Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
643126 | 6g4u RC | 34252 | cing | 1-original | 2 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 H1 PHE 1 HN PHE 1 0.280 0.644 0.985
2 HA PHE 1 HA PHE 1 0.582 2.873 0.016
3 HB2 PHE 1 HB1 PHE 1 2.517 0.734 -1.130
4 HB3 PHE 1 HB2 PHE 1 2.881 2.499 -0.977
5 HD1 PHE 1 HD1 PHE 1 2.706 3.534 1.392
6 HD2 PHE 1 HD2 PHE 1 2.978 -0.698 0.677
7 HE1 PHE 1 HE1 PHE 1 3.459 3.183 3.725
8 HE2 PHE 1 HE2 PHE 1 3.731 -1.041 3.011
9 HZ PHE 1 HZ PHE 1 3.966 0.898 4.536
10 H LEU 2 HN LEU 2 0.411 0.206 -2.328
11 HA LEU 2 HA LEU 2 0.381 1.835 -4.578
12 HB2 LEU 2 HB1 LEU 2 -0.108 -0.026 -5.932
13 HB3 LEU 2 HB2 LEU 2 1.116 -0.457 -4.711
14 HG LEU 2 HG LEU 2 -1.862 -1.215 -4.508
15 HD11 LEU 2 HD11 LEU 2 0.509 -2.866 -5.571
16 HD12 LEU 2 HD12 LEU 2 -0.846 -2.188 -6.553
17 HD13 LEU 2 HD13 LEU 2 -1.174 -3.459 -5.318
18 HD21 LEU 2 HD21 LEU 2 -0.714 -1.352 -2.281
19 HD22 LEU 2 HD22 LEU 2 0.638 -2.290 -3.029
20 HD23 LEU 2 HD23 LEU 2 -1.013 -2.996 -2.933
21 HA PRO 3 HA PRO 3 -4.230 1.708 -5.188
22 HB2 PRO 3 HB1 PRO 3 -6.036 1.869 -3.065
23 HB3 PRO 3 HB2 PRO 3 -5.431 0.305 -3.727
24 HG2 PRO 3 HG1 PRO 3 -4.344 1.831 -1.296
25 HG3 PRO 3 HG2 PRO 3 -4.804 0.085 -1.401
26 HD2 PRO 3 HD1 PRO 3 -2.195 0.914 -1.695
27 HD3 PRO 3 HD2 PRO 3 -2.863 -0.439 -2.718
28 H ILE 4 HN ILE 4 -3.221 3.557 -2.251
29 HA ILE 4 HA ILE 4 -4.551 5.922 -3.086
30 HB ILE 4 HB ILE 4 -3.163 7.111 -1.432
31 HG12 ILE 4 HG11 ILE 4 -1.987 4.322 -0.812
32 HG13 ILE 4 HG12 ILE 4 -1.087 5.671 -1.574
33 HG21 ILE 4 HG21 ILE 4 -4.541 4.520 -0.447
34 HG22 ILE 4 HG22 ILE 4 -4.334 6.051 0.473
35 HG23 ILE 4 HG23 ILE 4 -5.395 6.019 -0.974
36 HD11 ILE 4 HD1 ILE 4 -1.492 7.092 0.481
37 HD12 ILE 4 HD2 ILE 4 -2.285 5.680 1.272
38 HD13 ILE 4 HD3 ILE 4 -0.550 5.596 0.819
39 H LEU 5 HN LEU 5 -1.227 4.719 -3.652
40 HA LEU 5 HA LEU 5 -0.302 6.941 -5.073
41 HB2 LEU 5 HB1 LEU 5 0.993 5.026 -4.083
42 HB3 LEU 5 HB2 LEU 5 0.471 3.984 -5.430
43 HG LEU 5 HG LEU 5 1.975 6.635 -5.871
44 HD11 LEU 5 HD11 LEU 5 3.285 5.286 -4.243
45 HD12 LEU 5 HD12 LEU 5 4.113 5.349 -5.841
46 HD13 LEU 5 HD13 LEU 5 3.220 3.862 -5.347
47 HD21 LEU 5 HD21 LEU 5 1.804 4.038 -7.542
48 HD22 LEU 5 HD22 LEU 5 2.860 5.450 -7.922
49 HD23 LEU 5 HD23 LEU 5 1.074 5.633 -7.974
50 H ALA 6 HN ALA 6 -1.995 3.974 -6.289
51 HA ALA 6 HA ALA 6 -2.058 4.750 -8.977
52 HB1 ALA 6 HB1 ALA 6 -3.880 3.034 -9.157
53 HB2 ALA 6 HB2 ALA 6 -2.517 2.434 -8.140
54 HB3 ALA 6 HB3 ALA 6 -4.024 3.020 -7.357
55 H SER 7 HN SER 7 -4.446 5.386 -6.356
56 HA SER 7 HA SER 7 -6.299 6.745 -7.949
57 HB2 SER 7 HB1 SER 7 -6.691 5.907 -5.594
58 HB3 SER 7 HB2 SER 7 -5.727 7.279 -4.972
59 HG SER 7 HG1 SER 7 -7.294 8.661 -6.035
60 H LEU 8 HN LEU 8 -3.500 8.175 -6.081
61 HA LEU 8 HA LEU 8 -4.125 10.782 -7.035
62 HB2 LEU 8 HB1 LEU 8 -2.207 11.617 -5.959
63 HB3 LEU 8 HB2 LEU 8 -2.963 10.379 -4.920
64 HG LEU 8 HG LEU 8 -1.154 8.762 -6.034
65 HD11 LEU 8 HD11 LEU 8 1.041 9.915 -6.369
66 HD12 LEU 8 HD12 LEU 8 0.245 11.519 -6.193
67 HD13 LEU 8 HD13 LEU 8 -0.139 10.468 -7.608
68 HD21 LEU 8 HD21 LEU 8 0.343 9.251 -4.096
69 HD22 LEU 8 HD22 LEU 8 -1.392 9.255 -3.616
70 HD23 LEU 8 HD23 LEU 8 -0.509 10.816 -3.825
71 H ALA 9 HN ALA 9 -2.019 8.200 -8.324
72 HA ALA 9 HA ALA 9 -0.875 9.665 -10.389
73 HB1 ALA 9 HB1 ALA 9 -1.665 6.698 -10.267
74 HB2 ALA 9 HB2 ALA 9 -0.545 7.423 -11.477
75 HB3 ALA 9 HB3 ALA 9 -0.102 7.401 -9.728
76 H ALA 10 HN ALA 10 -4.000 7.828 -10.396
77 HA ALA 10 HA ALA 10 -4.744 8.570 -13.003
78 HB1 ALA 10 HB1 ALA 10 -5.790 6.711 -11.682
79 HB2 ALA 10 HB2 ALA 10 -6.460 7.914 -10.527
80 HB3 ALA 10 HB3 ALA 10 -7.038 7.887 -12.238
81 H LYS 11 HN LYS 11 -5.383 10.176 -9.867
82 HA LYS 11 HA LYS 11 -7.082 12.168 -10.796
83 HB2 LYS 11 HB1 LYS 11 -6.720 11.431 -8.425
84 HB3 LYS 11 HB2 LYS 11 -5.097 12.182 -8.454
85 HG2 LYS 11 HG1 LYS 11 -6.170 14.446 -8.769
86 HG3 LYS 11 HG2 LYS 11 -7.786 13.668 -8.714
87 HD2 LYS 11 HD1 LYS 11 -7.264 12.787 -6.415
88 HD3 LYS 11 HD2 LYS 11 -5.643 13.559 -6.497
89 HE2 LYS 11 HE1 LYS 11 -6.719 15.836 -6.622
90 HE3 LYS 11 HE2 LYS 11 -8.355 15.067 -6.538
91 HZ1 LYS 11 HZ1 LYS 11 -7.595 15.840 -4.378
92 HZ2 LYS 11 HZ2 LYS 11 -6.217 14.855 -4.468
93 HZ3 LYS 11 HZ3 LYS 11 -7.756 14.154 -4.387
94 H PHE 12 HN PHE 12 -3.501 12.376 -10.411
95 HA PHE 12 HA PHE 12 -3.460 14.446 -12.436
