 HG SER 11 HG SER 11 -7.131 0.043 -6.582
64 H PHE 12 HN PHE 12 -3.117 -0.279 -4.242
65 HA PHE 12 HA PHE 12 -1.643 -1.266 -6.595
66 HB2 PHE 12 HB2 PHE 12 0.016 -0.157 -5.415
67 HB3 PHE 12 HB1 PHE 12 -0.726 -0.488 -3.855
68 HD1 PHE 12 HD2 PHE 12 0.925 -2.289 -6.680
69 HD2 PHE 12 HD1 PHE 12 0.242 -2.048 -2.488
70 HE1 PHE 12 HE2 PHE 12 2.495 -4.150 -6.321
71 HE2 PHE 12 HE1 PHE 12 1.810 -3.908 -2.122
72 HZ PHE 12 HZ PHE 12 2.941 -4.961 -4.036
73 H SER 13 HN SER 13 -1.022 -3.480 -6.578
74 HA SER 13 HA SER 13 -2.749 -5.144 -4.875
75 HB2 SER 13 HB2 SER 13 -3.415 -5.760 -6.976
76 HB3 SER 13 HB1 SER 13 -1.868 -5.343 -7.707
77 HG SER 13 HG SER 13 -1.707 -7.464 -7.725
78 H CYS 14 HN CYS 14 -1.682 -5.987 -3.217
79 HA CYS 14 HA CYS 14 1.097 -6.156 -2.983
80 HB2 CYS 14 HB2 CYS 14 -1.219 -7.264 -1.485
81 HB3 CYS 14 HB1 CYS 14 0.357 -7.976 -1.177
82 HA PRO 15 HA PRO 15 2.091 -9.852 -5.187
83 HB2 PRO 15 HB2 PRO 15 4.452 -10.467 -4.079
84 HB3 PRO 15 HB1 PRO 15 4.247 -9.016 -5.068
85 HG2 PRO 15 HG2 PRO 15 4.276 -9.285 -2.084
86 HG3 PRO 15 HG1 PRO 15 5.078 -8.076 -3.103
87 HD2 PRO 15 HD2 PRO 15 2.719 -7.631 -1.807
88 HD3 PRO 15 HD1 PRO 15 3.173 -6.818 -3.317
89 H GLY 16 HN GLY 16 1.474 -11.921 -5.027
90 HA2 GLY 16 HA2 GLY 16 0.898 -13.958 -4.143
91 HA3 GLY 16 HA1 GLY 16 2.092 -13.642 -2.895
92 H THR 17 HN THR 17 -0.840 -11.779 -3.576
93 HA THR 17 HA THR 17 -2.467 -12.939 -1.608
94 HB THR 17 HB THR 17 -0.951 -12.138 0.049
95 HG1 THR 17 HG1 THR 17 -3.155 -11.728 0.500
96 HG21 THR 17 HG21 THR 17 -0.441 -9.702 0.262
97 HG22 THR 17 HG22 THR 17 -1.051 -9.502 -1.380
98 HG23 THR 17 HG23 THR 17 0.355 -10.523 -1.080
99 H HIS 18 HN HIS 18 -4.456 -11.781 -1.272
100 HA HIS 18 HA HIS 18 -5.018 -9.940 -3.482
101 HB2 HIS 18 HB2 HIS 18 -6.764 -11.749 -1.821
102 HB3 HIS 18 HB1 HIS 18 -7.445 -10.484 -2.842
103 HD1 HIS 18 HD1 HIS 18 -4.469 -12.198 -4.230
104 HD2 HIS 18 HD2 HIS 18 -8.603 -12.591 -4.357
105 HE1 HIS 18 HE1 HIS 18 -4.976 -13.753 -6.159
106 H VAL 19 HN VAL 19 -3.665 -8.682 -1.557
107 HA VAL 19 HA VAL 19 -5.717 -7.130 -0.117
108 HB VAL 19 HB VAL 19 -4.425 -8.203 1.558
109 HG11 VAL 19 HG11 VAL 19 -2.086 -8.408 1.613
110 HG12 VAL 19 HG12 VAL 19 -1.867 -7.194 0.353
111 HG13 VAL 19 HG13 VAL 19 -2.541 -8.772 -0.050
112 HG21 VAL 19 HG21 VAL 19 -4.602 -5.499 1.427
113 HG22 VAL 19 HG22 VAL 19 -2.864 -5.716 1.641
114 HG23 VAL 19 HG23 VAL 19 -3.989 -6.393 2.819
115 H CYS 20 HN CYS 20 -6.011 -5.240 -1.083
116 HA CYS 20 HA CYS 20 -3.801 -4.011 -2.543
117 HB2 CYS 20 HB2 CYS 20 -5.413 -2.732 -3.715
118 HB3 CYS 20 HB1 CYS 20 -6.100 -4.346 -3.578
119 H VAL 21 HN VAL 21 -3.589 -1.620 -2.421
120 HA VAL 21 HA VAL 21 -4.419 -0.383 0.066
121 HB VAL 21 HB VAL 21 -2.396 -1.491 0.794
122 HG11 VAL 21 HG11 VAL 21 -1.468 -0.790 -1.832
123 HG12 VAL 21 HG12 VAL 21 -0.793 -1.933 -0.671
124 HG13 VAL 21 HG13 VAL 21 -0.328 -0.234 -0.606
125 HG21 VAL 21 HG21 VAL 21 -1.337 0.320 1.792
126 HG22 VAL 21 HG22 VAL 21 -2.935 0.956 1.407
127 HG23 VAL 21 HG23 VAL 21 -1.558 1.354 0.381
128 HA PRO 22 HA PRO 22 -4.662 3.030 -2.800
129 HB2 PRO 22 HB2 PRO 22 -4.540 4.695 -0.353
130 HB3 PRO 22 HB1 PRO 22 -5.770 4.647 -1.621
131 HG2 PRO 22 HG2 PRO 22 -6.227 3.603 0.799
132 HG3 PRO 22 HG1 PRO 22 -6.869 2.849 -0.671
133 HD2 PRO 22 HD2 PRO 22 -4.533 2.046 1.008
134 HD3 PRO 22 HD1 PRO 22 -5.731 1.031 0.182
135 H GLU 23 HN GLU 23 -3.274 4.551 -3.679
136 HA GLU 23 HA GLU 23 -0.547 4.262 -3.331
137 HB2 GLU 23 HB2 GLU 23 -2.231 5.782 -4.973
138 HB3 GLU 23 HB1 GLU 23 -1.186 6.955 -4.186
139 HG2 GLU 23 HG2 GLU 23 0.280 6.502 -5.787
140 HG3 GLU 23 HG1 GLU 23 0.568 4.983 -4.938
141 H ARG 24 HN ARG 24 -2.718 6.656 -1.857
142 HA ARG 24 HA ARG 24 -0.710 8.133 -0.550
143 HB2 ARG 24 HB2 ARG 24 -2.408 9.322 0.417
144 HB3 ARG 24 HB1 ARG 24 -3.297 8.580 -0.901
145 HG2 ARG 24 HG2 ARG 24 -4.749 8.014 0.701
146 HG3 ARG 24 HG1 ARG 24 -3.607 6.715 1.046
147 HD2 ARG 24 HD2 ARG 24 -4.341 8.029 3.047
148 HD3 ARG 24 HD1 ARG 24 -2.596 7.963 2.803
149 HE ARG 24 HE ARG 24 -3.881 10.278 1.656
150 HH11 ARG 24 HH11 ARG 24 -2.347 8.936 4.491
151 HH12 ARG 24 HH12 ARG 24 -1.915 10.482 5.140
152 HH21 ARG 24 HH21 ARG 24 -3.311 12.310 2.511
153 HH22 ARG 24 HH22 ARG 24 -2.462 12.396 4.018
154 H TRP 25 HN TRP 25 -2.096 5.052 0.101
155 HA TRP 25 HA TRP 25 -1.194 4.983 2.865
156 HB2 TRP 25 HB2 TRP 25 -2.690 3.083 1.081
157 HB3 TRP 25 HB1 TRP 25 -1.955 2.501 2.570
158 HD1 TRP 25 HD1 TRP 25 -3.306 5.978 2.861
159 HE1 TRP 25 HE1 TRP 25 -5.506 5.952 4.196
160 HE3 TRP 25 HE3 TRP 25 -4.131 0.938 2.961
161 HZ2 TRP 25 HZ2 TRP 25 -7.346 4.045 5.167
162 HZ3 TRP 25 HZ3 TRP 25 -6.132 0.092 4.114
163 HH2 TRP 25 HH2 TRP 25 -7.705 1.614 5.195
164 H LEU 26 HN LEU 26 -0.217 3.878 -0.298
165 HA LEU 26 HA LEU 26 1.563 1.872 0.188
166 HB2 LEU 26 HB2 LEU 26 1.463 4.095 -1.776
167 HB3 LEU 26 HB1 LEU 26 2.954 3.185 -1.675
168 HG LEU 26 HG LEU 26 1.339 2.428 -3.443
169 HD11 LEU 26 HD11 LEU 26 2.851 0.790 -3.131
170 HD12 LEU 26 HD12 LEU 26 1.457 -0.056 -2.460
171 HD13 LEU 26 HD13 LEU 26 2.606 0.741 -1.385
172 HD21 LEU 26 HD21 LEU 26 -0.784 2.535 -2.565
173 HD22 LEU 26 HD22 LEU 26 -0.295 1.864 -1.011
174 HD23 LEU 26 HD23 LEU 26 -0.430 0.816 -2.420
175 H CYS 27 HN CYS 27 3.258 1.646 1.468
176 HA CYS 27 HA CYS 27 4.810 2.192 3.068
177 HB2 CYS 27 HB2 CYS 27 6.734 3.519 2.059
178 HB3 CYS 27 HB1 CYS 27 6.272 2.044 1.219
179 H ASP 28 HN ASP 28 2.858 3.510 3.988
180 HA ASP 28 HA ASP 28 3.592 6.345 4.204
181 HB2 ASP 28 HB2 ASP 28 1.306 6.683 5.057
182 HB3 ASP 28 HB1 ASP 28 1.300 5.931 3.465
183 H GLY 29 HN GLY 29 3.682 3.400 5.902
184 HA2 GLY 29 HA2 GLY 29 5.092 3.486 7.931
185 HA3 GLY 29 HA1 GLY 29 4.123 4.862 8.432
186 H ASP 30 HN ASP 30 2.281 2.453 6.910
187 HA ASP 30 HA ASP 30 1.663 1.123 9.447
188 HB2 ASP 30 HB2 ASP 30 -0.145 2.827 7.833
189 HB3 ASP 30 HB1 ASP 30 -0.828 1.312 8.415
190 H LYS 31 HN LYS 31 2.290 -0.897 8.951
191 HA LYS 31 HA LYS 31 2.265 -2.070 6.420
192 HB2 LYS 31 HB2 LYS 31 2.746 -2.935 9.157
193 HB3 LYS 31 HB1 LYS 31 2.009 -4.198 8.184
194 HG2 LYS 31 HG2 LYS 31 3.910 -3.369 6.485
195 HG3 LYS 31 HG1 LYS 31 4.692 -2.998 8.021
196 HD2 LYS 31 HD2 LYS 31 4.143 -5.348 8.743
197 HD3 LYS 31 HD1 LYS 31 3.651 -5.663 7.078
198 HE2 LYS 31 HE2 LYS 31 5.789 -6.266 6.778
199 HE3 LYS 31 HE1 LYS 31 6.100 -4.532 6.718
200 HZ1 LYS 31 HZ1 LYS 31 6.280 -4.820 9.286
201 HZ2 LYS 31 HZ2 LYS 31 7.594 -5.205 8.294
202 HZ3 LYS 31 HZ3 LYS 31 6.602 -6.435 8.896
203 H ASP 32 HN ASP 32 0.238 -1.641 5.469
204 HA ASP 32 HA ASP 32 -2.164 -2.747 6.641
205 HB2 ASP 32 HB2 ASP 32 -1.743 -1.580 3.879
206 HB3 ASP 32 HB1 ASP 32 -3.292 -1.893 4.655
207 H CYS 33 HN CYS 33 0.241 -3.629 4.308
208 HA CYS 33 HA CYS 33 -1.242 -5.771 3.110
209 HB2 CYS 33 HB2 CYS 33 0.679 -4.451 2.065
210 HB3 CYS 33 HB1 CYS 33 1.750 -5.414 3.077
211 H ALA 34 HN ALA 34 -0.485 -8.042 3.206
212 HA ALA 34 HA ALA 34 -0.467 -9.027 5.825
213 HB1 ALA 34 HB1 ALA 34 0.719 -10.790 3.795
214 HB2 ALA 34 HB2 ALA 34 -0.862 -10.129 3.379
215 HB3 ALA 34 HB3 ALA 34 -0.657 -11.053 4.867
216 H ASP 35 HN ASP 35 2.158 -8.394 3.559
217 HA ASP 35 HA ASP 35 4.069 -8.877 5.748
218 HB2 ASP 35 HB2 ASP 35 3.995 -9.987 3.067
219 HB3 ASP 35 HB1 ASP 35 5.505 -9.129 3.361
220 H GLY 36 HN GLY 36 2.698 -6.402 4.971
221 HA2 GLY 36 HA2 GLY 36 3.188 -4.178 4.688
222 HA3 GLY 36 HA1 GLY 36 4.809 -4.600 5.209
223 H ALA 37 HN ALA 37 3.418 -6.010 2.335
224 HA ALA 37 HA ALA 37 5.541 -5.463 0.672
225 HB1 ALA 37 HB1 ALA 37 2.876 -5.461 -0.610
226 HB2 ALA 37 HB2 ALA 37 3.288 -6.867 0.371
227 HB3 ALA 37 HB3 ALA 37 4.318 -6.405 -0.984
228 H ASP 38 HN ASP 38 2.615 -3.510 1.158
229 HA ASP 38 HA ASP 38 3.129 -1.576 -0.794
230 HB2 ASP 38 HB2 ASP 38 1.633 -0.104 0.550
231 HB3 ASP 38 HB1 ASP 38 0.959 -1.703 0.253
232 H GLU 39 HN GLU 39 4.557 -2.088 2.313
233 HA GLU 39 HA GLU 39 5.715 0.572 2.424
234 HB2 GLU 39 HB2 GLU 39 6.400 -1.716 4.250
235 HB3 GLU 39 HB1 GLU 39 6.494 0.007 4.574
236 HG2 GLU 39 HG2 GLU 39 3.867 -1.317 4.049
237 HG3 GLU 39 HG1 GLU 39 4.605 -1.354 5.647
238 H SER 40 HN SER 40 6.393 -1.802 0.450
239 HA SER 40 HA SER 40 9.301 -1.416 0.661
240 HB2 SER 40 HB2 SER 40 7.840 -3.883 0.792
241 HB3 SER 40 HB1 SER 40 8.846 -3.879 -0.656
242 HG SER 40 HG SER 40 9.576 -4.168 1.919
243 H ILE 41 HN ILE 41 10.414 -1.959 -1.465
244 HA ILE 41 HA ILE 41 9.464 -0.276 -3.483
245 HB ILE 41 HB ILE 41 11.500 -2.494 -3.623
246 HG12 ILE 41 HG12 ILE 41 11.945 -0.545 -2.103
247 HG13 ILE 41 HG11 ILE 41 13.135 -0.759 -3.380
248 HG21 ILE 41 HG21 ILE 41 10.863 -0.361 -5.653
249 HG22 ILE 41 HG22 ILE 41 10.678 -2.104 -5.853
250 HG23 ILE 41 HG23 ILE 41 12.288 -1.400 -5.696
251 HD11 ILE 41 HD11 ILE 41 10.873 1.068 -3.915
252 HD12 ILE 41 HD12 ILE 41 12.557 1.163 -4.429
253 HD13 ILE 41 HD13 ILE 41 12.113 1.600 -2.779
254 H ALA 42 HN ALA 42 8.826 -3.623 -2.832
255 HA ALA 42 HA ALA 42 8.095 -4.623 -5.293
256 HB1 ALA 42 HB1 ALA 42 8.011 -5.578 -2.777
257 HB2 ALA 42 HB2 ALA 42 7.229 -6.364 -4.149
258 HB3 ALA 42 HB3 ALA 42 6.290 -5.328 -3.072
259 H ALA 43 HN ALA 43 6.454 -2.282 -3.323
260 HA ALA 43 HA ALA 43 4.031 -2.442 -4.941
261 HB1 ALA 43 HB1 ALA 43 4.356 -0.435 -2.775
262 HB2 ALA 43 HB2 ALA 43 4.222 -2.137 -2.334
263 HB3 ALA 43 HB3 ALA 43 2.935 -1.361 -3.257
264 H GLY 44 HN GLY 44 6.828 -1.227 -5.656
265 HA2 GLY 44 HA2 GLY 44 7.450 0.380 -7.184
266 HA3 GLY 44 HA1 GLY 44 5.763 0.856 -7.302
267 H CYS 45 HN CYS 45 7.141 0.791 -4.146
268 HA CYS 45 HA CYS 45 6.728 3.607 -3.837
269 HB2 CYS 45 HB2 CYS 45 6.318 2.015 -2.000
270 HB3 CYS 45 HB1 CYS 45 8.034 1.628 -1.957
271 H LEU 46 HN LEU 46 8.141 4.583 -5.303
272 HA LEU 46 HA LEU 46 11.009 4.251 -4.765
273 HB2 LEU 46 HB2 LEU 46 9.913 5.761 -7.105
274 HB3 LEU 46 HB1 LEU 46 11.456 4.944 -6.944
275 HG LEU 46 HG LEU 46 9.337 3.015 -6.725
276 HD11 LEU 46 HD11 LEU 46 7.822 4.099 -8.028
277 HD12 LEU 46 HD12 LEU 46 8.804 3.368 -9.298
278 HD13 LEU 46 HD13 LEU 46 9.050 5.057 -8.856
279 HD21 LEU 46 HD21 LEU 46 10.527 1.997 -8.607
280 HD22 LEU 46 HD22 LEU 46 11.638 2.511 -7.338
281 HD23 LEU 46 HD23 LEU 46 11.473 3.473 -8.807
282 H TYR 47 HN TYR 47 10.319 5.589 -2.772
283 HA TYR 47 HA TYR 47 11.440 8.144 -3.012
284 HB2 TYR 47 HB2 TYR 47 9.547 9.601 -2.687
285 HB3 TYR 47 HB1 TYR 47 9.258 8.630 -4.125
286 HD1 TYR 47 HD1 TYR 47 8.056 6.250 -3.419
287 HD2 TYR 47 HD2 TYR 47 7.680 9.978 -1.409
288 HE1 TYR 47 HE1 TYR 47 5.896 5.525 -2.495
289 HE2 TYR 47 HE2 TYR 47 5.519 9.265 -0.477
290 HH TYR 47 HH TYR 47 3.659 7.218 -1.501
291 H ASN 48 HN ASN 48 11.847 5.988 -1.348
292 HA ASN 48 HA ASN 48 11.019 7.077 1.260
293 HB2 ASN 48 HB2 ASN 48 10.963 4.795 2.152
294 HB3 ASN 48 HB1 ASN 48 9.836 4.971 0.811
295 HD21 ASN 48 HD21 ASN 48 10.253 3.936 -1.128
296 HD22 ASN 48 HD22 ASN 48 11.425 2.675 -1.267
297 H SER 49 HN SER 49 12.523 5.726 2.980
298 HA SER 49 HA SER 49 15.135 6.799 2.545
299 HB2 SER 49 HB2 SER 49 14.053 6.720 4.782
300 HB3 SER 49 HB1 SER 49 14.182 4.962 4.755
301 HG SER 49 HG SER 49 16.348 6.795 4.634
302 H THR 50 HN THR 50 17.082 5.332 3.151
303 HA THR 50 HA THR 50 17.316 3.376 1.109
304 HB THR 50 HB THR 50 19.258 4.632 1.768
305 HG1 THR 50 HG1 THR 50 19.786 2.582 1.106
306 HG21 THR 50 HG21 THR 50 18.911 5.171 4.035
307 HG22 THR 50 HG22 THR 50 20.357 4.162 3.978
308 HG23 THR 50 HG23 THR 50 18.820 3.473 4.501
Start of MODEL 8
1 H1 GLY 1 HT1 GLY 1 -11.928 6.922 4.162
2 H2 GLY 1 HT2 GLY 1 -10.464 7.626 4.632
3 H3 GLY 1 HT3 GLY 1 -11.866 8.568 4.548
4 HA2 GLY 1 HA1 GLY 1 -11.045 6.620 6.580
5 HA3 GLY 1 HA2 GLY 1 -11.750 8.215 6.792
6 H SER 2 HN SER 2 -13.844 7.628 4.764
7 HA SER 2 HA SER 2 -15.588 6.062 6.531
8 HB2 SER 2 HB2 SER 2 -16.095 8.504 5.735
9 HB3 SER 2 HB1 SER 2 -16.600 7.716 4.241
10 HG SER 2 HG SER 2 -17.573 7.015 6.812
11 H GLU 3 HN GLU 3 -17.546 5.169 5.041
12 HA GLU 3 HA GLU 3 -18.110 3.325 3.819
13 HB2 GLU 3 HB2 GLU 3 -17.752 3.549 1.458
14 HB3 GLU 3 HB1 GLU 3 -18.015 5.154 2.123
15 HG2 GLU 3 HG2 GLU 3 -15.717 5.697 1.954
16 HG3 GLU 3 HG1 GLU 3 -15.281 4.025 1.603
17 H GLY 4 HN GLY 4 -16.909 1.812 1.897
18 HA2 GLY 4 HA2 GLY 4 -15.242 0.116 3.408
19 HA3 GLY 4 HA1 GLY 4 -15.512 0.004 1.675
20 H LYS 5 HN LYS 5 -14.453 2.306 0.714
21 HA LYS 5 HA LYS 5 -12.490 3.226 0.029
22 HB2 LYS 5 HB2 LYS 5 -12.424 3.227 2.926
23 HB3 LYS 5 HB1 LYS 5 -10.801 3.103 2.262
24 HG2 LYS 5 HG2 LYS 5 -12.830 5.253 1.703
25 HG3 LYS 5 HG1 LYS 5 -11.327 5.410 2.613
26 HD2 LYS 5 HD2 LYS 5 -10.855 4.337 -0.035
27 HD3 LYS 5 HD1 LYS 5 -11.698 5.886 -0.106
28 HE2 LYS 5 HE2 LYS 5 -9.928 6.696 1.568
29 HE3 LYS 5 HE1 LYS 5 -9.029 5.250 1.108
30 HZ1 LYS 5 HZ1 LYS 5 -8.594 7.437 -0.140
31 HZ2 LYS 5 HZ2 LYS 5 -10.035 7.097 -0.956
32 HZ3 LYS 5 HZ3 LYS 5 -8.742 6.011 -1.039
33 H THR 6 HN THR 6 -9.849 2.757 0.606
34 HA THR 6 HA THR 6 -8.103 1.363 0.198
35 HB THR 6 HB THR 6 -8.099 -0.779 1.090
36 HG1 THR 6 HG1 THR 6 -9.514 -2.109 0.345
37 HG21 THR 6 HG21 THR 6 -9.439 1.108 2.586
38 HG22 THR 6 HG22 THR 6 -8.774 -0.419 3.166
39 HG23 THR 6 HG23 THR 6 -10.467 -0.321 2.681
40 H CYS 7 HN CYS 7 -7.227 0.512 -1.609
41 HA CYS 7 HA CYS 7 -7.042 -0.225 -3.746
42 HB2 CYS 7 HB2 CYS 7 -9.774 -1.456 -3.545
43 HB3 CYS 7 HB1 CYS 7 -8.390 -2.000 -4.485
44 H GLY 8 HN GLY 8 -7.849 2.359 -3.478
45 HA2 GLY 8 HA2 GLY 8 -10.217 3.113 -4.760
46 HA3 GLY 8 HA1 GLY 8 -8.762 4.094 -4.672
47 HA PRO 9 HA PRO 9 -9.805 3.043 -9.158
48 HB2 PRO 9 HB2 PRO 9 -8.910 5.564 -9.952
49 HB3 PRO 9 HB1 PRO 9 -10.595 5.098 -9.711
50 HG2 PRO 9 HG2 PRO 9 -8.743 6.542 -7.872
51 HG3 PRO 9 HG1 PRO 9 -10.477 6.790 -8.144
52 HD2 PRO 9 HD2 PRO 9 -9.584 5.528 -5.963
53 HD3 PRO 9 HD1 PRO 9 -11.070 5.002 -6.784
54 H SER 10 HN SER 10 -7.079 4.682 -7.617
55 HA SER 10 HA SER 10 -5.270 3.232 -9.436
56 HB2 SER 10 HB2 SER 10 -3.775 5.382 -8.619
57 HB3 SER 10 HB1 SER 10 -4.648 5.290 -10.148
58 HG SER 10 HG SER 10 -5.599 6.412 -7.719
59 H SER 11 HN SER 11 -5.596 1.659 -7.583
60 HA SER 11 HA SER 11 -3.862 2.321 -5.304
61 HB2 SER 11 HB2 SER 11 -6.285 1.551 -4.949
62 HB3 SER 11 HB1 SER 11 -5.724 -0.046 -5.446
63 HG SER 11 HG SER 11 -5.582 0.994 -3.057
64 H PHE 12 HN PHE 12 -2.910 0.145 -4.350
65 HA PHE 12 HA PHE 12 -1.488 -1.180 -6.564
66 HB2 PHE 12 HB2 PHE 12 0.152 0.014 -5.395
67 HB3 PHE 12 HB1 PHE 12 -0.597 -0.299 -3.834
68 HD1 PHE 12 HD2 PHE 12 1.007 -2.158 -6.648
69 HD2 PHE 12 HD1 PHE 12 0.380 -1.839 -2.452
70 HE1 PHE 12 HE2 PHE 12 2.556 -4.034 -6.279
71 HE2 PHE 12 HE1 PHE 12 1.927 -3.715 -2.073
72 HZ PHE 12 HZ PHE 12 3.019 -4.815 -3.988
73 H SER 13 HN SER 13 -0.972 -3.408 -6.326
74 HA SER 13 HA SER 13 -2.768 -4.836 -4.484
75 HB2 SER 13 HB2 SER 13 -3.469 -6.080 -6.215
76 HB3 SER 13 HB1 SER 13 -2.599 -4.974 -7.273
77 HG SER 13 HG SER 13 -1.847 -7.503 -6.325
78 H CYS 14 HN CYS 14 -1.713 -5.741 -2.841
79 HA CYS 14 HA CYS 14 1.068 -6.038 -2.696
80 HB2 CYS 14 HB2 CYS 14 -0.865 -7.696 -1.089
81 HB3 CYS 14 HB1 CYS 14 0.730 -7.131 -0.619
82 HA PRO 15 HA PRO 15 1.717 -9.796 -4.941
83 HB2 PRO 15 HB2 PRO 15 4.185 -10.424 -4.086
84 HB3 PRO 15 HB1 PRO 15 3.887 -9.022 -5.121
85 HG2 PRO 15 HG2 PRO 15 4.289 -9.136 -2.157
86 HG3 PRO 15 HG1 PRO 15 4.958 -7.990 -3.332
87 HD2 PRO 15 HD2 PRO 15 2.790 -7.452 -1.765
88 HD3 PRO 15 HD1 PRO 15 3.055 -6.715 -3.356
89 H GLY 16 HN GLY 16 1.234 -11.901 -4.672
90 HA2 GLY 16 HA2 GLY 16 1.266 -13.997 -3.606
91 HA3 GLY 16 HA1 GLY 16 1.763 -13.209 -2.117
92 H THR 17 HN THR 17 -0.230 -11.284 -1.870
93 HA THR 17 HA THR 17 -2.580 -12.992 -1.401
94 HB THR 17 HB THR 17 -1.875 -12.271 0.700
95 HG1 THR 17 HG1 THR 17 -3.632 -10.183 -0.042
96 HG21 THR 17 HG21 THR 17 -1.286 -9.938 1.246
97 HG22 THR 17 HG22 THR 17 -1.358 -9.553 -0.473
98 HG23 THR 17 HG23 THR 17 -0.163 -10.704 0.123
99 H HIS 18 HN HIS 18 -4.686 -11.719 -1.323
100 HA HIS 18 HA HIS 18 -4.825 -10.092 -3.749
101 HB2 HIS 18 HB2 HIS 18 -7.316 -10.493 -3.507
102 HB3 HIS 18 HB1 HIS 18 -6.335 -11.924 -3.815
103 HD1 HIS 18 HD1 HIS 18 -5.861 -13.463 -1.639
104 HD2 HIS 18 HD2 HIS 18 -8.834 -10.587 -1.269
105 HE1 HIS 18 HE1 HIS 18 -7.219 -14.104 0.393
106 H VAL 19 HN VAL 19 -3.773 -8.852 -1.445
107 HA VAL 19 HA VAL 19 -5.941 -7.055 -0.600
108 HB VAL 19 HB VAL 19 -4.886 -7.898 1.330
109 HG11 VAL 19 HG11 VAL 19 -2.889 -8.837 1.171
110 HG12 VAL 19 HG12 VAL 19 -2.176 -7.225 1.201
111 HG13 VAL 19 HG13 VAL 19 -2.553 -7.994 -0.339
112 HG21 VAL 19 HG21 VAL 19 -4.997 -5.263 0.926
113 HG22 VAL 19 HG22 VAL 19 -3.259 -5.428 1.180
114 HG23 VAL 19 HG23 VAL 19 -4.388 -5.971 2.423
115 H CYS 20 HN CYS 20 -5.779 -4.844 -0.860
116 HA CYS 20 HA CYS 20 -3.521 -3.889 -2.485
117 HB2 CYS 20 HB2 CYS 20 -5.595 -2.244 -3.235
118 HB3 CYS 20 HB1 CYS 20 -4.992 -3.610 -4.164
119 H VAL 21 HN VAL 21 -3.182 -1.540 -2.387
120 HA VAL 21 HA VAL 21 -4.254 -0.226 -0.010
121 HB VAL 21 HB VAL 21 -2.257 -1.275 0.843
122 HG11 VAL 21 HG11 VAL 21 -0.143 -0.035 -0.514
123 HG12 VAL 21 HG12 VAL 21 -1.222 -0.665 -1.759
124 HG13 VAL 21 HG13 VAL 21 -0.577 -1.744 -0.522
125 HG21 VAL 21 HG21 VAL 21 -1.413 1.559 0.378
126 HG22 VAL 21 HG22 VAL 21 -1.251 0.571 1.831
127 HG23 VAL 21 HG23 VAL 21 -2.834 1.188 1.356
128 HA PRO 22 HA PRO 22 -4.414 3.136 -2.941
129 HB2 PRO 22 HB2 PRO 22 -4.454 4.847 -0.523
130 HB3 PRO 22 HB1 PRO 22 -5.616 4.747 -1.850
131 HG2 PRO 22 HG2 PRO 22 -6.177 3.736 0.561
132 HG3 PRO 22 HG1 PRO 22 -6.717 2.936 -0.926
133 HD2 PRO 22 HD2 PRO 22 -4.447 2.234 0.888
134 HD3 PRO 22 HD1 PRO 22 -5.582 1.168 0.034
135 H GLU 23 HN GLU 23 -3.033 4.710 -3.759
136 HA GLU 23 HA GLU 23 -0.317 4.479 -3.304
137 HB2 GLU 23 HB2 GLU 23 -1.969 5.974 -5.003
138 HB3 GLU 23 HB1 GLU 23 -0.976 7.163 -4.172
139 HG2 GLU 23 HG2 GLU 23 0.563 6.745 -5.711
140 HG3 GLU 23 HG1 GLU 23 0.837 5.221 -4.869
141 H ARG 24 HN ARG 24 -2.622 6.726 -1.847
142 HA ARG 24 HA ARG 24 -0.772 8.349 -0.492
143 HB2 ARG 24 HB2 ARG 24 -3.207 8.848 -0.806
144 HB3 ARG 24 HB1 ARG 24 -3.566 7.639 0.419
145 HG2 ARG 24 HG2 ARG 24 -3.443 9.277 1.909
146 HG3 ARG 24 HG1 ARG 24 -1.700 9.281 1.635
147 HD2 ARG 24 HD2 ARG 24 -3.552 10.849 -0.126
148 HD3 ARG 24 HD1 ARG 24 -2.989 11.501 1.413
149 HE ARG 24 HE ARG 24 -1.476 11.227 -1.007
150 HH11 ARG 24 HH11 ARG 24 -1.271 11.394 2.473
151 HH12 ARG 24 HH12 ARG 24 0.370 11.948 2.475
152 HH21 ARG 24 HH21 ARG 24 0.683 11.954 -1.006
153 HH22 ARG 24 HH22 ARG 24 1.480 12.266 0.500
154 H TRP 25 HN TRP 25 -1.993 5.172 0.156
155 HA TRP 25 HA TRP 25 -0.954 5.150 2.878
156 HB2 TRP 25 HB2 TRP 25 -2.526 3.176 1.233
157 HB3 TRP 25 HB1 TRP 25 -1.826 2.740 2.788
158 HD1 TRP 25 HD1 TRP 25 -3.412 6.184 2.230
159 HE1 TRP 25 HE1 TRP 25 -5.518 6.361 3.699
160 HE3 TRP 25 HE3 TRP 25 -3.628 1.366 3.921
161 HZ2 TRP 25 HZ2 TRP 25 -7.066 4.679 5.358
162 HZ3 TRP 25 HZ3 TRP 25 -5.451 0.730 5.445
163 HH2 TRP 25 HH2 TRP 25 -7.134 2.354 6.148
164 H LEU 26 HN LEU 26 -0.035 4.211 -0.309
165 HA LEU 26 HA LEU 26 1.665 2.077 0.100
166 HB2 LEU 26 HB2 LEU 26 1.503 4.288 -1.855
167 HB3 LEU 26 HB1 LEU 26 3.031 3.437 -1.783
168 HG LEU 26 HG LEU 26 1.472 2.582 -3.520
169 HD11 LEU 26 HD11 LEU 26 3.184 1.210 -1.939
170 HD12 LEU 26 HD12 LEU 26 2.328 0.519 -3.318
171 HD13 LEU 26 HD13 LEU 26 1.694 0.300 -1.687
172 HD21 LEU 26 HD21 LEU 26 -0.301 0.975 -2.391
173 HD22 LEU 26 HD22 LEU 26 -0.677 2.652 -2.778
174 HD23 LEU 26 HD23 LEU 26 -0.245 2.203 -1.129
175 H CYS 27 HN CYS 27 3.401 1.795 1.306
176 HA CYS 27 HA CYS 27 5.027 2.278 2.849
177 HB2 CYS 27 HB2 CYS 27 6.987 3.306 1.850
178 HB3 CYS 27 HB1 CYS 27 6.221 2.231 0.688
179 H ASP 28 HN ASP 28 3.063 3.632 3.800
180 HA ASP 28 HA ASP 28 3.897 6.428 4.112
181 HB2 ASP 28 HB2 ASP 28 1.632 6.834 4.956
182 HB3 ASP 28 HB1 ASP 28 1.583 6.080 3.367
183 H GLY 29 HN GLY 29 4.156 3.476 5.648
184 HA2 GLY 29 HA2 GLY 29 5.540 3.563 7.694
185 HA3 GLY 29 HA1 GLY 29 4.432 4.794 8.278
186 H ASP 30 HN ASP 30 2.174 3.171 7.029
187 HA ASP 30 HA ASP 30 1.925 1.271 9.261
188 HB2 ASP 30 HB2 ASP 30 0.261 3.276 8.783
189 HB3 ASP 30 HB1 ASP 30 -0.434 2.129 7.642
190 H LYS 31 HN LYS 31 2.460 -0.718 8.632
191 HA LYS 31 HA LYS 31 2.499 -1.692 6.025
192 HB2 LYS 31 HB2 LYS 31 2.665 -2.863 8.728
193 HB3 LYS 31 HB1 LYS 31 2.179 -3.972 7.455
194 HG2 LYS 31 HG2 LYS 31 4.208 -3.197 6.174
195 HG3 LYS 31 HG1 LYS 31 4.719 -2.385 7.655
196 HD2 LYS 31 HD2 LYS 31 5.753 -4.594 7.435
197 HD3 LYS 31 HD1 LYS 31 4.698 -4.506 8.846
198 HE2 LYS 31 HE2 LYS 31 3.217 -5.379 6.539
199 HE3 LYS 31 HE1 LYS 31 4.637 -6.396 6.775
200 HZ1 LYS 31 HZ1 LYS 31 3.831 -6.417 9.221
201 HZ2 LYS 31 HZ2 LYS 31 3.080 -7.424 8.088
202 HZ3 LYS 31 HZ3 LYS 31 2.336 -5.979 8.558
203 H ASP 32 HN ASP 32 0.667 -1.416 4.836
204 HA ASP 32 HA ASP 32 -1.894 -2.319 5.872
205 HB2 ASP 32 HB2 ASP 32 -1.362 -1.281 3.091
206 HB3 ASP 32 HB1 ASP 32 -2.881 -1.280 3.981
207 H CYS 33 HN CYS 33 0.579 -3.333 3.630
208 HA CYS 33 HA CYS 33 -0.998 -5.353 2.355
209 HB2 CYS 33 HB2 CYS 33 1.895 -4.588 2.357
210 HB3 CYS 33 HB1 CYS 33 1.424 -6.156 1.715
211 H ALA 34 HN ALA 34 0.042 -7.679 2.358
212 HA ALA 34 HA ALA 34 -0.436 -8.770 4.918
213 HB1 ALA 34 HB1 ALA 34 0.682 -10.844 3.720
214 HB2 ALA 34 HB2 ALA 34 0.442 -9.840 2.291
215 HB3 ALA 34 HB3 ALA 34 -0.937 -10.290 3.294
216 H ASP 35 HN ASP 35 2.572 -8.617 3.007
217 HA ASP 35 HA ASP 35 4.080 -8.983 5.507
218 HB2 ASP 35 HB2 ASP 35 4.840 -9.542 2.635
219 HB3 ASP 35 HB1 ASP 35 5.979 -9.617 3.976
220 H GLY 36 HN GLY 36 2.955 -6.452 4.665
221 HA2 GLY 36 HA2 GLY 36 3.582 -4.246 4.611
222 HA3 GLY 36 HA1 GLY 36 5.174 -4.783 5.125
223 H ALA 37 HN ALA 37 3.644 -5.856 2.161
224 HA ALA 37 HA ALA 37 5.856 -5.306 0.552
225 HB1 ALA 37 HB1 ALA 37 3.344 -6.505 0.223
226 HB2 ALA 37 HB2 ALA 37 4.686 -6.484 -0.923
227 HB3 ALA 37 HB3 ALA 37 3.440 -5.238 -1.001
228 H ASP 38 HN ASP 38 2.983 -3.378 1.235
229 HA ASP 38 HA ASP 38 3.388 -1.371 -0.679
230 HB2 ASP 38 HB2 ASP 38 1.989 0.044 0.880
231 HB3 ASP 38 HB1 ASP 38 1.267 -1.487 0.398
232 H GLU 39 HN GLU 39 4.981 -2.016 2.316
233 HA GLU 39 HA GLU 39 6.109 0.652 2.509
234 HB2 GLU 39 HB2 GLU 39 6.674 -1.808 4.170
235 HB3 GLU 39 HB1 GLU 39 7.185 -0.167 4.537
236 HG2 GLU 39 HG2 GLU 39 4.306 -0.453 4.140
237 HG3 GLU 39 HG1 GLU 39 4.945 -1.378 5.498
238 H SER 40 HN SER 40 6.712 -1.633 0.402
239 HA SER 40 HA SER 40 9.618 -1.190 0.458
240 HB2 SER 40 HB2 SER 40 8.173 -3.707 0.481
241 HB3 SER 40 HB1 SER 40 9.245 -3.593 -0.914
242 HG SER 40 HG SER 40 10.869 -2.892 0.716
243 H ILE 41 HN ILE 41 10.632 -1.485 -1.718
244 HA ILE 41 HA ILE 41 9.456 0.188 -3.611
245 HB ILE 41 HB ILE 41 11.618 -1.880 -3.981
246 HG12 ILE 41 HG12 ILE 41 12.133 -0.095 -2.369
247 HG13 ILE 41 HG11 ILE 41 13.135 0.026 -3.810
248 HG21 ILE 41 HG21 ILE 41 10.615 -1.373 -6.130
249 HG22 ILE 41 HG22 ILE 41 12.220 -0.648 -6.019
250 HG23 ILE 41 HG23 ILE 41 10.783 0.356 -5.821
251 HD11 ILE 41 HD11 ILE 41 11.668 1.790 -4.662
252 HD12 ILE 41 HD12 ILE 41 12.389 2.209 -3.108
253 HD13 ILE 41 HD13 ILE 41 10.707 1.685 -3.187
254 H ALA 42 HN ALA 42 9.041 -3.200 -3.053
255 HA ALA 42 HA ALA 42 8.266 -4.181 -5.506
256 HB1 ALA 42 HB1 ALA 42 7.566 -5.991 -4.363
257 HB2 ALA 42 HB2 ALA 42 6.566 -5.039 -3.264
258 HB3 ALA 42 HB3 ALA 42 8.304 -5.171 -2.987
259 H ALA 43 HN ALA 43 6.541 -2.051 -3.357
260 HA ALA 43 HA ALA 43 4.053 -2.302 -4.815
261 HB1 ALA 43 HB1 ALA 43 3.071 -1.288 -3.055
262 HB2 ALA 43 HB2 ALA 43 4.386 -0.132 -2.846
263 HB3 ALA 43 HB3 ALA 43 4.553 -1.779 -2.237
264 H GLY 44 HN GLY 44 6.868 -0.331 -4.906
265 HA2 GLY 44 HA2 GLY 44 7.291 1.030 -6.835
266 HA3 GLY 44 HA1 GLY 44 5.566 1.348 -6.940
267 H CYS 45 HN CYS 45 7.343 1.496 -3.931
268 HA CYS 45 HA CYS 45 6.404 4.075 -3.313
269 HB2 CYS 45 HB2 CYS 45 7.133 2.372 -1.643
270 HB3 CYS 45 HB1 CYS 45 8.799 2.669 -2.118
271 H LEU 46 HN LEU 46 9.059 3.010 -5.204
272 HA LEU 46 HA LEU 46 10.555 4.146 -6.483
273 HB2 LEU 46 HB2 LEU 46 9.394 6.719 -5.444
274 HB3 LEU 46 HB1 LEU 46 10.254 6.452 -6.949
275 HG LEU 46 HG LEU 46 7.925 4.771 -6.871
276 HD11 LEU 46 HD11 LEU 46 7.302 6.770 -5.304
277 HD12 LEU 46 HD12 LEU 46 6.168 6.203 -6.530
278 HD13 LEU 46 HD13 LEU 46 7.139 7.645 -6.827
279 HD21 LEU 46 HD21 LEU 46 7.408 5.996 -8.948
280 HD22 LEU 46 HD22 LEU 46 9.071 5.409 -8.901
281 HD23 LEU 46 HD23 LEU 46 8.727 7.112 -8.594
282 H TYR 47 HN TYR 47 10.175 6.338 -3.684
283 HA TYR 47 HA TYR 47 13.036 6.468 -3.391
284 HB2 TYR 47 HB2 TYR 47 12.661 8.141 -1.745