96 HB2 PHE 12 HB1 PHE 12 -2.309 16.188 -10.890
97 HB3 PHE 12 HB2 PHE 12 -4.080 15.973 -10.794
98 HD1 PHE 12 HD1 PHE 12 -4.428 16.904 -8.669
99 HD2 PHE 12 HD2 PHE 12 -1.526 13.755 -9.085
100 HE1 PHE 12 HE1 PHE 12 -4.195 16.780 -6.206
101 HE2 PHE 12 HE2 PHE 12 -1.325 13.614 -6.655
102 HZ PHE 12 HZ PHE 12 -2.647 15.114 -5.193
103 H GLY 13 HN GLY 13 -1.950 11.814 -11.260
104 HA2 GLY 13 HA1 GLY 13 0.767 12.832 -11.803
105 HA3 GLY 13 HA2 GLY 13 0.318 11.345 -10.948
106 HA PRO 14 HA PRO 14 -0.133 9.077 -14.580
107 HB2 PRO 14 HB1 PRO 14 -1.206 9.740 -17.070
108 HB3 PRO 14 HB2 PRO 14 -2.222 9.541 -15.591
109 HG2 PRO 14 HG1 PRO 14 -1.107 12.181 -16.703
110 HG3 PRO 14 HG2 PRO 14 -2.824 11.782 -16.273
111 HD2 PRO 14 HD1 PRO 14 -1.180 13.056 -14.460
112 HD3 PRO 14 HD2 PRO 14 -2.333 11.752 -13.925
113 H LYS 15 HN LYS 15 1.245 12.124 -15.565
114 HA LYS 15 HA LYS 15 2.835 11.180 -17.690
115 HB2 LYS 15 HB1 LYS 15 2.199 13.622 -16.755
116 HB3 LYS 15 HB2 LYS 15 3.779 13.502 -15.954
117 HG2 LYS 15 HG1 LYS 15 3.147 13.360 -18.985
118 HG3 LYS 15 HG2 LYS 15 3.828 14.734 -18.077
119 HD2 LYS 15 HD1 LYS 15 5.855 14.045 -18.779
120 HD3 LYS 15 HD2 LYS 15 5.734 12.882 -17.443
121 HE2 LYS 15 HE1 LYS 15 6.500 11.698 -19.458
122 HE3 LYS 15 HE2 LYS 15 4.821 11.139 -19.094
123 HZ1 LYS 15 HZ1 LYS 15 5.089 11.620 -21.422
124 HZ2 LYS 15 HZ2 LYS 15 5.598 13.207 -21.098
125 HZ3 LYS 15 HZ3 LYS 15 4.015 12.735 -20.732
126 H LEU 16 HN LEU 16 3.632 11.476 -14.155
127 HA LEU 16 HA LEU 16 6.201 10.255 -14.548
128 HB2 LEU 16 HB1 LEU 16 6.335 10.084 -12.097
129 HB3 LEU 16 HB2 LEU 16 6.143 11.742 -12.703
130 HG LEU 16 HG LEU 16 3.645 10.250 -11.794
131 HD11 LEU 16 HD11 LEU 16 4.066 10.953 -9.446
132 HD12 LEU 16 HD12 LEU 16 5.712 11.525 -9.900
133 HD13 LEU 16 HD13 LEU 16 5.303 9.772 -10.010
134 HD21 LEU 16 HD21 LEU 16 3.030 12.552 -10.982
135 HD22 LEU 16 HD22 LEU 16 3.393 12.578 -12.745
136 HD23 LEU 16 HD23 LEU 16 4.610 13.182 -11.556
137 H PHE 17 HN PHE 17 2.948 9.086 -13.587
138 HA PHE 17 HA PHE 17 3.750 6.529 -12.872
139 HB2 PHE 17 HB1 PHE 17 1.483 7.704 -12.500
140 HB3 PHE 17 HB2 PHE 17 1.066 7.285 -14.197
141 HD1 PHE 17 HD1 PHE 17 2.146 5.817 -10.896
142 HD2 PHE 17 HD2 PHE 17 0.173 5.133 -14.648
143 HE1 PHE 17 HE1 PHE 17 1.352 3.623 -10.076
144 HE2 PHE 17 HE2 PHE 17 -0.624 2.937 -13.828
145 HZ PHE 17 HZ PHE 17 -0.038 2.181 -11.537
146 H CYS 18 HN CYS 18 2.814 7.718 -16.161
147 HA CYS 18 HA CYS 18 3.065 5.203 -17.361
148 HB2 CYS 18 HB1 CYS 18 2.870 6.199 -19.484
149 HB3 CYS 18 HB2 CYS 18 1.806 7.093 -18.369
150 H LEU 19 HN LEU 19 5.659 7.681 -16.831
151 HA LEU 19 HA LEU 19 7.477 6.077 -18.374
152 HB2 LEU 19 HB1 LEU 19 9.230 7.570 -17.862
153 HB3 LEU 19 HB2 LEU 19 7.750 8.460 -18.307
154 HG LEU 19 HG LEU 19 7.437 8.590 -15.632
155 HD11 LEU 19 HD11 LEU 19 9.626 8.976 -14.496
156 HD12 LEU 19 HD12 LEU 19 10.511 8.502 -15.990
157 HD13 LEU 19 HD13 LEU 19 9.547 7.280 -15.087
158 HD21 LEU 19 HD21 LEU 19 8.527 10.829 -15.724
159 HD22 LEU 19 HD22 LEU 19 7.527 10.515 -17.192
160 HD23 LEU 19 HD23 LEU 19 9.331 10.384 -17.274
161 H VAL 20 HN VAL 20 6.905 6.365 -14.822
162 HA VAL 20 HA VAL 20 8.930 4.586 -14.079
163 HB VAL 20 HB VAL 20 6.308 5.358 -12.728
164 HG11 VAL 20 HG11 VAL 20 7.051 3.184 -11.727
165 HG12 VAL 20 HG12 VAL 20 8.743 3.797 -11.609
166 HG13 VAL 20 HG13 VAL 20 7.443 4.526 -10.603
167 HG21 VAL 20 HG21 VAL 20 7.847 6.810 -11.365
168 HG22 VAL 20 HG22 VAL 20 9.252 6.247 -12.336
169 HG23 VAL 20 HG23 VAL 20 7.959 7.240 -13.106
170 H THR 21 HN THR 21 5.497 3.882 -14.897
171 HA THR 21 HA THR 21 6.041 1.037 -14.421
172 HB THR 21 HB THR 21 3.707 0.603 -14.611
173 HG1 THR 21 HG1 THR 21 3.335 3.371 -15.028
174 HG21 THR 21 HG21 THR 21 4.592 1.497 -12.427
175 HG22 THR 21 HG22 THR 21 2.874 1.956 -12.716
176 HG23 THR 21 HG23 THR 21 4.176 3.170 -12.946
177 H LYS 22 HN LYS 22 7.054 2.669 -16.768
178 HA LYS 22 HA LYS 22 7.326 2.649 -18.909
179 HB2 LYS 22 HB1 LYS 22 8.815 0.945 -18.124
180 HB3 LYS 22 HB2 LYS 22 7.571 -0.314 -18.351
181 HG2 LYS 22 HG1 LYS 22 9.368 -0.309 -20.118
182 HG3 LYS 22 HG2 LYS 22 7.708 -0.188 -20.747
183 HD2 LYS 22 HD1 LYS 22 8.039 2.345 -20.979
184 HD3 LYS 22 HD2 LYS 22 9.769 2.094 -20.557
185 HE2 LYS 22 HE1 LYS 22 10.037 0.639 -22.599
186 HE3 LYS 22 HE2 LYS 22 8.260 0.744 -22.917
187 HZ1 LYS 22 HZ1 LYS 22 9.420 2.282 -24.298
188 HZ2 LYS 22 HZ2 LYS 22 10.201 3.004 -22.974
189 HZ3 LYS 22 HZ3 LYS 22 8.526 3.152 -23.157
190 H LYS 23 HN LYS 23 4.968 3.389 -19.001
191 HA LYS 23 HA LYS 23 3.745 1.876 -21.240
192 HB2 LYS 23 HB1 LYS 23 2.212 3.762 -19.381
193 HB3 LYS 23 HB2 LYS 23 1.578 2.560 -20.562
194 HG2 LYS 23 HG1 LYS 23 2.944 0.821 -19.132
195 HG3 LYS 23 HG2 LYS 23 2.976 2.099 -17.870
196 HD2 LYS 23 HD1 LYS 23 0.386 2.105 -18.001
197 HD3 LYS 23 HD2 LYS 23 0.524 0.667 -19.057
198 HE2 LYS 23 HE1 LYS 23 1.254 0.976 -16.079
199 HE3 LYS 23 HE2 LYS 23 0.187 -0.257 -16.855
200 HZ1 LYS 23 HZ1 LYS 23 2.249 -1.106 -17.965
201 HZ2 LYS 23 HZ2 LYS 23 2.287 -1.243 -16.266
202 HZ3 LYS 23 HZ3 LYS 23 3.157 -0.031 -17.048
203 H CYS 24 HN CYS 24 5.565 4.579 -20.479
204 HA CYS 24 HA CYS 24 4.563 6.112 -22.773
205 HB2 CYS 24 HB2 CYS 24 6.974 6.552 -20.933
206 HB3 CYS 24 HB1 CYS 24 6.583 7.591 -22.343
Start of MODEL 2
1 H1 PHE 1 HN PHE 1 0.162 -1.380 0.412
2 HA PHE 1 HA PHE 1 2.011 0.147 0.141
3 HB2 PHE 1 HB1 PHE 1 1.724 -1.803 -2.251
4 HB3 PHE 1 HB2 PHE 1 3.277 -1.049 -1.709
5 HD1 PHE 1 HD1 PHE 1 3.992 -1.442 0.739
6 HD2 PHE 1 HD2 PHE 1 1.028 -3.828 -1.259
7 HE1 PHE 1 HE1 PHE 1 4.317 -3.243 2.405
8 HE2 PHE 1 HE2 PHE 1 1.358 -5.632 0.410
9 HZ PHE 1 HZ PHE 1 3.002 -5.337 2.243
10 H LEU 2 HN LEU 2 -0.500 0.275 -2.178
11 HA LEU 2 HA LEU 2 0.426 2.870 -3.091
12 HB2 LEU 2 HB1 LEU 2 0.675 2.417 -5.406
13 HB3 LEU 2 HB2 LEU 2 1.667 1.231 -4.529
14 HG LEU 2 HG LEU 2 -1.118 0.636 -5.721
15 HD11 LEU 2 HD11 LEU 2 0.503 1.292 -7.483
16 HD12 LEU 2 HD12 LEU 2 0.111 -0.468 -7.576
17 HD13 LEU 2 HD13 LEU 2 1.681 0.070 -6.867
18 HD21 LEU 2 HD21 LEU 2 1.091 -1.252 -4.675
19 HD22 LEU 2 HD22 LEU 2 -0.381 -1.774 -5.574
20 HD23 LEU 2 HD23 LEU 2 -0.547 -1.018 -3.953
21 HA PRO 3 HA PRO 3 -4.073 2.054 -4.494
22 HB2 PRO 3 HB1 PRO 3 -5.888 2.316 -2.385
23 HB3 PRO 3 HB2 PRO 3 -5.135 0.744 -2.843
24 HG2 PRO 3 HG1 PRO 3 -4.203 2.670 -0.640
25 HG3 PRO 3 HG2 PRO 3 -4.493 0.891 -0.518
26 HD2 PRO 3 HD1 PRO 3 -1.960 1.919 -0.959
27 HD3 PRO 3 HD2 PRO 3 -2.509 0.384 -1.768
28 H ILE 4 HN ILE 4 -3.367 4.319 -1.774
29 HA ILE 4 HA ILE 4 -4.757 6.490 -2.911
30 HB ILE 4 HB ILE 4 -3.425 7.913 -1.382
31 HG12 ILE 4 HG11 ILE 4 -2.110 5.258 -0.494
32 HG13 ILE 4 HG12 ILE 4 -1.279 6.576 -1.390
33 HG21 ILE 4 HG21 ILE 4 -4.542 7.004 0.624
34 HG22 ILE 4 HG22 ILE 4 -5.601 6.771 -0.803
35 HG23 ILE 4 HG23 ILE 4 -4.678 5.377 -0.126
36 HD11 ILE 4 HD1 ILE 4 -2.480 6.797 1.445
37 HD12 ILE 4 HD2 ILE 4 -0.743 6.761 0.997
38 HD13 ILE 4 HD3 ILE 4 -1.763 8.163 0.517
39 H LEU 5 HN LEU 5 -1.431 5.349 -3.372
40 HA LEU 5 HA LEU 5 -0.498 7.529 -4.890
41 HB2 LEU 5 HB1 LEU 5 0.862 5.813 -3.690
42 HB3 LEU 5 HB2 LEU 5 0.410 4.591 -4.910
43 HG LEU 5 HG LEU 5 1.806 7.217 -5.685
44 HD11 LEU 5 HD11 LEU 5 3.137 6.199 -3.843
45 HD12 LEU 5 HD12 LEU 5 4.001 6.050 -5.415
46 HD13 LEU 5 HD13 LEU 5 3.159 4.620 -4.709
47 HD21 LEU 5 HD21 LEU 5 1.012 5.851 -7.627
48 HD22 LEU 5 HD22 LEU 5 1.813 4.386 -6.935
49 HD23 LEU 5 HD23 LEU 5 2.803 5.777 -7.511
50 H ALA 6 HN ALA 6 -2.006 4.407 -5.900
51 HA ALA 6 HA ALA 6 -1.986 4.922 -8.652
52 HB1 ALA 6 HB1 ALA 6 -3.941 3.269 -6.936
53 HB2 ALA 6 HB2 ALA 6 -3.731 3.114 -8.724
54 HB3 ALA 6 HB3 ALA 6 -2.383 2.677 -7.608
55 H SER 7 HN SER 7 -4.488 5.686 -6.186
56 HA SER 7 HA SER 7 -6.347 6.842 -7.948
57 HB2 SER 7 HB1 SER 7 -6.802 6.155 -5.572
58 HB3 SER 7 HB2 SER 7 -5.841 7.559 -5.001
59 HG SER 7 HG1 SER 7 -8.160 7.914 -5.131
60 H LEU 8 HN LEU 8 -3.734 8.538 -6.033
61 HA LEU 8 HA LEU 8 -4.358 11.013 -7.235
62 HB2 LEU 8 HB1 LEU 8 -2.525 12.008 -6.147
63 HB3 LEU 8 HB2 LEU 8 -3.279 10.816 -5.052
64 HG LEU 8 HG LEU 8 -1.361 9.204 -5.963
65 HD11 LEU 8 HD11 LEU 8 -0.336 10.824 -7.617
66 HD12 LEU 8 HD12 LEU 8 0.804 10.413 -6.289
67 HD13 LEU 8 HD13 LEU 8 -0.053 11.994 -6.271
68 HD21 LEU 8 HD21 LEU 8 -0.886 11.441 -3.890
69 HD22 LEU 8 HD22 LEU 8 0.030 9.894 -4.006
70 HD23 LEU 8 HD23 LEU 8 -1.724 9.870 -3.599
71 H ALA 9 HN ALA 9 -2.094 8.441 -8.251
72 HA ALA 9 HA ALA 9 -0.889 9.824 -10.337
73 HB1 ALA 9 HB1 ALA 9 -0.069 7.638 -9.498
74 HB2 ALA 9 HB2 ALA 9 -1.573 6.840 -10.071
75 HB3 ALA 9 HB3 ALA 9 -0.414 7.535 -11.265
76 H ALA 10 HN ALA 10 -3.963 7.878 -10.410
77 HA ALA 10 HA ALA 10 -4.519 8.455 -13.119
78 HB1 ALA 10 HB1 ALA 10 -6.843 7.726 -12.496
79 HB2 ALA 10 HB2 ALA 10 -5.603 6.620 -11.796
80 HB3 ALA 10 HB3 ALA 10 -6.396 7.846 -10.750