285 HB3 TYR 47 HB1 TYR 47 11.472 8.416 -3.010
286 HD1 TYR 47 HD1 TYR 47 9.100 7.556 -2.616
287 HD2 TYR 47 HD2 TYR 47 11.999 7.858 0.480
288 HE1 TYR 47 HE1 TYR 47 7.303 7.507 -0.939
289 HE2 TYR 47 HE2 TYR 47 10.211 7.810 2.167
290 HH TYR 47 HH TYR 47 7.619 8.469 2.121
291 H ASN 48 HN ASN 48 14.180 5.967 -1.437
292 HA ASN 48 HA ASN 48 14.004 3.403 -0.567
293 HB2 ASN 48 HB2 ASN 48 14.979 5.764 1.051
294 HB3 ASN 48 HB1 ASN 48 15.356 4.077 1.386
295 HD21 ASN 48 HD21 ASN 48 16.231 6.854 -0.312
296 HD22 ASN 48 HD22 ASN 48 17.474 6.164 -1.294
297 H SER 49 HN SER 49 13.057 6.062 1.615
298 HA SER 49 HA SER 49 11.390 6.243 3.157
299 HB2 SER 49 HB2 SER 49 10.056 5.277 1.100
300 HB3 SER 49 HB1 SER 49 9.984 3.821 2.092
301 HG SER 49 HG SER 49 9.252 6.352 3.112
302 H THR 50 HN THR 50 13.743 4.501 3.514
303 HA THR 50 HA THR 50 12.895 3.245 5.959
304 HB THR 50 HB THR 50 14.072 1.520 3.771
305 HG1 THR 50 HG1 THR 50 11.958 1.758 3.285
306 HG21 THR 50 HG21 THR 50 13.990 1.147 6.588
307 HG22 THR 50 HG22 THR 50 14.598 0.061 5.338
308 HG23 THR 50 HG23 THR 50 12.904 -0.012 5.822
Start of MODEL 9
1 H1 GLY 1 HT1 GLY 1 -13.554 6.891 5.711
2 H2 GLY 1 HT2 GLY 1 -12.770 7.346 7.139
3 H3 GLY 1 HT3 GLY 1 -14.417 6.961 7.165
4 HA2 GLY 1 HA1 GLY 1 -12.092 5.207 7.108
5 HA3 GLY 1 HA2 GLY 1 -13.629 4.999 7.932
6 H SER 2 HN SER 2 -15.086 5.648 5.397
7 HA SER 2 HA SER 2 -14.518 3.188 3.889
8 HB2 SER 2 HB2 SER 2 -16.683 3.467 5.575
9 HB3 SER 2 HB1 SER 2 -17.360 3.896 4.005
10 HG SER 2 HG SER 2 -16.310 1.883 3.260
11 H GLU 3 HN GLU 3 -16.573 3.438 2.021
12 HA GLU 3 HA GLU 3 -17.134 4.459 0.067
13 HB2 GLU 3 HB2 GLU 3 -17.417 6.430 1.873
14 HB3 GLU 3 HB1 GLU 3 -16.129 7.125 0.899
15 HG2 GLU 3 HG2 GLU 3 -17.568 6.731 -1.113
16 HG3 GLU 3 HG1 GLU 3 -18.871 6.299 -0.007
17 H GLY 4 HN GLY 4 -15.123 3.129 -0.480
18 HA2 GLY 4 HA2 GLY 4 -13.371 2.977 -1.973
19 HA3 GLY 4 HA1 GLY 4 -13.491 4.712 -2.219
20 H LYS 5 HN LYS 5 -12.777 2.737 0.657
21 HA LYS 5 HA LYS 5 -10.321 4.325 1.000
22 HB2 LYS 5 HB2 LYS 5 -12.379 3.368 2.882
23 HB3 LYS 5 HB1 LYS 5 -10.721 3.179 3.438
24 HG2 LYS 5 HG2 LYS 5 -10.770 5.749 2.442
25 HG3 LYS 5 HG1 LYS 5 -12.349 5.569 3.210
26 HD2 LYS 5 HD2 LYS 5 -11.260 4.835 5.275
27 HD3 LYS 5 HD1 LYS 5 -9.681 5.004 4.506
28 HE2 LYS 5 HE2 LYS 5 -10.550 7.451 4.049
29 HE3 LYS 5 HE1 LYS 5 -11.586 7.098 5.431
30 HZ1 LYS 5 HZ1 LYS 5 -9.817 7.852 6.569
31 HZ2 LYS 5 HZ2 LYS 5 -8.718 7.525 5.327
32 HZ3 LYS 5 HZ3 LYS 5 -9.227 6.281 6.353
33 H THR 6 HN THR 6 -11.651 1.115 0.786
34 HA THR 6 HA THR 6 -9.239 -0.198 1.649
35 HB THR 6 HB THR 6 -10.670 -2.135 0.358
36 HG1 THR 6 HG1 THR 6 -12.484 -1.169 -0.149
37 HG21 THR 6 HG21 THR 6 -10.937 -1.114 3.163
38 HG22 THR 6 HG22 THR 6 -10.027 -2.507 2.579
39 HG23 THR 6 HG23 THR 6 -11.790 -2.546 2.587
40 H CYS 7 HN CYS 7 -10.923 -0.939 -1.377
41 HA CYS 7 HA CYS 7 -8.341 -0.666 -2.768
42 HB2 CYS 7 HB2 CYS 7 -10.544 -2.427 -3.783
43 HB3 CYS 7 HB1 CYS 7 -8.815 -2.529 -4.088
44 H GLY 8 HN GLY 8 -9.640 1.632 -2.628
45 HA2 GLY 8 HA2 GLY 8 -11.676 2.202 -4.429
46 HA3 GLY 8 HA1 GLY 8 -10.443 3.347 -3.927
47 HA PRO 9 HA PRO 9 -10.315 2.358 -8.609
48 HB2 PRO 9 HB2 PRO 9 -10.037 5.093 -9.151
49 HB3 PRO 9 HB1 PRO 9 -11.508 4.138 -9.346
50 HG2 PRO 9 HG2 PRO 9 -10.682 5.915 -7.100
51 HG3 PRO 9 HG1 PRO 9 -12.295 5.641 -7.784
52 HD2 PRO 9 HD2 PRO 9 -11.579 4.548 -5.455
53 HD3 PRO 9 HD1 PRO 9 -12.587 3.655 -6.614
54 H SER 10 HN SER 10 -8.521 4.277 -6.309
55 HA SER 10 HA SER 10 -6.085 3.856 -7.912
56 HB2 SER 10 HB2 SER 10 -6.123 5.991 -5.839
57 HB3 SER 10 HB1 SER 10 -5.308 5.952 -7.402
58 HG SER 10 HG SER 10 -7.497 6.149 -8.311
59 H SER 11 HN SER 11 -6.582 1.741 -6.538
60 HA SER 11 HA SER 11 -5.057 1.974 -4.026
61 HB2 SER 11 HB2 SER 11 -7.503 0.440 -4.721
62 HB3 SER 11 HB1 SER 11 -6.331 -0.368 -3.680
63 HG SER 11 HG SER 11 -6.556 1.233 -2.182
64 H PHE 12 HN PHE 12 -3.420 0.526 -3.630
65 HA PHE 12 HA PHE 12 -2.434 -0.917 -5.966
66 HB2 PHE 12 HB2 PHE 12 -0.755 0.428 -4.972
67 HB3 PHE 12 HB1 PHE 12 -1.181 -0.097 -3.348
68 HD1 PHE 12 HD2 PHE 12 0.001 -1.561 -6.574
69 HD2 PHE 12 HD1 PHE 12 0.200 -1.617 -2.324
70 HE1 PHE 12 HE2 PHE 12 1.737 -3.301 -6.681
71 HE2 PHE 12 HE1 PHE 12 1.934 -3.358 -2.423
72 HZ PHE 12 HZ PHE 12 2.706 -4.202 -4.602
73 H SER 13 HN SER 13 -1.771 -3.108 -5.863
74 HA SER 13 HA SER 13 -3.140 -4.662 -3.767
75 HB2 SER 13 HB2 SER 13 -4.264 -5.226 -5.738
76 HB3 SER 13 HB1 SER 13 -2.795 -5.156 -6.710
77 HG SER 13 HG SER 13 -2.170 -7.103 -5.921
78 H CYS 14 HN CYS 14 -1.871 -5.805 -2.471
79 HA CYS 14 HA CYS 14 0.944 -5.873 -2.818
80 HB2 CYS 14 HB2 CYS 14 -0.539 -7.674 -0.926
81 HB3 CYS 14 HB1 CYS 14 1.045 -6.945 -0.728
82 HA PRO 15 HA PRO 15 1.360 -9.536 -5.261
83 HB2 PRO 15 HB2 PRO 15 3.916 -10.190 -4.697
84 HB3 PRO 15 HB1 PRO 15 3.498 -8.780 -5.677
85 HG2 PRO 15 HG2 PRO 15 4.226 -8.921 -2.775
86 HG3 PRO 15 HG1 PRO 15 4.769 -7.767 -4.007
87 HD2 PRO 15 HD2 PRO 15 2.808 -7.203 -2.221
88 HD3 PRO 15 HD1 PRO 15 2.850 -6.509 -3.852
89 H GLY 16 HN GLY 16 1.239 -11.751 -5.103
90 HA2 GLY 16 HA2 GLY 16 0.909 -13.799 -4.125
91 HA3 GLY 16 HA1 GLY 16 2.117 -13.311 -2.946
92 H THR 17 HN THR 17 -1.013 -11.780 -3.543
93 HA THR 17 HA THR 17 -2.474 -13.017 -1.510
94 HB THR 17 HB THR 17 -0.869 -12.096 0.047
95 HG1 THR 17 HG1 THR 17 -3.154 -10.437 0.179
96 HG21 THR 17 HG21 THR 17 0.030 -10.259 -1.240
97 HG22 THR 17 HG22 THR 17 -0.554 -9.691 0.324
98 HG23 THR 17 HG23 THR 17 -1.508 -9.405 -1.131
99 H HIS 18 HN HIS 18 -4.404 -11.625 -0.825
100 HA HIS 18 HA HIS 18 -5.201 -9.975 -3.129
101 HB2 HIS 18 HB2 HIS 18 -7.556 -10.585 -1.853
102 HB3 HIS 18 HB1 HIS 18 -6.898 -11.450 -3.236
103 HD1 HIS 18 HD1 HIS 18 -5.693 -13.752 -2.709
104 HD2 HIS 18 HD2 HIS 18 -7.619 -11.968 0.509
105 HE1 HIS 18 HE1 HIS 18 -5.886 -15.532 -0.924
106 H VAL 19 HN VAL 19 -3.702 -8.899 -0.964
107 HA VAL 19 HA VAL 19 -5.678 -7.293 0.495
108 HB VAL 19 HB VAL 19 -4.113 -8.184 2.017
109 HG11 VAL 19 HG11 VAL 19 -1.568 -7.408 1.393
110 HG12 VAL 19 HG12 VAL 19 -2.238 -7.823 -0.184
111 HG13 VAL 19 HG13 VAL 19 -2.246 -9.012 1.118
112 HG21 VAL 19 HG21 VAL 19 -3.573 -6.296 3.116
113 HG22 VAL 19 HG22 VAL 19 -4.418 -5.498 1.790
114 HG23 VAL 19 HG23 VAL 19 -2.660 -5.644 1.754
115 H CYS 20 HN CYS 20 -6.076 -5.258 -0.075
116 HA CYS 20 HA CYS 20 -4.299 -3.999 -2.045
117 HB2 CYS 20 HB2 CYS 20 -6.181 -2.663 -2.732
118 HB3 CYS 20 HB1 CYS 20 -6.693 -4.345 -2.673
119 H VAL 21 HN VAL 21 -4.122 -1.607 -1.918
120 HA VAL 21 HA VAL 21 -4.497 -0.382 0.670
121 HB VAL 21 HB VAL 21 -2.425 -1.464 1.156
122 HG11 VAL 21 HG11 VAL 21 -1.851 -0.874 -1.638
123 HG12 VAL 21 HG12 VAL 21 -1.237 -2.159 -0.598
124 HG13 VAL 21 HG13 VAL 21 -0.492 -0.561 -0.559
125 HG21 VAL 21 HG21 VAL 21 -1.900 1.410 0.406
126 HG22 VAL 21 HG22 VAL 21 -0.898 0.437 1.481
127 HG23 VAL 21 HG23 VAL 21 -2.556 0.828 1.937
128 HA PRO 22 HA PRO 22 -5.178 2.932 -2.273
129 HB2 PRO 22 HB2 PRO 22 -5.015 4.608 0.167
130 HB3 PRO 22 HB1 PRO 22 -6.298 4.504 -1.042
131 HG2 PRO 22 HG2 PRO 22 -6.599 3.434 1.387
132 HG3 PRO 22 HG1 PRO 22 -7.256 2.643 -0.057
133 HD2 PRO 22 HD2 PRO 22 -4.812 1.974 1.526
134 HD3 PRO 22 HD1 PRO 22 -5.985 0.892 0.747
135 H GLU 23 HN GLU 23 -3.941 4.541 -3.231
136 HA GLU 23 HA GLU 23 -1.183 4.415 -3.040
137 HB2 GLU 23 HB2 GLU 23 -3.108 5.977 -4.475
138 HB3 GLU 23 HB1 GLU 23 -1.830 7.038 -3.901
139 HG2 GLU 23 HG2 GLU 23 -0.747 6.425 -5.743
140 HG3 GLU 23 HG1 GLU 23 -0.413 4.925 -4.878
141 H ARG 24 HN ARG 24 -3.448 6.328 -1.201
142 HA ARG 24 HA ARG 24 -1.559 8.139 -0.092
143 HB2 ARG 24 HB2 ARG 24 -3.322 8.658 1.538
144 HB3 ARG 24 HB1 ARG 24 -3.952 8.638 -0.103
145 HG2 ARG 24 HG2 ARG 24 -4.173 6.050 1.174
146 HG3 ARG 24 HG1 ARG 24 -4.999 7.316 2.083
147 HD2 ARG 24 HD2 ARG 24 -5.407 6.585 -0.812
148 HD3 ARG 24 HD1 ARG 24 -6.542 6.345 0.515
149 HE ARG 24 HE ARG 24 -6.050 9.042 0.469
150 HH11 ARG 24 HH11 ARG 24 -7.262 6.687 -1.802
151 HH12 ARG 24 HH12 ARG 24 -8.258 7.826 -2.644
152 HH21 ARG 24 HH21 ARG 24 -7.364 10.542 -0.634
153 HH22 ARG 24 HH22 ARG 24 -8.317 10.015 -1.981
154 H TRP 25 HN TRP 25 -2.465 4.876 0.586
155 HA TRP 25 HA TRP 25 -1.068 4.894 3.166
156 HB2 TRP 25 HB2 TRP 25 -2.790 2.799 1.824
157 HB3 TRP 25 HB1 TRP 25 -1.975 2.566 3.365
158 HD1 TRP 25 HD1 TRP 25 -3.379 6.013 3.007
159 HE1 TRP 25 HE1 TRP 25 -5.535 6.230 4.395
160 HE3 TRP 25 HE3 TRP 25 -4.128 1.081 4.121
161 HZ2 TRP 25 HZ2 TRP 25 -7.316 4.535 5.783
162 HZ3 TRP 25 HZ3 TRP 25 -6.079 0.462 5.485
163 HH2 TRP 25 HH2 TRP 25 -7.639 2.155 6.300
164 H LEU 26 HN LEU 26 -0.005 4.831 0.207
165 HA LEU 26 HA LEU 26 1.561 2.383 0.271
166 HB2 LEU 26 HB2 LEU 26 0.924 4.480 -1.707
167 HB3 LEU 26 HB1 LEU 26 2.508 3.752 -1.860
168 HG LEU 26 HG LEU 26 0.751 2.712 -3.285
169 HD11 LEU 26 HD11 LEU 26 2.777 1.510 -1.823
170 HD12 LEU 26 HD12 LEU 26 1.952 0.847 -3.234
171 HD13 LEU 26 HD13 LEU 26 1.388 0.444 -1.612
172 HD21 LEU 26 HD21 LEU 26 -0.638 1.002 -1.787
173 HD22 LEU 26 HD22 LEU 26 -1.241 2.603 -2.216
174 HD23 LEU 26 HD23 LEU 26 -0.508 2.331 -0.636
175 H CYS 27 HN CYS 27 3.482 2.284 1.229
176 HA CYS 27 HA CYS 27 5.347 2.931 2.379
177 HB2 CYS 27 HB2 CYS 27 6.218 5.067 0.641
178 HB3 CYS 27 HB1 CYS 27 6.908 3.468 0.866
179 H ASP 28 HN ASP 28 3.813 3.865 3.995
180 HA ASP 28 HA ASP 28 4.380 6.730 4.327
181 HB2 ASP 28 HB2 ASP 28 1.865 6.177 5.548
182 HB3 ASP 28 HB1 ASP 28 2.214 7.271 4.216
183 H GLY 29 HN GLY 29 5.338 4.036 5.485
184 HA2 GLY 29 HA2 GLY 29 6.430 3.750 7.547
185 HA3 GLY 29 HA1 GLY 29 5.411 5.003 8.237
186 H ASP 30 HN ASP 30 3.020 3.575 6.995
187 HA ASP 30 HA ASP 30 2.738 1.597 9.149
188 HB2 ASP 30 HB2 ASP 30 1.101 3.720 8.424
189 HB3 ASP 30 HB1 ASP 30 0.279 2.315 7.752
190 H LYS 31 HN LYS 31 3.451 -0.290 8.290
191 HA LYS 31 HA LYS 31 3.133 -1.149 5.650
192 HB2 LYS 31 HB2 LYS 31 3.877 -2.394 8.218
193 HB3 LYS 31 HB1 LYS 31 3.258 -3.499 7.001
194 HG2 LYS 31 HG2 LYS 31 4.949 -2.684 5.422
195 HG3 LYS 31 HG1 LYS 31 5.586 -1.622 6.677
196 HD2 LYS 31 HD2 LYS 31 6.860 -3.738 6.423
197 HD3 LYS 31 HD1 LYS 31 6.196 -3.501 8.039
198 HE2 LYS 31 HE2 LYS 31 4.653 -5.184 7.801
199 HE3 LYS 31 HE1 LYS 31 4.600 -5.033 6.046
200 HZ1 LYS 31 HZ1 LYS 31 6.527 -6.261 5.799
201 HZ2 LYS 31 HZ2 LYS 31 5.763 -7.057 7.080
202 HZ3 LYS 31 HZ3 LYS 31 7.042 -5.995 7.388
203 H ASP 32 HN ASP 32 1.124 -1.045 4.781
204 HA ASP 32 HA ASP 32 -1.156 -2.151 6.205
205 HB2 ASP 32 HB2 ASP 32 -1.183 -1.118 3.375
206 HB3 ASP 32 HB1 ASP 32 -2.513 -1.190 4.526
207 H CYS 33 HN CYS 33 1.002 -2.972 3.597
208 HA CYS 33 HA CYS 33 -0.560 -5.072 2.491
209 HB2 CYS 33 HB2 CYS 33 2.231 -4.090 2.216
210 HB3 CYS 33 HB1 CYS 33 1.923 -5.754 1.738
211 H ALA 34 HN ALA 34 0.401 -7.367 2.416
212 HA ALA 34 HA ALA 34 0.285 -8.449 5.021
213 HB1 ALA 34 HB1 ALA 34 0.668 -9.498 2.290
214 HB2 ALA 34 HB2 ALA 34 -0.424 -10.029 3.569
215 HB3 ALA 34 HB3 ALA 34 1.274 -10.507 3.603
216 H ASP 35 HN ASP 35 2.978 -7.985 2.759
217 HA ASP 35 HA ASP 35 4.832 -8.443 5.004
218 HB2 ASP 35 HB2 ASP 35 4.966 -9.288 2.136
219 HB3 ASP 35 HB1 ASP 35 6.465 -8.948 2.995
220 H GLY 36 HN GLY 36 3.555 -5.946 4.154
221 HA2 GLY 36 HA2 GLY 36 4.156 -3.741 3.961
222 HA3 GLY 36 HA1 GLY 36 5.802 -4.248 4.304
223 H ALA 37 HN ALA 37 3.955 -5.452 1.580
224 HA ALA 37 HA ALA 37 5.963 -4.932 -0.290
225 HB1 ALA 37 HB1 ALA 37 4.654 -6.313 -1.432
226 HB2 ALA 37 HB2 ALA 37 3.527 -4.982 -1.695
227 HB3 ALA 37 HB3 ALA 37 3.325 -6.047 -0.304
228 H ASP 38 HN ASP 38 3.202 -2.999 0.721
229 HA ASP 38 HA ASP 38 3.317 -1.071 -1.324
230 HB2 ASP 38 HB2 ASP 38 2.150 0.405 0.403
231 HB3 ASP 38 HB1 ASP 38 1.347 -1.104 -0.017
232 H GLU 39 HN GLU 39 5.199 -1.539 1.558
233 HA GLU 39 HA GLU 39 6.409 1.103 1.352
234 HB2 GLU 39 HB2 GLU 39 6.961 -1.132 3.311
235 HB3 GLU 39 HB1 GLU 39 7.571 0.512 3.417
236 HG2 GLU 39 HG2 GLU 39 4.752 0.644 3.192
237 HG3 GLU 39 HG1 GLU 39 5.145 -0.557 4.420
238 H SER 40 HN SER 40 6.788 -1.331 -0.547
239 HA SER 40 HA SER 40 9.719 -1.125 -0.624
240 HB2 SER 40 HB2 SER 40 8.151 -3.497 -0.233
241 HB3 SER 40 HB1 SER 40 9.006 -3.612 -1.770
242 HG SER 40 HG SER 40 10.598 -4.201 -0.517
243 H ILE 41 HN ILE 41 10.283 -2.410 -2.919
244 HA ILE 41 HA ILE 41 9.456 -0.553 -4.907
245 HB ILE 41 HB ILE 41 11.074 -3.086 -5.037
246 HG12 ILE 41 HG12 ILE 41 12.060 -1.050 -3.993
247 HG13 ILE 41 HG11 ILE 41 12.930 -1.594 -5.422
248 HG21 ILE 41 HG21 ILE 41 10.103 -1.358 -7.275
249 HG22 ILE 41 HG22 ILE 41 10.174 -3.117 -7.171
250 HG23 ILE 41 HG23 ILE 41 11.656 -2.185 -7.393
251 HD11 ILE 41 HD11 ILE 41 12.493 0.285 -6.551
252 HD12 ILE 41 HD12 ILE 41 12.183 0.959 -4.951
253 HD13 ILE 41 HD13 ILE 41 10.841 0.389 -5.943
254 H ALA 42 HN ALA 42 8.307 -3.660 -3.887
255 HA ALA 42 HA ALA 42 7.052 -4.643 -6.133
256 HB1 ALA 42 HB1 ALA 42 7.214 -5.579 -3.713
257 HB2 ALA 42 HB2 ALA 42 5.843 -6.020 -4.730
258 HB3 ALA 42 HB3 ALA 42 5.660 -4.775 -3.494
259 H ALA 43 HN ALA 43 6.124 -1.957 -4.115
260 HA ALA 43 HA ALA 43 3.530 -1.718 -5.420
261 HB1 ALA 43 HB1 ALA 43 2.934 -0.892 -3.452
262 HB2 ALA 43 HB2 ALA 43 3.993 0.491 -3.727
263 HB3 ALA 43 HB3 ALA 43 4.608 -0.939 -2.898
264 H GLY 44 HN GLY 44 6.717 -0.469 -5.691
265 HA2 GLY 44 HA2 GLY 44 7.297 0.678 -7.742
266 HA3 GLY 44 HA1 GLY 44 5.739 1.485 -7.670
267 H CYS 45 HN CYS 45 7.518 1.174 -4.727
268 HA CYS 45 HA CYS 45 7.924 4.064 -4.704
269 HB2 CYS 45 HB2 CYS 45 7.246 2.104 -2.736
270 HB3 CYS 45 HB1 CYS 45 8.747 2.882 -2.251
271 H LEU 46 HN LEU 46 9.826 4.881 -5.254
272 HA LEU 46 HA LEU 46 12.222 3.198 -4.929
273 HB2 LEU 46 HB2 LEU 46 12.124 5.558 -6.763
274 HB3 LEU 46 HB1 LEU 46 13.154 4.142 -6.837
275 HG LEU 46 HG LEU 46 10.499 3.220 -7.152
276 HD11 LEU 46 HD11 LEU 46 10.905 5.114 -9.364
277 HD12 LEU 46 HD12 LEU 46 10.421 5.832 -7.828
278 HD13 LEU 46 HD13 LEU 46 9.419 4.587 -8.575
279 HD21 LEU 46 HD21 LEU 46 11.374 2.755 -9.497
280 HD22 LEU 46 HD22 LEU 46 12.282 2.063 -8.152
281 HD23 LEU 46 HD23 LEU 46 12.877 3.511 -8.965
282 H TYR 47 HN TYR 47 12.041 4.094 -2.652
283 HA TYR 47 HA TYR 47 14.087 5.921 -2.191
284 HB2 TYR 47 HB2 TYR 47 12.831 7.870 -1.326
285 HB3 TYR 47 HB1 TYR 47 12.595 7.638 -3.053
286 HD1 TYR 47 HD1 TYR 47 10.444 6.807 -3.908
287 HD2 TYR 47 HD2 TYR 47 11.010 7.653 0.222
288 HE1 TYR 47 HE1 TYR 47 8.007 6.812 -3.581
289 HE2 TYR 47 HE2 TYR 47 8.576 7.658 0.562
290 HH TYR 47 HH TYR 47 6.530 8.004 -0.779
291 H ASN 48 HN ASN 48 13.418 3.465 -1.172
292 HA ASN 48 HA ASN 48 12.026 3.554 1.284
293 HB2 ASN 48 HB2 ASN 48 13.094 1.563 -0.277
294 HB3 ASN 48 HB1 ASN 48 14.172 1.557 1.115
295 HD21 ASN 48 HD21 ASN 48 12.802 1.886 3.248
296 HD22 ASN 48 HD22 ASN 48 11.490 0.773 3.409
297 H SER 49 HN SER 49 12.701 3.854 3.365
298 HA SER 49 HA SER 49 15.527 4.433 3.857
299 HB2 SER 49 HB2 SER 49 14.448 6.389 5.364
300 HB3 SER 49 HB1 SER 49 14.993 6.648 3.707
301 HG SER 49 HG SER 49 12.998 6.941 3.114
302 H THR 50 HN THR 50 12.412 4.638 5.585
303 HA THR 50 HA THR 50 13.117 2.458 7.323
304 HB THR 50 HB THR 50 14.391 4.109 8.476
305 HG1 THR 50 HG1 THR 50 11.884 4.004 9.790
306 HG21 THR 50 HG21 THR 50 12.078 5.943 8.841
307 HG22 THR 50 HG22 THR 50 13.046 6.048 7.371
308 HG23 THR 50 HG23 THR 50 13.808 6.270 8.946
Start of MODEL 10
1 H1 GLY 1 HT1 GLY 1 -19.592 0.704 10.517
2 H2 GLY 1 HT2 GLY 1 -19.902 1.803 9.270
3 H3 GLY 1 HT3 GLY 1 -18.774 2.185 10.470
4 HA2 GLY 1 HA1 GLY 1 -17.461 0.192 9.719
5 HA3 GLY 1 HA2 GLY 1 -18.535 0.153 8.329
6 H SER 2 HN SER 2 -18.711 3.152 8.407
7 HA SER 2 HA SER 2 -17.702 4.943 7.440
8 HB2 SER 2 HB2 SER 2 -14.954 3.880 7.843
9 HB3 SER 2 HB1 SER 2 -15.600 5.489 8.164
10 HG SER 2 HG SER 2 -15.439 3.298 9.808
11 H GLU 3 HN GLU 3 -18.004 2.185 6.048
12 HA GLU 3 HA GLU 3 -17.666 1.317 3.973
13 HB2 GLU 3 HB2 GLU 3 -18.309 3.845 3.556
14 HB3 GLU 3 HB1 GLU 3 -16.649 3.947 2.986
15 HG2 GLU 3 HG2 GLU 3 -18.300 3.544 1.194
16 HG3 GLU 3 HG1 GLU 3 -17.054 2.302 1.302
17 H GLY 4 HN GLY 4 -16.009 0.908 2.243
18 HA2 GLY 4 HA2 GLY 4 -13.415 0.595 3.522
19 HA3 GLY 4 HA1 GLY 4 -13.923 -0.126 2.002
20 H LYS 5 HN LYS 5 -11.642 1.725 3.106
21 HA LYS 5 HA LYS 5 -11.789 3.782 1.022
22 HB2 LYS 5 HB2 LYS 5 -11.359 4.610 3.266
23 HB3 LYS 5 HB1 LYS 5 -9.988 3.524 3.434
24 HG2 LYS 5 HG2 LYS 5 -9.323 5.838 2.979
25 HG3 LYS 5 HG1 LYS 5 -8.773 4.718 1.733
26 HD2 LYS 5 HD2 LYS 5 -9.837 5.885 0.167
27 HD3 LYS 5 HD1 LYS 5 -11.364 5.713 1.034
28 HE2 LYS 5 HE2 LYS 5 -10.165 7.615 2.527
29 HE3 LYS 5 HE1 LYS 5 -9.474 7.972 0.945
30 HZ1 LYS 5 HZ1 LYS 5 -11.963 7.759 0.217
31 HZ2 LYS 5 HZ2 LYS 5 -11.373 9.205 0.866
32 HZ3 LYS 5 HZ3 LYS 5 -12.259 8.142 1.839
33 H THR 6 HN THR 6 -10.068 0.925 1.981
34 HA THR 6 HA THR 6 -7.676 1.212 0.603
35 HB THR 6 HB THR 6 -8.205 -1.451 0.292
36 HG1 THR 6 HG1 THR 6 -9.734 -2.078 1.585
37 HG21 THR 6 HG21 THR 6 -6.519 -0.022 1.830
38 HG22 THR 6 HG22 THR 6 -6.710 -1.772 1.926
39 HG23 THR 6 HG23 THR 6 -7.565 -0.729 3.061
40 H CYS 7 HN CYS 7 -6.976 0.508 -1.454
41 HA CYS 7 HA CYS 7 -7.084 0.302 -3.716
42 HB2 CYS 7 HB2 CYS 7 -9.902 -0.711 -3.488
43 HB3 CYS 7 HB1 CYS 7 -8.654 -1.170 -4.639
44 H GLY 8 HN GLY 8 -9.149 0.634 -5.543
45 HA2 GLY 8 HA2 GLY 8 -10.972 2.262 -5.932
46 HA3 GLY 8 HA1 GLY 8 -10.033 3.398 -4.977
47 HA PRO 9 HA PRO 9 -9.375 4.217 -9.572
48 HB2 PRO 9 HB2 PRO 9 -8.941 6.920 -8.943
49 HB3 PRO 9 HB1 PRO 9 -10.421 6.228 -9.610
50 HG2 PRO 9 HG2 PRO 9 -9.746 6.906 -6.790
51 HG3 PRO 9 HG1 PRO 9 -11.302 7.014 -7.634
52 HD2 PRO 9 HD2 PRO 9 -10.803 5.051 -5.888
53 HD3 PRO 9 HD1 PRO 9 -11.741 4.749 -7.368
54 H SER 10 HN SER 10 -7.382 3.564 -10.095
55 HA SER 10 HA SER 10 -5.114 3.480 -10.267
56 HB2 SER 10 HB2 SER 10 -5.446 6.014 -10.432
57 HB3 SER 10 HB1 SER 10 -4.983 6.076 -8.732
58 HG SER 10 HG SER 10 -3.344 6.183 -10.660
59 H SER 11 HN SER 11 -6.000 1.866 -8.419
60 HA SER 11 HA SER 11 -4.576 2.397 -5.918
61 HB2 SER 11 HB2 SER 11 -5.803 0.214 -5.238
62 HB3 SER 11 HB1 SER 11 -6.751 1.689 -5.417
63 HG SER 11 HG SER 11 -6.472 -0.399 -7.319
64 H PHE 12 HN PHE 12 -3.265 0.742 -4.955
65 HA PHE 12 HA PHE 12 -1.710 -0.719 -6.958
66 HB2 PHE 12 HB2 PHE 12 -0.294 0.613 -5.619
67 HB3 PHE 12 HB1 PHE 12 -1.154 0.193 -4.142
68 HD1 PHE 12 HD2 PHE 12 0.843 -1.432 -6.843
69 HD2 PHE 12 HD1 PHE 12 -0.202 -1.329 -2.718
70 HE1 PHE 12 HE2 PHE 12 2.490 -3.202 -6.385
71 HE2 PHE 12 HE1 PHE 12 1.445 -3.100 -2.255
72 HZ PHE 12 HZ PHE 12 2.793 -4.038 -4.087
73 H SER 13 HN SER 13 -1.099 -2.921 -6.595
74 HA SER 13 HA SER 13 -2.985 -4.389 -4.870
75 HB2 SER 13 HB2 SER 13 -3.657 -5.050 -6.982
76 HB3 SER 13 HB1 SER 13 -2.038 -4.893 -7.661
77 HG SER 13 HG SER 13 -2.410 -7.052 -7.485
78 H CYS 14 HN CYS 14 -1.975 -5.230 -3.170
79 HA CYS 14 HA CYS 14 0.825 -5.503 -2.973
80 HB2 CYS 14 HB2 CYS 14 -0.734 -5.201 -1.044
81 HB3 CYS 14 HB1 CYS 14 -1.263 -6.864 -1.264
82 HA PRO 15 HA PRO 15 1.368 -9.408 -5.029
83 HB2 PRO 15 HB2 PRO 15 3.880 -9.954 -4.191
84 HB3 PRO 15 HB1 PRO 15 3.533 -8.706 -5.394
85 HG2 PRO 15 HG2 PRO 15 4.022 -8.411 -2.451
86 HG3 PRO 15 HG1 PRO 15 4.687 -7.458 -3.791
87 HD2 PRO 15 HD2 PRO 15 2.608 -6.604 -2.308
88 HD3 PRO 15 HD1 PRO 15 2.754 -6.223 -4.032
89 H GLY 16 HN GLY 16 0.533 -11.307 -4.428
90 HA2 GLY 16 HA2 GLY 16 0.438 -13.318 -3.248
91 HA3 GLY 16 HA1 GLY 16 1.478 -12.619 -2.019
92 H THR 17 HN THR 17 -1.541 -11.221 -3.202
93 HA THR 17 HA THR 17 -3.284 -12.219 -1.280
94 HB THR 17 HB THR 17 -1.986 -11.224 0.450
95 HG1 THR 17 HG1 THR 17 -4.068 -9.380 -0.081
96 HG21 THR 17 HG21 THR 17 -1.522 -8.789 0.511
97 HG22 THR 17 HG22 THR 17 -2.017 -8.702 -1.180
98 HG23 THR 17 HG23 THR 17 -0.616 -9.669 -0.720
99 H HIS 18 HN HIS 18 -5.313 -10.983 -1.138
100 HA HIS 18 HA HIS 18 -5.758 -9.518 -3.632
101 HB2 HIS 18 HB2 HIS 18 -7.202 -11.533 -2.373
102 HB3 HIS 18 HB1 HIS 18 -8.140 -10.078 -2.050
103 HD1 HIS 18 HD1 HIS 18 -6.642 -11.905 -5.046
104 HD2 HIS 18 HD2 HIS 18 -9.748 -9.323 -4.069
105 HE1 HIS 18 HE1 HIS 18 -8.035 -11.645 -7.141
106 H VAL 19 HN VAL 19 -4.417 -8.148 -1.578
107 HA VAL 19 HA VAL 19 -6.458 -6.226 -0.670
108 HB VAL 19 HB VAL 19 -5.311 -7.199 1.216
109 HG11 VAL 19 HG11 VAL 19 -2.656 -6.254 0.949
110 HG12 VAL 19 HG12 VAL 19 -3.057 -7.142 -0.521
111 HG13 VAL 19 HG13 VAL 19 -3.222 -7.922 1.051
112 HG21 VAL 19 HG21 VAL 19 -4.742 -5.253 2.350
113 HG22 VAL 19 HG22 VAL 19 -5.761 -4.657 1.040
114 HG23 VAL 19 HG23 VAL 19 -4.006 -4.518 0.925
115 H CYS 20 HN CYS 20 -6.425 -4.256 -1.546
116 HA CYS 20 HA CYS 20 -3.974 -3.401 -2.938
117 HB2 CYS 20 HB2 CYS 20 -5.852 -1.961 -4.224
118 HB3 CYS 20 HB1 CYS 20 -5.314 -3.544 -4.763
119 H VAL 21 HN VAL 21 -3.523 -1.141 -2.988
120 HA VAL 21 HA VAL 21 -4.964 0.517 -1.055
121 HB VAL 21 HB VAL 21 -3.297 -0.194 0.396
122 HG11 VAL 21 HG11 VAL 21 -1.136 0.100 -1.661
123 HG12 VAL 21 HG12 VAL 21 -2.036 -1.399 -1.438
124 HG13 VAL 21 HG13 VAL 21 -1.077 -0.742 -0.114
125 HG21 VAL 21 HG21 VAL 21 -1.722 1.647 0.697
126 HG22 VAL 21 HG22 VAL 21 -3.338 2.243 0.324
127 HG23 VAL 21 HG23 VAL 21 -2.091 2.235 -0.924
128 HA PRO 22 HA PRO 22 -4.478 3.500 -4.311
129 HB2 PRO 22 HB2 PRO 22 -4.930 5.763 -2.845
130 HB3 PRO 22 HB1 PRO 22 -6.214 4.688 -3.408
131 HG2 PRO 22 HG2 PRO 22 -4.905 4.832 -0.720
132 HG3 PRO 22 HG1 PRO 22 -6.622 4.638 -1.120
133 HD2 PRO 22 HD2 PRO 22 -5.095 2.552 -0.377
134 HD3 PRO 22 HD1 PRO 22 -6.389 2.382 -1.579
135 H GLU 23 HN GLU 23 -2.936 4.903 -5.107
136 HA GLU 23 HA GLU 23 -0.334 4.737 -4.222
137 HB2 GLU 23 HB2 GLU 23 -1.617 5.906 -6.364
138 HB3 GLU 23 HB1 GLU 23 -0.914 7.288 -5.536
139 HG2 GLU 23 HG2 GLU 23 0.752 4.879 -6.111
140 HG3 GLU 23 HG1 GLU 23 0.432 6.066 -7.376
141 H ARG 24 HN ARG 24 -2.790 7.112 -3.354
142 HA ARG 24 HA ARG 24 -1.140 8.958 -2.047
143 HB2 ARG 24 HB2 ARG 24 -3.164 9.700 -0.886
144 HB3 ARG 24 HB1 ARG 24 -3.477 9.434 -2.596
145 HG2 ARG 24 HG2 ARG 24 -4.106 7.005 -1.520
146 HG3 ARG 24 HG1 ARG 24 -4.612 8.120 -0.250
147 HD2 ARG 24 HD2 ARG 24 -6.490 7.843 -1.654
148 HD3 ARG 24 HD1 ARG 24 -5.816 9.422 -2.053
149 HE ARG 24 HE ARG 24 -4.661 7.636 -3.807
150 HH11 ARG 24 HH11 ARG 24 -7.895 8.704 -3.043
151 HH12 ARG 24 HH12 ARG 24 -8.496 8.437 -4.645
152 HH21 ARG 24 HH21 ARG 24 -5.450 7.283 -5.913
153 HH22 ARG 24 HH22 ARG 24 -7.108 7.630 -6.274
154 H TRP 25 HN TRP 25 -2.217 5.812 -1.114
155 HA TRP 25 HA TRP 25 -1.371 6.233 1.659
156 HB2 TRP 25 HB2 TRP 25 -3.086 4.225 0.273
157 HB3 TRP 25 HB1 TRP 25 -2.241 3.728 1.735
158 HD1 TRP 25 HD1 TRP 25 -3.365 7.322 1.719
159 HE1 TRP 25 HE1 TRP 25 -5.381 7.598 3.297
160 HE3 TRP 25 HE3 TRP 25 -4.386 2.392 2.601
161 HZ2 TRP 25 HZ2 TRP 25 -7.167 5.943 4.727
162 HZ3 TRP 25 HZ3 TRP 25 -6.262 1.822 4.086
163 HH2 TRP 25 HH2 TRP 25 -7.623 3.562 5.127
164 H LEU 26 HN LEU 26 -0.273 4.918 -1.298
165 HA LEU 26 HA LEU 26 1.321 2.789 -0.545
166 HB2 LEU 26 HB2 LEU 26 1.311 4.752 -2.743
167 HB3 LEU 26 HB1 LEU 26 2.848 3.960 -2.462
168 HG LEU 26 HG LEU 26 1.496 2.839 -4.189
169 HD11 LEU 26 HD11 LEU 26 2.413 1.520 -1.712
170 HD12 LEU 26 HD12 LEU 26 2.917 1.280 -3.385
171 HD13 LEU 26 HD13 LEU 26 1.419 0.553 -2.802
172 HD21 LEU 26 HD21 LEU 26 -0.715 2.847 -3.824
173 HD22 LEU 26 HD22 LEU 26 -0.524 2.970 -2.075
174 HD23 LEU 26 HD23 LEU 26 -0.401 1.402 -2.866
175 H CYS 27 HN CYS 27 2.953 2.617 0.831
176 HA CYS 27 HA CYS 27 4.614 3.169 2.293
177 HB2 CYS 27 HB2 CYS 27 5.842 5.218 0.597
178 HB3 CYS 27 HB1 CYS 27 6.510 3.708 1.196
179 H ASP 28 HN ASP 28 2.470 4.390 3.149
180 HA ASP 28 HA ASP 28 3.138 7.221 3.544
181 HB2 ASP 28 HB2 ASP 28 0.807 7.491 4.269
182 HB3 ASP 28 HB1 ASP 28 0.896 6.788 2.657
183 H GLY 29 HN GLY 29 3.334 4.232 5.081
184 HA2 GLY 29 HA2 GLY 29 4.600 4.304 7.200
185 HA3 GLY 29 HA1 GLY 29 3.482 5.557 7.718
186 H ASP 30 HN ASP 30 1.263 3.982 6.362
187 HA ASP 30 HA ASP 30 0.818 2.144 8.606
188 HB2 ASP 30 HB2 ASP 30 -0.795 4.123 7.701
189 HB3 ASP 30 HB1 ASP 30 -1.419 2.764 6.772
190 H LYS 31 HN LYS 31 1.414 0.127 8.143
191 HA LYS 31 HA LYS 31 1.721 -0.972 5.596
192 HB2 LYS 31 HB2 LYS 31 1.567 -2.052 8.358
193 HB3 LYS 31 HB1 LYS 31 1.341 -3.194 7.044
194 HG2 LYS 31 HG2 LYS 31 3.512 -2.269 6.088
195 HG3 LYS 31 HG1 LYS 31 3.746 -1.519 7.668
196 HD2 LYS 31 HD2 LYS 31 3.966 -3.552 8.749
197 HD3 LYS 31 HD1 LYS 31 3.090 -4.428 7.493
198 HE2 LYS 31 HE2 LYS 31 5.008 -4.987 6.536
199 HE3 LYS 31 HE1 LYS 31 5.399 -3.282 6.308
200 HZ1 LYS 31 HZ1 LYS 31 5.838 -4.353 8.976