81 H LYS 11 HN LYS 11 -5.526 10.131 -10.120
82 HA LYS 11 HA LYS 11 -7.147 12.044 -11.320
83 HB2 LYS 11 HB1 LYS 11 -7.400 11.427 -9.041
84 HB3 LYS 11 HB2 LYS 11 -5.709 11.808 -8.651
85 HG2 LYS 11 HG1 LYS 11 -7.386 14.142 -9.610
86 HG3 LYS 11 HG2 LYS 11 -7.853 13.413 -8.043
87 HD2 LYS 11 HD1 LYS 11 -5.591 13.639 -7.138
88 HD3 LYS 11 HD2 LYS 11 -4.978 14.237 -8.714
89 HE2 LYS 11 HE1 LYS 11 -6.365 16.309 -8.517
90 HE3 LYS 11 HE2 LYS 11 -7.028 15.728 -6.934
91 HZ1 LYS 11 HZ1 LYS 11 -4.142 16.197 -7.533
92 HZ2 LYS 11 HZ2 LYS 11 -4.793 15.714 -6.053
93 HZ3 LYS 11 HZ3 LYS 11 -5.151 17.252 -6.673
94 H PHE 12 HN PHE 12 -3.620 12.398 -10.588
95 HA PHE 12 HA PHE 12 -3.564 14.360 -12.681
96 HB2 PHE 12 HB1 PHE 12 -2.863 16.349 -11.602
97 HB3 PHE 12 HB2 PHE 12 -4.405 15.837 -10.864
98 HD1 PHE 12 HD1 PHE 12 -2.792 17.947 -9.681
99 HD2 PHE 12 HD2 PHE 12 -2.446 13.695 -9.094
100 HE1 PHE 12 HE1 PHE 12 -1.792 18.324 -7.446
101 HE2 PHE 12 HE2 PHE 12 -1.471 14.079 -6.886
102 HZ PHE 12 HZ PHE 12 -1.136 16.386 -6.042
103 H GLY 13 HN GLY 13 -1.995 11.870 -11.412
104 HA2 GLY 13 HA1 GLY 13 0.693 12.968 -11.984
105 HA3 GLY 13 HA2 GLY 13 0.301 11.508 -11.052
106 HA PRO 14 HA PRO 14 -0.335 9.068 -14.498
107 HB2 PRO 14 HB1 PRO 14 -1.380 9.608 -17.038
108 HB3 PRO 14 HB2 PRO 14 -2.389 9.535 -15.544
109 HG2 PRO 14 HG1 PRO 14 -1.193 12.065 -16.815
110 HG3 PRO 14 HG2 PRO 14 -2.919 11.749 -16.353
111 HD2 PRO 14 HD1 PRO 14 -1.245 13.071 -14.612
112 HD3 PRO 14 HD2 PRO 14 -2.404 11.800 -14.009
113 H LYS 15 HN LYS 15 1.146 11.943 -15.956
114 HA LYS 15 HA LYS 15 2.665 10.509 -17.854
115 HB2 LYS 15 HB1 LYS 15 2.166 12.982 -17.933
116 HB3 LYS 15 HB2 LYS 15 3.337 13.227 -16.607
117 HG2 LYS 15 HG1 LYS 15 4.349 13.810 -18.745
118 HG3 LYS 15 HG2 LYS 15 5.184 12.366 -18.090
119 HD2 LYS 15 HD1 LYS 15 3.938 10.874 -19.606
120 HD3 LYS 15 HD2 LYS 15 2.940 12.219 -20.220
121 HE2 LYS 15 HE1 LYS 15 6.020 11.981 -20.567
122 HE3 LYS 15 HE2 LYS 15 4.802 11.435 -21.785
123 HZ1 LYS 15 HZ1 LYS 15 3.984 13.693 -21.924
124 HZ2 LYS 15 HZ2 LYS 15 5.635 13.631 -22.283
125 HZ3 LYS 15 HZ3 LYS 15 5.118 14.223 -20.781
126 H LEU 16 HN LEU 16 3.553 11.459 -14.467
127 HA LEU 16 HA LEU 16 6.134 10.258 -14.716
128 HB2 LEU 16 HB1 LEU 16 6.466 10.619 -12.368
129 HB3 LEU 16 HB2 LEU 16 5.813 12.067 -13.170
130 HG LEU 16 HG LEU 16 3.461 11.127 -12.260
131 HD11 LEU 16 HD11 LEU 16 4.412 9.025 -11.185
132 HD12 LEU 16 HD12 LEU 16 3.707 10.152 -9.972
133 HD13 LEU 16 HD13 LEU 16 5.490 10.060 -10.182
134 HD21 LEU 16 HD21 LEU 16 5.539 12.595 -10.523
135 HD22 LEU 16 HD22 LEU 16 3.756 12.604 -10.279
136 HD23 LEU 16 HD23 LEU 16 4.463 13.351 -11.758
137 H PHE 17 HN PHE 17 2.972 9.054 -13.548
138 HA PHE 17 HA PHE 17 3.871 6.566 -12.682
139 HB2 PHE 17 HB1 PHE 17 1.597 7.746 -12.317
140 HB3 PHE 17 HB2 PHE 17 1.127 7.199 -13.960
141 HD1 PHE 17 HD1 PHE 17 2.457 5.943 -10.649
142 HD2 PHE 17 HD2 PHE 17 0.117 5.073 -14.143
143 HE1 PHE 17 HE1 PHE 17 1.704 3.828 -9.615
144 HE2 PHE 17 HE2 PHE 17 -0.644 2.957 -13.104
145 HZ PHE 17 HZ PHE 17 0.147 2.334 -10.835
146 H CYS 18 HN CYS 18 2.834 7.601 -15.929
147 HA CYS 18 HA CYS 18 3.105 5.208 -17.311
148 HB2 CYS 18 HB1 CYS 18 2.012 7.274 -18.164
149 HB3 CYS 18 HB2 CYS 18 3.575 8.124 -18.166
150 H LEU 19 HN LEU 19 5.657 7.704 -16.621
151 HA LEU 19 HA LEU 19 7.710 6.270 -17.979
152 HB2 LEU 19 HB1 LEU 19 7.728 8.387 -15.760
153 HB3 LEU 19 HB2 LEU 19 9.226 7.792 -16.541
154 HG LEU 19 HG LEU 19 6.941 9.042 -18.159
155 HD11 LEU 19 HD11 LEU 19 7.636 10.691 -16.436
156 HD12 LEU 19 HD12 LEU 19 8.225 11.193 -18.067
157 HD13 LEU 19 HD13 LEU 19 9.367 10.456 -16.884
158 HD21 LEU 19 HD21 LEU 19 8.695 7.706 -19.423
159 HD22 LEU 19 HD22 LEU 19 9.970 8.749 -18.702
160 HD23 LEU 19 HD23 LEU 19 8.756 9.466 -19.820
161 H VAL 20 HN VAL 20 6.932 6.504 -14.455
162 HA VAL 20 HA VAL 20 9.003 4.859 -13.598
163 HB VAL 20 HB VAL 20 6.350 5.636 -12.318
164 HG11 VAL 20 HG11 VAL 20 7.123 3.553 -11.160
165 HG12 VAL 20 HG12 VAL 20 8.801 4.207 -11.065
166 HG13 VAL 20 HG13 VAL 20 7.475 4.978 -10.128
167 HG21 VAL 20 HG21 VAL 20 9.271 6.603 -11.935
168 HG22 VAL 20 HG22 VAL 20 7.993 7.513 -12.821
169 HG23 VAL 20 HG23 VAL 20 7.831 7.221 -11.054
170 H THR 21 HN THR 21 5.620 3.939 -14.402
171 HA THR 21 HA THR 21 6.305 1.178 -13.679
172 HB THR 21 HB THR 21 4.054 0.560 -13.895
173 HG1 THR 21 HG1 THR 21 3.449 3.201 -14.670
174 HG21 THR 21 HG21 THR 21 2.984 2.047 -12.237
175 HG22 THR 21 HG22 THR 21 4.177 3.349 -12.558
176 HG23 THR 21 HG23 THR 21 4.716 1.802 -11.812
177 H LYS 22 HN LYS 22 7.092 2.864 -16.255
178 HA LYS 22 HA LYS 22 8.005 2.321 -18.097
179 HB2 LYS 22 HB1 LYS 22 8.887 0.481 -16.754
180 HB3 LYS 22 HB2 LYS 22 7.533 -0.561 -17.250
181 HG2 LYS 22 HG1 LYS 22 9.533 -1.244 -18.318
182 HG3 LYS 22 HG2 LYS 22 8.405 -0.713 -19.566
183 HD2 LYS 22 HD1 LYS 22 10.802 0.921 -18.449
184 HD3 LYS 22 HD2 LYS 22 10.889 -0.154 -19.865
185 HE2 LYS 22 HE1 LYS 22 9.362 2.514 -19.671
186 HE3 LYS 22 HE2 LYS 22 10.775 2.106 -20.704
187 HZ1 LYS 22 HZ1 LYS 22 9.370 0.577 -21.954
188 HZ2 LYS 22 HZ2 LYS 22 8.662 2.124 -21.858
189 HZ3 LYS 22 HZ3 LYS 22 8.065 0.886 -20.905
190 H LYS 23 HN LYS 23 5.079 2.840 -18.230
191 HA LYS 23 HA LYS 23 4.177 1.376 -20.582
192 HB2 LYS 23 HB1 LYS 23 3.166 3.843 -19.096
193 HB3 LYS 23 HB2 LYS 23 2.636 3.533 -20.769
194 HG2 LYS 23 HG1 LYS 23 0.923 2.742 -19.495
195 HG3 LYS 23 HG2 LYS 23 1.724 1.284 -20.126
196 HD2 LYS 23 HD1 LYS 23 2.411 2.392 -17.346
197 HD3 LYS 23 HD2 LYS 23 0.866 1.518 -17.589
198 HE2 LYS 23 HE1 LYS 23 2.015 -0.551 -18.299
199 HE3 LYS 23 HE2 LYS 23 3.615 0.283 -18.259
200 HZ1 LYS 23 HZ1 LYS 23 1.964 -0.634 -16.017
201 HZ2 LYS 23 HZ2 LYS 23 2.807 0.836 -15.846
202 HZ3 LYS 23 HZ3 LYS 23 3.663 -0.528 -16.239
203 H CYS 24 HN CYS 24 5.745 4.556 -19.966
204 HA CYS 24 HA CYS 24 5.506 5.327 -22.683
205 HB2 CYS 24 HB1 CYS 24 7.344 6.420 -20.497
206 HB3 CYS 24 HB2 CYS 24 7.053 7.218 -22.080
Start of MODEL 3
1 H1 PHE 1 HN PHE 1 0.484 0.842 1.015
2 HA PHE 1 HA PHE 1 0.671 3.042 -0.048
3 HB2 PHE 1 HB1 PHE 1 2.614 0.903 -1.175
4 HB3 PHE 1 HB2 PHE 1 2.927 2.685 -1.163
5 HD1 PHE 1 HD1 PHE 1 2.838 3.885 1.123
6 HD2 PHE 1 HD2 PHE 1 3.210 -0.379 0.711
7 HE1 PHE 1 HE1 PHE 1 3.720 3.735 3.432
8 HE2 PHE 1 HE2 PHE 1 4.094 -0.522 3.021
9 HZ PHE 1 HZ PHE 1 4.346 1.534 4.381
10 H LEU 2 HN LEU 2 0.361 0.279 -2.252
11 HA LEU 2 HA LEU 2 0.269 1.794 -4.578
12 HB2 LEU 2 HB1 LEU 2 -0.350 -0.112 -5.811
13 HB3 LEU 2 HB2 LEU 2 0.924 -0.521 -4.636
14 HG LEU 2 HG LEU 2 -2.059 -1.179 -4.247
15 HD11 LEU 2 HD11 LEU 2 -1.167 -2.284 -6.284
16 HD12 LEU 2 HD12 LEU 2 -1.469 -3.480 -4.970
17 HD13 LEU 2 HD13 LEU 2 0.214 -2.949 -5.332
18 HD21 LEU 2 HD21 LEU 2 0.481 -2.251 -2.834
19 HD22 LEU 2 HD22 LEU 2 -1.182 -2.902 -2.623
20 HD23 LEU 2 HD23 LEU 2 -0.807 -1.238 -2.071
21 HA PRO 3 HA PRO 3 -4.366 1.815 -4.960
22 HB2 PRO 3 HB1 PRO 3 -6.063 2.113 -2.761
23 HB3 PRO 3 HB2 PRO 3 -5.538 0.506 -3.388
24 HG2 PRO 3 HG1 PRO 3 -4.284 2.090 -1.075
25 HG3 PRO 3 HG2 PRO 3 -4.808 0.358 -1.085
26 HD2 PRO 3 HD1 PRO 3 -2.190 1.075 -1.539
27 HD3 PRO 3 HD2 PRO 3 -2.957 -0.287 -2.475
28 H ILE 4 HN ILE 4 -3.120 3.730 -2.166
29 HA ILE 4 HA ILE 4 -4.418 6.113 -3.019
30 HB ILE 4 HB ILE 4 -2.917 7.314 -1.485
31 HG12 ILE 4 HG11 ILE 4 -1.799 4.516 -0.805
32 HG13 ILE 4 HG12 ILE 4 -0.897 5.803 -1.668
33 HG21 ILE 4 HG21 ILE 4 -5.156 6.315 -0.873
34 HG22 ILE 4 HG22 ILE 4 -4.323 4.812 -0.326
35 HG23 ILE 4 HG23 ILE 4 -4.024 6.371 0.517
36 HD11 ILE 4 HD1 ILE 4 -0.243 5.809 0.697
37 HD12 ILE 4 HD2 ILE 4 -1.155 7.319 0.342
38 HD13 ILE 4 HD3 ILE 4 -1.950 5.969 1.231
39 H LEU 5 HN LEU 5 -1.176 4.756 -3.701
40 HA LEU 5 HA LEU 5 -0.242 6.885 -5.250
41 HB2 LEU 5 HB1 LEU 5 1.025 4.952 -4.252
42 HB3 LEU 5 HB2 LEU 5 0.400 3.890 -5.539
43 HG LEU 5 HG LEU 5 1.981 6.464 -6.136
44 HD11 LEU 5 HD11 LEU 5 4.067 5.094 -6.161
45 HD12 LEU 5 HD12 LEU 5 3.139 3.660 -5.579
46 HD13 LEU 5 HD13 LEU 5 3.313 5.113 -4.525
47 HD21 LEU 5 HD21 LEU 5 1.625 3.825 -7.709
48 HD22 LEU 5 HD22 LEU 5 2.722 5.175 -8.186
49 HD23 LEU 5 HD23 LEU 5 0.945 5.435 -8.161
50 H ALA 6 HN ALA 6 -2.106 3.948 -6.269
51 HA ALA 6 HA ALA 6 -2.270 4.612 -8.978
52 HB1 ALA 6 HB1 ALA 6 -4.177 2.981 -8.995
53 HB2 ALA 6 HB2 ALA 6 -2.798 2.360 -8.014
54 HB3 ALA 6 HB3 ALA 6 -4.236 3.054 -7.190
55 H SER 7 HN SER 7 -4.466 5.487 -6.277
56 HA SER 7 HA SER 7 -6.378 6.853 -7.803
57 HB2 SER 7 HB1 SER 7 -6.645 6.126 -5.417
58 HB3 SER 7 HB2 SER 7 -5.500 7.409 -4.909
59 HG SER 7 HG1 SER 7 -7.824 7.897 -4.790
60 H LEU 8 HN LEU 8 -3.439 8.274 -6.151
61 HA LEU 8 HA LEU 8 -3.975 10.831 -7.255
62 HB2 LEU 8 HB1 LEU 8 -1.908 11.609 -6.372
63 HB3 LEU 8 HB2 LEU 8 -2.737 10.558 -5.190
64 HG LEU 8 HG LEU 8 -1.126 8.676 -6.198