201 HZ2 LYS 31 HZ2 LYS 31 6.775 -3.270 8.075
202 HZ3 LYS 31 HZ3 LYS 31 6.874 -4.931 7.768
203 H ASP 32 HN ASP 32 -0.119 -0.548 4.343
204 HA ASP 32 HA ASP 32 -2.741 -1.281 5.111
205 HB2 ASP 32 HB2 ASP 32 -1.481 -0.680 2.439
206 HB3 ASP 32 HB1 ASP 32 -3.177 -1.129 2.589
207 H CYS 33 HN CYS 33 -0.099 -3.020 3.659
208 HA CYS 33 HA CYS 33 -1.825 -5.310 3.074
209 HB2 CYS 33 HB2 CYS 33 -0.123 -4.530 1.390
210 HB3 CYS 33 HB1 CYS 33 1.132 -5.025 2.523
211 H ALA 34 HN ALA 34 -1.163 -7.455 3.769
212 HA ALA 34 HA ALA 34 -0.772 -7.658 6.521
213 HB1 ALA 34 HB1 ALA 34 -1.683 -9.594 5.843
214 HB2 ALA 34 HB2 ALA 34 -0.011 -10.112 5.625
215 HB3 ALA 34 HB3 ALA 34 -0.933 -9.503 4.249
216 H ASP 35 HN ASP 35 1.516 -7.689 3.866
217 HA ASP 35 HA ASP 35 3.723 -8.088 5.770
218 HB2 ASP 35 HB2 ASP 35 3.296 -8.849 2.950
219 HB3 ASP 35 HB1 ASP 35 4.908 -8.249 3.326
220 H GLY 36 HN GLY 36 2.085 -5.641 4.290
221 HA2 GLY 36 HA2 GLY 36 2.542 -3.395 4.132
222 HA3 GLY 36 HA1 GLY 36 4.081 -3.717 4.907
223 H ALA 37 HN ALA 37 3.082 -5.265 1.916
224 HA ALA 37 HA ALA 37 5.447 -4.720 0.560
225 HB1 ALA 37 HB1 ALA 37 2.861 -5.006 -0.922
226 HB2 ALA 37 HB2 ALA 37 3.532 -6.361 -0.013
227 HB3 ALA 37 HB3 ALA 37 4.457 -5.638 -1.329
228 H ASP 38 HN ASP 38 2.448 -2.892 0.715
229 HA ASP 38 HA ASP 38 2.972 -1.012 -1.287
230 HB2 ASP 38 HB2 ASP 38 1.481 0.495 0.261
231 HB3 ASP 38 HB1 ASP 38 0.787 -0.907 -0.540
232 H GLU 39 HN GLU 39 4.151 -1.279 1.979
233 HA GLU 39 HA GLU 39 5.392 1.363 1.853
234 HB2 GLU 39 HB2 GLU 39 5.579 -0.603 4.127
235 HB3 GLU 39 HB1 GLU 39 5.832 1.135 4.172
236 HG2 GLU 39 HG2 GLU 39 3.207 0.685 3.233
237 HG3 GLU 39 HG1 GLU 39 3.451 -0.341 4.644
238 H SER 40 HN SER 40 6.195 -1.219 0.346
239 HA SER 40 HA SER 40 9.047 -1.061 1.050
240 HB2 SER 40 HB2 SER 40 7.380 -3.341 1.235
241 HB3 SER 40 HB1 SER 40 8.445 -3.602 -0.145
242 HG SER 40 HG SER 40 9.137 -4.141 2.178
243 H ILE 41 HN ILE 41 10.039 -2.651 -0.983
244 HA ILE 41 HA ILE 41 9.886 -0.842 -3.204
245 HB ILE 41 HB ILE 41 11.366 -3.451 -2.889
246 HG12 ILE 41 HG12 ILE 41 13.316 -1.702 -2.898
247 HG13 ILE 41 HG11 ILE 41 12.051 -0.574 -2.424
248 HG21 ILE 41 HG21 ILE 41 11.576 -1.374 -5.064
249 HG22 ILE 41 HG22 ILE 41 10.950 -3.014 -5.239
250 HG23 ILE 41 HG23 ILE 41 12.654 -2.755 -4.862
251 HD11 ILE 41 HD11 ILE 41 11.791 -1.515 -0.370
252 HD12 ILE 41 HD12 ILE 41 13.500 -1.853 -0.646
253 HD13 ILE 41 HD13 ILE 41 12.296 -3.114 -0.914
254 H ALA 42 HN ALA 42 8.486 -3.911 -2.369
255 HA ALA 42 HA ALA 42 7.853 -4.989 -4.827
256 HB1 ALA 42 HB1 ALA 42 7.344 -5.744 -2.336
257 HB2 ALA 42 HB2 ALA 42 6.438 -6.380 -3.709
258 HB3 ALA 42 HB3 ALA 42 5.757 -5.081 -2.728
259 H ALA 43 HN ALA 43 6.387 -2.288 -3.163
260 HA ALA 43 HA ALA 43 4.150 -2.114 -4.973
261 HB1 ALA 43 HB1 ALA 43 4.576 -1.251 -2.424
262 HB2 ALA 43 HB2 ALA 43 3.262 -0.715 -3.471
263 HB3 ALA 43 HB3 ALA 43 4.738 0.243 -3.348
264 H GLY 44 HN GLY 44 7.374 -0.887 -4.812
265 HA2 GLY 44 HA2 GLY 44 8.358 -0.060 -6.865
266 HA3 GLY 44 HA1 GLY 44 6.825 0.719 -7.223
267 H CYS 45 HN CYS 45 8.103 0.851 -3.998
268 HA CYS 45 HA CYS 45 8.386 3.735 -4.260
269 HB2 CYS 45 HB2 CYS 45 7.601 1.957 -2.172
270 HB3 CYS 45 HB1 CYS 45 9.007 2.859 -1.620
271 H LEU 46 HN LEU 46 10.342 0.903 -3.990
272 HA LEU 46 HA LEU 46 12.586 0.585 -4.158
273 HB2 LEU 46 HB2 LEU 46 12.854 3.563 -4.524
274 HB3 LEU 46 HB1 LEU 46 13.996 2.323 -5.004
275 HG LEU 46 HG LEU 46 11.271 2.224 -6.193
276 HD11 LEU 46 HD11 LEU 46 11.541 3.966 -7.648
277 HD12 LEU 46 HD12 LEU 46 13.298 3.965 -7.499
278 HD13 LEU 46 HD13 LEU 46 12.304 4.639 -6.207
279 HD21 LEU 46 HD21 LEU 46 13.368 0.658 -6.526
280 HD22 LEU 46 HD22 LEU 46 13.824 1.909 -7.682
281 HD23 LEU 46 HD23 LEU 46 12.292 1.054 -7.866
282 H TYR 47 HN TYR 47 12.225 3.747 -2.527
283 HA TYR 47 HA TYR 47 12.896 4.478 -0.479
284 HB2 TYR 47 HB2 TYR 47 12.433 1.590 -0.057
285 HB3 TYR 47 HB1 TYR 47 13.470 2.367 1.132
286 HD1 TYR 47 HD1 TYR 47 10.582 3.860 -0.649
287 HD2 TYR 47 HD2 TYR 47 12.102 2.386 3.038
288 HE1 TYR 47 HE1 TYR 47 8.594 4.724 0.508
289 HE2 TYR 47 HE2 TYR 47 10.117 3.245 4.208
290 HH TYR 47 HH TYR 47 7.898 5.386 2.733
291 H ASN 48 HN ASN 48 14.802 4.975 0.628
292 HA ASN 48 HA ASN 48 17.207 3.453 0.080
293 HB2 ASN 48 HB2 ASN 48 16.821 5.124 -1.838
294 HB3 ASN 48 HB1 ASN 48 17.206 6.373 -0.658
295 HD21 ASN 48 HD21 ASN 48 18.497 3.204 -1.616
296 HD22 ASN 48 HD22 ASN 48 20.146 3.713 -1.696
297 H SER 49 HN SER 49 17.891 3.191 2.106
298 HA SER 49 HA SER 49 18.795 5.438 3.618
299 HB2 SER 49 HB2 SER 49 16.653 3.807 4.974
300 HB3 SER 49 HB1 SER 49 17.359 5.336 5.494
301 HG SER 49 HG SER 49 15.786 6.250 4.464
302 H THR 50 HN THR 50 20.657 4.765 4.424
303 HA THR 50 HA THR 50 22.282 3.465 5.340
304 HB THR 50 HB THR 50 20.057 1.695 6.352
305 HG1 THR 50 HG1 THR 50 19.733 3.105 7.959
306 HG21 THR 50 HG21 THR 50 21.704 1.741 8.377
307 HG22 THR 50 HG22 THR 50 22.891 2.131 7.132
308 HG23 THR 50 HG23 THR 50 21.963 0.635 7.028
Start of MODEL 11
1 H1 GLY 1 HT1 GLY 1 -12.689 10.477 3.148
2 H2 GLY 1 HT2 GLY 1 -12.370 8.970 3.845
3 H3 GLY 1 HT3 GLY 1 -13.325 10.096 4.669
4 HA2 GLY 1 HA1 GLY 1 -15.104 9.879 3.158
5 HA3 GLY 1 HA2 GLY 1 -14.094 8.979 2.037
6 H SER 2 HN SER 2 -12.945 7.056 3.461
7 HA SER 2 HA SER 2 -13.273 4.985 4.342
8 HB2 SER 2 HB2 SER 2 -13.687 5.967 6.451
9 HB3 SER 2 HB1 SER 2 -15.259 6.588 5.946
10 HG SER 2 HG SER 2 -15.070 4.544 7.306
11 H GLU 3 HN GLU 3 -15.017 3.229 4.685
12 HA GLU 3 HA GLU 3 -16.591 1.884 3.746
13 HB2 GLU 3 HB2 GLU 3 -17.886 4.187 4.376
14 HB3 GLU 3 HB1 GLU 3 -18.209 4.096 2.650
15 HG2 GLU 3 HG2 GLU 3 -18.871 2.023 4.726
16 HG3 GLU 3 HG1 GLU 3 -20.002 3.057 3.854
17 H GLY 4 HN GLY 4 -14.408 2.209 2.192
18 HA2 GLY 4 HA2 GLY 4 -14.925 1.218 -0.228
19 HA3 GLY 4 HA1 GLY 4 -15.239 2.925 -0.504
20 H LYS 5 HN LYS 5 -12.755 1.381 1.499
21 HA LYS 5 HA LYS 5 -10.730 2.801 -0.090
22 HB2 LYS 5 HB2 LYS 5 -10.385 1.733 2.712
23 HB3 LYS 5 HB1 LYS 5 -9.352 2.873 1.860
24 HG2 LYS 5 HG2 LYS 5 -11.157 4.528 1.901
25 HG3 LYS 5 HG1 LYS 5 -12.171 3.386 2.786
26 HD2 LYS 5 HD2 LYS 5 -11.332 4.497 4.574
27 HD3 LYS 5 HD1 LYS 5 -10.000 3.360 4.359
28 HE2 LYS 5 HE2 LYS 5 -9.852 5.838 2.768
29 HE3 LYS 5 HE1 LYS 5 -9.691 6.036 4.512
30 HZ1 LYS 5 HZ1 LYS 5 -7.903 4.733 2.617
31 HZ2 LYS 5 HZ2 LYS 5 -8.048 4.004 4.136
32 HZ3 LYS 5 HZ3 LYS 5 -7.543 5.614 4.016
33 H THR 6 HN THR 6 -8.661 1.118 1.380
34 HA THR 6 HA THR 6 -7.464 -0.777 1.067
35 HB THR 6 HB THR 6 -8.538 -2.838 0.857
36 HG1 THR 6 HG1 THR 6 -10.845 -1.699 -0.291
37 HG21 THR 6 HG21 THR 6 -9.831 -2.706 2.636
38 HG22 THR 6 HG22 THR 6 -11.076 -1.851 1.726
39 HG23 THR 6 HG23 THR 6 -9.773 -0.948 2.499
40 H CYS 7 HN CYS 7 -9.780 -0.808 -1.661
41 HA CYS 7 HA CYS 7 -7.540 -0.335 -3.479
42 HB2 CYS 7 HB2 CYS 7 -9.075 -2.138 -4.912
43 HB3 CYS 7 HB1 CYS 7 -7.526 -2.474 -4.155
44 H GLY 8 HN GLY 8 -8.179 0.432 -5.585
45 HA2 GLY 8 HA2 GLY 8 -10.811 0.962 -6.370
46 HA3 GLY 8 HA1 GLY 8 -10.241 2.352 -5.459
47 HA PRO 9 HA PRO 9 -9.299 2.919 -10.041
48 HB2 PRO 9 HB2 PRO 9 -9.534 5.691 -9.666
49 HB3 PRO 9 HB1 PRO 9 -10.750 4.625 -10.373
50 HG2 PRO 9 HG2 PRO 9 -10.529 5.670 -7.592
51 HG3 PRO 9 HG1 PRO 9 -11.977 5.359 -8.566
52 HD2 PRO 9 HD2 PRO 9 -11.253 3.707 -6.597
53 HD3 PRO 9 HD1 PRO 9 -11.940 3.081 -8.112
54 H SER 10 HN SER 10 -8.108 4.223 -7.031
55 HA SER 10 HA SER 10 -5.451 4.479 -8.244
56 HB2 SER 10 HB2 SER 10 -6.250 6.487 -6.179
57 HB3 SER 10 HB1 SER 10 -5.070 6.626 -7.482
58 HG SER 10 HG SER 10 -6.773 7.829 -8.134
59 H SER 11 HN SER 11 -5.385 2.321 -7.171
60 HA SER 11 HA SER 11 -4.333 2.636 -4.466
61 HB2 SER 11 HB2 SER 11 -6.234 0.372 -5.065
62 HB3 SER 11 HB1 SER 11 -5.643 0.920 -3.497
63 HG SER 11 HG SER 11 -7.365 2.106 -3.439
64 H PHE 12 HN PHE 12 -3.505 0.315 -3.748
65 HA PHE 12 HA PHE 12 -2.185 -0.958 -6.046
66 HB2 PHE 12 HB2 PHE 12 -0.451 0.385 -5.180
67 HB3 PHE 12 HB1 PHE 12 -0.928 0.080 -3.514
68 HD1 PHE 12 HD2 PHE 12 0.233 -1.823 -6.511
69 HD2 PHE 12 HD1 PHE 12 0.364 -1.348 -2.285
70 HE1 PHE 12 HE2 PHE 12 1.887 -3.640 -6.363
71 HE2 PHE 12 HE1 PHE 12 2.016 -3.166 -2.128
72 HZ PHE 12 HZ PHE 12 2.780 -4.313 -4.169
73 H SER 13 HN SER 13 -1.604 -3.154 -5.751
74 HA SER 13 HA SER 13 -3.034 -4.472 -3.539
75 HB2 SER 13 HB2 SER 13 -4.203 -5.213 -5.387
76 HB3 SER 13 HB1 SER 13 -2.795 -5.135 -6.442
77 HG SER 13 HG SER 13 -2.863 -7.233 -6.120
78 H CYS 14 HN CYS 14 -1.865 -5.678 -2.193
79 HA CYS 14 HA CYS 14 0.947 -5.797 -2.390
80 HB2 CYS 14 HB2 CYS 14 -0.680 -7.633 -0.650
81 HB3 CYS 14 HB1 CYS 14 0.916 -6.971 -0.343
82 HA PRO 15 HA PRO 15 1.453 -9.370 -4.959
83 HB2 PRO 15 HB2 PRO 15 4.014 -9.987 -4.355
84 HB3 PRO 15 HB1 PRO 15 3.585 -8.579 -5.333
85 HG2 PRO 15 HG2 PRO 15 4.272 -8.726 -2.422
86 HG3 PRO 15 HG1 PRO 15 4.805 -7.550 -3.637
87 HD2 PRO 15 HD2 PRO 15 2.811 -7.041 -1.874
88 HD3 PRO 15 HD1 PRO 15 2.854 -6.340 -3.503
89 H GLY 16 HN GLY 16 1.442 -11.606 -4.846
90 HA2 GLY 16 HA2 GLY 16 1.181 -13.682 -3.903
91 HA3 GLY 16 HA1 GLY 16 2.260 -13.134 -2.630
92 H THR 17 HN THR 17 -0.885 -11.760 -3.470
93 HA THR 17 HA THR 17 -2.421 -13.095 -1.548
94 HB THR 17 HB THR 17 -1.063 -12.073 0.142
95 HG1 THR 17 HG1 THR 17 -3.235 -12.025 0.656
96 HG21 THR 17 HG21 THR 17 -1.634 -9.422 -1.158
97 HG22 THR 17 HG22 THR 17 -0.077 -10.249 -1.120
98 HG23 THR 17 HG23 THR 17 -0.803 -9.666 0.378
99 H HIS 18 HN HIS 18 -4.424 -11.664 -0.927
100 HA HIS 18 HA HIS 18 -5.209 -10.202 -3.361
101 HB2 HIS 18 HB2 HIS 18 -6.468 -12.360 -1.925
102 HB3 HIS 18 HB1 HIS 18 -7.530 -10.956 -1.941
103 HD1 HIS 18 HD1 HIS 18 -5.315 -11.472 -4.899
104 HD2 HIS 18 HD2 HIS 18 -9.216 -12.298 -3.734
105 HE1 HIS 18 HE1 HIS 18 -6.557 -12.136 -6.999
106 H VAL 19 HN VAL 19 -3.853 -8.996 -1.138
107 HA VAL 19 HA VAL 19 -5.967 -7.391 0.117
108 HB VAL 19 HB VAL 19 -4.533 -8.219 1.790
109 HG11 VAL 19 HG11 VAL 19 -1.951 -7.480 1.396
110 HG12 VAL 19 HG12 VAL 19 -2.464 -7.864 -0.248
111 HG13 VAL 19 HG13 VAL 19 -2.611 -9.073 1.026
112 HG21 VAL 19 HG21 VAL 19 -4.845 -5.550 1.480
113 HG22 VAL 19 HG22 VAL 19 -3.087 -5.664 1.559
114 HG23 VAL 19 HG23 VAL 19 -4.071 -6.298 2.878
115 H CYS 20 HN CYS 20 -6.101 -5.208 -0.146
116 HA CYS 20 HA CYS 20 -4.274 -4.004 -2.121
117 HB2 CYS 20 HB2 CYS 20 -6.318 -2.450 -2.535
118 HB3 CYS 20 HB1 CYS 20 -6.313 -4.058 -3.245
119 H VAL 21 HN VAL 21 -4.092 -1.611 -1.951
120 HA VAL 21 HA VAL 21 -4.587 -0.521 0.704
121 HB VAL 21 HB VAL 21 -2.412 -1.488 1.014
122 HG11 VAL 21 HG11 VAL 21 -2.016 -0.644 -1.723
123 HG12 VAL 21 HG12 VAL 21 -1.157 -1.861 -0.780
124 HG13 VAL 21 HG13 VAL 21 -0.671 -0.169 -0.687
125 HG21 VAL 21 HG21 VAL 21 -1.062 0.514 1.497
126 HG22 VAL 21 HG22 VAL 21 -2.733 0.682 2.039
127 HG23 VAL 21 HG23 VAL 21 -2.200 1.485 0.563
128 HA PRO 22 HA PRO 22 -5.561 2.951 -1.960
129 HB2 PRO 22 HB2 PRO 22 -5.483 4.487 0.566
130 HB3 PRO 22 HB1 PRO 22 -6.798 4.305 -0.598
131 HG2 PRO 22 HG2 PRO 22 -6.878 3.102 1.791
132 HG3 PRO 22 HG1 PRO 22 -7.529 2.323 0.337
133 HD2 PRO 22 HD2 PRO 22 -4.942 1.827 1.756
134 HD3 PRO 22 HD1 PRO 22 -6.062 0.666 1.013
135 H GLU 23 HN GLU 23 -4.470 4.726 -2.802
136 HA GLU 23 HA GLU 23 -1.715 4.789 -2.701
137 HB2 GLU 23 HB2 GLU 23 -3.641 6.113 -4.135
138 HB3 GLU 23 HB1 GLU 23 -2.927 7.419 -3.200
139 HG2 GLU 23 HG2 GLU 23 -0.676 6.410 -4.030
140 HG3 GLU 23 HG1 GLU 23 -1.686 5.675 -5.274
141 H ARG 24 HN ARG 24 -4.027 6.617 -0.747
142 HA ARG 24 HA ARG 24 -2.218 8.357 0.498
143 HB2 ARG 24 HB2 ARG 24 -4.724 8.499 0.600
144 HB3 ARG 24 HB1 ARG 24 -4.699 7.170 1.751
145 HG2 ARG 24 HG2 ARG 24 -2.882 9.140 2.670
146 HG3 ARG 24 HG1 ARG 24 -4.387 9.950 2.233
147 HD2 ARG 24 HD2 ARG 24 -4.137 7.566 4.064
148 HD3 ARG 24 HD1 ARG 24 -4.375 9.235 4.580
149 HE ARG 24 HE ARG 24 -6.369 7.434 3.608
150 HH11 ARG 24 HH11 ARG 24 -5.477 10.803 3.805
151 HH12 ARG 24 HH12 ARG 24 -7.109 11.370 3.689
152 HH21 ARG 24 HH21 ARG 24 -8.515 8.179 3.458
153 HH22 ARG 24 HH22 ARG 24 -8.834 9.881 3.493
154 H TRP 25 HN TRP 25 -2.943 5.001 1.026
155 HA TRP 25 HA TRP 25 -1.491 4.889 3.539
156 HB2 TRP 25 HB2 TRP 25 -2.921 2.817 1.876
157 HB3 TRP 25 HB1 TRP 25 -1.995 2.403 3.314
158 HD1 TRP 25 HD1 TRP 25 -3.868 5.637 3.633
159 HE1 TRP 25 HE1 TRP 25 -5.927 5.300 5.141
160 HE3 TRP 25 HE3 TRP 25 -3.848 0.532 3.910
161 HZ2 TRP 25 HZ2 TRP 25 -7.353 3.155 6.296
162 HZ3 TRP 25 HZ3 TRP 25 -5.593 -0.584 5.237
163 HH2 TRP 25 HH2 TRP 25 -7.308 0.701 6.405
164 H LEU 26 HN LEU 26 -0.952 4.335 0.164
165 HA LEU 26 HA LEU 26 1.156 2.537 0.184
166 HB2 LEU 26 HB2 LEU 26 0.285 4.726 -1.620
167 HB3 LEU 26 HB1 LEU 26 1.899 4.090 -1.856
168 HG LEU 26 HG LEU 26 0.227 3.038 -3.327
169 HD11 LEU 26 HD11 LEU 26 1.927 1.581 -1.426
170 HD12 LEU 26 HD12 LEU 26 1.890 1.537 -3.188
171 HD13 LEU 26 HD13 LEU 26 0.715 0.608 -2.259
172 HD21 LEU 26 HD21 LEU 26 -1.070 2.456 -0.717
173 HD22 LEU 26 HD22 LEU 26 -1.210 1.270 -2.010
174 HD23 LEU 26 HD23 LEU 26 -1.788 2.915 -2.260
175 H CYS 27 HN CYS 27 2.961 2.625 1.329
176 HA CYS 27 HA CYS 27 4.799 3.402 2.431
177 HB2 CYS 27 HB2 CYS 27 5.235 5.696 0.638
178 HB3 CYS 27 HB1 CYS 27 6.307 4.360 1.035
179 H ASP 28 HN ASP 28 2.910 4.130 3.939
180 HA ASP 28 HA ASP 28 3.009 7.043 4.312
181 HB2 ASP 28 HB2 ASP 28 0.968 6.787 5.642
182 HB3 ASP 28 HB1 ASP 28 0.758 6.099 4.036
183 H GLY 29 HN GLY 29 4.421 4.267 5.461
184 HA2 GLY 29 HA2 GLY 29 6.137 4.698 7.192
185 HA3 GLY 29 HA1 GLY 29 4.867 5.488 8.114
186 H ASP 30 HN ASP 30 2.896 3.423 7.326
187 HA ASP 30 HA ASP 30 3.723 1.398 9.277
188 HB2 ASP 30 HB2 ASP 30 1.197 2.682 8.592
189 HB3 ASP 30 HB1 ASP 30 1.053 0.928 8.653
190 H LYS 31 HN LYS 31 2.535 -0.821 8.769
191 HA LYS 31 HA LYS 31 3.132 -1.483 5.960
192 HB2 LYS 31 HB2 LYS 31 3.949 -2.792 8.489
193 HB3 LYS 31 HB1 LYS 31 3.506 -3.855 7.161
194 HG2 LYS 31 HG2 LYS 31 5.142 -2.678 5.729
195 HG3 LYS 31 HG1 LYS 31 5.636 -1.731 7.134
196 HD2 LYS 31 HD2 LYS 31 7.136 -3.629 6.738
197 HD3 LYS 31 HD1 LYS 31 6.307 -3.759 8.290
198 HE2 LYS 31 HE2 LYS 31 5.299 -5.664 7.704
199 HE3 LYS 31 HE1 LYS 31 4.836 -5.027 6.127
200 HZ1 LYS 31 HZ1 LYS 31 6.315 -6.917 5.908
201 HZ2 LYS 31 HZ2 LYS 31 7.498 -6.142 6.835
202 HZ3 LYS 31 HZ3 LYS 31 7.067 -5.519 5.322
203 H ASP 32 HN ASP 32 0.947 -1.195 5.379
204 HA ASP 32 HA ASP 32 -1.151 -2.648 6.678
205 HB2 ASP 32 HB2 ASP 32 -1.255 -1.438 3.915
206 HB3 ASP 32 HB1 ASP 32 -2.598 -1.742 5.012
207 H CYS 33 HN CYS 33 0.966 -3.189 3.955
208 HA CYS 33 HA CYS 33 -0.482 -5.361 2.829
209 HB2 CYS 33 HB2 CYS 33 2.239 -4.190 2.488
210 HB3 CYS 33 HB1 CYS 33 1.960 -5.817 1.884
211 H ALA 34 HN ALA 34 0.881 -7.523 2.544
212 HA ALA 34 HA ALA 34 0.939 -8.719 5.139
213 HB1 ALA 34 HB1 ALA 34 0.842 -10.691 4.054
214 HB2 ALA 34 HB2 ALA 34 2.083 -10.233 2.888
215 HB3 ALA 34 HB3 ALA 34 0.423 -9.678 2.672
216 H ASP 35 HN ASP 35 3.391 -7.912 2.713
217 HA ASP 35 HA ASP 35 5.451 -8.350 4.775
218 HB2 ASP 35 HB2 ASP 35 5.387 -9.079 1.885
219 HB3 ASP 35 HB1 ASP 35 6.929 -8.582 2.574
220 H GLY 36 HN GLY 36 3.995 -5.917 4.335
221 HA2 GLY 36 HA2 GLY 36 4.403 -3.664 4.186
222 HA3 GLY 36 HA1 GLY 36 6.104 -4.071 4.347
223 H ALA 37 HN ALA 37 4.094 -5.239 1.732
224 HA ALA 37 HA ALA 37 5.860 -4.520 -0.289
225 HB1 ALA 37 HB1 ALA 37 4.466 -5.916 -1.314
226 HB2 ALA 37 HB2 ALA 37 3.352 -4.561 -1.497
227 HB3 ALA 37 HB3 ALA 37 3.206 -5.641 -0.110
228 H ASP 38 HN ASP 38 3.013 -2.797 0.929
229 HA ASP 38 HA ASP 38 2.952 -0.727 -0.936
230 HB2 ASP 38 HB2 ASP 38 1.811 0.580 0.893
231 HB3 ASP 38 HB1 ASP 38 1.105 -0.996 0.557
232 H GLU 39 HN GLU 39 4.978 -1.219 1.865
233 HA GLU 39 HA GLU 39 6.143 1.445 1.605
234 HB2 GLU 39 HB2 GLU 39 6.781 -0.726 3.607
235 HB3 GLU 39 HB1 GLU 39 7.290 0.955 3.682
236 HG2 GLU 39 HG2 GLU 39 4.386 0.455 3.530
237 HG3 GLU 39 HG1 GLU 39 5.198 -0.004 5.026
238 H SER 40 HN SER 40 6.513 -0.951 -0.284
239 HA SER 40 HA SER 40 9.445 -0.786 -0.362
240 HB2 SER 40 HB2 SER 40 8.015 -3.103 0.227
241 HB3 SER 40 HB1 SER 40 8.440 -3.278 -1.475
242 HG SER 40 HG SER 40 10.237 -3.979 -0.571
243 H ILE 41 HN ILE 41 9.879 -2.195 -2.683
244 HA ILE 41 HA ILE 41 9.149 -0.272 -4.659
245 HB ILE 41 HB ILE 41 10.521 -2.942 -4.934
246 HG12 ILE 41 HG12 ILE 41 11.729 -1.251 -3.593
247 HG13 ILE 41 HG11 ILE 41 12.567 -1.643 -5.089
248 HG21 ILE 41 HG21 ILE 41 11.234 -2.151 -7.149
249 HG22 ILE 41 HG22 ILE 41 10.206 -0.731 -6.956
250 HG23 ILE 41 HG23 ILE 41 9.483 -2.338 -7.038
251 HD11 ILE 41 HD11 ILE 41 12.675 0.714 -4.731
252 HD12 ILE 41 HD12 ILE 41 10.926 0.808 -4.521
253 HD13 ILE 41 HD13 ILE 41 11.605 0.402 -6.097
254 H ALA 42 HN ALA 42 7.942 -3.398 -3.693
255 HA ALA 42 HA ALA 42 6.574 -4.266 -5.907
256 HB1 ALA 42 HB1 ALA 42 5.264 -4.409 -3.223
257 HB2 ALA 42 HB2 ALA 42 6.771 -5.276 -3.525
258 HB3 ALA 42 HB3 ALA 42 5.342 -5.626 -4.498
259 H ALA 43 HN ALA 43 5.720 -1.674 -3.710
260 HA ALA 43 HA ALA 43 3.101 -1.308 -4.876
261 HB1 ALA 43 HB1 ALA 43 3.796 0.937 -3.317
262 HB2 ALA 43 HB2 ALA 43 4.439 -0.485 -2.494
263 HB3 ALA 43 HB3 ALA 43 2.724 -0.398 -2.892
264 H GLY 44 HN GLY 44 6.310 -0.116 -5.365
265 HA2 GLY 44 HA2 GLY 44 6.996 1.009 -7.315
266 HA3 GLY 44 HA1 GLY 44 5.334 1.505 -7.587
267 H CYS 45 HN CYS 45 7.323 1.892 -4.671
268 HA CYS 45 HA CYS 45 6.737 4.754 -4.754
269 HB2 CYS 45 HB2 CYS 45 6.911 2.853 -2.668
270 HB3 CYS 45 HB1 CYS 45 8.241 3.981 -2.427
271 H LEU 46 HN LEU 46 9.502 2.561 -4.425
272 HA LEU 46 HA LEU 46 11.696 2.789 -4.973
273 HB2 LEU 46 HB2 LEU 46 11.016 5.326 -6.430
274 HB3 LEU 46 HB1 LEU 46 12.309 4.191 -6.765
275 HG LEU 46 HG LEU 46 9.788 2.838 -6.993
276 HD11 LEU 46 HD11 LEU 46 8.804 4.048 -8.836
277 HD12 LEU 46 HD12 LEU 46 10.055 5.287 -8.730
278 HD13 LEU 46 HD13 LEU 46 8.892 5.093 -7.418
279 HD21 LEU 46 HD21 LEU 46 11.379 3.491 -9.391
280 HD22 LEU 46 HD22 LEU 46 10.776 1.937 -8.813
281 HD23 LEU 46 HD23 LEU 46 12.226 2.643 -8.098
282 H TYR 47 HN TYR 47 10.791 3.875 -2.520
283 HA TYR 47 HA TYR 47 13.047 5.346 -1.750
284 HB2 TYR 47 HB2 TYR 47 12.320 7.550 -1.511
285 HB3 TYR 47 HB1 TYR 47 11.663 7.087 -3.074
286 HD1 TYR 47 HD2 TYR 47 10.831 7.739 0.459
287 HD2 TYR 47 HD1 TYR 47 9.301 6.988 -3.438
288 HE1 TYR 47 HE2 TYR 47 8.589 8.402 1.219
289 HE2 TYR 47 HE1 TYR 47 7.054 7.650 -2.691
290 HH TYR 47 HH TYR 47 6.373 9.396 -0.234
291 H ASN 48 HN ASN 48 13.353 4.691 0.251
292 HA ASN 48 HA ASN 48 11.548 5.046 2.360
293 HB2 ASN 48 HB2 ASN 48 10.362 3.177 1.152
294 HB3 ASN 48 HB1 ASN 48 11.752 2.154 1.501
295 HD21 ASN 48 HD21 ASN 48 9.928 4.537 3.394
296 HD22 ASN 48 HD22 ASN 48 9.584 3.476 4.714
297 H SER 49 HN SER 49 13.993 2.718 1.229
298 HA SER 49 HA SER 49 15.975 2.040 2.112
299 HB2 SER 49 HB2 SER 49 16.465 4.473 2.071
300 HB3 SER 49 HB1 SER 49 15.819 4.610 3.706
301 HG SER 49 HG SER 49 18.065 3.082 2.885
302 H THR 50 HN THR 50 16.919 1.041 3.966
303 HA THR 50 HA THR 50 15.037 -0.111 5.719
304 HB THR 50 HB THR 50 18.047 -0.031 5.999
305 HG1 THR 50 HG1 THR 50 17.986 -1.970 4.849
306 HG21 THR 50 HG21 THR 50 17.828 -1.300 7.787
307 HG22 THR 50 HG22 THR 50 16.941 -2.489 6.834
308 HG23 THR 50 HG23 THR 50 16.072 -1.198 7.664
Start of MODEL 12
1 H1 GLY 1 HT1 GLY 1 -14.641 6.534 9.170
2 H2 GLY 1 HT2 GLY 1 -13.849 7.871 9.839
3 H3 GLY 1 HT3 GLY 1 -12.985 6.756 8.904
4 HA2 GLY 1 HA1 GLY 1 -14.998 8.730 8.007
5 HA3 GLY 1 HA2 GLY 1 -13.320 8.593 7.504
6 H SER 2 HN SER 2 -13.488 5.659 7.293
7 HA SER 2 HA SER 2 -15.499 4.868 5.507
8 HB2 SER 2 HB2 SER 2 -14.064 4.801 3.410
9 HB3 SER 2 HB1 SER 2 -14.633 6.397 3.896
10 HG SER 2 HG SER 2 -12.627 6.900 4.624
11 H GLU 3 HN GLU 3 -15.099 2.752 4.568
12 HA GLU 3 HA GLU 3 -13.802 1.005 6.325
13 HB2 GLU 3 HB2 GLU 3 -14.090 -0.679 4.450
14 HB3 GLU 3 HB1 GLU 3 -15.554 0.123 4.999
15 HG2 GLU 3 HG2 GLU 3 -14.175 1.442 2.771
16 HG3 GLU 3 HG1 GLU 3 -14.834 -0.154 2.414
17 H GLY 4 HN GLY 4 -12.681 2.623 3.433
18 HA2 GLY 4 HA2 GLY 4 -10.171 2.981 3.593
19 HA3 GLY 4 HA1 GLY 4 -10.093 1.229 3.691
20 H LYS 5 HN LYS 5 -9.640 3.724 1.665
21 HA LYS 5 HA LYS 5 -10.914 2.988 -0.722
22 HB2 LYS 5 HB2 LYS 5 -8.537 4.634 -0.004
23 HB3 LYS 5 HB1 LYS 5 -8.717 4.152 -1.685
24 HG2 LYS 5 HG2 LYS 5 -9.661 6.376 -1.190
25 HG3 LYS 5 HG1 LYS 5 -10.850 5.241 -1.830
26 HD2 LYS 5 HD2 LYS 5 -11.436 4.761 0.615
27 HD3 LYS 5 HD1 LYS 5 -10.518 6.220 0.992
28 HE2 LYS 5 HE2 LYS 5 -13.025 5.950 -0.641
29 HE3 LYS 5 HE1 LYS 5 -12.758 6.918 0.809
30 HZ1 LYS 5 HZ1 LYS 5 -11.546 7.407 -1.859
31 HZ2 LYS 5 HZ2 LYS 5 -11.248 8.324 -0.469
32 HZ3 LYS 5 HZ3 LYS 5 -12.795 8.306 -1.153
33 H THR 6 HN THR 6 -10.764 0.695 -0.832
34 HA THR 6 HA THR 6 -8.484 -0.846 -0.732
35 HB THR 6 HB THR 6 -9.878 -2.184 -2.619
36 HG1 THR 6 HG1 THR 6 -12.030 -1.697 -2.446
37 HG21 THR 6 HG21 THR 6 -10.424 -3.556 -0.958
38 HG22 THR 6 HG22 THR 6 -11.301 -2.299 -0.086
39 HG23 THR 6 HG23 THR 6 -9.550 -2.433 0.084
40 H CYS 7 HN CYS 7 -9.892 -0.685 -3.954
41 HA CYS 7 HA CYS 7 -7.202 -0.150 -4.988
42 HB2 CYS 7 HB2 CYS 7 -9.580 -1.314 -6.441
43 HB3 CYS 7 HB1 CYS 7 -7.948 -1.161 -7.077
44 H GLY 8 HN GLY 8 -8.178 2.132 -4.149
45 HA2 GLY 8 HA2 GLY 8 -9.940 3.562 -5.786
46 HA3 GLY 8 HA1 GLY 8 -8.682 4.278 -4.791
47 HA PRO 9 HA PRO 9 -7.826 5.334 -9.271
48 HB2 PRO 9 HB2 PRO 9 -6.479 7.640 -8.453
49 HB3 PRO 9 HB1 PRO 9 -8.150 7.566 -9.017
50 HG2 PRO 9 HG2 PRO 9 -7.088 7.629 -6.231
51 HG3 PRO 9 HG1 PRO 9 -8.544 8.389 -6.898
52 HD2 PRO 9 HD2 PRO 9 -8.694 6.177 -5.403
53 HD3 PRO 9 HD1 PRO 9 -9.767 6.418 -6.799
54 H SER 10 HN SER 10 -6.179 4.152 -10.012
55 HA SER 10 HA SER 10 -4.140 3.153 -10.203
56 HB2 SER 10 HB2 SER 10 -2.200 4.803 -9.483
57 HB3 SER 10 HB1 SER 10 -3.176 5.126 -10.915
58 HG SER 10 HG SER 10 -3.241 6.361 -8.395
59 H SER 11 HN SER 11 -5.189 1.950 -8.224
60 HA SER 11 HA SER 11 -3.581 2.263 -5.808
61 HB2 SER 11 HB2 SER 11 -6.119 0.802 -6.463
62 HB3 SER 11 HB1 SER 11 -5.185 0.352 -5.035
63 HG SER 11 HG SER 11 -5.973 3.017 -5.577
64 H PHE 12 HN PHE 12 -2.708 0.323 -4.758
65 HA PHE 12 HA PHE 12 -1.608 -1.546 -6.749
66 HB2 PHE 12 HB2 PHE 12 0.168 -0.274 -5.789
67 HB3 PHE 12 HB1 PHE 12 -0.472 -0.478 -4.163
68 HD1 PHE 12 HD2 PHE 12 0.642 -2.638 -7.004
69 HD2 PHE 12 HD1 PHE 12 0.648 -1.931 -2.807
70 HE1 PHE 12 HE2 PHE 12 2.096 -4.596 -6.681
71 HE2 PHE 12 HE1 PHE 12 2.102 -3.889 -2.476
72 HZ PHE 12 HZ PHE 12 2.829 -5.224 -4.413
73 H SER 13 HN SER 13 -1.528 -3.754 -6.270
74 HA SER 13 HA SER 13 -3.328 -4.583 -4.096
75 HB2 SER 13 HB2 SER 13 -3.445 -6.739 -5.523
76 HB3 SER 13 HB1 SER 13 -4.306 -5.312 -6.096
77 HG SER 13 HG SER 13 -3.026 -6.386 -7.720
78 H CYS 14 HN CYS 14 -2.412 -5.528 -2.414
79 HA CYS 14 HA CYS 14 0.302 -6.143 -2.216
80 HB2 CYS 14 HB2 CYS 14 -0.820 -5.746 -0.192
81 HB3 CYS 14 HB1 CYS 14 -2.102 -6.881 -0.574
82 HA PRO 15 HA PRO 15 0.434 -10.050 -4.360
83 HB2 PRO 15 HB2 PRO 15 2.940 -10.780 -3.646
84 HB3 PRO 15 HB1 PRO 15 2.623 -9.519 -4.843
85 HG2 PRO 15 HG2 PRO 15 3.300 -9.243 -1.937
86 HG3 PRO 15 HG1 PRO 15 3.943 -8.342 -3.322
87 HD2 PRO 15 HD2 PRO 15 2.018 -7.346 -1.717
88 HD3 PRO 15 HD1 PRO 15 2.093 -6.973 -3.449
89 H GLY 16 HN GLY 16 -0.006 -12.149 -3.868
90 HA2 GLY 16 HA2 GLY 16 0.069 -14.113 -2.562
91 HA3 GLY 16 HA1 GLY 16 0.584 -13.151 -1.186
92 H THR 17 HN THR 17 -1.420 -11.209 -1.160
93 HA THR 17 HA THR 17 -3.800 -12.845 -0.569
94 HB THR 17 HB THR 17 -3.116 -12.149 1.533
95 HG1 THR 17 HG1 THR 17 -4.656 -9.907 0.761
96 HG21 THR 17 HG21 THR 17 -1.262 -10.734 0.926
97 HG22 THR 17 HG22 THR 17 -2.298 -9.911 2.092
98 HG23 THR 17 HG23 THR 17 -2.370 -9.474 0.385
99 H HIS 18 HN HIS 18 -5.846 -11.465 -0.463
100 HA HIS 18 HA HIS 18 -5.945 -9.863 -2.907
101 HB2 HIS 18 HB2 HIS 18 -8.461 -10.108 -2.568
102 HB3 HIS 18 HB1 HIS 18 -7.570 -11.581 -2.941
103 HD1 HIS 18 HD1 HIS 18 -7.433 -10.293 0.563
104 HD2 HIS 18 HD2 HIS 18 -9.549 -13.091 -1.662
105 HE1 HIS 18 HE1 HIS 18 -8.650 -11.751 2.230
106 H VAL 19 HN VAL 19 -4.742 -8.610 -0.741
107 HA VAL 19 HA VAL 19 -6.781 -6.716 0.206
108 HB VAL 19 HB VAL 19 -5.592 -7.644 2.052
109 HG11 VAL 19 HG11 VAL 19 -2.905 -6.747 1.535
110 HG12 VAL 19 HG12 VAL 19 -3.452 -7.857 0.281
111 HG13 VAL 19 HG13 VAL 19 -3.493 -8.351 1.972
112 HG21 VAL 19 HG21 VAL 19 -4.285 -4.973 1.604
113 HG22 VAL 19 HG22 VAL 19 -4.763 -5.713 3.132
114 HG23 VAL 19 HG23 VAL 19 -5.994 -5.149 2.001
115 H CYS 20 HN CYS 20 -6.960 -4.956 -0.977
116 HA CYS 20 HA CYS 20 -4.833 -4.058 -2.705
117 HB2 CYS 20 HB2 CYS 20 -7.538 -3.978 -2.896