65 HD11 LEU 8 HD11 LEU 8 0.498 11.273 -6.652
66 HD12 LEU 8 HD12 LEU 8 -0.014 10.127 -7.947
67 HD13 LEU 8 HD13 LEU 8 1.156 9.596 -6.687
68 HD21 LEU 8 HD21 LEU 8 -0.224 10.850 -4.205
69 HD22 LEU 8 HD22 LEU 8 0.476 9.195 -4.353
70 HD23 LEU 8 HD23 LEU 8 -1.235 9.401 -3.831
71 H ALA 9 HN ALA 9 -2.024 8.102 -8.485
72 HA ALA 9 HA ALA 9 -0.891 9.404 -10.660
73 HB1 ALA 9 HB1 ALA 9 -0.191 7.149 -9.899
74 HB2 ALA 9 HB2 ALA 9 -1.805 6.487 -10.333
75 HB3 ALA 9 HB3 ALA 9 -0.703 7.081 -11.629
76 H ALA 10 HN ALA 10 -4.096 7.712 -10.487
77 HA ALA 10 HA ALA 10 -4.837 8.378 -13.134
78 HB1 ALA 10 HB1 ALA 10 -6.536 7.818 -10.623
79 HB2 ALA 10 HB2 ALA 10 -7.140 7.773 -12.326
80 HB3 ALA 10 HB3 ALA 10 -5.914 6.577 -11.764
81 H LYS 11 HN LYS 11 -5.434 10.056 -10.024
82 HA LYS 11 HA LYS 11 -7.125 12.017 -11.034
83 HB2 LYS 11 HB1 LYS 11 -6.842 11.222 -8.660
84 HB3 LYS 11 HB2 LYS 11 -5.307 12.129 -8.569
85 HG2 LYS 11 HG1 LYS 11 -6.615 14.277 -8.941
86 HG3 LYS 11 HG2 LYS 11 -8.119 13.312 -9.068
87 HD2 LYS 11 HD1 LYS 11 -7.728 12.408 -6.755
88 HD3 LYS 11 HD2 LYS 11 -6.249 13.413 -6.616
89 HE2 LYS 11 HE1 LYS 11 -7.641 15.510 -6.800
90 HE3 LYS 11 HE2 LYS 11 -9.134 14.502 -6.980
91 HZ1 LYS 11 HZ1 LYS 11 -8.828 15.244 -4.711
92 HZ2 LYS 11 HZ2 LYS 11 -7.300 14.514 -4.626
93 HZ3 LYS 11 HZ3 LYS 11 -8.685 13.557 -4.801
94 H PHE 12 HN PHE 12 -3.555 12.238 -10.586
95 HA PHE 12 HA PHE 12 -3.559 14.413 -12.528
96 HB2 PHE 12 HB1 PHE 12 -2.426 16.085 -11.054
97 HB3 PHE 12 HB2 PHE 12 -4.068 15.677 -10.458
98 HD1 PHE 12 HD1 PHE 12 -4.377 14.501 -8.370
99 HD2 PHE 12 HD2 PHE 12 -0.426 15.283 -9.831
100 HE1 PHE 12 HE1 PHE 12 -3.441 13.946 -6.131
101 HE2 PHE 12 HE2 PHE 12 0.514 14.733 -7.607
102 HZ PHE 12 HZ PHE 12 -0.993 14.068 -5.755
103 H GLY 13 HN GLY 13 -1.959 11.737 -11.218
104 HA2 GLY 13 HA1 GLY 13 0.690 12.692 -12.006
105 HA3 GLY 13 HA2 GLY 13 0.260 11.210 -11.127
106 HA PRO 14 HA PRO 14 -0.359 8.865 -14.605
107 HB2 PRO 14 HB1 PRO 14 -1.508 9.405 -17.091
108 HB3 PRO 14 HB2 PRO 14 -2.458 9.314 -15.560
109 HG2 PRO 14 HG1 PRO 14 -1.344 11.869 -16.854
110 HG3 PRO 14 HG2 PRO 14 -3.051 11.523 -16.336
111 HD2 PRO 14 HD1 PRO 14 -1.332 12.854 -14.649
112 HD3 PRO 14 HD2 PRO 14 -2.460 11.574 -14.011
113 H LYS 15 HN LYS 15 1.057 11.796 -15.986
114 HA LYS 15 HA LYS 15 2.597 10.444 -17.974
115 HB2 LYS 15 HB1 LYS 15 3.073 13.136 -16.585
116 HB3 LYS 15 HB2 LYS 15 4.009 12.553 -17.995
117 HG2 LYS 15 HG1 LYS 15 0.974 13.102 -17.994
118 HG3 LYS 15 HG2 LYS 15 2.251 14.214 -18.581
119 HD2 LYS 15 HD1 LYS 15 2.958 12.433 -20.280
120 HD3 LYS 15 HD2 LYS 15 1.624 11.404 -19.698
121 HE2 LYS 15 HE1 LYS 15 0.889 12.433 -21.764
122 HE3 LYS 15 HE2 LYS 15 -0.061 13.162 -20.411
123 HZ1 LYS 15 HZ1 LYS 15 2.332 14.363 -21.733
124 HZ2 LYS 15 HZ2 LYS 15 1.444 15.058 -20.467
125 HZ3 LYS 15 HZ3 LYS 15 0.720 14.815 -21.980
126 H LEU 16 HN LEU 16 3.479 11.370 -14.565
127 HA LEU 16 HA LEU 16 6.036 10.137 -14.825
128 HB2 LEU 16 HB1 LEU 16 6.231 10.296 -12.382
129 HB3 LEU 16 HB2 LEU 16 5.965 11.851 -13.197
130 HG LEU 16 HG LEU 16 3.553 10.403 -12.016
131 HD11 LEU 16 HD11 LEU 16 5.604 12.027 -10.390
132 HD12 LEU 16 HD12 LEU 16 5.286 10.258 -10.240
133 HD13 LEU 16 HD13 LEU 16 4.003 11.444 -9.806
134 HD21 LEU 16 HD21 LEU 16 4.403 13.373 -12.262
135 HD22 LEU 16 HD22 LEU 16 2.886 12.792 -11.500
136 HD23 LEU 16 HD23 LEU 16 3.146 12.549 -13.265
137 H PHE 17 HN PHE 17 2.851 8.956 -13.669
138 HA PHE 17 HA PHE 17 3.744 6.470 -12.789
139 HB2 PHE 17 HB1 PHE 17 1.452 7.531 -12.423
140 HB3 PHE 17 HB2 PHE 17 1.046 7.145 -14.131
141 HD1 PHE 17 HD1 PHE 17 2.344 5.510 -10.967
142 HD2 PHE 17 HD2 PHE 17 -0.020 5.092 -14.529
143 HE1 PHE 17 HE1 PHE 17 1.614 3.268 -10.220
144 HE2 PHE 17 HE2 PHE 17 -0.760 2.854 -13.774
145 HZ PHE 17 HZ PHE 17 0.058 1.939 -11.619
146 H CYS 18 HN CYS 18 2.783 7.465 -16.103
147 HA CYS 18 HA CYS 18 3.109 5.014 -17.372
148 HB2 CYS 18 HB1 CYS 18 2.047 7.168 -18.226
149 HB3 CYS 18 HB2 CYS 18 3.687 7.796 -18.537
150 H LEU 19 HN LEU 19 5.606 7.537 -16.698
151 HA LEU 19 HA LEU 19 7.749 6.098 -17.886
152 HB2 LEU 19 HB1 LEU 19 7.693 8.246 -15.699
153 HB3 LEU 19 HB2 LEU 19 9.190 7.662 -16.492
154 HG LEU 19 HG LEU 19 6.862 8.991 -17.996
155 HD11 LEU 19 HD11 LEU 19 8.301 11.025 -18.054
156 HD12 LEU 19 HD12 LEU 19 9.517 10.206 -17.007
157 HD13 LEU 19 HD13 LEU 19 7.873 10.574 -16.361
158 HD21 LEU 19 HD21 LEU 19 9.773 8.385 -18.836
159 HD22 LEU 19 HD22 LEU 19 8.555 9.276 -19.817
160 HD23 LEU 19 HD23 LEU 19 8.307 7.530 -19.445
161 H VAL 20 HN VAL 20 6.588 6.206 -14.455
162 HA VAL 20 HA VAL 20 8.583 4.527 -13.425
163 HB VAL 20 HB VAL 20 5.752 5.129 -12.500
164 HG11 VAL 20 HG11 VAL 20 7.994 3.547 -11.049
165 HG12 VAL 20 HG12 VAL 20 6.524 4.211 -10.256
166 HG13 VAL 20 HG13 VAL 20 6.355 2.921 -11.487
167 HG21 VAL 20 HG21 VAL 20 6.975 6.556 -10.848
168 HG22 VAL 20 HG22 VAL 20 8.555 6.026 -11.521
169 HG23 VAL 20 HG23 VAL 20 7.447 7.039 -12.515
170 H THR 21 HN THR 21 5.293 3.632 -14.590
171 HA THR 21 HA THR 21 5.607 0.850 -14.272
172 HB THR 21 HB THR 21 3.756 0.603 -15.965
173 HG1 THR 21 HG1 THR 21 3.596 3.400 -15.771
174 HG21 THR 21 HG21 THR 21 3.304 2.661 -13.690
175 HG22 THR 21 HG22 THR 21 3.295 0.868 -13.521
176 HG23 THR 21 HG23 THR 21 2.042 1.684 -14.520
177 H LYS 22 HN LYS 22 6.419 2.957 -16.951
178 HA LYS 22 HA LYS 22 7.985 2.773 -18.476
179 HB2 LYS 22 HB1 LYS 22 8.817 0.482 -17.129
180 HB3 LYS 22 HB2 LYS 22 8.306 -0.196 -18.669
181 HG2 LYS 22 HG1 LYS 22 10.676 0.291 -18.813
182 HG3 LYS 22 HG2 LYS 22 9.796 1.392 -19.903
183 HD2 LYS 22 HD1 LYS 22 11.608 2.566 -18.820
184 HD3 LYS 22 HD2 LYS 22 10.077 3.290 -18.289
185 HE2 LYS 22 HE1 LYS 22 11.679 1.214 -16.615
186 HE3 LYS 22 HE2 LYS 22 11.922 3.003 -16.501
187 HZ1 LYS 22 HZ1 LYS 22 10.364 2.225 -14.803
188 HZ2 LYS 22 HZ2 LYS 22 9.351 1.587 -15.988
189 HZ3 LYS 22 HZ3 LYS 22 9.597 3.233 -15.919
190 H LYS 23 HN LYS 23 5.001 2.416 -18.661
191 HA LYS 23 HA LYS 23 4.801 1.196 -21.274
192 HB2 LYS 23 HB1 LYS 23 2.941 2.039 -19.294
193 HB3 LYS 23 HB2 LYS 23 2.617 3.106 -20.676
194 HG2 LYS 23 HG1 LYS 23 2.598 0.029 -20.577
195 HG3 LYS 23 HG2 LYS 23 1.180 1.095 -20.764
196 HD2 LYS 23 HD1 LYS 23 3.449 0.647 -22.809
197 HD3 LYS 23 HD2 LYS 23 1.836 -0.089 -22.873
198 HE2 LYS 23 HE1 LYS 23 0.845 1.725 -23.854
199 HE3 LYS 23 HE2 LYS 23 1.662 2.899 -22.750
200 HZ1 LYS 23 HZ1 LYS 23 3.623 2.746 -24.006
201 HZ2 LYS 23 HZ2 LYS 23 2.366 3.136 -25.068
202 HZ3 LYS 23 HZ3 LYS 23 3.010 1.561 -25.049
203 H CYS 24 HN CYS 24 5.831 4.212 -20.006
204 HA CYS 24 HA CYS 24 6.211 5.264 -22.738
205 HB2 CYS 24 HB1 CYS 24 6.014 6.828 -20.093
206 HB3 CYS 24 HB2 CYS 24 6.426 7.542 -21.686
Start of MODEL 4
1 H1 PHE 1 HN PHE 1 0.092 0.335 0.792
2 HA PHE 1 HA PHE 1 0.323 2.643 -0.042
3 HB2 PHE 1 HB1 PHE 1 2.378 0.673 -1.277
4 HB3 PHE 1 HB2 PHE 1 2.668 2.417 -0.902
5 HD1 PHE 1 HD1 PHE 1 2.277 3.131 1.594
6 HD2 PHE 1 HD2 PHE 1 2.884 -0.936 0.334
7 HE1 PHE 1 HE1 PHE 1 2.932 2.510 3.900
8 HE2 PHE 1 HE2 PHE 1 3.541 -1.549 2.642
9 HZ PHE 1 HZ PHE 1 3.561 0.172 4.424
10 H LEU 2 HN LEU 2 0.219 0.064 -2.440
11 HA LEU 2 HA LEU 2 0.328 1.632 -4.730
12 HB2 LEU 2 HB1 LEU 2 -0.894 -1.156 -4.373
13 HB3 LEU 2 HB2 LEU 2 -0.591 -0.340 -5.936
14 HG LEU 2 HG LEU 2 1.900 -0.150 -5.150
15 HD11 LEU 2 HD11 LEU 2 1.730 -0.983 -2.803
16 HD12 LEU 2 HD12 LEU 2 2.651 -2.153 -3.798
17 HD13 LEU 2 HD13 LEU 2 0.937 -2.501 -3.382
18 HD21 LEU 2 HD21 LEU 2 0.643 -2.844 -5.966
19 HD22 LEU 2 HD22 LEU 2 2.366 -2.367 -6.188
20 HD23 LEU 2 HD23 LEU 2 1.069 -1.488 -7.078
21 HA PRO 3 HA PRO 3 -4.280 1.641 -5.402
22 HB2 PRO 3 HB1 PRO 3 -6.132 1.686 -3.280
23 HB3 PRO 3 HB2 PRO 3 -5.564 0.186 -4.104
24 HG2 PRO 3 HG1 PRO 3 -4.467 1.413 -1.516
25 HG3 PRO 3 HG2 PRO 3 -4.949 -0.304 -1.821
26 HD2 PRO 3 HD1 PRO 3 -2.336 0.479 -1.978
27 HD3 PRO 3 HD2 PRO 3 -3.000 -0.685 -3.215
28 H ILE 4 HN ILE 4 -3.365 3.364 -2.363
29 HA ILE 4 HA ILE 4 -4.705 5.748 -3.129
30 HB ILE 4 HB ILE 4 -3.364 6.888 -1.411
31 HG12 ILE 4 HG11 ILE 4 -2.157 4.095 -0.869
32 HG13 ILE 4 HG12 ILE 4 -1.265 5.483 -1.571
33 HG21 ILE 4 HG21 ILE 4 -5.587 5.749 -1.030
34 HG22 ILE 4 HG22 ILE 4 -4.720 4.245 -0.540
35 HG23 ILE 4 HG23 ILE 4 -4.550 5.747 0.434
36 HD11 ILE 4 HD1 ILE 4 -1.720 6.827 0.522
37 HD12 ILE 4 HD2 ILE 4 -2.510 5.382 1.254
38 HD13 ILE 4 HD3 ILE 4 -0.766 5.332 0.829
39 H LEU 5 HN LEU 5 -1.348 4.613 -3.675
40 HA LEU 5 HA LEU 5 -0.433 6.895 -4.996
41 HB2 LEU 5 HB1 LEU 5 0.878 4.974 -4.053
42 HB3 LEU 5 HB2 LEU 5 0.389 3.961 -5.434
43 HG LEU 5 HG LEU 5 1.854 6.644 -5.796
44 HD11 LEU 5 HD11 LEU 5 3.158 5.291 -4.164
45 HD12 LEU 5 HD12 LEU 5 4.017 5.402 -5.742
46 HD13 LEU 5 HD13 LEU 5 3.142 3.887 -5.294
47 HD21 LEU 5 HD21 LEU 5 2.798 5.515 -7.851
48 HD22 LEU 5 HD22 LEU 5 1.008 5.653 -7.930