118 HB3 CYS 20 HB1 CYS 20 -7.207 -2.343 -2.340
119 H VAL 21 HN VAL 21 -4.197 -1.765 -2.776
120 HA VAL 21 HA VAL 21 -4.381 -0.270 -0.301
121 HB VAL 21 HB VAL 21 -2.473 -1.634 0.226
122 HG11 VAL 21 HG11 VAL 21 -0.498 -1.754 -1.188
123 HG12 VAL 21 HG12 VAL 21 -1.290 -0.744 -2.397
124 HG13 VAL 21 HG13 VAL 21 -1.920 -2.353 -2.042
125 HG21 VAL 21 HG21 VAL 21 -2.301 0.682 0.909
126 HG22 VAL 21 HG22 VAL 21 -1.604 1.117 -0.652
127 HG23 VAL 21 HG23 VAL 21 -0.710 0.073 0.453
128 HA PRO 22 HA PRO 22 -4.377 2.797 -3.567
129 HB2 PRO 22 HB2 PRO 22 -4.854 4.958 -2.019
130 HB3 PRO 22 HB1 PRO 22 -6.114 3.784 -2.417
131 HG2 PRO 22 HG2 PRO 22 -4.489 4.050 0.078
132 HG3 PRO 22 HG1 PRO 22 -6.219 3.709 -0.099
133 HD2 PRO 22 HD2 PRO 22 -4.354 1.782 0.400
134 HD3 PRO 22 HD1 PRO 22 -5.864 1.472 -0.474
135 H GLU 23 HN GLU 23 -3.076 4.574 -4.247
136 HA GLU 23 HA GLU 23 -0.368 4.373 -3.687
137 HB2 GLU 23 HB2 GLU 23 -1.877 5.742 -5.513
138 HB3 GLU 23 HB1 GLU 23 -1.235 7.053 -4.533
139 HG2 GLU 23 HG2 GLU 23 0.976 6.520 -5.059
140 HG3 GLU 23 HG1 GLU 23 0.543 4.912 -5.637
141 H ARG 24 HN ARG 24 -2.835 6.287 -2.107
142 HA ARG 24 HA ARG 24 -1.044 7.989 -0.693
143 HB2 ARG 24 HB2 ARG 24 -3.027 8.460 0.764
144 HB3 ARG 24 HB1 ARG 24 -3.304 8.724 -0.951
145 HG2 ARG 24 HG2 ARG 24 -4.114 6.137 -0.648
146 HG3 ARG 24 HG1 ARG 24 -4.572 6.854 0.896
147 HD2 ARG 24 HD2 ARG 24 -6.442 7.375 -0.268
148 HD3 ARG 24 HD1 ARG 24 -5.469 8.773 -0.712
149 HE ARG 24 HE ARG 24 -6.073 6.460 -2.407
150 HH11 ARG 24 HH11 ARG 24 -4.644 9.634 -2.053
151 HH12 ARG 24 HH12 ARG 24 -4.495 9.886 -3.758
152 HH21 ARG 24 HH21 ARG 24 -5.874 6.803 -4.643
153 HH22 ARG 24 HH22 ARG 24 -5.192 8.284 -5.226
154 H TRP 25 HN TRP 25 -2.118 4.744 -0.261
155 HA TRP 25 HA TRP 25 -1.101 4.663 2.493
156 HB2 TRP 25 HB2 TRP 25 -2.670 2.632 0.891
157 HB3 TRP 25 HB1 TRP 25 -2.087 2.368 2.529
158 HD1 TRP 25 HD1 TRP 25 -3.341 5.846 2.042
159 HE1 TRP 25 HE1 TRP 25 -5.672 6.103 3.099
160 HE3 TRP 25 HE3 TRP 25 -4.376 0.921 2.925
161 HZ2 TRP 25 HZ2 TRP 25 -7.680 4.438 4.178
162 HZ3 TRP 25 HZ3 TRP 25 -6.522 0.336 3.975
163 HH2 TRP 25 HH2 TRP 25 -8.139 2.060 4.589
164 H LEU 26 HN LEU 26 0.259 4.547 -0.388
165 HA LEU 26 HA LEU 26 1.732 2.079 -0.216
166 HB2 LEU 26 HB2 LEU 26 1.465 4.314 -2.094
167 HB3 LEU 26 HB1 LEU 26 3.072 3.622 -2.032
168 HG LEU 26 HG LEU 26 1.632 2.663 -3.809
169 HD11 LEU 26 HD11 LEU 26 3.054 0.979 -3.581
170 HD12 LEU 26 HD12 LEU 26 1.909 0.218 -2.476
171 HD13 LEU 26 HD13 LEU 26 3.185 1.259 -1.845
172 HD21 LEU 26 HD21 LEU 26 -0.528 2.518 -3.109
173 HD22 LEU 26 HD22 LEU 26 -0.084 2.080 -1.460
174 HD23 LEU 26 HD23 LEU 26 -0.009 0.874 -2.743
175 H CYS 27 HN CYS 27 3.369 1.793 1.120
176 HA CYS 27 HA CYS 27 4.955 2.258 2.700
177 HB2 CYS 27 HB2 CYS 27 6.968 3.310 1.761
178 HB3 CYS 27 HB1 CYS 27 6.281 2.124 0.660
179 H ASP 28 HN ASP 28 3.327 3.501 3.929
180 HA ASP 28 HA ASP 28 4.135 6.325 4.160
181 HB2 ASP 28 HB2 ASP 28 1.513 5.867 5.268
182 HB3 ASP 28 HB1 ASP 28 2.004 6.992 4.010
183 H GLY 29 HN GLY 29 4.536 3.474 5.613
184 HA2 GLY 29 HA2 GLY 29 5.710 3.609 7.775
185 HA3 GLY 29 HA1 GLY 29 4.417 4.670 8.313
186 H ASP 30 HN ASP 30 2.374 2.982 6.967
187 HA ASP 30 HA ASP 30 2.157 0.990 9.095
188 HB2 ASP 30 HB2 ASP 30 0.084 1.874 7.076
189 HB3 ASP 30 HB1 ASP 30 -0.198 0.845 8.477
190 H LYS 31 HN LYS 31 0.991 -1.102 8.394
191 HA LYS 31 HA LYS 31 2.245 -2.078 5.909
192 HB2 LYS 31 HB2 LYS 31 2.397 -3.069 8.620
193 HB3 LYS 31 HB1 LYS 31 1.738 -4.296 7.550
194 HG2 LYS 31 HG2 LYS 31 3.844 -3.393 6.092
195 HG3 LYS 31 HG1 LYS 31 4.449 -3.210 7.739
196 HD2 LYS 31 HD2 LYS 31 3.761 -5.576 8.170
197 HD3 LYS 31 HD1 LYS 31 3.382 -5.721 6.454
198 HE2 LYS 31 HE2 LYS 31 5.714 -6.476 7.382
199 HE3 LYS 31 HE1 LYS 31 5.586 -5.667 5.823
200 HZ1 LYS 31 HZ1 LYS 31 6.230 -3.606 6.834
201 HZ2 LYS 31 HZ2 LYS 31 7.375 -4.782 7.241
202 HZ3 LYS 31 HZ3 LYS 31 6.223 -4.296 8.379
203 H ASP 32 HN ASP 32 0.396 -1.655 4.665
204 HA ASP 32 HA ASP 32 -2.173 -2.708 5.397
205 HB2 ASP 32 HB2 ASP 32 -1.554 -2.025 2.558
206 HB3 ASP 32 HB1 ASP 32 -2.997 -1.681 3.503
207 H CYS 33 HN CYS 33 0.515 -3.719 3.409
208 HA CYS 33 HA CYS 33 -0.891 -6.049 2.403
209 HB2 CYS 33 HB2 CYS 33 0.629 -4.915 0.896
210 HB3 CYS 33 HB1 CYS 33 1.945 -5.067 2.052
211 H ALA 34 HN ALA 34 -0.458 -8.168 2.974
212 HA ALA 34 HA ALA 34 0.019 -8.840 5.569
213 HB1 ALA 34 HB1 ALA 34 -0.747 -10.272 3.536
214 HB2 ALA 34 HB2 ALA 34 0.044 -11.046 4.909
215 HB3 ALA 34 HB3 ALA 34 0.959 -10.709 3.440
216 H ASP 35 HN ASP 35 2.409 -8.234 3.089
217 HA ASP 35 HA ASP 35 4.529 -8.685 5.085
218 HB2 ASP 35 HB2 ASP 35 4.449 -10.248 3.045
219 HB3 ASP 35 HB1 ASP 35 4.964 -8.848 2.108
220 H GLY 36 HN GLY 36 2.949 -6.245 4.446
221 HA2 GLY 36 HA2 GLY 36 3.293 -3.995 4.161
222 HA3 GLY 36 HA1 GLY 36 4.933 -4.322 4.693
223 H ALA 37 HN ALA 37 3.629 -5.758 1.787
224 HA ALA 37 HA ALA 37 5.706 -5.151 0.124
225 HB1 ALA 37 HB1 ALA 37 4.238 -5.583 -1.744
226 HB2 ALA 37 HB2 ALA 37 2.819 -5.301 -0.734
227 HB3 ALA 37 HB3 ALA 37 3.858 -6.692 -0.427
228 H ASP 38 HN ASP 38 2.812 -3.160 0.689
229 HA ASP 38 HA ASP 38 3.332 -1.172 -1.195
230 HB2 ASP 38 HB2 ASP 38 1.699 0.115 -0.130
231 HB3 ASP 38 HB1 ASP 38 1.247 -1.526 0.305
232 H GLU 39 HN GLU 39 4.748 -1.785 1.909
233 HA GLU 39 HA GLU 39 6.049 0.788 2.078
234 HB2 GLU 39 HB2 GLU 39 6.428 -1.700 3.750
235 HB3 GLU 39 HB1 GLU 39 7.041 -0.098 4.129
236 HG2 GLU 39 HG2 GLU 39 4.118 -0.493 3.724
237 HG3 GLU 39 HG1 GLU 39 4.863 -0.975 5.246
238 H SER 40 HN SER 40 6.578 -1.593 0.018
239 HA SER 40 HA SER 40 9.497 -1.254 0.105
240 HB2 SER 40 HB2 SER 40 7.944 -3.716 0.144
241 HB3 SER 40 HB1 SER 40 9.083 -3.674 -1.201
242 HG SER 40 HG SER 40 9.742 -3.168 1.514
243 H ILE 41 HN ILE 41 10.420 -2.018 -2.141
244 HA ILE 41 HA ILE 41 9.344 -0.241 -4.081
245 HB ILE 41 HB ILE 41 11.585 -2.230 -4.104
246 HG12 ILE 41 HG12 ILE 41 12.965 -0.286 -4.354
247 HG13 ILE 41 HG11 ILE 41 11.570 0.731 -4.690
248 HG21 ILE 41 HG21 ILE 41 10.694 -2.471 -6.308
249 HG22 ILE 41 HG22 ILE 41 12.128 -1.449 -6.415
250 HG23 ILE 41 HG23 ILE 41 10.522 -0.724 -6.486
251 HD11 ILE 41 HD11 ILE 41 11.890 -0.675 -2.066
252 HD12 ILE 41 HD12 ILE 41 10.879 0.715 -2.462
253 HD13 ILE 41 HD13 ILE 41 12.632 0.892 -2.385
254 H ALA 42 HN ALA 42 8.718 -3.521 -3.298
255 HA ALA 42 HA ALA 42 8.017 -4.660 -5.718
256 HB1 ALA 42 HB1 ALA 42 7.926 -5.490 -3.161
257 HB2 ALA 42 HB2 ALA 42 7.127 -6.334 -4.487
258 HB3 ALA 42 HB3 ALA 42 6.206 -5.235 -3.460
259 H ALA 43 HN ALA 43 6.258 -2.377 -3.732
260 HA ALA 43 HA ALA 43 3.878 -2.543 -5.381
261 HB1 ALA 43 HB1 ALA 43 3.776 -2.231 -2.910
262 HB2 ALA 43 HB2 ALA 43 2.892 -1.014 -3.831
263 HB3 ALA 43 HB3 ALA 43 4.465 -0.623 -3.136
264 H GLY 44 HN GLY 44 6.759 -0.652 -5.175
265 HA2 GLY 44 HA2 GLY 44 7.422 0.669 -7.072
266 HA3 GLY 44 HA1 GLY 44 5.729 1.056 -7.340
267 H CYS 45 HN CYS 45 7.162 1.140 -4.157
268 HA CYS 45 HA CYS 45 6.265 3.699 -3.549
269 HB2 CYS 45 HB2 CYS 45 6.938 2.077 -1.842
270 HB3 CYS 45 HB1 CYS 45 8.612 2.207 -2.363
271 H LEU 46 HN LEU 46 9.652 2.769 -4.171
272 HA LEU 46 HA LEU 46 11.324 3.838 -5.299
273 HB2 LEU 46 HB2 LEU 46 9.430 6.074 -5.965
274 HB3 LEU 46 HB1 LEU 46 10.880 5.588 -6.821
275 HG LEU 46 HG LEU 46 8.673 3.605 -6.647
276 HD11 LEU 46 HD11 LEU 46 7.854 6.043 -7.278
277 HD12 LEU 46 HD12 LEU 46 7.253 4.610 -8.111
278 HD13 LEU 46 HD13 LEU 46 8.522 5.590 -8.846
279 HD21 LEU 46 HD21 LEU 46 10.934 4.292 -8.444
280 HD22 LEU 46 HD22 LEU 46 9.515 3.523 -9.156
281 HD23 LEU 46 HD23 LEU 46 10.392 2.721 -7.853
282 H TYR 47 HN TYR 47 9.264 6.347 -3.806
283 HA TYR 47 HA TYR 47 11.129 8.198 -3.115
284 HB2 TYR 47 HB2 TYR 47 9.111 7.483 -1.023
285 HB3 TYR 47 HB1 TYR 47 9.627 9.069 -1.577
286 HD1 TYR 47 HD2 TYR 47 8.729 9.983 -3.712
287 HD2 TYR 47 HD1 TYR 47 7.306 6.344 -2.048
288 HE1 TYR 47 HE2 TYR 47 6.739 10.108 -5.153
289 HE2 TYR 47 HE1 TYR 47 5.318 6.449 -3.476
290 HH TYR 47 HH TYR 47 4.734 7.556 -5.743
291 H ASN 48 HN ASN 48 10.322 5.310 -1.208
292 HA ASN 48 HA ASN 48 11.470 4.173 0.392
293 HB2 ASN 48 HB2 ASN 48 13.387 4.981 -1.499
294 HB3 ASN 48 HB1 ASN 48 14.100 5.328 0.073
295 HD21 ASN 48 HD21 ASN 48 14.845 3.333 -1.902
296 HD22 ASN 48 HD22 ASN 48 14.751 1.804 -1.102
297 H SER 49 HN SER 49 11.220 4.596 2.474
298 HA SER 49 HA SER 49 12.425 7.024 3.592
299 HB2 SER 49 HB2 SER 49 9.553 6.292 3.569
300 HB3 SER 49 HB1 SER 49 10.187 6.901 5.097
301 HG SER 49 HG SER 49 10.992 8.718 3.885
302 H THR 50 HN THR 50 13.835 6.360 5.062
303 HA THR 50 HA THR 50 13.008 4.584 7.179
304 HB THR 50 HB THR 50 15.291 3.273 6.658
305 HG1 THR 50 HG1 THR 50 15.829 3.298 4.626
306 HG21 THR 50 HG21 THR 50 12.509 2.721 6.218
307 HG22 THR 50 HG22 THR 50 13.810 1.636 6.711
308 HG23 THR 50 HG23 THR 50 13.507 1.929 4.998
Start of MODEL 13
1 H1 GLY 1 HT1 GLY 1 -14.235 12.220 3.301
2 H2 GLY 1 HT2 GLY 1 -14.662 12.341 4.933
3 H3 GLY 1 HT3 GLY 1 -15.845 12.505 3.737
4 HA2 GLY 1 HA1 GLY 1 -14.488 10.077 4.692
5 HA3 GLY 1 HA2 GLY 1 -16.206 10.360 4.453
6 H SER 2 HN SER 2 -15.116 8.068 3.494
7 HA SER 2 HA SER 2 -15.432 8.444 0.617
8 HB2 SER 2 HB2 SER 2 -13.214 6.675 1.628
9 HB3 SER 2 HB1 SER 2 -13.467 7.301 -0.002
10 HG SER 2 HG SER 2 -11.967 8.640 0.750
11 H GLU 3 HN GLU 3 -17.226 7.425 2.552
12 HA GLU 3 HA GLU 3 -18.723 5.725 2.770
13 HB2 GLU 3 HB2 GLU 3 -17.922 5.526 0.167
14 HB3 GLU 3 HB1 GLU 3 -17.509 3.929 0.777
15 HG2 GLU 3 HG2 GLU 3 -19.832 3.705 1.611
16 HG3 GLU 3 HG1 GLU 3 -20.213 5.244 0.840
17 H GLY 4 HN GLY 4 -15.790 3.957 1.770
18 HA2 GLY 4 HA2 GLY 4 -15.810 2.664 4.428
19 HA3 GLY 4 HA1 GLY 4 -15.511 1.761 2.950
20 H LYS 5 HN LYS 5 -13.453 1.110 3.125
21 HA LYS 5 HA LYS 5 -11.336 2.904 2.726
22 HB2 LYS 5 HB2 LYS 5 -12.081 3.047 5.317
23 HB3 LYS 5 HB1 LYS 5 -10.934 1.718 5.409
24 HG2 LYS 5 HG2 LYS 5 -9.746 3.712 5.877
25 HG3 LYS 5 HG1 LYS 5 -9.268 3.190 4.261
26 HD2 LYS 5 HD2 LYS 5 -11.184 4.772 3.480
27 HD3 LYS 5 HD1 LYS 5 -10.994 5.493 5.080
28 HE2 LYS 5 HE2 LYS 5 -8.491 5.606 4.501
29 HE3 LYS 5 HE1 LYS 5 -9.007 5.333 2.837
30 HZ1 LYS 5 HZ1 LYS 5 -10.598 7.296 3.335
31 HZ2 LYS 5 HZ2 LYS 5 -8.977 7.612 2.969
32 HZ3 LYS 5 HZ3 LYS 5 -9.503 7.652 4.575
33 H THR 6 HN THR 6 -11.195 1.190 1.123
34 HA THR 6 HA THR 6 -9.827 -1.203 2.169
35 HB THR 6 HB THR 6 -11.121 -1.224 -0.521
36 HG1 THR 6 HG1 THR 6 -13.087 -1.376 0.260
37 HG21 THR 6 HG21 THR 6 -11.530 -3.479 1.264
38 HG22 THR 6 HG22 THR 6 -9.828 -3.131 0.959
39 HG23 THR 6 HG23 THR 6 -10.923 -3.432 -0.391
40 H CYS 7 HN CYS 7 -10.095 0.831 -0.748
41 HA CYS 7 HA CYS 7 -7.335 1.334 -0.912
42 HB2 CYS 7 HB2 CYS 7 -6.805 -0.013 -2.933
43 HB3 CYS 7 HB1 CYS 7 -7.097 -0.992 -1.502
44 H GLY 8 HN GLY 8 -10.361 0.962 -2.697
45 HA2 GLY 8 HA2 GLY 8 -11.380 2.314 -4.249
46 HA3 GLY 8 HA1 GLY 8 -10.484 3.629 -3.507
47 HA PRO 9 HA PRO 9 -9.167 3.351 -7.960
48 HB2 PRO 9 HB2 PRO 9 -8.626 6.059 -8.056
49 HB3 PRO 9 HB1 PRO 9 -10.164 5.323 -8.516
50 HG2 PRO 9 HG2 PRO 9 -9.385 6.643 -5.951
51 HG3 PRO 9 HG1 PRO 9 -10.911 6.747 -6.848
52 HD2 PRO 9 HD2 PRO 9 -10.679 5.215 -4.667
53 HD3 PRO 9 HD1 PRO 9 -11.660 4.700 -6.055
54 H SER 10 HN SER 10 -7.090 3.450 -8.801
55 HA SER 10 HA SER 10 -4.817 3.389 -8.787
56 HB2 SER 10 HB2 SER 10 -4.800 5.400 -6.550
57 HB3 SER 10 HB1 SER 10 -3.665 5.225 -7.889
58 HG SER 10 HG SER 10 -5.685 6.853 -7.778
59 H SER 11 HN SER 11 -6.114 1.450 -7.284
60 HA SER 11 HA SER 11 -4.820 1.221 -4.712
61 HB2 SER 11 HB2 SER 11 -5.959 -1.028 -4.673
62 HB3 SER 11 HB1 SER 11 -7.049 0.347 -4.861
63 HG SER 11 HG SER 11 -7.296 -0.139 -6.996
64 H PHE 12 HN PHE 12 -3.731 -0.903 -4.175
65 HA PHE 12 HA PHE 12 -2.123 -1.937 -6.395
66 HB2 PHE 12 HB2 PHE 12 -0.628 -0.333 -5.502
67 HB3 PHE 12 HB1 PHE 12 -1.078 -0.716 -3.845
68 HD1 PHE 12 HD2 PHE 12 0.561 -2.192 -6.841
69 HD2 PHE 12 HD1 PHE 12 0.215 -2.168 -2.601
70 HE1 PHE 12 HE2 PHE 12 2.459 -3.751 -6.683
71 HE2 PHE 12 HE1 PHE 12 2.111 -3.731 -2.434
72 HZ PHE 12 HZ PHE 12 3.236 -4.523 -4.475
73 H SER 13 HN SER 13 -1.837 -4.087 -6.322
74 HA SER 13 HA SER 13 -2.986 -5.518 -4.056
75 HB2 SER 13 HB2 SER 13 -3.404 -7.269 -5.494
76 HB3 SER 13 HB1 SER 13 -3.454 -5.919 -6.624
77 HG SER 13 HG SER 13 -1.725 -8.013 -6.505
78 H CYS 14 HN CYS 14 -1.895 -7.194 -2.982
79 HA CYS 14 HA CYS 14 0.973 -6.779 -2.819
80 HB2 CYS 14 HB2 CYS 14 -0.929 -7.251 -0.921
81 HB3 CYS 14 HB1 CYS 14 -0.233 -8.853 -1.115
82 HA PRO 15 HA PRO 15 2.125 -10.219 -5.362
83 HB2 PRO 15 HB2 PRO 15 4.458 -10.881 -4.030
84 HB3 PRO 15 HB1 PRO 15 4.322 -9.616 -5.254
85 HG2 PRO 15 HG2 PRO 15 4.282 -9.383 -2.272
86 HG3 PRO 15 HG1 PRO 15 5.085 -8.345 -3.467
87 HD2 PRO 15 HD2 PRO 15 2.797 -7.603 -2.313
88 HD3 PRO 15 HD1 PRO 15 3.107 -7.259 -4.027
89 H GLY 16 HN GLY 16 1.511 -12.298 -5.327
90 HA2 GLY 16 HA2 GLY 16 1.424 -14.492 -4.461
91 HA3 GLY 16 HA1 GLY 16 1.775 -13.850 -2.863
92 H THR 17 HN THR 17 -0.186 -11.904 -2.641
93 HA THR 17 HA THR 17 -2.616 -13.563 -2.573
94 HB THR 17 HB THR 17 -1.997 -12.968 -0.355
95 HG1 THR 17 HG1 THR 17 -3.768 -11.802 0.279
96 HG21 THR 17 HG21 THR 17 -0.433 -11.184 -0.755
97 HG22 THR 17 HG22 THR 17 -1.675 -10.651 0.379
98 HG23 THR 17 HG23 THR 17 -1.735 -10.129 -1.304
99 H HIS 18 HN HIS 18 -4.651 -12.001 -2.432
100 HA HIS 18 HA HIS 18 -4.406 -10.109 -4.678
101 HB2 HIS 18 HB2 HIS 18 -6.583 -12.061 -3.970
102 HB3 HIS 18 HB1 HIS 18 -6.915 -10.658 -4.982
103 HD1 HIS 18 HD1 HIS 18 -4.001 -13.133 -5.076
104 HD2 HIS 18 HD2 HIS 18 -7.010 -11.587 -7.488
105 HE1 HIS 18 HE1 HIS 18 -3.655 -14.134 -7.373
106 H VAL 19 HN VAL 19 -3.884 -9.106 -2.218
107 HA VAL 19 HA VAL 19 -6.257 -8.077 -0.969
108 HB VAL 19 HB VAL 19 -4.921 -7.194 0.669
109 HG11 VAL 19 HG11 VAL 19 -4.184 -9.683 -0.180
110 HG12 VAL 19 HG12 VAL 19 -3.672 -8.927 1.328
111 HG13 VAL 19 HG13 VAL 19 -2.635 -8.845 -0.095
112 HG21 VAL 19 HG21 VAL 19 -2.971 -6.593 -1.515
113 HG22 VAL 19 HG22 VAL 19 -2.441 -6.601 0.166
114 HG23 VAL 19 HG23 VAL 19 -3.721 -5.503 -0.351
115 H CYS 20 HN CYS 20 -5.994 -5.501 -0.484
116 HA CYS 20 HA CYS 20 -5.398 -4.075 -2.949
117 HB2 CYS 20 HB2 CYS 20 -7.858 -4.950 -2.871
118 HB3 CYS 20 HB1 CYS 20 -8.101 -3.629 -1.733
119 H VAL 21 HN VAL 21 -4.276 -2.348 -2.408
120 HA VAL 21 HA VAL 21 -4.900 -0.988 0.131
121 HB VAL 21 HB VAL 21 -2.770 -2.053 0.408
122 HG11 VAL 21 HG11 VAL 21 -2.333 -1.137 -2.362
123 HG12 VAL 21 HG12 VAL 21 -1.811 -2.616 -1.556
124 HG13 VAL 21 HG13 VAL 21 -0.928 -1.112 -1.295
125 HG21 VAL 21 HG21 VAL 21 -1.252 -0.091 0.662
126 HG22 VAL 21 HG22 VAL 21 -2.845 0.127 1.383
127 HG23 VAL 21 HG23 VAL 21 -2.464 0.890 -0.160
128 HA PRO 22 HA PRO 22 -5.537 2.535 -2.511
129 HB2 PRO 22 HB2 PRO 22 -5.706 4.451 -0.619
130 HB3 PRO 22 HB1 PRO 22 -6.990 3.264 -0.868
131 HG2 PRO 22 HG2 PRO 22 -4.836 3.321 1.205
132 HG3 PRO 22 HG1 PRO 22 -6.548 2.894 1.380
133 HD2 PRO 22 HD2 PRO 22 -4.542 1.050 1.173
134 HD3 PRO 22 HD1 PRO 22 -6.211 0.744 0.658
135 H GLU 23 HN GLU 23 -4.287 4.095 -3.478
136 HA GLU 23 HA GLU 23 -1.554 4.045 -3.328
137 HB2 GLU 23 HB2 GLU 23 -3.517 5.632 -4.644
138 HB3 GLU 23 HB1 GLU 23 -2.303 6.722 -3.989
139 HG2 GLU 23 HG2 GLU 23 -0.713 4.851 -5.085
140 HG3 GLU 23 HG1 GLU 23 -2.108 4.742 -6.157
141 H ARG 24 HN ARG 24 -3.774 5.990 -1.406
142 HA ARG 24 HA ARG 24 -1.894 7.712 -0.228
143 HB2 ARG 24 HB2 ARG 24 -3.573 8.029 1.549
144 HB3 ARG 24 HB1 ARG 24 -4.287 8.126 -0.054
145 HG2 ARG 24 HG2 ARG 24 -5.637 6.394 0.322
146 HG3 ARG 24 HG1 ARG 24 -4.351 5.436 1.058
147 HD2 ARG 24 HD2 ARG 24 -6.305 6.040 2.554
148 HD3 ARG 24 HD1 ARG 24 -4.696 6.410 3.175
149 HE ARG 24 HE ARG 24 -5.947 8.598 1.785
150 HH11 ARG 24 HH11 ARG 24 -5.583 6.983 4.858
151 HH12 ARG 24 HH12 ARG 24 -5.985 8.388 5.785
152 HH21 ARG 24 HH21 ARG 24 -6.478 10.447 3.005
153 HH22 ARG 24 HH22 ARG 24 -6.495 10.355 4.734
154 H TRP 25 HN TRP 25 -2.767 4.407 0.406
155 HA TRP 25 HA TRP 25 -1.287 4.295 2.901
156 HB2 TRP 25 HB2 TRP 25 -2.940 2.338 1.333
157 HB3 TRP 25 HB1 TRP 25 -1.873 1.773 2.613
158 HD1 TRP 25 HD1 TRP 25 -3.196 5.039 3.643
159 HE1 TRP 25 HE1 TRP 25 -5.168 4.758 5.274
160 HE3 TRP 25 HE3 TRP 25 -4.131 0.061 2.941
161 HZ2 TRP 25 HZ2 TRP 25 -6.889 2.699 6.149
162 HZ3 TRP 25 HZ3 TRP 25 -5.956 -0.987 4.215
163 HH2 TRP 25 HH2 TRP 25 -7.306 0.306 5.785
164 H LEU 26 HN LEU 26 -0.834 3.578 -0.471
165 HA LEU 26 HA LEU 26 1.155 1.696 -0.497
166 HB2 LEU 26 HB2 LEU 26 0.426 3.972 -2.221
167 HB3 LEU 26 HB1 LEU 26 2.056 3.369 -2.427
168 HG LEU 26 HG LEU 26 0.476 2.365 -4.015
169 HD11 LEU 26 HD11 LEU 26 1.098 0.038 -3.643
170 HD12 LEU 26 HD12 LEU 26 1.562 0.422 -1.986
171 HD13 LEU 26 HD13 LEU 26 2.455 1.121 -3.337
172 HD21 LEU 26 HD21 LEU 26 -1.389 2.430 -2.185
173 HD22 LEU 26 HD22 LEU 26 -0.786 0.818 -1.805
174 HD23 LEU 26 HD23 LEU 26 -1.393 1.175 -3.422
175 H CYS 27 HN CYS 27 2.808 1.628 0.883
176 HA CYS 27 HA CYS 27 4.632 2.232 2.113
177 HB2 CYS 27 HB2 CYS 27 5.465 2.356 -0.268
178 HB3 CYS 27 HB1 CYS 27 5.213 4.093 -0.190
179 H ASP 28 HN ASP 28 2.895 3.317 3.483
180 HA ASP 28 HA ASP 28 3.289 6.227 3.573
181 HB2 ASP 28 HB2 ASP 28 1.207 6.311 4.863
182 HB3 ASP 28 HB1 ASP 28 0.959 5.494 3.324
183 H GLY 29 HN GLY 29 4.403 3.457 5.016
184 HA2 GLY 29 HA2 GLY 29 6.115 3.882 6.745
185 HA3 GLY 29 HA1 GLY 29 4.920 4.887 7.549
186 H ASP 30 HN ASP 30 2.773 2.928 6.892
187 HA ASP 30 HA ASP 30 3.389 1.025 9.043
188 HB2 ASP 30 HB2 ASP 30 0.912 2.393 8.136
189 HB3 ASP 30 HB1 ASP 30 0.734 0.754 8.757
190 H LYS 31 HN LYS 31 3.038 -1.174 8.791
191 HA LYS 31 HA LYS 31 3.161 -2.125 6.062
192 HB2 LYS 31 HB2 LYS 31 3.730 -3.217 8.736
193 HB3 LYS 31 HB1 LYS 31 3.085 -4.381 7.592
194 HG2 LYS 31 HG2 LYS 31 4.901 -3.592 6.002
195 HG3 LYS 31 HG1 LYS 31 5.615 -2.785 7.400
196 HD2 LYS 31 HD2 LYS 31 6.037 -4.794 8.500
197 HD3 LYS 31 HD1 LYS 31 4.865 -5.681 7.526
198 HE2 LYS 31 HE2 LYS 31 7.386 -6.038 7.089
199 HE3 LYS 31 HE1 LYS 31 6.299 -5.846 5.715
200 HZ1 LYS 31 HZ1 LYS 31 8.317 -4.528 5.467
201 HZ2 LYS 31 HZ2 LYS 31 7.975 -3.695 6.898
202 HZ3 LYS 31 HZ3 LYS 31 6.955 -3.528 5.560
203 H ASP 32 HN ASP 32 1.124 -1.806 5.186
204 HA ASP 32 HA ASP 32 -1.191 -2.948 6.529
205 HB2 ASP 32 HB2 ASP 32 -1.848 -2.161 3.863
206 HB3 ASP 32 HB1 ASP 32 -2.344 -1.414 5.374
207 H CYS 33 HN CYS 33 1.017 -3.652 3.954
208 HA CYS 33 HA CYS 33 -0.511 -5.750 2.756
209 HB2 CYS 33 HB2 CYS 33 1.939 -4.364 2.246
210 HB3 CYS 33 HB1 CYS 33 2.263 -6.094 2.230
211 H ALA 34 HN ALA 34 0.449 -8.010 2.616
212 HA ALA 34 HA ALA 34 0.499 -9.171 5.177
213 HB1 ALA 34 HB1 ALA 34 0.417 -11.150 4.096
214 HB2 ALA 34 HB2 ALA 34 1.721 -10.721 2.988
215 HB3 ALA 34 HB3 ALA 34 0.084 -10.133 2.693
216 H ASP 35 HN ASP 35 3.078 -8.443 2.867
217 HA ASP 35 HA ASP 35 5.038 -8.895 5.021
218 HB2 ASP 35 HB2 ASP 35 6.668 -9.351 3.120
219 HB3 ASP 35 HB1 ASP 35 5.446 -10.585 3.406
220 H GLY 36 HN GLY 36 3.580 -6.449 4.330
221 HA2 GLY 36 HA2 GLY 36 4.022 -4.204 4.189
222 HA3 GLY 36 HA1 GLY 36 5.702 -4.607 4.484
223 H ALA 37 HN ALA 37 4.131 -6.024 1.739
224 HA ALA 37 HA ALA 37 5.989 -5.246 -0.127
225 HB1 ALA 37 HB1 ALA 37 3.128 -5.479 -0.959
226 HB2 ALA 37 HB2 ALA 37 3.969 -6.884 -0.305
227 HB3 ALA 37 HB3 ALA 37 4.581 -6.085 -1.754
228 H ASP 38 HN ASP 38 2.981 -3.584 0.736
229 HA ASP 38 HA ASP 38 3.135 -1.521 -1.146
230 HB2 ASP 38 HB2 ASP 38 1.753 -0.237 0.626
231 HB3 ASP 38 HB1 ASP 38 1.068 -1.702 -0.068
232 H GLU 39 HN GLU 39 4.943 -2.076 1.734
233 HA GLU 39 HA GLU 39 5.885 0.685 1.855
234 HB2 GLU 39 HB2 GLU 39 6.562 -1.678 3.615
235 HB3 GLU 39 HB1 GLU 39 7.045 -0.013 3.896
236 HG2 GLU 39 HG2 GLU 39 4.162 -0.429 3.587
237 HG3 GLU 39 HG1 GLU 39 4.883 -1.197 4.998
238 H SER 40 HN SER 40 6.556 -1.453 -0.273
239 HA SER 40 HA SER 40 9.474 -1.089 -0.116
240 HB2 SER 40 HB2 SER 40 8.132 -3.531 -0.050
241 HB3 SER 40 HB1 SER 40 8.692 -3.389 -1.716
242 HG SER 40 HG SER 40 10.155 -3.584 0.651
243 H ILE 41 HN ILE 41 10.349 -1.779 -2.487
244 HA ILE 41 HA ILE 41 9.435 0.304 -4.206
245 HB ILE 41 HB ILE 41 11.418 -1.925 -4.634
246 HG12 ILE 41 HG12 ILE 41 13.020 0.023 -4.614
247 HG13 ILE 41 HG11 ILE 41 11.675 1.036 -4.108
248 HG21 ILE 41 HG21 ILE 41 10.687 0.332 -6.492
249 HG22 ILE 41 HG22 ILE 41 10.507 -1.396 -6.794
250 HG23 ILE 41 HG23 ILE 41 12.117 -0.685 -6.669
251 HD11 ILE 41 HD11 ILE 41 12.447 -1.407 -2.564
252 HD12 ILE 41 HD12 ILE 41 11.520 -0.002 -2.033
253 HD13 ILE 41 HD13 ILE 41 13.255 0.141 -2.317
254 H ALA 42 HN ALA 42 8.767 -3.089 -3.897
255 HA ALA 42 HA ALA 42 7.857 -3.765 -6.419
256 HB1 ALA 42 HB1 ALA 42 6.816 -5.591 -5.436
257 HB2 ALA 42 HB2 ALA 42 6.408 -4.696 -3.971
258 HB3 ALA 42 HB3 ALA 42 8.076 -5.186 -4.270
259 H ALA 43 HN ALA 43 6.313 -1.846 -3.940
260 HA ALA 43 HA ALA 43 3.792 -1.759 -5.386
261 HB1 ALA 43 HB1 ALA 43 4.393 -1.665 -2.729
262 HB2 ALA 43 HB2 ALA 43 2.858 -1.171 -3.443
263 HB3 ALA 43 HB3 ALA 43 4.099 0.035 -3.099
264 H GLY 44 HN GLY 44 6.711 -0.014 -5.294
265 HA2 GLY 44 HA2 GLY 44 7.024 1.635 -7.062
266 HA3 GLY 44 HA1 GLY 44 5.409 2.227 -6.705
267 H CYS 45 HN CYS 45 7.522 1.373 -4.090
268 HA CYS 45 HA CYS 45 7.760 4.226 -3.421
269 HB2 CYS 45 HB2 CYS 45 6.558 2.824 -1.787
270 HB3 CYS 45 HB1 CYS 45 7.985 1.812 -1.612
271 H LEU 46 HN LEU 46 9.641 4.974 -4.177
272 HA LEU 46 HA LEU 46 12.068 3.377 -3.685
273 HB2 LEU 46 HB2 LEU 46 11.747 5.564 -5.733
274 HB3 LEU 46 HB1 LEU 46 13.080 4.435 -5.580
275 HG LEU 46 HG LEU 46 10.502 3.112 -5.975
276 HD11 LEU 46 HD11 LEU 46 10.043 3.774 -8.168
277 HD12 LEU 46 HD12 LEU 46 11.579 4.625 -8.330
278 HD13 LEU 46 HD13 LEU 46 10.308 5.287 -7.302
279 HD21 LEU 46 HD21 LEU 46 11.753 1.738 -7.427
280 HD22 LEU 46 HD22 LEU 46 12.834 2.130 -6.089
281 HD23 LEU 46 HD23 LEU 46 13.005 2.964 -7.634
282 H TYR 47 HN TYR 47 10.793 5.167 -1.775
283 HA TYR 47 HA TYR 47 12.289 7.604 -1.703
284 HB2 TYR 47 HB2 TYR 47 11.142 8.098 0.294
285 HB3 TYR 47 HB1 TYR 47 9.988 7.200 -0.681
286 HD1 TYR 47 HD1 TYR 47 11.310 4.438 -0.079
287 HD2 TYR 47 HD2 TYR 47 10.049 7.669 2.382
288 HE1 TYR 47 HE1 TYR 47 10.961 2.873 1.782
289 HE2 TYR 47 HE2 TYR 47 9.698 6.114 4.253
290 HH TYR 47 HH TYR 47 10.821 3.624 4.814
291 H ASN 48 HN ASN 48 13.053 4.411 -0.899
292 HA ASN 48 HA ASN 48 14.881 3.454 0.049
293 HB2 ASN 48 HB2 ASN 48 16.011 6.253 0.229
294 HB3 ASN 48 HB1 ASN 48 16.914 4.743 0.283
295 HD21 ASN 48 HD21 ASN 48 17.025 7.077 -1.544
296 HD22 ASN 48 HD22 ASN 48 16.855 6.414 -3.130
297 H SER 49 HN SER 49 14.831 6.590 1.746
298 HA SER 49 HA SER 49 14.512 7.135 3.931
299 HB2 SER 49 HB2 SER 49 12.599 5.234 3.472
300 HB3 SER 49 HB1 SER 49 13.485 4.522 4.820
301 HG SER 49 HG SER 49 11.968 6.860 4.712
302 H THR 50 HN THR 50 15.739 7.088 5.765
303 HA THR 50 HA THR 50 18.159 5.648 5.709
304 HB THR 50 HB THR 50 17.187 6.732 8.302
305 HG1 THR 50 HG1 THR 50 17.832 8.431 6.129
306 HG21 THR 50 HG21 THR 50 19.358 7.666 8.478
307 HG22 THR 50 HG22 THR 50 19.703 7.339 6.779
308 HG23 THR 50 HG23 THR 50 19.542 6.003 7.920
Start of MODEL 14
1 H1 GLY 1 HT1 GLY 1 -21.558 8.664 4.374
2 H2 GLY 1 HT2 GLY 1 -22.006 8.055 5.887
3 H3 GLY 1 HT3 GLY 1 -21.365 7.018 4.715
4 HA2 GLY 1 HA1 GLY 1 -19.689 9.275 5.430
5 HA3 GLY 1 HA2 GLY 1 -19.932 8.083 6.698
6 H SER 2 HN SER 2 -17.960 8.940 4.221
7 HA SER 2 HA SER 2 -16.221 7.929 3.161
8 HB2 SER 2 HB2 SER 2 -16.455 5.377 4.646
9 HB3 SER 2 HB1 SER 2 -15.046 6.404 4.379
10 HG SER 2 HG SER 2 -16.859 6.395 6.450
11 H GLU 3 HN GLU 3 -16.331 7.189 1.155
12 HA GLU 3 HA GLU 3 -18.494 5.418 0.382
13 HB2 GLU 3 HB2 GLU 3 -16.348 6.478 -1.443
14 HB3 GLU 3 HB1 GLU 3 -17.983 5.982 -1.855
15 HG2 GLU 3 HG2 GLU 3 -18.329 8.200 -1.899
16 HG3 GLU 3 HG1 GLU 3 -18.547 7.975 -0.165
17 H GLY 4 HN GLY 4 -15.008 5.441 -0.392
18 HA2 GLY 4 HA2 GLY 4 -14.861 2.597 0.260
19 HA3 GLY 4 HA1 GLY 4 -14.525 3.047 -1.405
20 H LYS 5 HN LYS 5 -13.467 3.408 1.930
21 HA LYS 5 HA LYS 5 -11.123 4.887 1.392
22 HB2 LYS 5 HB2 LYS 5 -12.414 3.793 3.666
23 HB3 LYS 5 HB1 LYS 5 -10.758 3.204 3.683
24 HG2 LYS 5 HG2 LYS 5 -10.885 6.028 3.060
25 HG3 LYS 5 HG1 LYS 5 -11.661 5.654 4.600
26 HD2 LYS 5 HD2 LYS 5 -9.569 5.802 5.419
27 HD3 LYS 5 HD1 LYS 5 -9.401 4.164 4.784
28 HE2 LYS 5 HE2 LYS 5 -7.764 4.866 3.461
29 HE3 LYS 5 HE1 LYS 5 -8.902 5.936 2.643
30 HZ1 LYS 5 HZ1 LYS 5 -6.738 6.794 3.924
31 HZ2 LYS 5 HZ2 LYS 5 -7.866 6.894 5.180
32 HZ3 LYS 5 HZ3 LYS 5 -8.135 7.729 3.735
33 H THR 6 HN THR 6 -11.815 1.440 1.438
34 HA THR 6 HA THR 6 -9.091 0.611 1.261
35 HB THR 6 HB THR 6 -10.228 -1.568 0.426
36 HG1 THR 6 HG1 THR 6 -12.450 -1.636 1.016
37 HG21 THR 6 HG21 THR 6 -10.052 -0.426 3.062
38 HG22 THR 6 HG22 THR 6 -9.812 -2.091 2.533
39 HG23 THR 6 HG23 THR 6 -11.432 -1.515 2.925
40 H CYS 7 HN CYS 7 -7.905 -0.027 -0.502
41 HA CYS 7 HA CYS 7 -7.127 0.054 -2.629
42 HB2 CYS 7 HB2 CYS 7 -10.032 -0.411 -3.334
43 HB3 CYS 7 HB1 CYS 7 -8.667 -0.633 -4.420
44 H GLY 8 HN GLY 8 -10.276 1.426 -3.520
45 HA2 GLY 8 HA2 GLY 8 -10.816 3.446 -4.470
46 HA3 GLY 8 HA1 GLY 8 -9.648 4.132 -3.351
47 HA PRO 9 HA PRO 9 -8.409 4.784 -7.908
48 HB2 PRO 9 HB2 PRO 9 -7.652 7.409 -7.307
49 HB3 PRO 9 HB1 PRO 9 -9.145 6.920 -8.111
50 HG2 PRO 9 HG2 PRO 9 -8.664 7.594 -5.246
51 HG3 PRO 9 HG1 PRO 9 -10.077 7.939 -6.261
52 HD2 PRO 9 HD2 PRO 9 -10.124 5.982 -4.443
53 HD3 PRO 9 HD1 PRO 9 -10.927 5.790 -6.017
54 H SER 10 HN SER 10 -6.353 4.423 -8.518
55 HA SER 10 HA SER 10 -4.104 4.097 -8.423
56 HB2 SER 10 HB2 SER 10 -4.286 6.612 -7.800
57 HB3 SER 10 HB1 SER 10 -3.918 6.071 -6.162
58 HG SER 10 HG SER 10 -2.034 6.641 -7.344
59 H SER 11 HN SER 11 -5.419 2.158 -7.221
60 HA SER 11 HA SER 11 -4.372 1.786 -4.520
61 HB2 SER 11 HB2 SER 11 -5.749 -0.525 -5.180
62 HB3 SER 11 HB1 SER 11 -6.405 0.851 -4.299
63 HG SER 11 HG SER 11 -7.108 1.702 -6.299
64 H PHE 12 HN PHE 12 -3.319 -0.215 -3.932
65 HA PHE 12 HA PHE 12 -1.784 -1.408 -6.145
66 HB2 PHE 12 HB2 PHE 12 -0.231 -0.059 -4.939
67 HB3 PHE 12 HB1 PHE 12 -0.859 -0.600 -3.385
68 HD1 PHE 12 HD2 PHE 12 0.601 -2.111 -6.475
69 HD2 PHE 12 HD1 PHE 12 0.437 -2.080 -2.223
70 HE1 PHE 12 HE2 PHE 12 2.306 -3.883 -6.401
71 HE2 PHE 12 HE1 PHE 12 2.141 -3.854 -2.141
72 HZ PHE 12 HZ PHE 12 3.078 -4.757 -4.231
73 H SER 13 HN SER 13 -1.220 -3.625 -5.903
74 HA SER 13 HA SER 13 -2.873 -5.059 -3.928
75 HB2 SER 13 HB2 SER 13 -3.782 -5.419 -6.136
76 HB3 SER 13 HB1 SER 13 -2.191 -5.833 -6.771
77 HG SER 13 HG SER 13 -2.374 -7.780 -5.968
78 H CYS 14 HN CYS 14 -1.738 -6.145 -2.478
79 HA CYS 14 HA CYS 14 1.066 -6.418 -2.602
80 HB2 CYS 14 HB2 CYS 14 -0.714 -8.090 -0.841
81 HB3 CYS 14 HB1 CYS 14 0.917 -7.529 -0.517
82 HA PRO 15 HA PRO 15 1.437 -10.067 -5.090
83 HB2 PRO 15 HB2 PRO 15 3.948 -10.812 -4.385
84 HB3 PRO 15 HB1 PRO 15 3.619 -9.433 -5.440
85 HG2 PRO 15 HG2 PRO 15 4.228 -9.472 -2.509
86 HG3 PRO 15 HG1 PRO 15 4.852 -8.387 -3.766
87 HD2 PRO 15 HD2 PRO 15 2.859 -7.670 -2.089
88 HD3 PRO 15 HD1 PRO 15 2.953 -7.082 -3.760
89 H GLY 16 HN GLY 16 0.971 -12.189 -4.879
90 HA2 GLY 16 HA2 GLY 16 0.636 -14.250 -3.915
91 HA3 GLY 16 HA1 GLY 16 1.764 -13.777 -2.655
92 H THR 17 HN THR 17 -1.258 -12.157 -3.514
93 HA THR 17 HA THR 17 -2.918 -13.314 -1.596
94 HB THR 17 HB THR 17 -1.468 -12.474 0.115
95 HG1 THR 17 HG1 THR 17 -2.922 -11.312 1.250
96 HG21 THR 17 HG21 THR 17 -1.698 -9.780 -1.199
97 HG22 THR 17 HG22 THR 17 -0.246 -10.773 -1.073
98 HG23 THR 17 HG23 THR 17 -0.974 -10.087 0.379
99 H HIS 18 HN HIS 18 -4.771 -11.727 -0.973
100 HA HIS 18 HA HIS 18 -5.368 -10.092 -3.352
101 HB2 HIS 18 HB2 HIS 18 -6.753 -12.203 -2.918
102 HB3 HIS 18 HB1 HIS 18 -7.433 -11.340 -1.542
103 HD1 HIS 18 HD1 HIS 18 -9.805 -11.203 -2.557
104 HD2 HIS 18 HD2 HIS 18 -6.849 -9.498 -4.927
105 HE1 HIS 18 HE1 HIS 18 -11.006 -9.906 -4.366
106 H VAL 19 HN VAL 19 -3.940 -8.945 -1.303
107 HA VAL 19 HA VAL 19 -5.924 -7.282 0.103
108 HB VAL 19 HB VAL 19 -4.584 -8.312 1.746
109 HG11 VAL 19 HG11 VAL 19 -2.503 -8.118 -0.278
110 HG12 VAL 19 HG12 VAL 19 -2.709 -9.283 1.030
111 HG13 VAL 19 HG13 VAL 19 -1.932 -7.731 1.344
112 HG21 VAL 19 HG21 VAL 19 -2.892 -5.920 1.685
113 HG22 VAL 19 HG22 VAL 19 -4.025 -6.479 2.916
114 HG23 VAL 19 HG23 VAL 19 -4.617 -5.595 1.510
115 H CYS 20 HN CYS 20 -6.034 -5.160 -0.345
116 HA CYS 20 HA CYS 20 -3.972 -4.046 -2.120
117 HB2 CYS 20 HB2 CYS 20 -5.576 -2.714 -3.164
118 HB3 CYS 20 HB1 CYS 20 -6.447 -4.213 -2.879
119 H VAL 21 HN VAL 21 -3.595 -1.682 -1.891
120 HA VAL 21 HA VAL 21 -4.147 -0.556 0.725
121 HB VAL 21 HB VAL 21 -2.128 -1.816 1.188
122 HG11 VAL 21 HG11 VAL 21 -0.589 -2.166 -0.364
123 HG12 VAL 21 HG12 VAL 21 -0.179 -0.451 -0.353
124 HG13 VAL 21 HG13 VAL 21 -1.420 -1.054 -1.452
125 HG21 VAL 21 HG21 VAL 21 -0.949 -0.145 2.259
126 HG22 VAL 21 HG22 VAL 21 -2.512 0.628 1.991
127 HG23 VAL 21 HG23 VAL 21 -1.152 0.995 0.929
128 HA PRO 22 HA PRO 22 -4.489 2.972 -2.007
129 HB2 PRO 22 HB2 PRO 22 -4.327 4.493 0.534
130 HB3 PRO 22 HB1 PRO 22 -5.567 4.531 -0.723
131 HG2 PRO 22 HG2 PRO 22 -6.023 3.343 1.624
132 HG3 PRO 22 HG1 PRO 22 -6.660 2.669 0.112
133 HD2 PRO 22 HD2 PRO 22 -4.310 1.791 1.740
134 HD3 PRO 22 HD1 PRO 22 -5.513 0.812 0.874
135 H GLU 23 HN GLU 23 -3.124 4.558 -2.817
136 HA GLU 23 HA GLU 23 -0.393 4.252 -2.572
137 HB2 GLU 23 HB2 GLU 23 -2.018 5.765 -4.148
138 HB3 GLU 23 HB1 GLU 23 -1.260 7.008 -3.163
139 HG2 GLU 23 HG2 GLU 23 0.601 6.887 -4.347
140 HG3 GLU 23 HG1 GLU 23 0.720 5.150 -4.067
141 H ARG 24 HN ARG 24 -2.541 6.390 -0.763
142 HA ARG 24 HA ARG 24 -0.580 7.890 0.573
143 HB2 ARG 24 HB2 ARG 24 -3.098 8.300 0.491
144 HB3 ARG 24 HB1 ARG 24 -3.235 7.096 1.765
145 HG2 ARG 24 HG2 ARG 24 -2.645 8.557 3.327
146 HG3 ARG 24 HG1 ARG 24 -1.238 9.086 2.403
147 HD2 ARG 24 HD2 ARG 24 -2.571 10.629 1.142
148 HD3 ARG 24 HD1 ARG 24 -4.056 10.003 1.858
149 HE ARG 24 HE ARG 24 -3.694 11.347 3.667
150 HH11 ARG 24 HH11 ARG 24 -0.691 11.009 1.922
151 HH12 ARG 24 HH12 ARG 24 0.149 12.171 2.893
152 HH21 ARG 24 HH21 ARG 24 -2.592 12.877 4.945
153 HH22 ARG 24 HH22 ARG 24 -0.930 13.231 4.610
154 H TRP 25 HN TRP 25 -1.785 4.672 1.061
155 HA TRP 25 HA TRP 25 -0.521 4.403 3.666
156 HB2 TRP 25 HB2 TRP 25 -2.214 2.592 1.960
157 HB3 TRP 25 HB1 TRP 25 -1.359 1.981 3.372
158 HD1 TRP 25 HD1 TRP 25 -3.079 5.419 3.319
159 HE1 TRP 25 HE1 TRP 25 -4.996 5.392 5.036
160 HE3 TRP 25 HE3 TRP 25 -2.930 0.479 4.624
161 HZ2 TRP 25 HZ2 TRP 25 -6.275 3.523 6.723
162 HZ3 TRP 25 HZ3 TRP 25 -4.533 -0.349 6.295
163 HH2 TRP 25 HH2 TRP 25 -6.171 1.143 7.323
164 H LEU 26 HN LEU 26 0.127 3.725 0.335
165 HA LEU 26 HA LEU 26 1.920 1.625 0.464
166 HB2 LEU 26 HB2 LEU 26 1.523 3.938 -1.347
167 HB3 LEU 26 HB1 LEU 26 3.051 3.093 -1.476
168 HG LEU 26 HG LEU 26 1.345 2.312 -3.092
169 HD11 LEU 26 HD11 LEU 26 2.889 0.669 -2.855
170 HD12 LEU 26 HD12 LEU 26 1.492 -0.185 -2.197
171 HD13 LEU 26 HD13 LEU 26 2.666 0.556 -1.109
172 HD21 LEU 26 HD21 LEU 26 -0.721 2.431 -2.096
173 HD22 LEU 26 HD22 LEU 26 -0.147 1.760 -0.571
174 HD23 LEU 26 HD23 LEU 26 -0.379 0.708 -1.966
175 H CYS 27 HN CYS 27 3.760 1.361 1.517
176 HA CYS 27 HA CYS 27 5.499 1.854 2.936
177 HB2 CYS 27 HB2 CYS 27 7.305 3.128 1.772
178 HB3 CYS 27 HB1 CYS 27 6.624 1.820 0.814
179 H ASP 28 HN ASP 28 3.598 3.146 4.079
180 HA ASP 28 HA ASP 28 4.381 5.961 4.361
181 HB2 ASP 28 HB2 ASP 28 2.188 6.229 5.493
182 HB3 ASP 28 HB1 ASP 28 2.034 5.630 3.845
183 H GLY 29 HN GLY 29 4.709 2.959 5.880
184 HA2 GLY 29 HA2 GLY 29 6.292 2.967 7.769
185 HA3 GLY 29 HA1 GLY 29 5.357 4.296 8.434
186 H ASP 30 HN ASP 30 3.602 1.748 6.925
187 HA ASP 30 HA ASP 30 3.210 0.291 9.409
188 HB2 ASP 30 HB2 ASP 30 1.239 2.163 8.261
189 HB3 ASP 30 HB1 ASP 30 0.599 0.577 8.679
190 H LYS 31 HN LYS 31 3.832 -1.633 8.588
191 HA LYS 31 HA LYS 31 3.459 -2.574 6.007
192 HB2 LYS 31 HB2 LYS 31 4.106 -3.784 8.622
193 HB3 LYS 31 HB1 LYS 31 3.481 -4.888 7.406
194 HG2 LYS 31 HG2 LYS 31 5.250 -3.933 5.853
195 HG3 LYS 31 HG1 LYS 31 5.958 -3.203 7.294
196 HD2 LYS 31 HD2 LYS 31 7.011 -5.348 6.759
197 HD3 LYS 31 HD1 LYS 31 6.185 -5.399 8.317
198 HE2 LYS 31 HE2 LYS 31 4.377 -6.178 6.230
199 HE3 LYS 31 HE1 LYS 31 5.855 -7.133 6.126
200 HZ1 LYS 31 HZ1 LYS 31 3.800 -7.118 8.174
201 HZ2 LYS 31 HZ2 LYS 31 5.389 -7.221 8.743
202 HZ3 LYS 31 HZ3 LYS 31 4.805 -8.377 7.655
203 H ASP 32 HN ASP 32 1.434 -2.316 5.165
204 HA ASP 32 HA ASP 32 -0.860 -3.443 6.567
205 HB2 ASP 32 HB2 ASP 32 -0.906 -2.136 3.850
206 HB3 ASP 32 HB1 ASP 32 -2.227 -2.304 5.002
207 H CYS 33 HN CYS 33 1.209 -4.067 3.834
208 HA CYS 33 HA CYS 33 -0.438 -6.031 2.597
209 HB2 CYS 33 HB2 CYS 33 2.415 -5.165 2.337
210 HB3 CYS 33 HB1 CYS 33 1.912 -6.680 1.600
211 H ALA 34 HN ALA 34 0.568 -8.316 2.252
212 HA ALA 34 HA ALA 34 0.462 -9.662 4.725
213 HB1 ALA 34 HB1 ALA 34 0.894 -10.418 1.906
214 HB2 ALA 34 HB2 ALA 34 -0.206 -11.091 3.108
215 HB3 ALA 34 HB3 ALA 34 1.497 -11.547 3.119
216 H ASP 35 HN ASP 35 3.181 -9.007 2.530
217 HA ASP 35 HA ASP 35 5.009 -9.638 4.755
218 HB2 ASP 35 HB2 ASP 35 5.329 -10.046 1.783
219 HB3 ASP 35 HB1 ASP 35 6.703 -10.055 2.884
220 H GLY 36 HN GLY 36 3.787 -7.090 4.348
221 HA2 GLY 36 HA2 GLY 36 4.357 -4.866 4.319
222 HA3 GLY 36 HA1 GLY 36 6.004 -5.403 4.609
223 H ALA 37 HN ALA 37 4.147 -6.305 1.781
224 HA ALA 37 HA ALA 37 6.151 -5.621 -0.035
225 HB1 ALA 37 HB1 ALA 37 4.828 -6.781 -1.385
226 HB2 ALA 37 HB2 ALA 37 3.620 -5.497 -1.342
227 HB3 ALA 37 HB3 ALA 37 3.579 -6.787 -0.140
228 H ASP 38 HN ASP 38 3.341 -3.783 1.069
229 HA ASP 38 HA ASP 38 3.515 -1.670 -0.758
230 HB2 ASP 38 HB2 ASP 38 2.342 -0.350 1.103
231 HB3 ASP 38 HB1 ASP 38 1.525 -1.782 0.487
232 H GLU 39 HN GLU 39 5.389 -2.398 2.073
233 HA GLU 39 HA GLU 39 6.583 0.261 2.119
234 HB2 GLU 39 HB2 GLU 39 7.125 -2.146 3.865
235 HB3 GLU 39 HB1 GLU 39 7.766 -0.529 4.114
236 HG2 GLU 39 HG2 GLU 39 4.876 -0.557 3.904
237 HG3 GLU 39 HG1 GLU 39 5.471 -1.568 5.218
238 H SER 40 HN SER 40 6.976 -2.062 0.049
239 HA SER 40 HA SER 40 9.902 -1.784 -0.043
240 HB2 SER 40 HB2 SER 40 8.405 -4.202 0.243
241 HB3 SER 40 HB1 SER 40 9.180 -4.211 -1.340
242 HG SER 40 HG SER 40 10.990 -4.589 -0.368
243 H ILE 41 HN ILE 41 10.744 -2.352 -2.298
244 HA ILE 41 HA ILE 41 9.649 -0.589 -4.169
245 HB ILE 41 HB ILE 41 11.611 -2.849 -4.448
246 HG12 ILE 41 HG12 ILE 41 13.114 -0.860 -4.978
247 HG13 ILE 41 HG11 ILE 41 11.783 0.160 -4.444
248 HG21 ILE 41 HG21 ILE 41 10.918 -2.925 -6.613
249 HG22 ILE 41 HG22 ILE 41 12.031 -1.562 -6.735
250 HG23 ILE 41 HG23 ILE 41 10.297 -1.274 -6.587
251 HD11 ILE 41 HD11 ILE 41 13.666 -0.459 -2.791
252 HD12 ILE 41 HD12 ILE 41 12.817 -2.000 -2.666
253 HD13 ILE 41 HD13 ILE 41 11.989 -0.499 -2.247
254 H ALA 42 HN ALA 42 8.868 -3.874 -3.433
255 HA ALA 42 HA ALA 42 7.798 -4.821 -5.796
256 HB1 ALA 42 HB1 ALA 42 6.342 -5.360 -3.253
257 HB2 ALA 42 HB2 ALA 42 8.016 -5.894 -3.410
258 HB3 ALA 42 HB3 ALA 42 6.797 -6.466 -4.549
259 H ALA 43 HN ALA 43 6.566 -2.379 -3.657
260 HA ALA 43 HA ALA 43 4.008 -2.332 -5.089
261 HB1 ALA 43 HB1 ALA 43 3.049 -1.331 -3.261
262 HB2 ALA 43 HB2 ALA 43 4.561 -0.596 -2.731
263 HB3 ALA 43 HB3 ALA 43 4.286 -2.322 -2.487
264 H GLY 44 HN GLY 44 6.690 -1.286 -6.044
265 HA2 GLY 44 HA2 GLY 44 7.356 0.459 -7.380
266 HA3 GLY 44 HA1 GLY 44 5.703 1.050 -7.315
267 H CYS 45 HN CYS 45 7.260 0.563 -4.296
268 HA CYS 45 HA CYS 45 7.288 3.437 -3.850
269 HB2 CYS 45 HB2 CYS 45 7.251 1.009 -2.142
270 HB3 CYS 45 HB1 CYS 45 8.041 2.432 -1.479
271 H LEU 46 HN LEU 46 9.117 3.791 -5.279
272 HA LEU 46 HA LEU 46 11.683 3.108 -4.002
273 HB2 LEU 46 HB2 LEU 46 12.244 3.841 -6.637
274 HB3 LEU 46 HB1 LEU 46 12.311 2.232 -5.947
275 HG LEU 46 HG LEU 46 9.713 3.267 -7.013
276 HD11 LEU 46 HD11 LEU 46 10.538 1.945 -9.140
277 HD12 LEU 46 HD12 LEU 46 12.117 2.493 -8.577
278 HD13 LEU 46 HD13 LEU 46 10.855 3.669 -8.946
279 HD21 LEU 46 HD21 LEU 46 9.409 1.234 -5.952
280 HD22 LEU 46 HD22 LEU 46 10.975 0.611 -6.472
281 HD23 LEU 46 HD23 LEU 46 9.653 0.750 -7.630
282 H TYR 47 HN TYR 47 9.847 5.437 -3.618
283 HA TYR 47 HA TYR 47 11.076 7.706 -4.815
284 HB2 TYR 47 HB2 TYR 47 9.628 9.024 -3.470
285 HB3 TYR 47 HB1 TYR 47 8.715 7.595 -3.929
286 HD1 TYR 47 HD1 TYR 47 10.275 5.834 -1.782
287 HD2 TYR 47 HD2 TYR 47 8.107 9.494 -1.634
288 HE1 TYR 47 HE1 TYR 47 9.744 5.417 0.580
289 HE2 TYR 47 HE2 TYR 47 7.574 9.087 0.730
290 HH TYR 47 HH TYR 47 7.534 6.458 2.179
291 H ASN 48 HN ASN 48 12.129 5.659 -2.376
292 HA ASN 48 HA ASN 48 13.868 5.731 -0.918
293 HB2 ASN 48 HB2 ASN 48 15.093 6.651 -2.849
294 HB3 ASN 48 HB1 ASN 48 14.588 8.275 -2.390
295 HD21 ASN 48 HD21 ASN 48 16.288 5.435 -1.137
296 HD22 ASN 48 HD22 ASN 48 17.432 6.321 -0.194
297 H SER 49 HN SER 49 13.752 6.184 1.174
298 HA SER 49 HA SER 49 13.624 8.762 2.273
299 HB2 SER 49 HB2 SER 49 11.363 8.890 3.092
300 HB3 SER 49 HB1 SER 49 11.289 8.622 1.351
301 HG SER 49 HG SER 49 10.954 6.676 3.389
302 H THR 50 HN THR 50 12.778 5.363 2.701
303 HA THR 50 HA THR 50 13.141 3.889 4.392
304 HB THR 50 HB THR 50 15.213 3.969 5.486
305 HG1 THR 50 HG1 THR 50 15.334 6.770 5.104
306 HG21 THR 50 HG21 THR 50 16.262 5.782 3.479
307 HG22 THR 50 HG22 THR 50 15.188 4.555 2.807
308 HG23 THR 50 HG23 THR 50 16.595 4.073 3.754
Start of MODEL 15
1 H1 GLY 1 HT1 GLY 1 -18.736 7.548 5.964
2 H2 GLY 1 HT2 GLY 1 -18.737 6.395 4.727
3 H3 GLY 1 HT3 GLY 1 -20.074 7.408 4.939
4 HA2 GLY 1 HA1 GLY 1 -19.143 9.142 3.882
5 HA3 GLY 1 HA2 GLY 1 -17.551 8.772 4.527
6 H SER 2 HN SER 2 -16.546 6.726 3.601
7 HA SER 2 HA SER 2 -17.154 6.565 0.721
8 HB2 SER 2 HB2 SER 2 -14.791 6.303 0.268
9 HB3 SER 2 HB1 SER 2 -15.019 7.756 1.240
10 HG SER 2 HG SER 2 -14.453 6.468 3.082
11 H GLU 3 HN GLU 3 -18.107 4.895 2.967
12 HA GLU 3 HA GLU 3 -18.225 2.721 3.674
13 HB2 GLU 3 HB2 GLU 3 -18.323 1.191 1.473
14 HB3 GLU 3 HB1 GLU 3 -19.645 2.228 1.982
15 HG2 GLU 3 HG2 GLU 3 -17.537 3.112 0.033
16 HG3 GLU 3 HG1 GLU 3 -19.027 2.311 -0.455
17 H GLY 4 HN GLY 4 -16.419 1.700 0.832
18 HA2 GLY 4 HA2 GLY 4 -14.361 0.634 2.656
19 HA3 GLY 4 HA1 GLY 4 -14.799 -0.079 1.111
20 H LYS 5 HN LYS 5 -12.721 2.060 2.733
21 HA LYS 5 HA LYS 5 -11.797 3.296 0.245
22 HB2 LYS 5 HB2 LYS 5 -10.468 4.766 1.686
23 HB3 LYS 5 HB1 LYS 5 -12.165 4.790 2.145
24 HG2 LYS 5 HG2 LYS 5 -11.756 3.442 4.055
25 HG3 LYS 5 HG1 LYS 5 -10.110 3.087 3.527
26 HD2 LYS 5 HD2 LYS 5 -10.756 5.945 3.820
27 HD3 LYS 5 HD1 LYS 5 -10.754 5.012 5.318
28 HE2 LYS 5 HE2 LYS 5 -8.523 4.693 5.270
29 HE3 LYS 5 HE1 LYS 5 -8.484 4.507 3.517
30 HZ1 LYS 5 HZ1 LYS 5 -8.718 7.087 4.971
31 HZ2 LYS 5 HZ2 LYS 5 -8.660 6.902 3.290
32 HZ3 LYS 5 HZ3 LYS 5 -7.314 6.498 4.231
33 H THR 6 HN THR 6 -11.346 0.487 0.724
34 HA THR 6 HA THR 6 -8.709 0.015 1.636
35 HB THR 6 HB THR 6 -9.638 -1.886 -0.369
36 HG1 THR 6 HG1 THR 6 -11.669 -1.788 0.110
37 HG21 THR 6 HG21 THR 6 -9.721 -3.321 1.798
38 HG22 THR 6 HG22 THR 6 -8.846 -1.959 2.498
39 HG23 THR 6 HG23 THR 6 -8.173 -2.825 1.116
40 H CYS 7 HN CYS 7 -9.971 -0.125 -1.703
41 HA CYS 7 HA CYS 7 -7.259 0.371 -2.684
42 HB2 CYS 7 HB2 CYS 7 -9.659 -0.260 -4.391
43 HB3 CYS 7 HB1 CYS 7 -7.957 -0.487 -4.774
44 H GLY 8 HN GLY 8 -10.506 1.411 -3.759
45 HA2 GLY 8 HA2 GLY 8 -11.256 3.443 -4.526
46 HA3 GLY 8 HA1 GLY 8 -10.094 4.158 -3.420
47 HA PRO 9 HA PRO 9 -9.076 5.229 -7.920
48 HB2 PRO 9 HB2 PRO 9 -8.359 7.812 -7.152
49 HB3 PRO 9 HB1 PRO 9 -9.900 7.344 -7.874
50 HG2 PRO 9 HG2 PRO 9 -9.203 7.780 -5.006
51 HG3 PRO 9 HG1 PRO 9 -10.694 8.186 -5.875
52 HD2 PRO 9 HD2 PRO 9 -10.573 6.070 -4.247
53 HD3 PRO 9 HD1 PRO 9 -11.496 6.008 -5.764
54 H SER 10 HN SER 10 -7.104 4.608 -8.508
55 HA SER 10 HA SER 10 -4.857 4.261 -8.538
56 HB2 SER 10 HB2 SER 10 -4.669 6.687 -8.491
57 HB3 SER 10 HB1 SER 10 -4.844 6.694 -6.736
58 HG SER 10 HG SER 10 -2.622 6.732 -7.829
59 H SER 11 HN SER 11 -5.151 2.256 -7.445
60 HA SER 11 HA SER 11 -4.100 2.292 -4.697
61 HB2 SER 11 HB2 SER 11 -5.659 -0.027 -4.896
62 HB3 SER 11 HB1 SER 11 -6.039 1.427 -3.974
63 HG SER 11 HG SER 11 -7.014 0.568 -6.434
64 H PHE 12 HN PHE 12 -3.015 0.304 -4.053
65 HA PHE 12 HA PHE 12 -1.736 -1.013 -6.354
66 HB2 PHE 12 HB2 PHE 12 -0.048 0.135 -5.175
67 HB3 PHE 12 HB1 PHE 12 -0.722 -0.303 -3.610
68 HD1 PHE 12 HD2 PHE 12 0.676 -1.971 -6.647
69 HD2 PHE 12 HD1 PHE 12 0.364 -1.912 -2.405
70 HE1 PHE 12 HE2 PHE 12 2.222 -3.882 -6.510
71 HE2 PHE 12 HE1 PHE 12 1.907 -3.822 -2.259
72 HZ PHE 12 HZ PHE 12 2.840 -4.810 -4.311
73 H SER 13 HN SER 13 -1.288 -3.260 -6.225
74 HA SER 13 HA SER 13 -3.075 -4.700 -4.380
75 HB2 SER 13 HB2 SER 13 -3.897 -5.212 -6.491
76 HB3 SER 13 HB1 SER 13 -2.300 -5.178 -7.234
77 HG SER 13 HG SER 13 -1.993 -7.205 -6.694
78 H CYS 14 HN CYS 14 -2.246 -6.202 -3.052
79 HA CYS 14 HA CYS 14 0.613 -6.433 -2.854
80 HB2 CYS 14 HB2 CYS 14 -1.359 -6.477 -1.016
81 HB3 CYS 14 HB1 CYS 14 -1.106 -8.203 -1.220
82 HA PRO 15 HA PRO 15 1.146 -10.041 -5.375
83 HB2 PRO 15 HB2 PRO 15 3.358 -11.066 -4.092
84 HB3 PRO 15 HB1 PRO 15 3.412 -9.769 -5.289
85 HG2 PRO 15 HG2 PRO 15 3.422 -9.593 -2.301
86 HG3 PRO 15 HG1 PRO 15 4.391 -8.687 -3.479
87 HD2 PRO 15 HD2 PRO 15 2.260 -7.591 -2.310
88 HD3 PRO 15 HD1 PRO 15 2.632 -7.268 -4.014
89 H GLY 16 HN GLY 16 -0.039 -11.835 -5.260
90 HA2 GLY 16 HA2 GLY 16 -0.888 -13.830 -4.492
91 HA3 GLY 16 HA1 GLY 16 0.322 -13.784 -3.219
92 H THR 17 HN THR 17 -2.178 -11.365 -3.828
93 HA THR 17 HA THR 17 -4.103 -12.252 -2.030
94 HB THR 17 HB THR 17 -2.832 -12.054 -0.126
95 HG1 THR 17 HG1 THR 17 -4.425 -10.678 0.377
96 HG21 THR 17 HG21 THR 17 -1.372 -9.784 0.036
97 HG22 THR 17 HG22 THR 17 -1.226 -10.166 -1.680
98 HG23 THR 17 HG23 THR 17 -0.741 -11.352 -0.468
99 H HIS 18 HN HIS 18 -5.800 -10.736 -1.701
100 HA HIS 18 HA HIS 18 -5.863 -8.689 -3.752
101 HB2 HIS 18 HB2 HIS 18 -7.746 -10.381 -3.132
102 HB3 HIS 18 HB1 HIS 18 -8.116 -9.234 -1.847
103 HD1 HIS 18 HD1 HIS 18 -7.040 -8.082 -5.271
104 HD2 HIS 18 HD2 HIS 18 -10.484 -8.402 -2.971
105 HE1 HIS 18 HE1 HIS 18 -8.837 -6.797 -6.502
106 H VAL 19 HN VAL 19 -4.859 -8.749 -0.598
107 HA VAL 19 HA VAL 19 -5.999 -6.507 0.592
108 HB VAL 19 HB VAL 19 -4.587 -8.024 1.851
109 HG11 VAL 19 HG11 VAL 19 -2.865 -7.851 -0.312
110 HG12 VAL 19 HG12 VAL 19 -2.566 -8.698 1.205
111 HG13 VAL 19 HG13 VAL 19 -1.999 -7.041 0.993
112 HG21 VAL 19 HG21 VAL 19 -3.075 -5.444 1.915
113 HG22 VAL 19 HG22 VAL 19 -3.607 -6.465 3.251
114 HG23 VAL 19 HG23 VAL 19 -4.779 -5.483 2.371
115 H CYS 20 HN CYS 20 -6.275 -4.866 -0.949
116 HA CYS 20 HA CYS 20 -3.981 -3.759 -2.309
117 HB2 CYS 20 HB2 CYS 20 -5.544 -2.229 -3.337
118 HB3 CYS 20 HB1 CYS 20 -6.234 -3.847 -3.366
119 H VAL 21 HN VAL 21 -3.496 -1.418 -2.183
120 HA VAL 21 HA VAL 21 -4.155 -0.114 0.328
121 HB VAL 21 HB VAL 21 -2.211 -1.420 0.964
122 HG11 VAL 21 HG11 VAL 21 -0.627 -1.913 -0.501
123 HG12 VAL 21 HG12 VAL 21 -0.125 -0.223 -0.519
124 HG13 VAL 21 HG13 VAL 21 -1.331 -0.797 -1.670
125 HG21 VAL 21 HG21 VAL 21 -1.048 0.262 2.022
126 HG22 VAL 21 HG22 VAL 21 -2.548 1.088 1.599
127 HG23 VAL 21 HG23 VAL 21 -1.101 1.328 0.617
128 HA PRO 22 HA PRO 22 -4.128 3.305 -2.549
129 HB2 PRO 22 HB2 PRO 22 -4.048 4.987 -0.123
130 HB3 PRO 22 HB1 PRO 22 -5.254 4.932 -1.412
131 HG2 PRO 22 HG2 PRO 22 -5.765 3.949 1.028
132 HG3 PRO 22 HG1 PRO 22 -6.409 3.185 -0.437
133 HD2 PRO 22 HD2 PRO 22 -4.089 2.365 1.266
134 HD3 PRO 22 HD1 PRO 22 -5.328 1.360 0.486
135 H GLU 23 HN GLU 23 -2.680 4.880 -3.293
136 HA GLU 23 HA GLU 23 0.025 4.449 -2.906
137 HB2 GLU 23 HB2 GLU 23 -1.465 6.004 -4.589
138 HB3 GLU 23 HB1 GLU 23 -0.668 7.224 -3.605
139 HG2 GLU 23 HG2 GLU 23 1.472 6.497 -4.253
140 HG3 GLU 23 HG1 GLU 23 0.842 4.996 -4.930
141 H ARG 24 HN ARG 24 -2.107 6.765 -1.294
142 HA ARG 24 HA ARG 24 -0.153 8.191 0.120
143 HB2 ARG 24 HB2 ARG 24 -2.491 8.925 -0.052
144 HB3 ARG 24 HB1 ARG 24 -2.997 7.562 0.937
145 HG2 ARG 24 HG2 ARG 24 -2.898 9.065 2.598
146 HG3 ARG 24 HG1 ARG 24 -1.174 8.688 2.572
147 HD2 ARG 24 HD2 ARG 24 -2.314 10.855 0.843
148 HD3 ARG 24 HD1 ARG 24 -1.903 11.161 2.530
149 HE ARG 24 HE ARG 24 0.296 9.949 1.309
150 HH11 ARG 24 HH11 ARG 24 -1.494 12.940 1.135
151 HH12 ARG 24 HH12 ARG 24 -0.129 13.871 0.618
152 HH21 ARG 24 HH21 ARG 24 2.092 11.173 0.627
153 HH22 ARG 24 HH22 ARG 24 1.906 12.869 0.328
154 H TRP 25 HN TRP 25 -1.531 5.049 0.610
155 HA TRP 25 HA TRP 25 -0.442 4.799 3.298
156 HB2 TRP 25 HB2 TRP 25 -2.126 3.019 1.547
157 HB3 TRP 25 HB1 TRP 25 -1.409 2.430 3.043
158 HD1 TRP 25 HD1 TRP 25 -2.832 5.977 2.832
159 HE1 TRP 25 HE1 TRP 25 -4.899 6.123 4.358
160 HE3 TRP 25 HE3 TRP 25 -3.270 1.039 4.077
161 HZ2 TRP 25 HZ2 TRP 25 -6.503 4.374 5.890
162 HZ3 TRP 25 HZ3 TRP 25 -5.096 0.357 5.576
163 HH2 TRP 25 HH2 TRP 25 -6.679 1.991 6.465
164 H LEU 26 HN LEU 26 0.336 3.955 0.028
165 HA LEU 26 HA LEU 26 1.981 1.765 0.296
166 HB2 LEU 26 HB2 LEU 26 1.857 4.069 -1.559
167 HB3 LEU 26 HB1 LEU 26 3.338 3.135 -1.575
168 HG LEU 26 HG LEU 26 1.685 2.438 -3.294
169 HD11 LEU 26 HD11 LEU 26 2.598 0.519 -1.182
170 HD12 LEU 26 HD12 LEU 26 3.277 0.816 -2.782
171 HD13 LEU 26 HD13 LEU 26 1.738 -0.029 -2.620
172 HD21 LEU 26 HD21 LEU 26 -0.147 0.890 -2.182
173 HD22 LEU 26 HD22 LEU 26 -0.436 2.602 -2.483
174 HD23 LEU 26 HD23 LEU 26 0.016 2.054 -0.869
175 H CYS 27 HN CYS 27 3.749 1.373 1.428
176 HA CYS 27 HA CYS 27 5.424 1.743 2.953
177 HB2 CYS 27 HB2 CYS 27 7.368 2.942 1.919
178 HB3 CYS 27 HB1 CYS 27 6.692 1.658 0.926
179 H ASP 28 HN ASP 28 3.630 3.070 4.101
180 HA ASP 28 HA ASP 28 4.524 5.849 4.446
181 HB2 ASP 28 HB2 ASP 28 2.293 6.230 5.460
182 HB3 ASP 28 HB1 ASP 28 2.192 5.661 3.798
183 H GLY 29 HN GLY 29 4.794 2.844 5.860
184 HA2 GLY 29 HA2 GLY 29 6.255 2.842 7.857
185 HA3 GLY 29 HA1 GLY 29 5.176 4.054 8.529
186 H ASP 30 HN ASP 30 2.823 2.588 7.387
187 HA ASP 30 HA ASP 30 2.651 0.567 9.511
188 HB2 ASP 30 HB2 ASP 30 0.706 2.424 8.254
189 HB3 ASP 30 HB1 ASP 30 0.093 0.840 8.719
190 H LYS 31 HN LYS 31 3.263 -1.355 8.706
191 HA LYS 31 HA LYS 31 3.029 -2.186 6.045
192 HB2 LYS 31 HB2 LYS 31 3.676 -3.455 8.622
193 HB3 LYS 31 HB1 LYS 31 3.049 -4.547 7.398
194 HG2 LYS 31 HG2 LYS 31 4.793 -3.776 5.848
195 HG3 LYS 31 HG1 LYS 31 5.441 -2.744 7.123
196 HD2 LYS 31 HD2 LYS 31 6.651 -4.895 6.883
197 HD3 LYS 31 HD1 LYS 31 5.953 -4.655 8.485
198 HE2 LYS 31 HE2 LYS 31 4.175 -6.164 8.027
199 HE3 LYS 31 HE1 LYS 31 4.583 -6.226 6.314
200 HZ1 LYS 31 HZ1 LYS 31 6.864 -7.059 7.389
201 HZ2 LYS 31 HZ2 LYS 31 5.615 -8.107 6.941
202 HZ3 LYS 31 HZ3 LYS 31 5.780 -7.630 8.555
203 H ASP 32 HN ASP 32 0.900 -1.672 5.381
204 HA ASP 32 HA ASP 32 -1.380 -2.876 6.631
205 HB2 ASP 32 HB2 ASP 32 -1.257 -1.707 3.849
206 HB3 ASP 32 HB1 ASP 32 -2.669 -1.867 4.888
207 H CYS 33 HN CYS 33 0.779 -3.688 4.019
208 HA CYS 33 HA CYS 33 -0.818 -5.704 2.824
209 HB2 CYS 33 HB2 CYS 33 1.869 -4.632 2.522
210 HB3 CYS 33 HB1 CYS 33 1.838 -6.380 2.326
211 H ALA 34 HN ALA 34 0.040 -8.033 2.717
212 HA ALA 34 HA ALA 34 -0.094 -9.132 5.342
213 HB1 ALA 34 HB1 ALA 34 0.697 -11.198 3.688
214 HB2 ALA 34 HB2 ALA 34 -0.189 -10.118 2.611
215 HB3 ALA 34 HB3 ALA 34 -0.964 -10.743 4.067
216 H ASP 35 HN ASP 35 2.474 -8.716 2.957
217 HA ASP 35 HA ASP 35 4.425 -9.494 5.024
218 HB2 ASP 35 HB2 ASP 35 4.597 -9.881 2.029
219 HB3 ASP 35 HB1 ASP 35 5.925 -10.176 3.147
220 H GLY 36 HN GLY 36 3.268 -6.853 4.420
221 HA2 GLY 36 HA2 GLY 36 3.994 -4.683 4.319
222 HA3 GLY 36 HA1 GLY 36 5.608 -5.309 4.608
223 H ALA 37 HN ALA 37 3.732 -6.310 1.838
224 HA ALA 37 HA ALA 37 5.723 -5.770 -0.023
225 HB1 ALA 37 HB1 ALA 37 4.247 -6.477 -1.628
226 HB2 ALA 37 HB2 ALA 37 2.876 -5.647 -0.891
227 HB3 ALA 37 HB3 ALA 37 3.484 -7.144 -0.184
228 H ASP 38 HN ASP 38 2.949 -3.791 0.943
229 HA ASP 38 HA ASP 38 3.308 -1.724 -0.919
230 HB2 ASP 38 HB2 ASP 38 2.066 -0.332 0.854
231 HB3 ASP 38 HB1 ASP 38 1.236 -1.731 0.182
232 H GLU 39 HN GLU 39 4.933 -2.451 2.067
233 HA GLU 39 HA GLU 39 6.244 0.155 2.115
234 HB2 GLU 39 HB2 GLU 39 6.559 -2.170 4.017
235 HB3 GLU 39 HB1 GLU 39 7.150 -0.532 4.257
236 HG2 GLU 39 HG2 GLU 39 4.335 -0.492 3.740
237 HG3 GLU 39 HG1 GLU 39 4.694 -1.610 5.054
238 H SER 40 HN SER 40 6.704 -2.208 0.156
239 HA SER 40 HA SER 40 9.634 -2.111 0.345
240 HB2 SER 40 HB2 SER 40 7.923 -4.455 0.426
241 HB3 SER 40 HB1 SER 40 9.063 -4.534 -0.916
242 HG SER 40 HG SER 40 10.745 -4.211 0.563
243 H ILE 41 HN ILE 41 10.616 -2.889 -1.823
244 HA ILE 41 HA ILE 41 9.807 -1.115 -3.837
245 HB ILE 41 HB ILE 41 11.689 -3.443 -3.787
246 HG12 ILE 41 HG12 ILE 41 13.352 -1.708 -4.196
247 HG13 ILE 41 HG11 ILE 41 12.081 -0.506 -4.380
248 HG21 ILE 41 HG21 ILE 41 10.903 -3.683 -5.983
249 HG22 ILE 41 HG22 ILE 41 12.361 -2.702 -6.138
250 HG23 ILE 41 HG23 ILE 41 10.772 -1.940 -6.218
251 HD11 ILE 41 HD11 ILE 41 11.564 -0.544 -2.102
252 HD12 ILE 41 HD12 ILE 41 13.327 -0.572 -2.170
253 HD13 ILE 41 HD13 ILE 41 12.433 -2.057 -1.842
254 H ALA 42 HN ALA 42 8.710 -4.279 -3.030
255 HA ALA 42 HA ALA 42 7.817 -5.299 -5.435
256 HB1 ALA 42 HB1 ALA 42 6.000 -5.576 -3.111
257 HB2 ALA 42 HB2 ALA 42 7.657 -6.149 -2.916
258 HB3 ALA 42 HB3 ALA 42 6.643 -6.804 -4.202
259 H ALA 43 HN ALA 43 6.476 -2.733 -3.484
260 HA ALA 43 HA ALA 43 4.064 -2.573 -5.091
261 HB1 ALA 43 HB1 ALA 43 4.412 -2.103 -2.506
262 HB2 ALA 43 HB2 ALA 43 3.191 -1.254 -3.455
263 HB3 ALA 43 HB3 ALA 43 4.734 -0.475 -3.104
264 H GLY 44 HN GLY 44 7.201 -1.144 -4.962
265 HA2 GLY 44 HA2 GLY 44 8.054 0.042 -6.854
266 HA3 GLY 44 HA1 GLY 44 6.429 0.623 -7.179
267 H CYS 45 HN CYS 45 7.782 0.669 -3.960
268 HA CYS 45 HA CYS 45 7.316 3.465 -3.709
269 HB2 CYS 45 HB2 CYS 45 7.187 1.797 -1.830
270 HB3 CYS 45 HB1 CYS 45 8.944 1.713 -1.860
271 H LEU 46 HN LEU 46 10.385 1.758 -3.134
272 HA LEU 46 HA LEU 46 12.537 2.255 -3.669
273 HB2 LEU 46 HB2 LEU 46 11.407 4.187 -5.691
274 HB3 LEU 46 HB1 LEU 46 13.017 3.493 -5.677
275 HG LEU 46 HG LEU 46 10.624 1.704 -5.895
276 HD11 LEU 46 HD11 LEU 46 10.725 3.690 -7.620
277 HD12 LEU 46 HD12 LEU 46 10.334 2.049 -8.134
278 HD13 LEU 46 HD13 LEU 46 11.965 2.679 -8.363
279 HD21 LEU 46 HD21 LEU 46 12.140 0.189 -6.875
280 HD22 LEU 46 HD22 LEU 46 12.988 0.881 -5.492
281 HD23 LEU 46 HD23 LEU 46 13.355 1.443 -7.123
282 H TYR 47 HN TYR 47 10.881 5.377 -4.178
283 HA TYR 47 HA TYR 47 12.900 6.886 -2.930
284 HB2 TYR 47 HB2 TYR 47 11.362 8.760 -3.056
285 HB3 TYR 47 HB1 TYR 47 11.306 7.834 -4.548
286 HD1 TYR 47 HD1 TYR 47 9.525 5.678 -2.748
287 HD2 TYR 47 HD2 TYR 47 9.218 9.744 -3.967
288 HE1 TYR 47 HE1 TYR 47 7.080 5.542 -2.570
289 HE2 TYR 47 HE2 TYR 47 6.770 9.617 -3.785
290 HH TYR 47 HH TYR 47 5.171 7.024 -2.263
291 H ASN 48 HN ASN 48 13.218 5.641 -0.970
292 HA ASN 48 HA ASN 48 11.820 6.830 1.242
293 HB2 ASN 48 HB2 ASN 48 10.728 4.481 0.289
294 HB3 ASN 48 HB1 ASN 48 11.774 3.923 1.590
295 HD21 ASN 48 HD21 ASN 48 11.184 4.253 3.658
296 HD22 ASN 48 HD22 ASN 48 9.728 5.045 4.142
297 H SER 49 HN SER 49 14.520 6.731 0.218
298 HA SER 49 HA SER 49 15.950 5.115 2.190
299 HB2 SER 49 HB2 SER 49 16.863 6.667 -0.235
300 HB3 SER 49 HB1 SER 49 17.987 5.934 0.908
301 HG SER 49 HG SER 49 16.173 4.695 -0.848
302 H THR 50 HN THR 50 15.267 8.441 1.344
303 HA THR 50 HA THR 50 17.170 9.734 2.928
304 HB THR 50 HB THR 50 15.910 10.993 1.325
305 HG1 THR 50 HG1 THR 50 16.474 12.003 3.404
306 HG21 THR 50 HG21 THR 50 13.634 9.658 2.451
307 HG22 THR 50 HG22 THR 50 13.776 10.566 0.946
308 HG23 THR 50 HG23 THR 50 13.395 11.405 2.450
Start of MODEL 16
1 H1 GLY 1 HT1 GLY 1 -17.583 -0.535 7.271
2 H2 GLY 1 HT2 GLY 1 -18.226 -1.443 5.997
3 H3 GLY 1 HT3 GLY 1 -17.051 -0.266 5.687
4 HA2 GLY 1 HA1 GLY 1 -16.639 -2.755 7.252
5 HA3 GLY 1 HA2 GLY 1 -16.099 -2.490 5.601
6 H SER 2 HN SER 2 -14.376 -1.055 5.202
7 HA SER 2 HA SER 2 -12.839 -0.294 7.599
8 HB2 SER 2 HB2 SER 2 -10.883 -0.650 5.749
9 HB3 SER 2 HB1 SER 2 -11.399 -1.900 6.882
10 HG SER 2 HG SER 2 -12.457 -2.917 5.311
11 H GLU 3 HN GLU 3 -13.592 1.835 7.523
12 HA GLU 3 HA GLU 3 -13.426 4.045 7.009
13 HB2 GLU 3 HB2 GLU 3 -10.998 3.332 6.549
14 HB3 GLU 3 HB1 GLU 3 -11.444 3.361 4.849
15 HG2 GLU 3 HG2 GLU 3 -10.349 5.431 5.617
16 HG3 GLU 3 HG1 GLU 3 -11.963 5.695 4.960
17 H GLY 4 HN GLY 4 -12.893 2.476 3.844
18 HA2 GLY 4 HA2 GLY 4 -14.961 2.248 2.434
19 HA3 GLY 4 HA1 GLY 4 -15.281 3.920 2.871
20 H LYS 5 HN LYS 5 -12.241 2.357 1.918
21 HA LYS 5 HA LYS 5 -12.222 3.985 -0.526
22 HB2 LYS 5 HB2 LYS 5 -9.982 3.762 1.490
23 HB3 LYS 5 HB1 LYS 5 -9.788 4.436 -0.122
24 HG2 LYS 5 HG2 LYS 5 -11.981 5.622 1.404
25 HG3 LYS 5 HG1 LYS 5 -10.387 5.857 2.123
26 HD2 LYS 5 HD2 LYS 5 -9.716 7.248 0.484
27 HD3 LYS 5 HD1 LYS 5 -10.509 6.302 -0.778
28 HE2 LYS 5 HE2 LYS 5 -12.567 7.355 -0.437
29 HE3 LYS 5 HE1 LYS 5 -12.098 7.957 1.152
30 HZ1 LYS 5 HZ1 LYS 5 -10.592 9.499 0.123
31 HZ2 LYS 5 HZ2 LYS 5 -12.125 9.694 -0.566
32 HZ3 LYS 5 HZ3 LYS 5 -10.915 8.870 -1.415
33 H THR 6 HN THR 6 -10.385 1.500 1.242
34 HA THR 6 HA THR 6 -9.292 -0.367 0.556
35 HB THR 6 HB THR 6 -10.608 -1.633 -1.323
36 HG1 THR 6 HG1 THR 6 -12.516 -0.835 -1.836
37 HG21 THR 6 HG21 THR 6 -11.271 -2.766 0.450
38 HG22 THR 6 HG22 THR 6 -12.584 -1.606 0.654
39 HG23 THR 6 HG23 THR 6 -11.050 -1.357 1.487
40 H CYS 7 HN CYS 7 -10.513 0.079 -2.713
41 HA CYS 7 HA CYS 7 -7.742 0.549 -3.583
42 HB2 CYS 7 HB2 CYS 7 -9.889 -0.417 -5.439
43 HB3 CYS 7 HB1 CYS 7 -8.150 -0.657 -5.532
44 H GLY 8 HN GLY 8 -8.148 2.852 -3.096
45 HA2 GLY 8 HA2 GLY 8 -10.073 4.347 -4.556
46 HA3 GLY 8 HA1 GLY 8 -8.671 5.002 -3.724
47 HA PRO 9 HA PRO 9 -8.118 5.780 -8.284
48 HB2 PRO 9 HB2 PRO 9 -6.604 8.044 -7.787
49 HB3 PRO 9 HB1 PRO 9 -8.344 8.037 -8.084
50 HG2 PRO 9 HG2 PRO 9 -6.860 8.146 -5.494
51 HG3 PRO 9 HG1 PRO 9 -8.333 9.006 -5.982
52 HD2 PRO 9 HD2 PRO 9 -8.434 6.866 -4.373
53 HD3 PRO 9 HD1 PRO 9 -9.685 7.160 -5.599
54 H SER 10 HN SER 10 -6.561 4.618 -9.208
55 HA SER 10 HA SER 10 -4.552 3.646 -9.652
56 HB2 SER 10 HB2 SER 10 -3.697 5.912 -9.825
57 HB3 SER 10 HB1 SER 10 -3.522 6.016 -8.073
58 HG SER 10 HG SER 10 -1.958 4.352 -8.212
59 H SER 11 HN SER 11 -5.759 2.207 -7.911
60 HA SER 11 HA SER 11 -4.375 1.979 -5.394
61 HB2 SER 11 HB2 SER 11 -5.850 -0.260 -5.460
62 HB3 SER 11 HB1 SER 11 -6.534 1.313 -5.051
63 HG SER 11 HG SER 11 -7.494 1.420 -6.971
64 H PHE 12 HN PHE 12 -3.038 0.327 -4.725
65 HA PHE 12 HA PHE 12 -1.784 -1.222 -6.887
66 HB2 PHE 12 HB2 PHE 12 -0.084 0.077 -5.959
67 HB3 PHE 12 HB1 PHE 12 -0.744 -0.041 -4.332
68 HD1 PHE 12 HD2 PHE 12 0.747 -2.212 -6.979
69 HD2 PHE 12 HD1 PHE 12 0.302 -1.412 -2.824
70 HE1 PHE 12 HE2 PHE 12 2.328 -4.026 -6.464
71 HE2 PHE 12 HE1 PHE 12 1.879 -3.226 -2.300
72 HZ PHE 12 HZ PHE 12 2.896 -4.535 -4.120
73 H SER 13 HN SER 13 -1.226 -3.416 -6.503
74 HA SER 13 HA SER 13 -2.933 -4.701 -4.481
75 HB2 SER 13 HB2 SER 13 -3.648 -5.600 -6.484
76 HB3 SER 13 HB1 SER 13 -2.056 -5.483 -7.228
77 HG SER 13 HG SER 13 -2.826 -7.656 -6.626
78 H CYS 14 HN CYS 14 -2.010 -5.737 -2.840
79 HA CYS 14 HA CYS 14 0.839 -5.812 -2.595
80 HB2 CYS 14 HB2 CYS 14 -1.031 -7.269 -0.752
81 HB3 CYS 14 HB1 CYS 14 0.497 -6.490 -0.378
82 HA PRO 15 HA PRO 15 1.537 -9.836 -4.311
83 HB2 PRO 15 HB2 PRO 15 3.936 -10.393 -3.198
84 HB3 PRO 15 HB1 PRO 15 3.742 -9.186 -4.475
85 HG2 PRO 15 HG2 PRO 15 3.957 -8.793 -1.513
86 HG3 PRO 15 HG1 PRO 15 4.744 -7.888 -2.820
87 HD2 PRO 15 HD2 PRO 15 2.534 -6.988 -1.541
88 HD3 PRO 15 HD1 PRO 15 2.869 -6.624 -3.244
89 H GLY 16 HN GLY 16 1.268 -11.977 -3.797
90 HA2 GLY 16 HA2 GLY 16 0.773 -13.833 -2.540
91 HA3 GLY 16 HA1 GLY 16 1.694 -13.097 -1.238
92 H THR 17 HN THR 17 -1.162 -11.705 -2.756
93 HA THR 17 HA THR 17 -3.102 -12.614 -0.970
94 HB THR 17 HB THR 17 -1.980 -11.533 0.824
95 HG1 THR 17 HG1 THR 17 -4.153 -11.093 0.918
96 HG21 THR 17 HG21 THR 17 -0.474 -10.075 -0.363
97 HG22 THR 17 HG22 THR 17 -1.401 -9.151 0.818
98 HG23 THR 17 HG23 THR 17 -1.822 -9.070 -0.893
99 H HIS 18 HN HIS 18 -5.022 -10.972 -0.874
100 HA HIS 18 HA HIS 18 -5.229 -9.730 -3.537
101 HB2 HIS 18 HB2 HIS 18 -7.149 -11.325 -1.904
102 HB3 HIS 18 HB1 HIS 18 -7.797 -10.056 -2.940
103 HD1 HIS 18 HD1 HIS 18 -4.824 -12.031 -4.091
104 HD2 HIS 18 HD2 HIS 18 -8.939 -11.927 -4.652
105 HE1 HIS 18 HE1 HIS 18 -5.307 -13.519 -6.078
106 H VAL 19 HN VAL 19 -4.213 -8.461 -1.120
107 HA VAL 19 HA VAL 19 -6.329 -6.588 -0.382
108 HB VAL 19 HB VAL 19 -5.109 -7.284 1.512
109 HG11 VAL 19 HG11 VAL 19 -2.462 -6.638 1.280
110 HG12 VAL 19 HG12 VAL 19 -2.846 -7.259 -0.325
111 HG13 VAL 19 HG13 VAL 19 -3.143 -8.255 1.099
112 HG21 VAL 19 HG21 VAL 19 -5.200 -4.628 0.821
113 HG22 VAL 19 HG22 VAL 19 -3.510 -4.853 1.273
114 HG23 VAL 19 HG23 VAL 19 -4.791 -5.261 2.415
115 H CYS 20 HN CYS 20 -6.448 -4.542 -1.093
116 HA CYS 20 HA CYS 20 -4.333 -3.625 -2.920
117 HB2 CYS 20 HB2 CYS 20 -5.976 -2.379 -4.115
118 HB3 CYS 20 HB1 CYS 20 -6.656 -3.981 -3.855
119 H VAL 21 HN VAL 21 -4.053 -1.235 -3.029
120 HA VAL 21 HA VAL 21 -4.766 0.255 -0.649
121 HB VAL 21 HB VAL 21 -2.768 -0.827 0.152
122 HG11 VAL 21 HG11 VAL 21 -0.641 0.053 -1.336
123 HG12 VAL 21 HG12 VAL 21 -1.842 -0.341 -2.566
124 HG13 VAL 21 HG13 VAL 21 -1.343 -1.564 -1.398
125 HG21 VAL 21 HG21 VAL 21 -2.233 2.033 -0.640
126 HG22 VAL 21 HG22 VAL 21 -1.315 1.131 0.566
127 HG23 VAL 21 HG23 VAL 21 -3.024 1.473 0.833
128 HA PRO 22 HA PRO 22 -4.759 3.378 -3.823
129 HB2 PRO 22 HB2 PRO 22 -5.208 5.542 -2.261
130 HB3 PRO 22 HB1 PRO 22 -6.472 4.364 -2.637
131 HG2 PRO 22 HG2 PRO 22 -4.797 4.625 -0.173
132 HG3 PRO 22 HG1 PRO 22 -6.531 4.282 -0.317
133 HD2 PRO 22 HD2 PRO 22 -4.664 2.354 0.142
134 HD3 PRO 22 HD1 PRO 22 -6.180 2.047 -0.726
135 H GLU 23 HN GLU 23 -3.356 4.918 -4.666
136 HA GLU 23 HA GLU 23 -0.682 4.796 -4.058
137 HB2 GLU 23 HB2 GLU 23 -2.327 6.302 -5.820
138 HB3 GLU 23 HB1 GLU 23 -1.214 7.424 -5.050
139 HG2 GLU 23 HG2 GLU 23 0.514 5.496 -5.683
140 HG3 GLU 23 HG1 GLU 23 -0.687 5.220 -6.944
141 H ARG 24 HN ARG 24 -3.096 7.024 -2.757
142 HA ARG 24 HA ARG 24 -1.322 8.727 -1.397
143 HB2 ARG 24 HB2 ARG 24 -3.188 9.781 -0.691
144 HB3 ARG 24 HB1 ARG 24 -4.006 8.715 -1.819
145 HG2 ARG 24 HG2 ARG 24 -5.298 8.371 0.009
146 HG3 ARG 24 HG1 ARG 24 -4.080 7.130 0.305
147 HD2 ARG 24 HD2 ARG 24 -2.944 8.488 1.876
148 HD3 ARG 24 HD1 ARG 24 -3.846 9.924 1.394
149 HE ARG 24 HE ARG 24 -5.773 8.245 2.291
150 HH11 ARG 24 HH11 ARG 24 -2.780 9.409 3.658
151 HH12 ARG 24 HH12 ARG 24 -3.350 9.331 5.292
152 HH21 ARG 24 HH21 ARG 24 -6.525 8.142 4.440
153 HH22 ARG 24 HH22 ARG 24 -5.476 8.611 5.736
154 H TRP 25 HN TRP 25 -2.525 5.559 -0.671
155 HA TRP 25 HA TRP 25 -1.614 5.638 2.088
156 HB2 TRP 25 HB2 TRP 25 -3.046 3.620 0.389
157 HB3 TRP 25 HB1 TRP 25 -2.276 3.114 1.888
158 HD1 TRP 25 HD1 TRP 25 -3.623 6.532 2.296
159 HE1 TRP 25 HE1 TRP 25 -5.859 6.476 3.570
160 HE3 TRP 25 HE3 TRP 25 -4.573 1.515 2.054
161 HZ2 TRP 25 HZ2 TRP 25 -7.769 4.560 4.369
162 HZ3 TRP 25 HZ3 TRP 25 -6.625 0.652 3.099
163 HH2 TRP 25 HH2 TRP 25 -8.190 2.144 4.234
164 H LEU 26 HN LEU 26 -0.501 4.616 -1.029
165 HA LEU 26 HA LEU 26 1.353 2.657 -0.402
166 HB2 LEU 26 HB2 LEU 26 1.108 4.700 -2.544
167 HB3 LEU 26 HB1 LEU 26 2.650 3.886 -2.382
168 HG LEU 26 HG LEU 26 1.128 2.866 -4.065
169 HD11 LEU 26 HD11 LEU 26 1.387 0.751 -2.040
170 HD12 LEU 26 HD12 LEU 26 2.858 1.660 -2.388
171 HD13 LEU 26 HD13 LEU 26 2.004 0.832 -3.690
172 HD21 LEU 26 HD21 LEU 26 -1.026 3.036 -3.268
173 HD22 LEU 26 HD22 LEU 26 -0.582 2.527 -1.640
174 HD23 LEU 26 HD23 LEU 26 -0.656 1.345 -2.944
175 H CYS 27 HN CYS 27 3.086 2.643 0.853
176 HA CYS 27 HA CYS 27 4.594 3.439 2.398
177 HB2 CYS 27 HB2 CYS 27 6.327 4.978 1.083
178 HB3 CYS 27 HB1 CYS 27 6.228 3.243 0.819
179 H ASP 28 HN ASP 28 2.478 4.781 3.047
180 HA ASP 28 HA ASP 28 3.106 7.643 3.009
181 HB2 ASP 28 HB2 ASP 28 0.797 7.953 3.813
182 HB3 ASP 28 HB1 ASP 28 0.844 7.033 2.314
183 H GLY 29 HN GLY 29 3.364 4.912 5.001
184 HA2 GLY 29 HA2 GLY 29 4.741 5.282 7.013
185 HA3 GLY 29 HA1 GLY 29 3.696 6.647 7.368
186 H ASP 30 HN ASP 30 2.170 3.842 6.099
187 HA ASP 30 HA ASP 30 1.621 2.680 8.693
188 HB2 ASP 30 HB2 ASP 30 -0.258 4.471 7.335
189 HB3 ASP 30 HB1 ASP 30 -0.956 2.906 7.739
190 H LYS 31 HN LYS 31 2.077 0.626 8.241
191 HA LYS 31 HA LYS 31 2.000 -0.600 5.753
192 HB2 LYS 31 HB2 LYS 31 2.146 -1.536 8.559
193 HB3 LYS 31 HB1 LYS 31 1.673 -2.730 7.361
194 HG2 LYS 31 HG2 LYS 31 3.726 -2.069 6.060
195 HG3 LYS 31 HG1 LYS 31 4.217 -1.142 7.478
196 HD2 LYS 31 HD2 LYS 31 5.250 -3.362 7.448
197 HD3 LYS 31 HD1 LYS 31 4.178 -3.161 8.834
198 HE2 LYS 31 HE2 LYS 31 2.690 -4.211 6.627
199 HE3 LYS 31 HE1 LYS 31 4.135 -5.190 6.874
200 HZ1 LYS 31 HZ1 LYS 31 2.150 -5.905 8.168
201 HZ2 LYS 31 HZ2 LYS 31 2.258 -4.468 9.053
202 HZ3 LYS 31 HZ3 LYS 31 3.518 -5.594 9.114
203 H ASP 32 HN ASP 32 0.107 -0.237 4.637
204 HA ASP 32 HA ASP 32 -2.427 -1.074 5.795
205 HB2 ASP 32 HB2 ASP 32 -2.065 -0.145 2.958
206 HB3 ASP 32 HB1 ASP 32 -3.479 0.005 3.996
207 H CYS 33 HN CYS 33 -0.071 -2.154 3.459
208 HA CYS 33 HA CYS 33 -1.658 -4.103 2.166
209 HB2 CYS 33 HB2 CYS 33 1.203 -3.400 2.302
210 HB3 CYS 33 HB1 CYS 33 0.872 -5.090 1.942
211 H ALA 34 HN ALA 34 -0.517 -6.499 2.281
212 HA ALA 34 HA ALA 34 -1.419 -7.533 4.790
213 HB1 ALA 34 HB1 ALA 34 -0.609 -9.728 3.815
214 HB2 ALA 34 HB2 ALA 34 -0.173 -8.813 2.372
215 HB3 ALA 34 HB3 ALA 34 -1.854 -8.877 2.900
216 H ASP 35 HN ASP 35 1.745 -7.418 3.169
217 HA ASP 35 HA ASP 35 3.005 -7.848 5.799
218 HB2 ASP 35 HB2 ASP 35 3.259 -9.493 3.641
219 HB3 ASP 35 HB1 ASP 35 4.628 -8.413 3.400
220 H GLY 36 HN GLY 36 2.190 -5.309 4.699
221 HA2 GLY 36 HA2 GLY 36 3.028 -3.175 4.570
222 HA3 GLY 36 HA1 GLY 36 4.543 -3.823 5.178
223 H ALA 37 HN ALA 37 3.105 -5.036 2.246
224 HA ALA 37 HA ALA 37 5.411 -4.693 0.710
225 HB1 ALA 37 HB1 ALA 37 2.775 -5.721 0.326
226 HB2 ALA 37 HB2 ALA 37 4.246 -6.066 -0.585
227 HB3 ALA 37 HB3 ALA 37 3.212 -4.717 -1.057
228 H ASP 38 HN ASP 38 2.524 -2.664 0.995
229 HA ASP 38 HA ASP 38 3.034 -0.846 -1.037
230 HB2 ASP 38 HB2 ASP 38 1.686 0.761 0.332
231 HB3 ASP 38 HB1 ASP 38 0.924 -0.810 0.113
232 H GLU 39 HN GLU 39 4.539 -1.187 2.076
233 HA GLU 39 HA GLU 39 5.908 1.379 1.826
234 HB2 GLU 39 HB2 GLU 39 6.202 -0.655 4.034
235 HB3 GLU 39 HB1 GLU 39 6.648 1.044 4.074
236 HG2 GLU 39 HG2 GLU 39 3.876 0.818 3.444
237 HG3 GLU 39 HG1 GLU 39 4.229 -0.145 4.877
238 H SER 40 HN SER 40 6.385 -1.145 0.153
239 HA SER 40 HA SER 40 9.300 -1.201 0.537
240 HB2 SER 40 HB2 SER 40 7.634 -3.362 0.970
241 HB3 SER 40 HB1 SER 40 8.201 -3.626 -0.678
242 HG SER 40 HG SER 40 10.078 -4.139 0.096
243 H ILE 41 HN ILE 41 9.922 -2.761 -1.677
244 HA ILE 41 HA ILE 41 9.622 -0.822 -3.784
245 HB ILE 41 HB ILE 41 11.003 -3.503 -3.789
246 HG12 ILE 41 HG12 ILE 41 12.062 -2.024 -2.216
247 HG13 ILE 41 HG11 ILE 41 13.071 -2.105 -3.655
248 HG21 ILE 41 HG21 ILE 41 11.132 -1.247 -5.781
249 HG22 ILE 41 HG22 ILE 41 10.398 -2.831 -6.039
250 HG23 ILE 41 HG23 ILE 41 12.142 -2.693 -5.805
251 HD11 ILE 41 HD11 ILE 41 13.078 0.107 -3.634
252 HD12 ILE 41 HD12 ILE 41 11.804 0.166 -2.415
253 HD13 ILE 41 HD13 ILE 41 11.385 0.038 -4.123
254 H ALA 42 HN ALA 42 8.237 -3.899 -2.937
255 HA ALA 42 HA ALA 42 7.300 -4.846 -5.345
256 HB1 ALA 42 HB1 ALA 42 7.085 -5.802 -2.944
257 HB2 ALA 42 HB2 ALA 42 5.849 -6.188 -4.142
258 HB3 ALA 42 HB3 ALA 42 5.544 -4.945 -2.927
259 H ALA 43 HN ALA 43 6.099 -2.173 -3.439
260 HA ALA 43 HA ALA 43 3.705 -1.890 -5.046
261 HB1 ALA 43 HB1 ALA 43 4.183 0.384 -3.384
262 HB2 ALA 43 HB2 ALA 43 4.495 -1.090 -2.466
263 HB3 ALA 43 HB3 ALA 43 2.933 -0.853 -3.248
264 H GLY 44 HN GLY 44 6.941 -0.737 -5.083
265 HA2 GLY 44 HA2 GLY 44 7.758 0.286 -7.108
266 HA3 GLY 44 HA1 GLY 44 6.210 1.100 -7.266
267 H CYS 45 HN CYS 45 7.639 0.983 -4.128
268 HA CYS 45 HA CYS 45 8.138 3.864 -4.293
269 HB2 CYS 45 HB2 CYS 45 6.794 2.409 -2.419
270 HB3 CYS 45 HB1 CYS 45 8.381 2.543 -1.671
271 H LEU 46 HN LEU 46 10.101 3.306 -5.561
272 HA LEU 46 HA LEU 46 12.304 2.076 -4.192
273 HB2 LEU 46 HB2 LEU 46 12.520 3.760 -6.668
274 HB3 LEU 46 HB1 LEU 46 13.537 2.422 -6.167
275 HG LEU 46 HG LEU 46 10.715 1.710 -6.615
276 HD11 LEU 46 HD11 LEU 46 12.384 2.958 -8.741
277 HD12 LEU 46 HD12 LEU 46 10.644 3.048 -8.472
278 HD13 LEU 46 HD13 LEU 46 11.355 1.588 -9.158
279 HD21 LEU 46 HD21 LEU 46 11.672 -0.248 -7.565
280 HD22 LEU 46 HD22 LEU 46 12.611 0.141 -6.123
281 HD23 LEU 46 HD23 LEU 46 13.251 0.522 -7.722
282 H TYR 47 HN TYR 47 12.265 3.465 -2.295
283 HA TYR 47 HA TYR 47 13.452 6.117 -2.755
284 HB2 TYR 47 HB2 TYR 47 11.839 4.990 -0.474
285 HB3 TYR 47 HB1 TYR 47 12.791 6.458 -0.296
286 HD1 TYR 47 HD1 TYR 47 10.508 5.119 -2.931
287 HD2 TYR 47 HD2 TYR 47 11.487 8.351 -0.349
288 HE1 TYR 47 HE1 TYR 47 8.655 6.425 -3.876
289 HE2 TYR 47 HE2 TYR 47 9.634 9.669 -1.285
290 HH TYR 47 HH TYR 47 7.946 8.713 -4.114
291 H ASN 48 HN ASN 48 14.013 2.986 -1.417
292 HA ASN 48 HA ASN 48 15.848 2.013 -0.495
293 HB2 ASN 48 HB2 ASN 48 17.277 4.551 -1.317
294 HB3 ASN 48 HB1 ASN 48 18.037 3.023 -0.884
295 HD21 ASN 48 HD21 ASN 48 16.908 1.130 -2.198
296 HD22 ASN 48 HD22 ASN 48 16.881 1.399 -3.904
297 H SER 49 HN SER 49 14.743 2.243 1.551
298 HA SER 49 HA SER 49 16.379 3.598 3.487
299 HB2 SER 49 HB2 SER 49 14.213 4.701 4.478
300 HB3 SER 49 HB1 SER 49 15.096 5.512 3.185
301 HG SER 49 HG SER 49 12.944 3.749 2.675
302 H THR 50 HN THR 50 16.285 2.627 5.459
303 HA THR 50 HA THR 50 14.635 0.232 5.640
304 HB THR 50 HB THR 50 16.699 1.130 7.643
305 HG1 THR 50 HG1 THR 50 18.206 -0.036 6.417
306 HG21 THR 50 HG21 THR 50 16.633 -0.932 8.498
307 HG22 THR 50 HG22 THR 50 16.452 -1.693 6.917
308 HG23 THR 50 HG23 THR 50 15.046 -1.009 7.732
Start of MODEL 17
1 H1 GLY 1 HT1 GLY 1 -9.812 3.068 10.266
2 H2 GLY 1 HT2 GLY 1 -8.205 3.271 9.778
3 H3 GLY 1 HT3 GLY 1 -9.355 2.691 8.681
4 HA2 GLY 1 HA1 GLY 1 -9.787 5.313 9.926
5 HA3 GLY 1 HA2 GLY 1 -8.612 5.179 8.627
6 H SER 2 HN SER 2 -11.288 6.519 8.831
7 HA SER 2 HA SER 2 -13.088 6.925 7.502
8 HB2 SER 2 HB2 SER 2 -12.785 6.735 5.191
9 HB3 SER 2 HB1 SER 2 -11.129 6.795 5.795
10 HG SER 2 HG SER 2 -11.005 4.564 5.578
11 H GLU 3 HN GLU 3 -14.480 5.498 5.646
12 HA GLU 3 HA GLU 3 -15.001 2.864 6.802
13 HB2 GLU 3 HB2 GLU 3 -17.402 3.295 6.963
14 HB3 GLU 3 HB1 GLU 3 -16.498 4.399 7.989
15 HG2 GLU 3 HG2 GLU 3 -17.348 5.189 5.231
16 HG3 GLU 3 HG1 GLU 3 -18.440 5.328 6.608
17 H GLY 4 HN GLY 4 -13.839 3.772 4.291
18 HA2 GLY 4 HA2 GLY 4 -14.934 1.990 2.505
19 HA3 GLY 4 HA1 GLY 4 -15.787 3.498 2.216
20 H LYS 5 HN LYS 5 -13.014 1.684 1.551
21 HA LYS 5 HA LYS 5 -12.105 3.417 -0.451
22 HB2 LYS 5 HB2 LYS 5 -11.342 4.376 1.998
23 HB3 LYS 5 HB1 LYS 5 -9.947 3.406 1.546
24 HG2 LYS 5 HG2 LYS 5 -9.962 4.649 -0.656
25 HG3 LYS 5 HG1 LYS 5 -11.126 5.748 0.085
26 HD2 LYS 5 HD2 LYS 5 -8.820 5.282 1.788
27 HD3 LYS 5 HD1 LYS 5 -8.365 5.938 0.214
28 HE2 LYS 5 HE2 LYS 5 -9.282 7.942 0.647
29 HE3 LYS 5 HE1 LYS 5 -10.688 7.235 1.442
30 HZ1 LYS 5 HZ1 LYS 5 -9.703 7.315 3.463
31 HZ2 LYS 5 HZ2 LYS 5 -8.866 8.602 2.754
32 HZ3 LYS 5 HZ3 LYS 5 -8.141 7.078 2.856
33 H THR 6 HN THR 6 -10.274 1.508 1.933
34 HA THR 6 HA THR 6 -8.952 -0.323 1.732
35 HB THR 6 HB THR 6 -10.018 -1.712 -0.482
36 HG1 THR 6 HG1 THR 6 -11.873 -0.715 -0.679
37 HG21 THR 6 HG21 THR 6 -11.364 -2.799 1.556
38 HG22 THR 6 HG22 THR 6 -10.103 -1.951 2.449
39 HG23 THR 6 HG23 THR 6 -9.667 -3.135 1.217
40 H CYS 7 HN CYS 7 -9.798 -0.159 -1.704
41 HA CYS 7 HA CYS 7 -6.946 0.280 -2.288
42 HB2 CYS 7 HB2 CYS 7 -9.012 -0.976 -4.100
43 HB3 CYS 7 HB1 CYS 7 -7.271 -0.917 -4.353
44 H GLY 8 HN GLY 8 -10.238 1.146 -3.280
45 HA2 GLY 8 HA2 GLY 8 -11.048 2.978 -4.407
46 HA3 GLY 8 HA1 GLY 8 -9.640 3.827 -3.790
47 HA PRO 9 HA PRO 9 -9.519 3.583 -8.502
48 HB2 PRO 9 HB2 PRO 9 -8.814 6.231 -8.762
49 HB3 PRO 9 HB1 PRO 9 -10.472 5.628 -8.842
50 HG2 PRO 9 HG2 PRO 9 -9.014 6.865 -6.542
51 HG3 PRO 9 HG1 PRO 9 -10.685 7.124 -7.079
52 HD2 PRO 9 HD2 PRO 9 -10.120 5.560 -4.981
53 HD3 PRO 9 HD1 PRO 9 -11.432 5.154 -6.109
54 H SER 10 HN SER 10 -7.661 3.235 -9.609
55 HA SER 10 HA SER 10 -5.449 2.777 -9.916
56 HB2 SER 10 HB2 SER 10 -3.934 4.800 -9.304
57 HB3 SER 10 HB1 SER 10 -5.162 5.009 -10.552
58 HG SER 10 HG SER 10 -5.141 6.713 -8.996
59 H SER 11 HN SER 11 -5.560 1.090 -8.281
60 HA SER 11 HA SER 11 -4.016 1.770 -5.863
61 HB2 SER 11 HB2 SER 11 -5.179 0.047 -4.665
62 HB3 SER 11 HB1 SER 11 -6.393 1.040 -5.470
63 HG SER 11 HG SER 11 -7.049 -0.741 -6.348
64 H PHE 12 HN PHE 12 -2.619 0.081 -5.033
65 HA PHE 12 HA PHE 12 -1.304 -1.362 -7.204
66 HB2 PHE 12 HB2 PHE 12 0.306 -0.202 -5.986
67 HB3 PHE 12 HB1 PHE 12 -0.507 -0.485 -4.451
68 HD1 PHE 12 HD2 PHE 12 1.238 -2.371 -7.158
69 HD2 PHE 12 HD1 PHE 12 0.375 -2.026 -3.005
70 HE1 PHE 12 HE2 PHE 12 2.761 -4.246 -6.690
71 HE2 PHE 12 HE1 PHE 12 1.897 -3.901 -2.530
72 HZ PHE 12 HZ PHE 12 3.092 -5.014 -4.372
73 H SER 13 HN SER 13 -0.752 -3.596 -7.014
74 HA SER 13 HA SER 13 -2.640 -5.092 -5.329
75 HB2 SER 13 HB2 SER 13 -3.166 -5.906 -7.385
76 HB3 SER 13 HB1 SER 13 -1.604 -5.465 -8.072
77 HG SER 13 HG SER 13 -1.232 -7.532 -7.932
78 H CYS 14 HN CYS 14 -1.859 -6.193 -3.666
79 HA CYS 14 HA CYS 14 0.959 -6.359 -3.200
80 HB2 CYS 14 HB2 CYS 14 -0.947 -6.091 -1.473
81 HB3 CYS 14 HB1 CYS 14 -1.116 -7.836 -1.602
82 HA PRO 15 HA PRO 15 1.712 -10.247 -5.215
83 HB2 PRO 15 HB2 PRO 15 3.988 -10.937 -3.871
84 HB3 PRO 15 HB1 PRO 15 3.949 -9.747 -5.176
85 HG2 PRO 15 HG2 PRO 15 3.913 -9.309 -2.211
86 HG3 PRO 15 HG1 PRO 15 4.852 -8.459 -3.454
87 HD2 PRO 15 HD2 PRO 15 2.626 -7.401 -2.419
88 HD3 PRO 15 HD1 PRO 15 3.033 -7.191 -4.132
89 H GLY 16 HN GLY 16 0.804 -12.174 -4.857
90 HA2 GLY 16 HA2 GLY 16 0.600 -14.224 -3.677
91 HA3 GLY 16 HA1 GLY 16 1.003 -13.378 -2.192
92 H THR 17 HN THR 17 -0.819 -11.275 -2.299
93 HA THR 17 HA THR 17 -3.375 -12.726 -2.085
94 HB THR 17 HB THR 17 -2.960 -12.122 0.102
95 HG1 THR 17 HG1 THR 17 -4.409 -10.587 0.559
96 HG21 THR 17 HG21 THR 17 -1.803 -9.498 -0.800
97 HG22 THR 17 HG22 THR 17 -0.882 -10.901 -0.260
98 HG23 THR 17 HG23 THR 17 -1.948 -10.059 0.865
99 H HIS 18 HN HIS 18 -5.327 -11.416 -2.428
100 HA HIS 18 HA HIS 18 -5.016 -9.780 -4.788
101 HB2 HIS 18 HB2 HIS 18 -7.429 -9.866 -4.953
102 HB3 HIS 18 HB1 HIS 18 -6.817 -11.480 -4.600
103 HD1 HIS 18 HD1 HIS 18 -6.550 -10.194 -1.426
104 HD2 HIS 18 HD2 HIS 18 -9.847 -11.010 -3.818
105 HE1 HIS 18 HE1 HIS 18 -8.518 -10.450 0.140
106 H VAL 19 HN VAL 19 -4.761 -9.090 -1.590
107 HA VAL 19 HA VAL 19 -6.365 -6.804 -1.252
108 HB VAL 19 HB VAL 19 -5.345 -7.887 0.659
109 HG11 VAL 19 HG11 VAL 19 -3.220 -8.531 0.732
110 HG12 VAL 19 HG12 VAL 19 -2.649 -6.893 0.413
111 HG13 VAL 19 HG13 VAL 19 -3.054 -7.963 -0.929
112 HG21 VAL 19 HG21 VAL 19 -4.625 -5.965 1.874
113 HG22 VAL 19 HG22 VAL 19 -5.836 -5.427 0.710
114 HG23 VAL 19 HG23 VAL 19 -4.124 -5.144 0.395
115 H CYS 20 HN CYS 20 -6.132 -4.732 -1.875
116 HA CYS 20 HA CYS 20 -3.605 -3.978 -3.180
117 HB2 CYS 20 HB2 CYS 20 -5.262 -2.398 -4.528
118 HB3 CYS 20 HB1 CYS 20 -4.926 -4.043 -5.050
119 H VAL 21 HN VAL 21 -3.022 -1.756 -3.086
120 HA VAL 21 HA VAL 21 -4.416 -0.196 -1.020
121 HB VAL 21 HB VAL 21 -2.525 -1.118 0.111
122 HG11 VAL 21 HG11 VAL 21 -0.243 -0.175 -1.158
123 HG12 VAL 21 HG12 VAL 21 -1.247 -0.816 -2.459
124 HG13 VAL 21 HG13 VAL 21 -0.811 -1.844 -1.095
125 HG21 VAL 21 HG21 VAL 21 -2.950 1.214 0.615
126 HG22 VAL 21 HG22 VAL 21 -1.912 1.714 -0.722
127 HG23 VAL 21 HG23 VAL 21 -1.218 0.887 0.671
128 HA PRO 22 HA PRO 22 -4.245 3.041 -4.061
129 HB2 PRO 22 HB2 PRO 22 -4.321 4.956 -1.830
130 HB3 PRO 22 HB1 PRO 22 -5.500 4.686 -3.115
131 HG2 PRO 22 HG2 PRO 22 -5.969 3.966 -0.561
132 HG3 PRO 22 HG1 PRO 22 -6.607 3.050 -1.937
133 HD2 PRO 22 HD2 PRO 22 -4.272 2.444 -0.173
134 HD3 PRO 22 HD1 PRO 22 -5.480 1.344 -0.866
135 H GLU 23 HN GLU 23 -2.753 4.450 -4.939
136 HA GLU 23 HA GLU 23 -0.076 4.197 -4.319
137 HB2 GLU 23 HB2 GLU 23 -1.646 5.706 -6.152
138 HB3 GLU 23 HB1 GLU 23 -0.469 6.796 -5.434
139 HG2 GLU 23 HG2 GLU 23 1.337 5.581 -6.248
140 HG3 GLU 23 HG1 GLU 23 0.361 4.139 -6.527
141 H ARG 24 HN ARG 24 -2.370 6.648 -3.206
142 HA ARG 24 HA ARG 24 -0.546 8.316 -1.879
143 HB2 ARG 24 HB2 ARG 24 -2.916 8.892 -2.377
144 HB3 ARG 24 HB1 ARG 24 -3.423 7.769 -1.122
145 HG2 ARG 24 HG2 ARG 24 -1.532 9.492 0.055
146 HG3 ARG 24 HG1 ARG 24 -2.629 10.502 -0.890
147 HD2 ARG 24 HD2 ARG 24 -3.274 8.627 1.365
148 HD3 ARG 24 HD1 ARG 24 -3.618 10.351 1.235
149 HE ARG 24 HE ARG 24 -5.238 8.209 0.290
150 HH11 ARG 24 HH11 ARG 24 -4.296 11.499 -0.392
151 HH12 ARG 24 HH12 ARG 24 -5.754 11.872 -1.248
152 HH21 ARG 24 HH21 ARG 24 -7.157 8.697 -0.834
153 HH22 ARG 24 HH22 ARG 24 -7.380 10.281 -1.498
154 H TRP 25 HN TRP 25 -1.931 5.254 -1.026
155 HA TRP 25 HA TRP 25 -1.071 5.440 1.748
156 HB2 TRP 25 HB2 TRP 25 -2.574 3.373 0.158
157 HB3 TRP 25 HB1 TRP 25 -1.981 3.036 1.780
158 HD1 TRP 25 HD1 TRP 25 -3.228 6.552 1.268
159 HE1 TRP 25 HE1 TRP 25 -5.504 6.834 2.437
160 HE3 TRP 25 HE3 TRP 25 -4.191 1.653 2.359
161 HZ2 TRP 25 HZ2 TRP 25 -7.450 5.193 3.663
162 HZ3 TRP 25 HZ3 TRP 25 -6.279 1.091 3.529
163 HH2 TRP 25 HH2 TRP 25 -7.875 2.826 4.168
164 H LEU 26 HN LEU 26 0.000 4.140 -1.277
165 HA LEU 26 HA LEU 26 1.629 2.046 -0.561
166 HB2 LEU 26 HB2 LEU 26 1.666 4.072 -2.718
167 HB3 LEU 26 HB1 LEU 26 3.146 3.170 -2.472
168 HG LEU 26 HG LEU 26 1.652 2.221 -4.219
169 HD11 LEU 26 HD11 LEU 26 1.713 0.159 -2.103
170 HD12 LEU 26 HD12 LEU 26 3.244 0.935 -2.511
171 HD13 LEU 26 HD13 LEU 26 2.314 0.109 -3.760
172 HD21 LEU 26 HD21 LEU 26 -0.532 2.441 -3.621
173 HD22 LEU 26 HD22 LEU 26 -0.215 2.138 -1.914
174 HD23 LEU 26 HD23 LEU 26 -0.252 0.798 -3.055
175 H CYS 27 HN CYS 27 3.364 1.814 0.672
176 HA CYS 27 HA CYS 27 4.927 2.377 2.254
177 HB2 CYS 27 HB2 CYS 27 6.911 3.395 1.285
178 HB3 CYS 27 HB1 CYS 27 6.203 2.254 0.149
179 H ASP 28 HN ASP 28 2.904 3.759 3.063
180 HA ASP 28 HA ASP 28 3.736 6.564 3.309
181 HB2 ASP 28 HB2 ASP 28 1.433 7.024 3.994
182 HB3 ASP 28 HB1 ASP 28 1.464 6.196 2.441
183 H GLY 29 HN GLY 29 3.891 3.674 4.962
184 HA2 GLY 29 HA2 GLY 29 5.148 3.833 7.083
185 HA3 GLY 29 HA1 GLY 29 4.006 5.082 7.556
186 H ASP 30 HN ASP 30 1.852 3.373 6.196
187 HA ASP 30 HA ASP 30 1.466 1.554 8.477
188 HB2 ASP 30 HB2 ASP 30 -0.168 3.559 7.793
189 HB3 ASP 30 HB1 ASP 30 -0.827 2.311 6.740
190 H LYS 31 HN LYS 31 1.781 -0.515 8.025
191 HA LYS 31 HA LYS 31 2.018 -1.541 5.406
192 HB2 LYS 31 HB2 LYS 31 2.090 -2.627 8.147
193 HB3 LYS 31 HB1 LYS 31 1.626 -3.773 6.900
194 HG2 LYS 31 HG2 LYS 31 3.692 -3.126 5.653
195 HG3 LYS 31 HG1 LYS 31 4.169 -2.180 7.063
196 HD2 LYS 31 HD2 LYS 31 5.214 -4.396 7.063
197 HD3 LYS 31 HD1 LYS 31 4.137 -4.181 8.443
198 HE2 LYS 31 HE2 LYS 31 2.680 -5.273 6.225
199 HE3 LYS 31 HE1 LYS 31 4.115 -6.248 6.536
200 HZ1 LYS 31 HZ1 LYS 31 2.744 -7.208 8.024
201 HZ2 LYS 31 HZ2 LYS 31 1.750 -5.848 8.180
202 HZ3 LYS 31 HZ3 LYS 31 3.223 -5.917 9.009
203 H ASP 32 HN ASP 32 0.141 -1.087 4.249
204 HA ASP 32 HA ASP 32 -2.464 -1.737 5.133
205 HB2 ASP 32 HB2 ASP 32 -1.501 -1.472 2.278
206 HB3 ASP 32 HB1 ASP 32 -3.161 -1.324 2.847
207 H CYS 33 HN CYS 33 0.016 -3.539 3.449
208 HA CYS 33 HA CYS 33 -1.791 -5.763 2.938
209 HB2 CYS 33 HB2 CYS 33 0.023 -4.998 1.309
210 HB3 CYS 33 HB1 CYS 33 1.178 -5.717 2.425
211 H ALA 34 HN ALA 34 -1.185 -7.953 3.610
212 HA ALA 34 HA ALA 34 -0.724 -8.095 6.398
213 HB1 ALA 34 HB1 ALA 34 -1.975 -9.879 5.836
214 HB2 ALA 34 HB2 ALA 34 -0.411 -10.656 5.593
215 HB3 ALA 34 HB3 ALA 34 -1.285 -9.984 4.216
216 H ASP 35 HN ASP 35 1.353 -8.359 3.614
217 HA ASP 35 HA ASP 35 3.586 -9.219 5.317
218 HB2 ASP 35 HB2 ASP 35 3.383 -9.155 2.300
219 HB3 ASP 35 HB1 ASP 35 4.751 -9.767 3.225
220 H GLY 36 HN GLY 36 2.250 -6.419 4.129
221 HA2 GLY 36 HA2 GLY 36 3.029 -4.256 4.161
222 HA3 GLY 36 HA1 GLY 36 4.528 -4.866 4.841
223 H ALA 37 HN ALA 37 3.196 -5.950 1.776
224 HA ALA 37 HA ALA 37 5.605 -5.551 0.385
225 HB1 ALA 37 HB1 ALA 37 4.513 -6.350 -1.495
226 HB2 ALA 37 HB2 ALA 37 2.974 -5.623 -1.036
227 HB3 ALA 37 HB3 ALA 37 3.562 -7.051 -0.185
228 H ASP 38 HN ASP 38 2.699 -3.576 0.672
229 HA ASP 38 HA ASP 38 3.325 -1.650 -1.265
230 HB2 ASP 38 HB2 ASP 38 1.836 -0.146 0.217
231 HB3 ASP 38 HB1 ASP 38 1.117 -1.586 -0.491
232 H GLU 39 HN GLU 39 4.525 -2.134 1.956
233 HA GLU 39 HA GLU 39 5.718 0.512 2.085
234 HB2 GLU 39 HB2 GLU 39 5.877 -1.830 3.990
235 HB3 GLU 39 HB1 GLU 39 6.548 -0.234 4.291
236 HG2 GLU 39 HG2 GLU 39 3.727 -0.182 3.576
237 HG3 GLU 39 HG1 GLU 39 4.066 -1.100 5.042
238 H SER 40 HN SER 40 6.505 -2.004 0.298
239 HA SER 40 HA SER 40 9.391 -1.589 0.673
240 HB2 SER 40 HB2 SER 40 7.872 -4.109 0.662
241 HB3 SER 40 HB1 SER 40 9.299 -4.109 -0.374
242 HG SER 40 HG SER 40 9.101 -3.941 2.394
243 H ILE 41 HN ILE 41 10.577 -2.539 -1.362
244 HA ILE 41 HA ILE 41 9.876 -0.956 -3.559
245 HB ILE 41 HB ILE 41 11.669 -3.377 -3.439
246 HG12 ILE 41 HG12 ILE 41 12.305 -1.438 -2.016
247 HG13 ILE 41 HG11 ILE 41 13.479 -1.784 -3.281
248 HG21 ILE 41 HG21 ILE 41 10.960 -3.027 -5.726
249 HG22 ILE 41 HG22 ILE 41 12.646 -2.543 -5.538
250 HG23 ILE 41 HG23 ILE 41 11.381 -1.317 -5.619
251 HD11 ILE 41 HD11 ILE 41 13.032 0.622 -2.954
252 HD12 ILE 41 HD12 ILE 41 11.367 0.345 -3.464
253 HD13 ILE 41 HD13 ILE 41 12.693 0.057 -4.590
254 H ALA 42 HN ALA 42 8.798 -4.092 -2.602
255 HA ALA 42 HA ALA 42 8.100 -5.313 -4.963
256 HB1 ALA 42 HB1 ALA 42 6.115 -5.417 -2.759
257 HB2 ALA 42 HB2 ALA 42 7.755 -5.971 -2.418
258 HB3 ALA 42 HB3 ALA 42 6.820 -6.724 -3.710
259 H ALA 43 HN ALA 43 6.599 -2.582 -3.404
260 HA ALA 43 HA ALA 43 4.305 -2.645 -5.186
261 HB1 ALA 43 HB1 ALA 43 4.799 -1.627 -2.606
262 HB2 ALA 43 HB2 ALA 43 3.291 -1.596 -3.520
263 HB3 ALA 43 HB3 ALA 43 4.423 -0.249 -3.641
264 H GLY 44 HN GLY 44 7.411 -1.185 -5.023
265 HA2 GLY 44 HA2 GLY 44 8.333 -0.179 -6.998
266 HA3 GLY 44 HA1 GLY 44 6.731 0.423 -7.391
267 H CYS 45 HN CYS 45 7.880 0.666 -4.130
268 HA CYS 45 HA CYS 45 7.890 3.571 -4.380
269 HB2 CYS 45 HB2 CYS 45 7.505 1.625 -2.177
270 HB3 CYS 45 HB1 CYS 45 8.271 3.149 -1.748
271 H LEU 46 HN LEU 46 9.835 4.127 -5.261
272 HA LEU 46 HA LEU 46 12.293 3.021 -4.175
273 HB2 LEU 46 HB2 LEU 46 12.156 5.198 -6.230
274 HB3 LEU 46 HB1 LEU 46 13.398 3.983 -5.997
275 HG LEU 46 HG LEU 46 10.963 2.633 -6.605
276 HD11 LEU 46 HD11 LEU 46 10.494 3.518 -8.827
277 HD12 LEU 46 HD12 LEU 46 11.659 4.816 -8.565
278 HD13 LEU 46 HD13 LEU 46 10.196 4.733 -7.584
279 HD21 LEU 46 HD21 LEU 46 12.249 1.609 -8.268
280 HD22 LEU 46 HD22 LEU 46 13.417 2.031 -7.016
281 HD23 LEU 46 HD23 LEU 46 13.283 3.024 -8.467
282 H TYR 47 HN TYR 47 11.337 4.187 -2.092
283 HA TYR 47 HA TYR 47 13.172 6.187 -1.407
284 HB2 TYR 47 HB2 TYR 47 11.740 8.141 -1.178
285 HB3 TYR 47 HB1 TYR 47 11.760 7.606 -2.854
286 HD1 TYR 47 HD1 TYR 47 9.806 5.769 -3.327
287 HD2 TYR 47 HD2 TYR 47 9.702 8.829 -0.375
288 HE1 TYR 47 HE1 TYR 47 7.349 5.680 -3.331
289 HE2 TYR 47 HE2 TYR 47 7.244 8.750 -0.370
290 HH TYR 47 HH TYR 47 5.422 8.053 -1.780
291 H ASN 48 HN ASN 48 13.521 5.296 0.529
292 HA ASN 48 HA ASN 48 11.202 4.823 2.282
293 HB2 ASN 48 HB2 ASN 48 13.088 3.009 1.546
294 HB3 ASN 48 HB1 ASN 48 13.800 3.634 3.030
295 HD21 ASN 48 HD21 ASN 48 13.493 1.895 4.311
296 HD22 ASN 48 HD22 ASN 48 11.942 1.278 4.753
297 H SER 49 HN SER 49 12.641 4.583 4.687
298 HA SER 49 HA SER 49 13.565 5.777 6.395
299 HB2 SER 49 HB2 SER 49 15.037 6.623 4.172
300 HB3 SER 49 HB1 SER 49 14.529 8.114 4.965
301 HG SER 49 HG SER 49 16.392 6.308 5.734
302 H THR 50 HN THR 50 12.499 8.240 4.039
303 HA THR 50 HA THR 50 10.623 9.232 6.084
304 HB THR 50 HB THR 50 11.069 11.485 5.458
305 HG1 THR 50 HG1 THR 50 12.492 10.345 3.301
306 HG21 THR 50 HG21 THR 50 13.804 10.260 5.386
307 HG22 THR 50 HG22 THR 50 12.843 10.357 6.861
308 HG23 THR 50 HG23 THR 50 13.318 11.833 6.020
Start of MODEL 18
1 H1 GLY 1 HT1 GLY 1 -16.071 9.280 8.279
2 H2 GLY 1 HT2 GLY 1 -16.692 8.041 7.308
3 H3 GLY 1 HT3 GLY 1 -15.710 9.237 6.627
4 HA2 GLY 1 HA1 GLY 1 -13.841 8.483 8.006
5 HA3 GLY 1 HA2 GLY 1 -14.870 7.190 8.605
6 H SER 2 HN SER 2 -15.141 5.366 7.403
7 HA SER 2 HA SER 2 -13.881 5.322 4.742
8 HB2 SER 2 HB2 SER 2 -13.164 2.958 5.293
9 HB3 SER 2 HB1 SER 2 -12.329 4.222 6.194
10 HG SER 2 HG SER 2 -13.335 2.239 7.308
11 H GLU 3 HN GLU 3 -14.875 4.102 3.178
12 HA GLU 3 HA GLU 3 -17.233 2.540 3.907
13 HB2 GLU 3 HB2 GLU 3 -18.653 3.635 2.287
14 HB3 GLU 3 HB1 GLU 3 -18.025 4.834 3.408
15 HG2 GLU 3 HG2 GLU 3 -16.969 4.309 0.638
16 HG3 GLU 3 HG1 GLU 3 -18.038 5.632 1.098
17 H GLY 4 HN GLY 4 -15.047 3.594 1.315
18 HA2 GLY 4 HA2 GLY 4 -14.732 0.874 0.429
19 HA3 GLY 4 HA1 GLY 4 -15.642 1.863 -0.701
20 H LYS 5 HN LYS 5 -12.835 2.649 1.338
21 HA LYS 5 HA LYS 5 -11.485 3.655 -1.059
22 HB2 LYS 5 HB2 LYS 5 -10.047 4.892 0.437
23 HB3 LYS 5 HB1 LYS 5 -11.722 5.174 0.886
24 HG2 LYS 5 HG2 LYS 5 -11.280 3.203 2.557
25 HG3 LYS 5 HG1 LYS 5 -9.595 3.677 2.330
26 HD2 LYS 5 HD2 LYS 5 -11.729 5.678 3.018
27 HD3 LYS 5 HD1 LYS 5 -10.880 4.758 4.261
28 HE2 LYS 5 HE2 LYS 5 -8.775 5.625 2.861
29 HE3 LYS 5 HE1 LYS 5 -9.906 6.927 2.496
30 HZ1 LYS 5 HZ1 LYS 5 -9.851 7.682 4.601
31 HZ2 LYS 5 HZ2 LYS 5 -8.355 6.894 4.651
32 HZ3 LYS 5 HZ3 LYS 5 -9.729 6.140 5.287
33 H THR 6 HN THR 6 -11.669 0.822 -0.570
34 HA THR 6 HA THR 6 -9.216 -0.144 0.508
35 HB THR 6 HB THR 6 -10.119 -2.130 -1.190
36 HG1 THR 6 HG1 THR 6 -12.424 -0.921 -0.093
37 HG21 THR 6 HG21 THR 6 -9.672 -2.038 1.395
38 HG22 THR 6 HG22 THR 6 -10.689 -3.289 0.680
39 HG23 THR 6 HG23 THR 6 -11.428 -1.891 1.461
40 H CYS 7 HN CYS 7 -10.312 -0.684 -2.827
41 HA CYS 7 HA CYS 7 -7.544 -0.271 -3.706
42 HB2 CYS 7 HB2 CYS 7 -9.734 -1.532 -5.347
43 HB3 CYS 7 HB1 CYS 7 -7.994 -1.670 -5.562
44 H GLY 8 HN GLY 8 -10.693 0.103 -5.350
45 HA2 GLY 8 HA2 GLY 8 -11.577 1.895 -6.500
46 HA3 GLY 8 HA1 GLY 8 -10.415 2.921 -5.670
47 HA PRO 9 HA PRO 9 -9.426 2.597 -10.279
48 HB2 PRO 9 HB2 PRO 9 -9.152 5.314 -10.586
49 HB3 PRO 9 HB1 PRO 9 -10.646 4.425 -10.898
50 HG2 PRO 9 HG2 PRO 9 -9.833 5.974 -8.470
51 HG3 PRO 9 HG1 PRO 9 -11.404 5.924 -9.293
52 HD2 PRO 9 HD2 PRO 9 -10.962 4.549 -7.039
53 HD3 PRO 9 HD1 PRO 9 -11.977 3.891 -8.340
54 H SER 10 HN SER 10 -8.069 4.162 -7.480
55 HA SER 10 HA SER 10 -5.395 3.880 -8.678
56 HB2 SER 10 HB2 SER 10 -4.681 5.893 -7.422
57 HB3 SER 10 HB1 SER 10 -5.944 6.257 -8.597
58 HG SER 10 HG SER 10 -6.006 6.908 -6.127
59 H SER 11 HN SER 11 -4.689 2.075 -7.677
60 HA SER 11 HA SER 11 -4.057 2.228 -4.886
61 HB2 SER 11 HB2 SER 11 -6.462 0.815 -5.718
62 HB3 SER 11 HB1 SER 11 -5.333 -0.246 -4.877
63 HG SER 11 HG SER 11 -5.806 0.732 -3.086
64 H PHE 12 HN PHE 12 -3.165 -0.044 -4.172
65 HA PHE 12 HA PHE 12 -1.639 -1.186 -6.417
66 HB2 PHE 12 HB2 PHE 12 0.003 0.074 -5.326
67 HB3 PHE 12 HB1 PHE 12 -0.679 -0.237 -3.733
68 HD1 PHE 12 HD2 PHE 12 0.884 -2.088 -6.575
69 HD2 PHE 12 HD1 PHE 12 0.390 -1.727 -2.366
70 HE1 PHE 12 HE2 PHE 12 2.494 -3.919 -6.233
71 HE2 PHE 12 HE1 PHE 12 1.995 -3.559 -2.013
72 HZ PHE 12 HZ PHE 12 3.051 -4.656 -3.949
73 H SER 13 HN SER 13 -1.045 -3.391 -6.202
74 HA SER 13 HA SER 13 -2.764 -4.876 -4.333
75 HB2 SER 13 HB2 SER 13 -3.406 -5.544 -6.476
76 HB3 SER 13 HB1 SER 13 -1.758 -5.474 -7.098
77 HG SER 13 HG SER 13 -1.514 -7.480 -6.550
78 H CYS 14 HN CYS 14 -1.833 -6.010 -2.758
79 HA CYS 14 HA CYS 14 1.015 -6.054 -2.494
80 HB2 CYS 14 HB2 CYS 14 -0.850 -7.673 -0.785
81 HB3 CYS 14 HB1 CYS 14 0.670 -6.917 -0.340
82 HA PRO 15 HA PRO 15 1.799 -9.945 -4.447
83 HB2 PRO 15 HB2 PRO 15 4.201 -10.532 -3.376
84 HB3 PRO 15 HB1 PRO 15 3.988 -9.219 -4.539
85 HG2 PRO 15 HG2 PRO 15 4.189 -9.092 -1.555
86 HG3 PRO 15 HG1 PRO 15 4.950 -8.051 -2.771
87 HD2 PRO 15 HD2 PRO 15 2.702 -7.353 -1.408
88 HD3 PRO 15 HD1 PRO 15 3.058 -6.782 -3.049
89 H GLY 16 HN GLY 16 1.526 -12.109 -4.088
90 HA2 GLY 16 HA2 GLY 16 1.108 -14.070 -2.964
91 HA3 GLY 16 HA1 GLY 16 1.960 -13.384 -1.590
92 H THR 17 HN THR 17 -0.855 -11.889 -3.050
93 HA THR 17 HA THR 17 -2.857 -13.016 -1.470
94 HB THR 17 HB THR 17 -1.873 -12.183 0.502
95 HG1 THR 17 HG1 THR 17 -3.478 -10.972 1.229
96 HG21 THR 17 HG21 THR 17 -1.153 -9.887 0.837
97 HG22 THR 17 HG22 THR 17 -1.519 -9.519 -0.848
98 HG23 THR 17 HG23 THR 17 -0.236 -10.663 -0.454
99 H HIS 18 HN HIS 18 -4.848 -11.593 -1.374
100 HA HIS 18 HA HIS 18 -4.969 -10.013 -3.847
101 HB2 HIS 18 HB2 HIS 18 -6.591 -12.075 -2.904
102 HB3 HIS 18 HB1 HIS 18 -7.541 -10.618 -2.631
103 HD1 HIS 18 HD1 HIS 18 -9.227 -10.951 -4.519
104 HD2 HIS 18 HD2 HIS 18 -5.275 -11.112 -5.789
105 HE1 HIS 18 HE1 HIS 18 -9.293 -10.957 -7.048
106 H VAL 19 HN VAL 19 -4.007 -9.023 -1.231
107 HA VAL 19 HA VAL 19 -6.100 -7.169 -0.406
108 HB VAL 19 HB VAL 19 -4.907 -8.086 1.429
109 HG11 VAL 19 HG11 VAL 19 -2.648 -7.909 -0.357
110 HG12 VAL 19 HG12 VAL 19 -2.877 -8.913 1.074
111 HG13 VAL 19 HG13 VAL 19 -2.256 -7.270 1.239
112 HG21 VAL 19 HG21 VAL 19 -5.074 -5.380 1.033
113 HG22 VAL 19 HG22 VAL 19 -3.381 -5.593 1.479
114 HG23 VAL 19 HG23 VAL 19 -4.655 -6.166 2.556
115 H CYS 20 HN CYS 20 -6.098 -5.009 -0.799
116 HA CYS 20 HA CYS 20 -3.904 -3.973 -2.467
117 HB2 CYS 20 HB2 CYS 20 -5.476 -2.601 -3.658
118 HB3 CYS 20 HB1 CYS 20 -6.084 -4.251 -3.666
119 H VAL 21 HN VAL 21 -3.619 -1.605 -2.357
120 HA VAL 21 HA VAL 21 -4.505 -0.361 0.127
121 HB VAL 21 HB VAL 21 -2.431 -1.395 0.805
122 HG11 VAL 21 HG11 VAL 21 -1.579 -0.604 -1.850
123 HG12 VAL 21 HG12 VAL 21 -0.932 -1.844 -0.776
124 HG13 VAL 21 HG13 VAL 21 -0.401 -0.170 -0.611
125 HG21 VAL 21 HG21 VAL 21 -2.832 0.781 1.745
126 HG22 VAL 21 HG22 VAL 21 -2.120 1.565 0.333
127 HG23 VAL 21 HG23 VAL 21 -1.108 0.609 1.416
128 HA PRO 22 HA PRO 22 -4.761 3.053 -2.717
129 HB2 PRO 22 HB2 PRO 22 -5.244 5.031 -0.928
130 HB3 PRO 22 HB1 PRO 22 -6.468 3.843 -1.390
131 HG2 PRO 22 HG2 PRO 22 -4.723 3.919 1.040
132 HG3 PRO 22 HG1 PRO 22 -6.447 3.524 0.912
133 HD2 PRO 22 HD2 PRO 22 -4.513 1.631 1.119
134 HD3 PRO 22 HD1 PRO 22 -6.028 1.363 0.236
135 H GLU 23 HN GLU 23 -3.470 4.713 -3.471
136 HA GLU 23 HA GLU 23 -0.775 4.698 -2.981
137 HB2 GLU 23 HB2 GLU 23 -2.563 6.229 -4.547
138 HB3 GLU 23 HB1 GLU 23 -1.537 7.374 -3.694
139 HG2 GLU 23 HG2 GLU 23 0.440 6.092 -4.525
140 HG3 GLU 23 HG1 GLU 23 -0.669 5.147 -5.517
141 H ARG 24 HN ARG 24 -3.235 6.688 -1.403
142 HA ARG 24 HA ARG 24 -1.549 8.384 0.042
143 HB2 ARG 24 HB2 ARG 24 -4.152 8.352 -0.218
144 HB3 ARG 24 HB1 ARG 24 -4.102 7.355 1.229
145 HG2 ARG 24 HG2 ARG 24 -2.514 9.392 1.997
146 HG3 ARG 24 HG1 ARG 24 -3.604 10.232 0.892
147 HD2 ARG 24 HD2 ARG 24 -5.517 9.539 2.131
148 HD3 ARG 24 HD1 ARG 24 -4.556 8.431 3.109
149 HE ARG 24 HE ARG 24 -4.892 11.246 3.515
150 HH11 ARG 24 HH11 ARG 24 -2.744 8.545 4.026
151 HH12 ARG 24 HH12 ARG 24 -1.957 9.266 5.390
152 HH21 ARG 24 HH21 ARG 24 -3.860 12.199 5.308
153 HH22 ARG 24 HH22 ARG 24 -2.591 11.342 6.118
154 H TRP 25 HN TRP 25 -2.450 5.064 0.546
155 HA TRP 25 HA TRP 25 -1.260 4.989 3.207
156 HB2 TRP 25 HB2 TRP 25 -2.764 2.978 1.542
157 HB3 TRP 25 HB1 TRP 25 -1.952 2.528 3.037
158 HD1 TRP 25 HD1 TRP 25 -3.546 5.928 3.143
159 HE1 TRP 25 HE1 TRP 25 -5.694 5.830 4.558
160 HE3 TRP 25 HE3 TRP 25 -3.976 0.856 3.617
161 HZ2 TRP 25 HZ2 TRP 25 -7.350 3.862 5.723
162 HZ3 TRP 25 HZ3 TRP 25 -5.869 -0.053 4.897
163 HH2 TRP 25 HH2 TRP 25 -7.521 1.420 5.928
164 H LEU 26 HN LEU 26 -0.500 4.222 -0.080
165 HA LEU 26 HA LEU 26 1.398 2.239 0.132
166 HB2 LEU 26 HB2 LEU 26 0.919 4.490 -1.722
167 HB3 LEU 26 HB1 LEU 26 2.514 3.771 -1.784
168 HG LEU 26 HG LEU 26 0.984 2.814 -3.454
169 HD11 LEU 26 HD11 LEU 26 2.769 1.501 -1.891
170 HD12 LEU 26 HD12 LEU 26 1.944 0.797 -3.282
171 HD13 LEU 26 HD13 LEU 26 1.320 0.524 -1.656
172 HD21 LEU 26 HD21 LEU 26 -0.675 2.356 -1.037
173 HD22 LEU 26 HD22 LEU 26 -0.704 1.128 -2.302
174 HD23 LEU 26 HD23 LEU 26 -1.154 2.790 -2.678
175 H CYS 27 HN CYS 27 3.272 2.062 1.150
176 HA CYS 27 HA CYS 27 4.932 2.645 2.635
177 HB2 CYS 27 HB2 CYS 27 6.528 4.369 1.371
178 HB3 CYS 27 HB1 CYS 27 6.398 2.684 0.888
179 H ASP 28 HN ASP 28 2.948 3.844 3.728
180 HA ASP 28 HA ASP 28 3.587 6.692 4.024
181 HB2 ASP 28 HB2 ASP 28 1.373 6.898 5.060
182 HB3 ASP 28 HB1 ASP 28 1.256 6.161 3.466
183 H GLY 29 HN GLY 29 3.987 3.695 5.565
184 HA2 GLY 29 HA2 GLY 29 5.573 3.822 7.475
185 HA3 GLY 29 HA1 GLY 29 4.510 5.054 8.136
186 H ASP 30 HN ASP 30 2.146 3.450 7.139
187 HA ASP 30 HA ASP 30 2.106 1.551 9.384
188 HB2 ASP 30 HB2 ASP 30 0.175 3.456 8.326
189 HB3 ASP 30 HB1 ASP 30 -0.514 1.842 8.481
190 H LYS 31 HN LYS 31 2.277 -0.526 8.887
191 HA LYS 31 HA LYS 31 2.254 -1.521 6.258
192 HB2 LYS 31 HB2 LYS 31 2.403 -2.688 8.977
193 HB3 LYS 31 HB1 LYS 31 1.895 -3.769 7.688
194 HG2 LYS 31 HG2 LYS 31 3.956 -3.025 6.430
195 HG3 LYS 31 HG1 LYS 31 4.480 -2.268 7.935
196 HD2 LYS 31 HD2 LYS 31 5.442 -4.506 7.662
197 HD3 LYS 31 HD1 LYS 31 4.384 -4.416 9.071
198 HE2 LYS 31 HE2 LYS 31 2.897 -5.184 6.724
199 HE3 LYS 31 HE1 LYS 31 4.271 -6.262 6.973
200 HZ1 LYS 31 HZ1 LYS 31 3.469 -6.966 8.990
201 HZ2 LYS 31 HZ2 LYS 31 2.026 -6.747 8.136
202 HZ3 LYS 31 HZ3 LYS 31 2.536 -5.578 9.246
203 H ASP 32 HN ASP 32 0.496 -1.487 5.015
204 HA ASP 32 HA ASP 32 -2.094 -2.227 6.188
205 HB2 ASP 32 HB2 ASP 32 -1.745 -1.101 3.422
206 HB3 ASP 32 HB1 ASP 32 -3.155 -1.028 4.474
207 H CYS 33 HN CYS 33 0.304 -3.164 3.860
208 HA CYS 33 HA CYS 33 -1.322 -5.069 2.480
209 HB2 CYS 33 HB2 CYS 33 1.551 -4.289 2.484
210 HB3 CYS 33 HB1 CYS 33 1.145 -5.885 1.866
211 H ALA 34 HN ALA 34 -0.195 -7.401 2.336
212 HA ALA 34 HA ALA 34 -0.793 -8.668 4.787
213 HB1 ALA 34 HB1 ALA 34 -1.182 -10.046 2.996
214 HB2 ALA 34 HB2 ALA 34 0.377 -10.658 3.546
215 HB3 ALA 34 HB3 ALA 34 0.297 -9.566 2.164
216 H ASP 35 HN ASP 35 2.318 -8.322 3.070
217 HA ASP 35 HA ASP 35 3.674 -8.780 5.646
218 HB2 ASP 35 HB2 ASP 35 4.462 -9.460 2.824
219 HB3 ASP 35 HB1 ASP 35 5.671 -9.331 4.098
220 H GLY 36 HN GLY 36 2.652 -6.229 4.824
221 HA2 GLY 36 HA2 GLY 36 3.324 -4.034 4.834
222 HA3 GLY 36 HA1 GLY 36 4.893 -4.614 5.371
223 H ALA 37 HN ALA 37 3.489 -5.669 2.357
224 HA ALA 37 HA ALA 37 5.739 -5.054 0.829
225 HB1 ALA 37 HB1 ALA 37 4.498 -6.559 -0.305
226 HB2 ALA 37 HB2 ALA 37 3.828 -5.115 -1.064
227 HB3 ALA 37 HB3 ALA 37 2.968 -5.891 0.265
228 H ASP 38 HN ASP 38 2.748 -3.214 1.314
229 HA ASP 38 HA ASP 38 3.196 -1.194 -0.546
230 HB2 ASP 38 HB2 ASP 38 1.751 0.214 0.998
231 HB3 ASP 38 HB1 ASP 38 1.051 -1.305 0.452
232 H GLU 39 HN GLU 39 4.781 -1.815 2.445
233 HA GLU 39 HA GLU 39 5.821 0.883 2.694
234 HB2 GLU 39 HB2 GLU 39 6.378 -1.621 4.291
235 HB3 GLU 39 HB1 GLU 39 7.009 -0.025 4.669
236 HG2 GLU 39 HG2 GLU 39 4.102 -0.146 4.363
237 HG3 GLU 39 HG1 GLU 39 4.745 -1.086 5.708
238 H SER 40 HN SER 40 6.503 -1.304 0.513
239 HA SER 40 HA SER 40 9.392 -0.767 0.594
240 HB2 SER 40 HB2 SER 40 8.052 -3.328 0.581
241 HB3 SER 40 HB1 SER 40 9.069 -3.153 -0.849
242 HG SER 40 HG SER 40 9.927 -3.899 1.405
243 H ILE 41 HN ILE 41 10.371 -1.244 -1.669
244 HA ILE 41 HA ILE 41 9.188 0.537 -3.501
245 HB ILE 41 HB ILE 41 11.405 -1.473 -3.817
246 HG12 ILE 41 HG12 ILE 41 12.514 0.953 -4.201
247 HG13 ILE 41 HG11 ILE 41 11.182 1.401 -3.142
248 HG21 ILE 41 HG21 ILE 41 10.508 -1.293 -6.004
249 HG22 ILE 41 HG22 ILE 41 11.925 -0.243 -5.955
250 HG23 ILE 41 HG23 ILE 41 10.308 0.453 -5.851
251 HD11 ILE 41 HD11 ILE 41 12.754 -0.924 -2.280
252 HD12 ILE 41 HD12 ILE 41 12.112 0.430 -1.349
253 HD13 ILE 41 HD13 ILE 41 13.599 0.624 -2.277
254 H ALA 42 HN ALA 42 8.767 -2.843 -2.957
255 HA ALA 42 HA ALA 42 7.959 -3.786 -5.430
256 HB1 ALA 42 HB1 ALA 42 7.150 -5.614 -4.322
257 HB2 ALA 42 HB2 ALA 42 6.438 -4.651 -3.026
258 HB3 ALA 42 HB3 ALA 42 8.179 -4.932 -3.064
259 H ALA 43 HN ALA 43 6.361 -1.582 -3.303
260 HA ALA 43 HA ALA 43 3.789 -1.898 -4.616
261 HB1 ALA 43 HB1 ALA 43 2.888 -0.920 -2.809
262 HB2 ALA 43 HB2 ALA 43 4.150 0.306 -2.710
263 HB3 ALA 43 HB3 ALA 43 4.438 -1.310 -2.066
264 H GLY 44 HN GLY 44 6.565 -0.338 -5.406
265 HA2 GLY 44 HA2 GLY 44 6.530 0.986 -7.439
266 HA3 GLY 44 HA1 GLY 44 5.065 1.752 -6.847
267 H CYS 45 HN CYS 45 6.676 1.671 -4.119
268 HA CYS 45 HA CYS 45 7.446 4.391 -4.209
269 HB2 CYS 45 HB2 CYS 45 7.049 2.436 -2.217
270 HB3 CYS 45 HB1 CYS 45 8.715 2.974 -2.036
271 H LEU 46 HN LEU 46 9.490 5.345 -4.241
272 HA LEU 46 HA LEU 46 11.690 3.554 -5.042
273 HB2 LEU 46 HB2 LEU 46 11.339 6.365 -6.054
274 HB3 LEU 46 HB1 LEU 46 12.438 5.135 -6.647
275 HG LEU 46 HG LEU 46 9.890 4.014 -6.933
276 HD11 LEU 46 HD11 LEU 46 9.734 6.627 -8.323
277 HD12 LEU 46 HD12 LEU 46 9.302 6.578 -6.614
278 HD13 LEU 46 HD13 LEU 46 8.447 5.556 -7.770
279 HD21 LEU 46 HD21 LEU 46 11.803 3.710 -8.424
280 HD22 LEU 46 HD22 LEU 46 11.636 5.374 -8.982
281 HD23 LEU 46 HD23 LEU 46 10.364 4.199 -9.317
282 H TYR 47 HN TYR 47 10.700 6.251 -3.089
283 HA TYR 47 HA TYR 47 13.078 7.498 -2.497
284 HB2 TYR 47 HB2 TYR 47 12.067 8.309 -0.529
285 HB3 TYR 47 HB1 TYR 47 10.729 8.040 -1.636
286 HD1 TYR 47 HD1 TYR 47 10.108 5.257 -1.422
287 HD2 TYR 47 HD2 TYR 47 11.373 7.930 1.634
288 HE1 TYR 47 HE1 TYR 47 9.003 3.844 0.262
289 HE2 TYR 47 HE2 TYR 47 10.272 6.526 3.327
290 HH TYR 47 HH TYR 47 9.501 4.269 3.629
291 H ASN 48 HN ASN 48 14.963 6.738 -1.837
292 HA ASN 48 HA ASN 48 15.400 4.126 -0.951
293 HB2 ASN 48 HB2 ASN 48 17.654 4.695 -0.757
294 HB3 ASN 48 HB1 ASN 48 17.063 5.849 -1.946
295 HD21 ASN 48 HD21 ASN 48 16.208 7.933 -0.898
296 HD22 ASN 48 HD22 ASN 48 17.222 8.621 0.319
297 H SER 49 HN SER 49 15.169 3.161 0.949
298 HA SER 49 HA SER 49 14.951 4.845 3.358
299 HB2 SER 49 HB2 SER 49 13.365 2.404 2.562
300 HB3 SER 49 HB1 SER 49 13.436 2.977 4.229
301 HG SER 49 HG SER 49 11.814 3.805 2.376
302 H THR 50 HN THR 50 17.086 2.999 1.934
303 HA THR 50 HA THR 50 18.732 1.542 2.540
304 HB THR 50 HB THR 50 19.678 1.980 4.830
305 HG1 THR 50 HG1 THR 50 18.515 3.000 6.228
306 HG21 THR 50 HG21 THR 50 19.802 3.581 2.630
307 HG22 THR 50 HG22 THR 50 20.753 3.786 4.101
308 HG23 THR 50 HG23 THR 50 19.262 4.703 3.879
Start of MODEL 19
1 H1 GLY 1 HT1 GLY 1 -9.279 4.616 6.820
2 H2 GLY 1 HT2 GLY 1 -10.590 3.681 6.302
3 H3 GLY 1 HT3 GLY 1 -9.999 3.507 7.877
4 HA2 GLY 1 HA1 GLY 1 -11.088 5.285 8.661
5 HA3 GLY 1 HA2 GLY 1 -10.799 6.197 7.187
6 H SER 2 HN SER 2 -12.745 6.887 6.551
7 HA SER 2 HA SER 2 -14.946 4.934 6.464
8 HB2 SER 2 HB2 SER 2 -14.914 7.426 7.644
9 HB3 SER 2 HB1 SER 2 -15.680 7.747 6.089
10 HG SER 2 HG SER 2 -17.029 5.835 6.651
11 H GLU 3 HN GLU 3 -16.636 5.718 4.697
12 HA GLU 3 HA GLU 3 -17.127 5.802 2.477
13 HB2 GLU 3 HB2 GLU 3 -15.620 8.028 3.000
14 HB3 GLU 3 HB1 GLU 3 -14.720 7.292 1.682
15 HG2 GLU 3 HG2 GLU 3 -17.074 7.131 0.561
16 HG3 GLU 3 HG1 GLU 3 -17.475 8.414 1.702
17 H GLY 4 HN GLY 4 -15.813 5.645 0.165
18 HA2 GLY 4 HA2 GLY 4 -14.949 2.988 0.031
19 HA3 GLY 4 HA1 GLY 4 -14.700 4.193 -1.223
20 H LYS 5 HN LYS 5 -13.165 2.109 0.812
21 HA LYS 5 HA LYS 5 -10.635 3.556 0.489
22 HB2 LYS 5 HB2 LYS 5 -11.887 3.334 2.925
23 HB3 LYS 5 HB1 LYS 5 -10.794 1.958 2.946
24 HG2 LYS 5 HG2 LYS 5 -9.849 4.007 3.955
25 HG3 LYS 5 HG1 LYS 5 -8.896 3.374 2.612
26 HD2 LYS 5 HD2 LYS 5 -10.920 5.305 1.779
27 HD3 LYS 5 HD1 LYS 5 -9.741 5.977 2.908
28 HE2 LYS 5 HE2 LYS 5 -7.961 5.602 1.476
29 HE3 LYS 5 HE1 LYS 5 -8.816 4.348 0.579
30 HZ1 LYS 5 HZ1 LYS 5 -10.354 6.474 0.090
31 HZ2 LYS 5 HZ2 LYS 5 -9.079 5.988 -0.910
32 HZ3 LYS 5 HZ3 LYS 5 -8.842 7.223 0.221
33 H THR 6 HN THR 6 -9.146 1.505 1.914
34 HA THR 6 HA THR 6 -8.010 -0.400 1.469
35 HB THR 6 HB THR 6 -9.821 -2.107 0.197
36 HG1 THR 6 HG1 THR 6 -11.754 -1.552 0.772
37 HG21 THR 6 HG21 THR 6 -8.841 -3.174 1.909
38 HG22 THR 6 HG22 THR 6 -10.299 -2.676 2.768
39 HG23 THR 6 HG23 THR 6 -8.814 -1.739 2.934
40 H CYS 7 HN CYS 7 -10.197 -0.866 -1.276
41 HA CYS 7 HA CYS 7 -7.862 -0.620 -3.037
42 HB2 CYS 7 HB2 CYS 7 -10.471 -1.692 -4.020
43 HB3 CYS 7 HB1 CYS 7 -8.836 -2.124 -4.495
44 H GLY 8 HN GLY 8 -9.197 -0.209 -5.461
45 HA2 GLY 8 HA2 GLY 8 -11.091 1.617 -5.855
46 HA3 GLY 8 HA1 GLY 8 -9.819 2.626 -5.184
47 HA PRO 9 HA PRO 9 -9.533 2.217 -9.924
48 HB2 PRO 9 HB2 PRO 9 -9.294 4.963 -10.230
49 HB3 PRO 9 HB1 PRO 9 -10.786 4.043 -10.442
50 HG2 PRO 9 HG2 PRO 9 -9.835 5.596 -8.073
51 HG3 PRO 9 HG1 PRO 9 -11.468 5.474 -8.753
52 HD2 PRO 9 HD2 PRO 9 -10.782 4.121 -6.555
53 HD3 PRO 9 HD1 PRO 9 -11.850 3.400 -7.778
54 H SER 10 HN SER 10 -7.843 3.907 -7.375
55 HA SER 10 HA SER 10 -5.332 3.530 -8.861
56 HB2 SER 10 HB2 SER 10 -4.641 5.648 -7.398
57 HB3 SER 10 HB1 SER 10 -5.403 5.824 -8.978
58 HG SER 10 HG SER 10 -6.551 7.102 -7.606
59 H SER 11 HN SER 11 -6.204 1.589 -7.200
60 HA SER 11 HA SER 11 -4.711 1.980 -4.694
61 HB2 SER 11 HB2 SER 11 -7.202 0.596 -5.351
62 HB3 SER 11 HB1 SER 11 -6.088 -0.411 -4.426
63 HG SER 11 HG SER 11 -7.243 2.065 -3.727
64 H PHE 12 HN PHE 12 -3.075 0.608 -4.122
65 HA PHE 12 HA PHE 12 -1.986 -1.032 -6.269
66 HB2 PHE 12 HB2 PHE 12 -0.371 0.413 -5.285
67 HB3 PHE 12 HB1 PHE 12 -0.861 -0.030 -3.653
68 HD1 PHE 12 HD2 PHE 12 0.463 -1.654 -6.746
69 HD2 PHE 12 HD1 PHE 12 0.491 -1.472 -2.496
70 HE1 PHE 12 HE2 PHE 12 2.218 -3.378 -6.686
71 HE2 PHE 12 HE1 PHE 12 2.244 -3.196 -2.427
72 HZ PHE 12 HZ PHE 12 3.110 -4.152 -4.523
73 H SER 13 HN SER 13 -1.784 -3.213 -6.200
74 HA SER 13 HA SER 13 -3.073 -4.568 -3.938
75 HB2 SER 13 HB2 SER 13 -3.050 -6.517 -5.695
76 HB3 SER 13 HB1 SER 13 -4.250 -5.232 -5.818
77 HG SER 13 HG SER 13 -3.265 -4.449 -7.549
78 H CYS 14 HN CYS 14 -1.923 -5.825 -2.632
79 HA CYS 14 HA CYS 14 0.860 -5.934 -2.691
80 HB2 CYS 14 HB2 CYS 14 -0.912 -7.963 -1.330
81 HB3 CYS 14 HB1 CYS 14 0.706 -7.468 -0.854
82 HA PRO 15 HA PRO 15 1.760 -9.030 -5.727
83 HB2 PRO 15 HB2 PRO 15 4.171 -9.886 -4.758
84 HB3 PRO 15 HB1 PRO 15 3.954 -8.382 -5.658
85 HG2 PRO 15 HG2 PRO 15 4.140 -8.813 -2.703
86 HG3 PRO 15 HG1 PRO 15 4.884 -7.548 -3.698
87 HD2 PRO 15 HD2 PRO 15 2.672 -7.093 -2.244
88 HD3 PRO 15 HD1 PRO 15 2.930 -6.318 -3.818
89 H GLY 16 HN GLY 16 1.144 -11.090 -5.959
90 HA2 GLY 16 HA2 GLY 16 0.424 -13.204 -5.423
91 HA3 GLY 16 HA1 GLY 16 1.826 -13.251 -4.365
92 H THR 17 HN THR 17 -0.811 -10.980 -3.978
93 HA THR 17 HA THR 17 -1.900 -12.544 -1.759
94 HB THR 17 HB THR 17 -1.748 -9.750 -1.019
95 HG1 THR 17 HG1 THR 17 0.190 -9.847 -2.261
96 HG21 THR 17 HG21 THR 17 -0.307 -10.891 0.851
97 HG22 THR 17 HG22 THR 17 -1.010 -12.361 0.176
98 HG23 THR 17 HG23 THR 17 -2.059 -11.084 0.793
99 H HIS 18 HN HIS 18 -4.015 -11.855 -1.078
100 HA HIS 18 HA HIS 18 -5.491 -10.574 -3.260
101 HB2 HIS 18 HB2 HIS 18 -6.193 -12.538 -1.125
102 HB3 HIS 18 HB1 HIS 18 -7.467 -11.489 -1.742
103 HD1 HIS 18 HD1 HIS 18 -6.991 -11.487 -4.714
104 HD2 HIS 18 HD2 HIS 18 -6.524 -14.882 -2.365
105 HE1 HIS 18 HE1 HIS 18 -7.220 -13.466 -6.273
106 H VAL 19 HN VAL 19 -3.919 -9.047 -1.343
107 HA VAL 19 HA VAL 19 -6.069 -7.538 -0.008
108 HB VAL 19 HB VAL 19 -4.697 -8.243 1.738
109 HG11 VAL 19 HG11 VAL 19 -2.548 -8.082 -0.267
110 HG12 VAL 19 HG12 VAL 19 -2.835 -9.270 1.003
111 HG13 VAL 19 HG13 VAL 19 -2.084 -7.724 1.396
112 HG21 VAL 19 HG21 VAL 19 -4.106 -6.286 2.703
113 HG22 VAL 19 HG22 VAL 19 -4.870 -5.598 1.270
114 HG23 VAL 19 HG23 VAL 19 -3.117 -5.784 1.332
115 H CYS 20 HN CYS 20 -6.262 -5.386 -0.384
116 HA CYS 20 HA CYS 20 -4.469 -4.237 -2.418
117 HB2 CYS 20 HB2 CYS 20 -6.321 -2.809 -3.082
118 HB3 CYS 20 HB1 CYS 20 -6.838 -4.491 -3.108
119 H VAL 21 HN VAL 21 -4.255 -1.829 -2.304
120 HA VAL 21 HA VAL 21 -4.573 -0.649 0.326
121 HB VAL 21 HB VAL 21 -2.440 -1.695 0.652
122 HG11 VAL 21 HG11 VAL 21 -1.942 -0.769 -2.113
123 HG12 VAL 21 HG12 VAL 21 -1.476 -2.271 -1.316
124 HG13 VAL 21 HG13 VAL 21 -0.569 -0.790 -1.008
125 HG21 VAL 21 HG21 VAL 21 -0.980 0.246 1.002
126 HG22 VAL 21 HG22 VAL 21 -2.631 0.556 1.540
127 HG23 VAL 21 HG23 VAL 21 -2.060 1.227 0.011
128 HA PRO 22 HA PRO 22 -5.213 2.795 -2.433
129 HB2 PRO 22 HB2 PRO 22 -5.596 4.721 -0.584
130 HB3 PRO 22 HB1 PRO 22 -6.807 3.473 -0.904
131 HG2 PRO 22 HG2 PRO 22 -4.791 3.635 1.304
132 HG3 PRO 22 HG1 PRO 22 -6.498 3.162 1.380
133 HD2 PRO 22 HD2 PRO 22 -4.447 1.365 1.330
134 HD3 PRO 22 HD1 PRO 22 -6.061 1.018 0.684
135 H GLU 23 HN GLU 23 -4.072 4.589 -3.213
136 HA GLU 23 HA GLU 23 -1.323 4.612 -2.961
137 HB2 GLU 23 HB2 GLU 23 -3.334 6.283 -4.210
138 HB3 GLU 23 HB1 GLU 23 -1.994 7.250 -3.609
139 HG2 GLU 23 HG2 GLU 23 -1.076 4.881 -4.993
140 HG3 GLU 23 HG1 GLU 23 -2.113 5.881 -6.009
141 H ARG 24 HN ARG 24 -3.721 6.167 -0.971
142 HA ARG 24 HA ARG 24 -1.983 7.996 0.336
143 HB2 ARG 24 HB2 ARG 24 -4.670 7.681 0.275
144 HB3 ARG 24 HB1 ARG 24 -4.312 6.953 1.835
145 HG2 ARG 24 HG2 ARG 24 -3.936 8.928 2.790
146 HG3 ARG 24 HG1 ARG 24 -2.943 9.488 1.442
147 HD2 ARG 24 HD2 ARG 24 -4.950 10.043 0.177
148 HD3 ARG 24 HD1 ARG 24 -5.960 9.441 1.491
149 HE ARG 24 HE ARG 24 -4.175 11.476 2.378
150 HH11 ARG 24 HH11 ARG 24 -7.183 10.947 0.690
151 HH12 ARG 24 HH12 ARG 24 -7.832 12.498 1.102
152 HH21 ARG 24 HH21 ARG 24 -5.028 13.517 2.922
153 HH22 ARG 24 HH22 ARG 24 -6.609 13.958 2.369
154 H TRP 25 HN TRP 25 -2.640 4.622 0.685
155 HA TRP 25 HA TRP 25 -1.201 4.511 3.242
156 HB2 TRP 25 HB2 TRP 25 -2.920 2.494 1.794
157 HB3 TRP 25 HB1 TRP 25 -1.996 2.112 3.241
158 HD1 TRP 25 HD1 TRP 25 -3.421 5.539 3.457
159 HE1 TRP 25 HE1 TRP 25 -5.498 5.544 4.979
160 HE3 TRP 25 HE3 TRP 25 -4.157 0.494 3.847
161 HZ2 TRP 25 HZ2 TRP 25 -7.218 3.660 6.186
162 HZ3 TRP 25 HZ3 TRP 25 -6.040 -0.322 5.203
163 HH2 TRP 25 HH2 TRP 25 -7.538 1.230 6.349
164 H LEU 26 HN LEU 26 -0.124 4.828 0.375
165 HA LEU 26 HA LEU 26 1.505 2.419 0.146
166 HB2 LEU 26 HB2 LEU 26 0.710 4.635 -1.623
167 HB3 LEU 26 HB1 LEU 26 2.336 4.033 -1.869
168 HG LEU 26 HG LEU 26 0.655 2.992 -3.357
169 HD11 LEU 26 HD11 LEU 26 1.490 0.725 -1.686
170 HD12 LEU 26 HD12 LEU 26 2.776 1.839 -2.153
171 HD13 LEU 26 HD13 LEU 26 1.794 1.057 -3.391
172 HD21 LEU 26 HD21 LEU 26 -1.336 2.702 -2.323
173 HD22 LEU 26 HD22 LEU 26 -0.601 2.373 -0.754
174 HD23 LEU 26 HD23 LEU 26 -0.653 1.112 -1.985
175 H CYS 27 HN CYS 27 3.336 2.342 1.255
176 HA CYS 27 HA CYS 27 5.224 2.958 2.375
177 HB2 CYS 27 HB2 CYS 27 5.805 5.198 0.531
178 HB3 CYS 27 HB1 CYS 27 6.824 3.855 1.026
179 H ASP 28 HN ASP 28 3.368 3.869 3.852
180 HA ASP 28 HA ASP 28 3.910 6.727 4.321
181 HB2 ASP 28 HB2 ASP 28 1.554 5.844 5.710
182 HB3 ASP 28 HB1 ASP 28 1.710 7.091 4.479
183 H GLY 29 HN GLY 29 4.320 3.604 5.561
184 HA2 GLY 29 HA2 GLY 29 5.886 3.511 7.473
185 HA3 GLY 29 HA1 GLY 29 4.872 4.723 8.241
186 H ASP 30 HN ASP 30 2.431 3.334 7.185
187 HA ASP 30 HA ASP 30 2.306 1.294 9.288
188 HB2 ASP 30 HB2 ASP 30 0.501 3.329 8.381
189 HB3 ASP 30 HB1 ASP 30 -0.265 1.757 8.176
190 H LYS 31 HN LYS 31 2.892 -0.636 8.494
191 HA LYS 31 HA LYS 31 2.680 -1.496 5.852
192 HB2 LYS 31 HB2 LYS 31 3.133 -2.808 8.471
193 HB3 LYS 31 HB1 LYS 31 2.635 -3.849 7.146
194 HG2 LYS 31 HG2 LYS 31 4.517 -3.003 5.806
195 HG3 LYS 31 HG1 LYS 31 5.034 -2.035 7.187
196 HD2 LYS 31 HD2 LYS 31 6.271 -4.169 6.970
197 HD3 LYS 31 HD1 LYS 31 5.407 -4.016 8.500
198 HE2 LYS 31 HE2 LYS 31 3.991 -5.712 8.022
199 HE3 LYS 31 HE1 LYS 31 3.920 -5.309 6.308
200 HZ1 LYS 31 HZ1 LYS 31 6.049 -6.349 5.981
201 HZ2 LYS 31 HZ2 LYS 31 5.012 -7.447 6.740
202 HZ3 LYS 31 HZ3 LYS 31 6.209 -6.657 7.637
203 H ASP 32 HN ASP 32 0.703 -1.201 4.910
204 HA ASP 32 HA ASP 32 -1.689 -2.261 6.169
205 HB2 ASP 32 HB2 ASP 32 -1.516 -1.106 3.391
206 HB3 ASP 32 HB1 ASP 32 -2.915 -1.179 4.457
207 H CYS 33 HN CYS 33 0.521 -3.045 3.577
208 HA CYS 33 HA CYS 33 -1.049 -5.008 2.297
209 HB2 CYS 33 HB2 CYS 33 1.705 -4.057 2.186
210 HB3 CYS 33 HB1 CYS 33 1.594 -5.794 1.934
211 H ALA 34 HN ALA 34 0.161 -7.350 2.181
212 HA ALA 34 HA ALA 34 -0.433 -8.535 4.722
213 HB1 ALA 34 HB1 ALA 34 -0.931 -9.574 2.489
214 HB2 ALA 34 HB2 ALA 34 -0.130 -10.632 3.650
215 HB3 ALA 34 HB3 ALA 34 0.796 -9.902 2.339
216 H ASP 35 HN ASP 35 2.502 -8.128 2.769
217 HA ASP 35 HA ASP 35 4.083 -8.726 5.183
218 HB2 ASP 35 HB2 ASP 35 4.164 -9.997 2.646
219 HB3 ASP 35 HB1 ASP 35 5.651 -9.067 2.805
220 H GLY 36 HN GLY 36 3.039 -6.158 4.308
221 HA2 GLY 36 HA2 GLY 36 3.785 -3.986 4.286
222 HA3 GLY 36 HA1 GLY 36 5.387 -4.607 4.646
223 H ALA 37 HN ALA 37 3.561 -5.576 1.819
224 HA ALA 37 HA ALA 37 5.641 -5.083 0.026
225 HB1 ALA 37 HB1 ALA 37 4.255 -6.387 -1.128
226 HB2 ALA 37 HB2 ALA 37 3.335 -4.930 -1.505
227 HB3 ALA 37 HB3 ALA 37 2.876 -5.932 -0.127
228 H ASP 38 HN ASP 38 2.825 -3.097 0.859
229 HA ASP 38 HA ASP 38 3.176 -1.057 -1.002
230 HB2 ASP 38 HB2 ASP 38 1.941 0.374 0.645
231 HB3 ASP 38 HB1 ASP 38 1.154 -1.161 0.295
232 H GLU 39 HN GLU 39 4.884 -1.748 1.945
233 HA GLU 39 HA GLU 39 6.258 0.826 1.890
234 HB2 GLU 39 HB2 GLU 39 6.597 -1.458 3.837
235 HB3 GLU 39 HB1 GLU 39 7.187 0.186 4.027
236 HG2 GLU 39 HG2 GLU 39 4.403 0.337 3.594
237 HG3 GLU 39 HG1 GLU 39 4.685 -0.922 4.794
238 H SER 40 HN SER 40 6.604 -1.547 -0.052
239 HA SER 40 HA SER 40 9.540 -1.613 0.122
240 HB2 SER 40 HB2 SER 40 7.918 -3.817 0.483
241 HB3 SER 40 HB1 SER 40 8.359 -3.931 -1.220
242 HG SER 40 HG SER 40 10.228 -3.546 0.878
243 H ILE 41 HN ILE 41 10.132 -2.859 -2.216
244 HA ILE 41 HA ILE 41 9.662 -0.790 -4.130
245 HB ILE 41 HB ILE 41 11.137 -3.404 -4.237
246 HG12 ILE 41 HG12 ILE 41 13.083 -1.948 -4.517
247 HG13 ILE 41 HG11 ILE 41 12.036 -0.535 -4.539
248 HG21 ILE 41 HG21 ILE 41 10.252 -1.714 -6.492
249 HG22 ILE 41 HG22 ILE 41 10.613 -3.439 -6.439
250 HG23 ILE 41 HG23 ILE 41 11.927 -2.265 -6.527
251 HD11 ILE 41 HD11 ILE 41 13.269 -1.067 -2.380
252 HD12 ILE 41 HD12 ILE 41 12.118 -2.390 -2.191
253 HD13 ILE 41 HD13 ILE 41 11.542 -0.725 -2.268
254 H ALA 42 HN ALA 42 8.248 -3.885 -3.440
255 HA ALA 42 HA ALA 42 7.126 -4.608 -5.854
256 HB1 ALA 42 HB1 ALA 42 5.502 -4.887 -3.369
257 HB2 ALA 42 HB2 ALA 42 7.049 -5.726 -3.491
258 HB3 ALA 42 HB3 ALA 42 5.778 -6.044 -4.671
259 H ALA 43 HN ALA 43 6.274 -1.970 -3.770
260 HA ALA 43 HA ALA 43 3.797 -1.493 -5.262
261 HB1 ALA 43 HB1 ALA 43 2.959 -0.541 -3.418
262 HB2 ALA 43 HB2 ALA 43 4.445 0.348 -3.082
263 HB3 ALA 43 HB3 ALA 43 4.297 -1.340 -2.591
264 H GLY 44 HN GLY 44 6.792 -0.896 -5.978
265 HA2 GLY 44 HA2 GLY 44 7.643 0.618 -7.516
266 HA3 GLY 44 HA1 GLY 44 6.176 1.569 -7.350
267 H CYS 45 HN CYS 45 7.774 0.728 -4.422
268 HA CYS 45 HA CYS 45 8.715 3.501 -4.188
269 HB2 CYS 45 HB2 CYS 45 7.375 1.659 -2.363
270 HB3 CYS 45 HB1 CYS 45 8.802 2.395 -1.648
271 H LEU 46 HN LEU 46 10.743 3.318 -5.097
272 HA LEU 46 HA LEU 46 12.582 1.329 -3.988
273 HB2 LEU 46 HB2 LEU 46 13.392 3.256 -6.114
274 HB3 LEU 46 HB1 LEU 46 13.897 1.596 -5.863
275 HG LEU 46 HG LEU 46 11.105 2.256 -6.760
276 HD11 LEU 46 HD11 LEU 46 11.696 2.468 -8.934
277 HD12 LEU 46 HD12 LEU 46 13.115 1.434 -8.766
278 HD13 LEU 46 HD13 LEU 46 13.174 3.109 -8.217
279 HD21 LEU 46 HD21 LEU 46 12.811 -0.166 -6.542
280 HD22 LEU 46 HD22 LEU 46 11.653 -0.079 -7.869
281 HD23 LEU 46 HD23 LEU 46 11.094 0.045 -6.201
282 H TYR 47 HN TYR 47 12.442 4.834 -4.595
283 HA TYR 47 HA TYR 47 14.794 5.650 -3.473
284 HB2 TYR 47 HB2 TYR 47 13.823 7.801 -3.181
285 HB3 TYR 47 HB1 TYR 47 13.033 7.088 -4.581
286 HD1 TYR 47 HD1 TYR 47 10.841 5.637 -3.840
287 HD2 TYR 47 HD2 TYR 47 12.455 8.978 -1.761
288 HE1 TYR 47 HE1 TYR 47 8.646 6.049 -2.813
289 HE2 TYR 47 HE2 TYR 47 10.265 9.400 -0.726
290 HH TYR 47 HH TYR 47 7.484 8.305 -1.795
291 H ASN 48 HN ASN 48 11.845 4.725 -1.786
292 HA ASN 48 HA ASN 48 11.387 4.329 0.408
293 HB2 ASN 48 HB2 ASN 48 13.583 2.917 -0.124
294 HB3 ASN 48 HB1 ASN 48 14.278 4.016 1.064
295 HD21 ASN 48 HD21 ASN 48 11.194 2.290 0.716
296 HD22 ASN 48 HD22 ASN 48 11.215 1.589 2.295
297 H SER 49 HN SER 49 11.992 5.008 2.732
298 HA SER 49 HA SER 49 13.550 7.283 3.225
299 HB2 SER 49 HB2 SER 49 11.388 8.775 3.657
300 HB3 SER 49 HB1 SER 49 12.199 8.759 2.091
301 HG SER 49 HG SER 49 10.010 8.448 1.765
302 H THR 50 HN THR 50 13.732 5.379 4.790
303 HA THR 50 HA THR 50 11.678 5.253 6.826
304 HB THR 50 HB THR 50 13.415 3.708 7.930
305 HG1 THR 50 HG1 THR 50 15.281 4.074 6.948
306 HG21 THR 50 HG21 THR 50 11.479 2.865 6.649
307 HG22 THR 50 HG22 THR 50 12.906 1.835 6.530
308 HG23 THR 50 HG23 THR 50 12.473 2.899 5.192
Start of MODEL 20
1 H1 GLY 1 HT1 GLY 1 -18.057 1.913 6.135
2 H2 GLY 1 HT2 GLY 1 -18.076 1.190 7.664
3 H3 GLY 1 HT3 GLY 1 -18.395 0.262 6.286
4 HA2 GLY 1 HA1 GLY 1 -16.019 0.346 7.477
5 HA3 GLY 1 HA2 GLY 1 -16.246 -0.013 5.772
6 H SER 2 HN SER 2 -16.606 3.091 7.437
7 HA SER 2 HA SER 2 -15.602 5.108 7.127
8 HB2 SER 2 HB2 SER 2 -13.232 3.414 6.299
9 HB3 SER 2 HB1 SER 2 -13.174 5.125 6.724
10 HG SER 2 HG SER 2 -12.683 4.137 8.586
11 H GLU 3 HN GLU 3 -17.115 3.940 4.963
12 HA GLU 3 HA GLU 3 -17.643 4.354 2.791
13 HB2 GLU 3 HB2 GLU 3 -16.743 6.727 3.789
14 HB3 GLU 3 HB1 GLU 3 -15.666 6.507 2.417
15 HG2 GLU 3 HG2 GLU 3 -17.948 5.967 1.189
16 HG3 GLU 3 HG1 GLU 3 -18.589 6.977 2.484
17 H GLY 4 HN GLY 4 -16.250 5.108 0.576
18 HA2 GLY 4 HA2 GLY 4 -14.707 2.766 0.039
19 HA3 GLY 4 HA1 GLY 4 -14.972 4.111 -1.061
20 H LYS 5 HN LYS 5 -12.943 2.842 1.493
21 HA LYS 5 HA LYS 5 -10.802 4.632 0.584
22 HB2 LYS 5 HB2 LYS 5 -12.056 5.100 2.934
23 HB3 LYS 5 HB1 LYS 5 -10.810 3.980 3.470
24 HG2 LYS 5 HG2 LYS 5 -9.339 5.662 1.955
25 HG3 LYS 5 HG1 LYS 5 -10.589 6.760 2.544
26 HD2 LYS 5 HD2 LYS 5 -10.052 5.626 4.851
27 HD3 LYS 5 HD1 LYS 5 -8.520 5.239 4.064
28 HE2 LYS 5 HE2 LYS 5 -8.783 7.855 3.412
29 HE3 LYS 5 HE1 LYS 5 -9.582 7.826 4.983
30 HZ1 LYS 5 HZ1 LYS 5 -6.851 7.866 4.461
31 HZ2 LYS 5 HZ2 LYS 5 -7.188 6.351 5.131
32 HZ3 LYS 5 HZ3 LYS 5 -7.615 7.758 5.966
33 H THR 6 HN THR 6 -11.427 1.824 0.032
34 HA THR 6 HA THR 6 -9.217 0.454 1.392
35 HB THR 6 HB THR 6 -10.430 -1.458 -0.155
36 HG1 THR 6 HG1 THR 6 -12.491 0.215 0.835
37 HG21 THR 6 HG21 THR 6 -10.035 -2.028 2.049
38 HG22 THR 6 HG22 THR 6 -11.796 -1.961 1.962
39 HG23 THR 6 HG23 THR 6 -10.896 -0.621 2.674
40 H CYS 7 HN CYS 7 -10.559 -0.063 -1.851
41 HA CYS 7 HA CYS 7 -7.825 -0.003 -2.905
42 HB2 CYS 7 HB2 CYS 7 -10.296 -0.978 -4.338
43 HB3 CYS 7 HB1 CYS 7 -8.616 -1.298 -4.750
44 H GLY 8 HN GLY 8 -11.039 0.866 -4.201
45 HA2 GLY 8 HA2 GLY 8 -11.738 2.709 -5.383
46 HA3 GLY 8 HA1 GLY 8 -10.421 3.587 -4.621
47 HA PRO 9 HA PRO 9 -9.815 3.242 -9.311
48 HB2 PRO 9 HB2 PRO 9 -8.967 5.889 -9.433
49 HB3 PRO 9 HB1 PRO 9 -10.590 5.315 -9.825
50 HG2 PRO 9 HG2 PRO 9 -9.568 6.541 -7.302
51 HG3 PRO 9 HG1 PRO 9 -11.130 6.770 -8.110
52 HD2 PRO 9 HD2 PRO 9 -10.907 5.225 -5.941
53 HD3 PRO 9 HD1 PRO 9 -11.990 4.780 -7.278
54 H SER 10 HN SER 10 -7.929 4.989 -6.852
55 HA SER 10 HA SER 10 -5.459 4.077 -8.153
56 HB2 SER 10 HB2 SER 10 -4.315 5.820 -6.935
57 HB3 SER 10 HB1 SER 10 -5.742 6.527 -7.693
58 HG SER 10 HG SER 10 -6.600 6.866 -5.785
59 H SER 11 HN SER 11 -5.228 2.002 -7.401
60 HA SER 11 HA SER 11 -4.517 1.763 -4.583
61 HB2 SER 11 HB2 SER 11 -5.879 -0.609 -5.006
62 HB3 SER 11 HB1 SER 11 -6.471 0.768 -4.080
63 HG SER 11 HG SER 11 -7.611 -0.228 -6.147
64 H PHE 12 HN PHE 12 -3.068 0.107 -4.127
65 HA PHE 12 HA PHE 12 -1.808 -1.095 -6.497
66 HB2 PHE 12 HB2 PHE 12 -0.151 0.191 -5.482
67 HB3 PHE 12 HB1 PHE 12 -0.737 -0.152 -3.860
68 HD1 PHE 12 HD2 PHE 12 0.730 -1.948 -6.787
69 HD2 PHE 12 HD1 PHE 12 0.483 -1.581 -2.555
70 HE1 PHE 12 HE2 PHE 12 2.436 -3.706 -6.539
71 HE2 PHE 12 HE1 PHE 12 2.188 -3.338 -2.301
72 HZ PHE 12 HZ PHE 12 3.166 -4.402 -4.290
73 H SER 13 HN SER 13 -1.138 -3.274 -6.425
74 HA SER 13 HA SER 13 -2.665 -4.898 -4.515
75 HB2 SER 13 HB2 SER 13 -3.182 -6.281 -6.211
76 HB3 SER 13 HB1 SER 13 -2.622 -4.988 -7.267
77 HG SER 13 HG SER 13 -0.774 -6.038 -7.609
78 H CYS 14 HN CYS 14 -1.602 -5.982 -3.001
79 HA CYS 14 HA CYS 14 1.265 -5.966 -2.940
80 HB2 CYS 14 HB2 CYS 14 -0.905 -6.521 -1.085
81 HB3 CYS 14 HB1 CYS 14 0.420 -7.661 -0.906
82 HA PRO 15 HA PRO 15 2.080 -9.853 -4.862
83 HB2 PRO 15 HB2 PRO 15 4.383 -10.537 -3.592
84 HB3 PRO 15 HB1 PRO 15 4.303 -9.274 -4.826
85 HG2 PRO 15 HG2 PRO 15 4.297 -9.010 -1.841
86 HG3 PRO 15 HG1 PRO 15 5.202 -8.070 -3.043
87 HD2 PRO 15 HD2 PRO 15 2.946 -7.142 -1.912
88 HD3 PRO 15 HD1 PRO 15 3.367 -6.780 -3.597
89 H GLY 16 HN GLY 16 1.453 -11.913 -4.563
90 HA2 GLY 16 HA2 GLY 16 0.804 -13.855 -3.526
91 HA3 GLY 16 HA1 GLY 16 1.844 -13.394 -2.188
92 H THR 17 HN THR 17 -0.883 -11.503 -3.361
93 HA THR 17 HA THR 17 -2.858 -12.446 -1.634
94 HB THR 17 HB THR 17 -1.606 -11.785 0.256
95 HG1 THR 17 HG1 THR 17 -3.351 -10.887 0.959
96 HG21 THR 17 HG21 THR 17 -1.120 -9.126 -1.062
97 HG22 THR 17 HG22 THR 17 0.076 -10.397 -0.812
98 HG23 THR 17 HG23 THR 17 -0.641 -9.576 0.574
99 H HIS 18 HN HIS 18 -4.774 -11.179 -1.673
100 HA HIS 18 HA HIS 18 -4.876 -9.400 -3.970
101 HB2 HIS 18 HB2 HIS 18 -6.611 -11.320 -2.931
102 HB3 HIS 18 HB1 HIS 18 -7.403 -9.784 -2.589
103 HD1 HIS 18 HD1 HIS 18 -6.024 -8.611 -5.398
104 HD2 HIS 18 HD2 HIS 18 -8.635 -11.794 -4.845
105 HE1 HIS 18 HE1 HIS 18 -7.184 -8.970 -7.616
106 H VAL 19 HN VAL 19 -4.151 -8.921 -0.841
107 HA VAL 19 HA VAL 19 -5.825 -6.885 0.064
108 HB VAL 19 HB VAL 19 -4.281 -7.835 1.602
109 HG11 VAL 19 HG11 VAL 19 -2.229 -8.459 1.044
110 HG12 VAL 19 HG12 VAL 19 -1.764 -6.788 0.727
111 HG13 VAL 19 HG13 VAL 19 -2.484 -7.761 -0.555
112 HG21 VAL 19 HG21 VAL 19 -3.895 -5.947 2.739
113 HG22 VAL 19 HG22 VAL 19 -4.593 -5.120 1.346
114 HG23 VAL 19 HG23 VAL 19 -2.843 -5.298 1.480
115 H CYS 20 HN CYS 20 -6.201 -4.903 -0.664
116 HA CYS 20 HA CYS 20 -4.312 -3.729 -2.576
117 HB2 CYS 20 HB2 CYS 20 -6.121 -2.445 -3.443
118 HB3 CYS 20 HB1 CYS 20 -6.727 -4.083 -3.233
119 H VAL 21 HN VAL 21 -4.051 -1.358 -2.512
120 HA VAL 21 HA VAL 21 -4.528 -0.035 0.012
121 HB VAL 21 HB VAL 21 -2.499 -1.159 0.615
122 HG11 VAL 21 HG11 VAL 21 -0.448 -0.364 -0.968
123 HG12 VAL 21 HG12 VAL 21 -1.743 -0.551 -2.150
124 HG13 VAL 21 HG13 VAL 21 -1.290 -1.906 -1.117
125 HG21 VAL 21 HG21 VAL 21 -2.611 1.115 1.390
126 HG22 VAL 21 HG22 VAL 21 -1.949 1.709 -0.133
127 HG23 VAL 21 HG23 VAL 21 -0.945 0.743 0.947
128 HA PRO 22 HA PRO 22 -4.764 3.284 -2.946
129 HB2 PRO 22 HB2 PRO 22 -5.011 5.350 -1.209
130 HB3 PRO 22 HB1 PRO 22 -6.332 4.227 -1.550
131 HG2 PRO 22 HG2 PRO 22 -4.440 4.279 0.767
132 HG3 PRO 22 HG1 PRO 22 -6.188 3.984 0.755
133 HD2 PRO 22 HD2 PRO 22 -4.354 1.986 0.919
134 HD3 PRO 22 HD1 PRO 22 -5.938 1.779 0.147
135 H GLU 23 HN GLU 23 -3.409 4.802 -3.859
136 HA GLU 23 HA GLU 23 -0.693 4.644 -3.487
137 HB2 GLU 23 HB2 GLU 23 -2.398 6.065 -5.160
138 HB3 GLU 23 HB1 GLU 23 -1.478 7.318 -4.338
139 HG2 GLU 23 HG2 GLU 23 0.600 6.042 -4.991
140 HG3 GLU 23 HG1 GLU 23 -0.438 5.066 -6.030
141 H ARG 24 HN ARG 24 -2.966 6.861 -1.933
142 HA ARG 24 HA ARG 24 -1.124 8.552 -0.683
143 HB2 ARG 24 HB2 ARG 24 -2.920 9.100 0.878
144 HB3 ARG 24 HB1 ARG 24 -3.535 9.015 -0.767
145 HG2 ARG 24 HG2 ARG 24 -4.792 7.162 -0.352
146 HG3 ARG 24 HG1 ARG 24 -3.704 6.568 0.904
147 HD2 ARG 24 HD2 ARG 24 -5.698 8.816 1.116
148 HD3 ARG 24 HD1 ARG 24 -5.746 7.260 1.945
149 HE ARG 24 HE ARG 24 -3.412 8.312 2.789
150 HH11 ARG 24 HH11 ARG 24 -6.668 9.566 2.683
151 HH12 ARG 24 HH12 ARG 24 -6.453 10.587 4.065
152 HH21 ARG 24 HH21 ARG 24 -3.129 9.653 4.608
153 HH22 ARG 24 HH22 ARG 24 -4.444 10.637 5.158
154 H TRP 25 HN TRP 25 -2.165 5.322 0.073
155 HA TRP 25 HA TRP 25 -0.892 5.339 2.687
156 HB2 TRP 25 HB2 TRP 25 -2.506 3.327 1.143
157 HB3 TRP 25 HB1 TRP 25 -1.586 2.843 2.564
158 HD1 TRP 25 HD1 TRP 25 -3.110 6.274 2.799
159 HE1 TRP 25 HE1 TRP 25 -5.124 6.215 4.401
160 HE3 TRP 25 HE3 TRP 25 -3.565 1.211 3.344
161 HZ2 TRP 25 HZ2 TRP 25 -6.697 4.278 5.721
162 HZ3 TRP 25 HZ3 TRP 25 -5.350 0.337 4.794
163 HH2 TRP 25 HH2 TRP 25 -6.882 1.839 5.958
164 H LEU 26 HN LEU 26 -0.235 4.389 -0.577
165 HA LEU 26 HA LEU 26 1.723 2.446 -0.229
166 HB2 LEU 26 HB2 LEU 26 1.087 4.443 -2.335
167 HB3 LEU 26 HB1 LEU 26 2.651 3.660 -2.414
168 HG LEU 26 HG LEU 26 1.017 2.527 -3.824
169 HD11 LEU 26 HD11 LEU 26 2.836 1.334 -2.368
170 HD12 LEU 26 HD12 LEU 26 1.658 0.394 -3.285
171 HD13 LEU 26 HD13 LEU 26 1.432 0.646 -1.554
172 HD21 LEU 26 HD21 LEU 26 -0.556 2.496 -1.299
173 HD22 LEU 26 HD22 LEU 26 -0.737 1.160 -2.431
174 HD23 LEU 26 HD23 LEU 26 -1.080 2.807 -2.953
175 H CYS 27 HN CYS 27 3.494 2.571 0.977
176 HA CYS 27 HA CYS 27 5.379 3.350 1.990
177 HB2 CYS 27 HB2 CYS 27 5.646 5.316 -0.268
178 HB3 CYS 27 HB1 CYS 27 6.920 4.490 0.622
179 H ASP 28 HN ASP 28 3.283 4.350 3.221
180 HA ASP 28 HA ASP 28 3.702 7.247 3.466
181 HB2 ASP 28 HB2 ASP 28 1.517 7.253 4.643
182 HB3 ASP 28 HB1 ASP 28 1.401 6.629 3.001
183 H GLY 29 HN GLY 29 4.231 4.258 5.047
184 HA2 GLY 29 HA2 GLY 29 5.894 4.436 6.886
185 HA3 GLY 29 HA1 GLY 29 4.863 5.693 7.552
186 H ASP 30 HN ASP 30 2.548 3.855 6.533
187 HA ASP 30 HA ASP 30 2.519 2.180 8.952
188 HB2 ASP 30 HB2 ASP 30 0.360 3.572 7.405
189 HB3 ASP 30 HB1 ASP 30 -0.035 2.152 8.369
190 H LYS 31 HN LYS 31 3.159 0.177 8.465
191 HA LYS 31 HA LYS 31 3.054 -1.033 5.949
192 HB2 LYS 31 HB2 LYS 31 3.582 -1.918 8.714
193 HB3 LYS 31 HB1 LYS 31 3.063 -3.180 7.608
194 HG2 LYS 31 HG2 LYS 31 4.897 -2.351 6.054
195 HG3 LYS 31 HG1 LYS 31 5.496 -1.438 7.440
196 HD2 LYS 31 HD2 LYS 31 5.935 -3.387 8.675
197 HD3 LYS 31 HD1 LYS 31 4.943 -4.384 7.611
198 HE2 LYS 31 HE2 LYS 31 6.682 -4.825 6.301
199 HE3 LYS 31 HE1 LYS 31 7.042 -3.109 6.116
200 HZ1 LYS 31 HZ1 LYS 31 7.971 -3.520 8.561
201 HZ2 LYS 31 HZ2 LYS 31 8.919 -3.722 7.175
202 HZ3 LYS 31 HZ3 LYS 31 8.214 -5.067 7.920
203 H ASP 32 HN ASP 32 0.939 -0.688 5.128
204 HA ASP 32 HA ASP 32 -1.367 -1.752 6.446
205 HB2 ASP 32 HB2 ASP 32 -1.168 -1.109 3.506
206 HB3 ASP 32 HB1 ASP 32 -2.598 -1.071 4.533
207 H CYS 33 HN CYS 33 1.016 -2.967 4.255
208 HA CYS 33 HA CYS 33 -0.527 -5.274 3.455
209 HB2 CYS 33 HB2 CYS 33 1.298 -4.032 2.097
210 HB3 CYS 33 HB1 CYS 33 2.434 -4.960 3.071
211 H ALA 34 HN ALA 34 0.391 -7.482 3.758
212 HA ALA 34 HA ALA 34 0.682 -8.079 6.491
213 HB1 ALA 34 HB1 ALA 34 1.584 -10.333 5.294
214 HB2 ALA 34 HB2 ALA 34 0.702 -9.582 3.964
215 HB3 ALA 34 HB3 ALA 34 -0.121 -9.926 5.485
216 H ASP 35 HN ASP 35 3.011 -7.663 3.892
217 HA ASP 35 HA ASP 35 5.181 -7.923 5.870
218 HB2 ASP 35 HB2 ASP 35 4.902 -9.004 3.128
219 HB3 ASP 35 HB1 ASP 35 6.479 -8.332 3.532
220 H GLY 36 HN GLY 36 3.520 -5.588 4.748
221 HA2 GLY 36 HA2 GLY 36 3.929 -3.362 4.378
222 HA3 GLY 36 HA1 GLY 36 5.602 -3.681 4.793
223 H ALA 37 HN ALA 37 4.107 -5.414 2.165
224 HA ALA 37 HA ALA 37 6.065 -4.833 0.307
225 HB1 ALA 37 HB1 ALA 37 3.608 -6.226 0.313
226 HB2 ALA 37 HB2 ALA 37 4.910 -6.317 -0.872
227 HB3 ALA 37 HB3 ALA 37 3.597 -5.160 -1.092
228 H ASP 38 HN ASP 38 3.103 -3.067 1.021
229 HA ASP 38 HA ASP 38 3.168 -1.281 -1.142
230 HB2 ASP 38 HB2 ASP 38 1.914 0.260 0.550
231 HB3 ASP 38 HB1 ASP 38 1.150 -1.230 0.011
232 H GLU 39 HN GLU 39 5.093 -1.459 1.717
233 HA GLU 39 HA GLU 39 6.088 1.268 1.349
234 HB2 GLU 39 HB2 GLU 39 6.865 -0.681 3.515
235 HB3 GLU 39 HB1 GLU 39 7.098 1.060 3.502
236 HG2 GLU 39 HG2 GLU 39 4.323 0.471 3.190
237 HG3 GLU 39 HG1 GLU 39 4.958 -0.400 4.583
238 H SER 40 HN SER 40 6.684 -1.180 -0.384
239 HA SER 40 HA SER 40 9.607 -0.876 -0.307
240 HB2 SER 40 HB2 SER 40 8.247 -3.236 0.300
241 HB3 SER 40 HB1 SER 40 8.799 -3.460 -1.359
242 HG SER 40 HG SER 40 10.358 -4.117 0.204
243 H ILE 41 HN ILE 41 10.477 -2.000 -2.476
244 HA ILE 41 HA ILE 41 9.669 -0.331 -4.582
245 HB ILE 41 HB ILE 41 11.339 -2.834 -4.543
246 HG12 ILE 41 HG12 ILE 41 13.093 -1.065 -5.192
247 HG13 ILE 41 HG11 ILE 41 11.888 0.118 -4.698
248 HG21 ILE 41 HG21 ILE 41 10.349 -2.778 -6.730
249 HG22 ILE 41 HG22 ILE 41 12.026 -2.245 -6.858
250 HG23 ILE 41 HG23 ILE 41 10.719 -1.061 -6.899
251 HD11 ILE 41 HD11 ILE 41 12.585 -2.070 -2.815
252 HD12 ILE 41 HD12 ILE 41 12.072 -0.414 -2.489
253 HD13 ILE 41 HD13 ILE 41 13.718 -0.736 -3.035
254 H ALA 42 HN ALA 42 8.433 -3.348 -3.472
255 HA ALA 42 HA ALA 42 7.363 -4.509 -5.728
256 HB1 ALA 42 HB1 ALA 42 6.055 -5.768 -4.324
257 HB2 ALA 42 HB2 ALA 42 5.695 -4.407 -3.261
258 HB3 ALA 42 HB3 ALA 42 7.277 -5.185 -3.193
259 H ALA 43 HN ALA 43 6.204 -1.737 -3.918
260 HA ALA 43 HA ALA 43 3.762 -1.547 -5.456
261 HB1 ALA 43 HB1 ALA 43 3.804 0.762 -4.112
262 HB2 ALA 43 HB2 ALA 43 4.917 -0.171 -3.111
263 HB3 ALA 43 HB3 ALA 43 3.278 -0.759 -3.392
264 H GLY 44 HN GLY 44 6.988 -0.336 -5.616
265 HA2 GLY 44 HA2 GLY 44 7.827 0.595 -7.651
266 HA3 GLY 44 HA1 GLY 44 6.228 1.248 -7.972
267 H CYS 45 HN CYS 45 8.074 1.476 -4.964
268 HA CYS 45 HA CYS 45 7.868 4.388 -5.141
269 HB2 CYS 45 HB2 CYS 45 8.100 2.419 -2.928
270 HB3 CYS 45 HB1 CYS 45 8.832 3.998 -2.673
271 H LEU 46 HN LEU 46 10.290 2.034 -4.001
272 HA LEU 46 HA LEU 46 12.553 1.940 -4.258
273 HB2 LEU 46 HB2 LEU 46 12.380 4.233 -6.197
274 HB3 LEU 46 HB1 LEU 46 13.611 2.989 -6.098
275 HG LEU 46 HG LEU 46 10.918 1.949 -6.621
276 HD11 LEU 46 HD11 LEU 46 10.387 3.593 -8.074
277 HD12 LEU 46 HD12 LEU 46 11.448 2.676 -9.144
278 HD13 LEU 46 HD13 LEU 46 12.064 4.093 -8.293
279 HD21 LEU 46 HD21 LEU 46 13.544 1.602 -8.059
280 HD22 LEU 46 HD22 LEU 46 12.109 0.588 -8.214
281 HD23 LEU 46 HD23 LEU 46 13.003 0.624 -6.694
282 H TYR 47 HN TYR 47 11.290 3.573 -2.266
283 HA TYR 47 HA TYR 47 12.913 5.970 -2.043
284 HB2 TYR 47 HB2 TYR 47 10.976 4.826 -0.023
285 HB3 TYR 47 HB1 TYR 47 11.629 6.458 -0.056
286 HD1 TYR 47 HD1 TYR 47 11.144 6.068 -3.355
287 HD2 TYR 47 HD2 TYR 47 8.809 6.208 0.200
288 HE1 TYR 47 HE1 TYR 47 9.203 6.813 -4.663
289 HE2 TYR 47 HE2 TYR 47 6.862 6.954 -1.102
290 HH TYR 47 HH TYR 47 6.339 8.005 -3.195
291 H ASN 48 HN ASN 48 12.691 2.770 -0.623
292 HA ASN 48 HA ASN 48 14.137 1.564 0.652
293 HB2 ASN 48 HB2 ASN 48 15.793 2.674 -1.007
294 HB3 ASN 48 HB1 ASN 48 16.213 3.718 0.347
295 HD21 ASN 48 HD21 ASN 48 17.336 2.889 2.071
296 HD22 ASN 48 HD22 ASN 48 18.067 1.324 2.051
297 H SER 49 HN SER 49 12.334 3.321 1.899
298 HA SER 49 HA SER 49 13.456 4.949 3.883
299 HB2 SER 49 HB2 SER 49 11.248 4.564 5.075
300 HB3 SER 49 HB1 SER 49 11.125 5.172 3.424
301 HG SER 49 HG SER 49 9.965 3.480 3.024
302 H THR 50 HN THR 50 11.804 1.889 4.618
303 HA THR 50 HA THR 50 14.061 0.827 6.039
304 HB THR 50 HB THR 50 13.401 2.331 7.763
305 HG1 THR 50 HG1 THR 50 13.661 0.673 9.007
306 HG21 THR 50 HG21 THR 50 11.057 2.681 6.808
307 HG22 THR 50 HG22 THR 50 11.255 2.716 8.561
308 HG23 THR 50 HG23 THR 50 10.602 1.278 7.775
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