49 HD23 LEU 5 HD23 LEU 5 1.772 4.071 -7.510
50 H ALA 6 HN ALA 6 -2.044 3.955 -6.348
51 HA ALA 6 HA ALA 6 -2.030 4.789 -9.016
52 HB1 ALA 6 HB1 ALA 6 -4.035 3.000 -7.510
53 HB2 ALA 6 HB2 ALA 6 -3.820 3.054 -9.303
54 HB3 ALA 6 HB3 ALA 6 -2.491 2.448 -8.246
55 H SER 7 HN SER 7 -4.513 5.340 -6.473
56 HA SER 7 HA SER 7 -6.357 6.702 -8.090
57 HB2 SER 7 HB1 SER 7 -6.809 5.781 -5.797
58 HB3 SER 7 HB2 SER 7 -5.807 7.091 -5.089
59 HG SER 7 HG1 SER 7 -8.106 7.539 -5.136
60 H LEU 8 HN LEU 8 -3.702 8.139 -6.025
61 HA LEU 8 HA LEU 8 -4.299 10.740 -6.947
62 HB2 LEU 8 HB1 LEU 8 -2.414 11.576 -5.786
63 HB3 LEU 8 HB2 LEU 8 -3.220 10.316 -4.810
64 HG LEU 8 HG LEU 8 -1.362 8.719 -5.857
65 HD11 LEU 8 HD11 LEU 8 -0.263 10.438 -7.358
66 HD12 LEU 8 HD12 LEU 8 0.851 9.871 -6.066
67 HD13 LEU 8 HD13 LEU 8 0.050 11.475 -5.914
68 HD21 LEU 8 HD21 LEU 8 -1.711 9.180 -3.447
69 HD22 LEU 8 HD22 LEU 8 -0.814 10.739 -3.591
70 HD23 LEU 8 HD23 LEU 8 0.043 9.174 -3.845
71 H ALA 9 HN ALA 9 -2.054 8.276 -8.237
72 HA ALA 9 HA ALA 9 -0.875 9.873 -10.191
73 HB1 ALA 9 HB1 ALA 9 -1.535 6.869 -10.183
74 HB2 ALA 9 HB2 ALA 9 -0.402 7.676 -11.333
75 HB3 ALA 9 HB3 ALA 9 -0.027 7.626 -9.565
76 H ALA 10 HN ALA 10 -3.930 7.910 -10.426
77 HA ALA 10 HA ALA 10 -4.494 8.675 -13.080
78 HB1 ALA 10 HB1 ALA 10 -6.364 7.888 -10.758
79 HB2 ALA 10 HB2 ALA 10 -6.813 7.886 -12.507
80 HB3 ALA 10 HB3 ALA 10 -5.565 6.743 -11.887
81 H LYS 11 HN LYS 11 -5.490 10.128 -9.966
82 HA LYS 11 HA LYS 11 -7.099 12.140 -11.018
83 HB2 LYS 11 HB1 LYS 11 -7.340 11.358 -8.783
84 HB3 LYS 11 HB2 LYS 11 -5.643 11.696 -8.382
85 HG2 LYS 11 HG1 LYS 11 -7.289 14.112 -9.168
86 HG3 LYS 11 HG2 LYS 11 -7.778 13.279 -7.661
87 HD2 LYS 11 HD1 LYS 11 -5.522 13.406 -6.726
88 HD3 LYS 11 HD2 LYS 11 -4.884 14.095 -8.253
89 HE2 LYS 11 HE1 LYS 11 -6.234 16.177 -7.930
90 HE3 LYS 11 HE2 LYS 11 -6.919 15.506 -6.393
91 HZ1 LYS 11 HZ1 LYS 11 -4.689 15.387 -5.504
92 HZ2 LYS 11 HZ2 LYS 11 -5.016 16.971 -6.017
93 HZ3 LYS 11 HZ3 LYS 11 -4.022 15.959 -6.945
94 H PHE 12 HN PHE 12 -3.553 12.396 -10.265
95 HA PHE 12 HA PHE 12 -3.492 14.523 -12.192
96 HB2 PHE 12 HB1 PHE 12 -2.793 16.411 -10.965
97 HB3 PHE 12 HB2 PHE 12 -4.324 15.835 -10.251
98 HD1 PHE 12 HD1 PHE 12 -2.673 17.849 -8.933
99 HD2 PHE 12 HD2 PHE 12 -2.357 13.563 -8.682
100 HE1 PHE 12 HE1 PHE 12 -1.649 18.044 -6.685
101 HE2 PHE 12 HE2 PHE 12 -1.362 13.765 -6.458
102 HZ PHE 12 HZ PHE 12 -1.000 15.998 -5.440
103 H GLY 13 HN GLY 13 -1.949 11.903 -11.453
104 HA2 GLY 13 HA1 GLY 13 0.706 13.114 -12.029
105 HA3 GLY 13 HA2 GLY 13 0.457 11.737 -10.922
106 HA PRO 14 HA PRO 14 -0.366 9.253 -14.513
107 HB2 PRO 14 HB1 PRO 14 -1.249 10.026 -17.053
108 HB3 PRO 14 HB2 PRO 14 -2.337 9.939 -15.616
109 HG2 PRO 14 HG1 PRO 14 -0.900 12.443 -16.672
110 HG3 PRO 14 HG2 PRO 14 -2.664 12.231 -16.307
111 HD2 PRO 14 HD1 PRO 14 -0.987 13.322 -14.411
112 HD3 PRO 14 HD2 PRO 14 -2.263 12.109 -13.945
113 H LYS 15 HN LYS 15 1.336 12.135 -15.687
114 HA LYS 15 HA LYS 15 2.862 10.763 -17.625
115 HB2 LYS 15 HB1 LYS 15 2.432 13.382 -17.077
116 HB3 LYS 15 HB2 LYS 15 4.081 13.242 -16.415
117 HG2 LYS 15 HG1 LYS 15 3.141 12.446 -19.257
118 HG3 LYS 15 HG2 LYS 15 3.898 14.014 -18.825
119 HD2 LYS 15 HD1 LYS 15 6.034 12.851 -18.228
120 HD3 LYS 15 HD2 LYS 15 5.270 11.266 -18.509
121 HE2 LYS 15 HE1 LYS 15 6.702 11.798 -20.416
122 HE3 LYS 15 HE2 LYS 15 4.971 11.728 -20.927
123 HZ1 LYS 15 HZ1 LYS 15 4.900 14.136 -20.824
124 HZ2 LYS 15 HZ2 LYS 15 6.121 13.618 -21.876
125 HZ3 LYS 15 HZ3 LYS 15 6.523 14.208 -20.340
126 H LEU 16 HN LEU 16 3.690 11.502 -14.156
127 HA LEU 16 HA LEU 16 6.208 10.187 -14.372
128 HB2 LEU 16 HB1 LEU 16 6.366 10.316 -11.952
129 HB3 LEU 16 HB2 LEU 16 5.867 11.858 -12.684
130 HG LEU 16 HG LEU 16 3.388 10.938 -12.072
131 HD11 LEU 16 HD11 LEU 16 4.216 8.771 -11.019
132 HD12 LEU 16 HD12 LEU 16 3.399 9.849 -9.831
133 HD13 LEU 16 HD13 LEU 16 5.193 9.744 -9.863
134 HD21 LEU 16 HD21 LEU 16 3.526 12.321 -10.009
135 HD22 LEU 16 HD22 LEU 16 4.381 13.117 -11.382
136 HD23 LEU 16 HD23 LEU 16 5.323 12.283 -10.089
137 H PHE 17 HN PHE 17 2.952 9.039 -13.421
138 HA PHE 17 HA PHE 17 3.730 6.454 -12.767
139 HB2 PHE 17 HB1 PHE 17 1.543 7.546 -12.196
140 HB3 PHE 17 HB2 PHE 17 1.062 7.483 -13.923
141 HD1 PHE 17 HD1 PHE 17 2.657 4.924 -11.591
142 HD2 PHE 17 HD2 PHE 17 -0.727 5.970 -14.028
143 HE1 PHE 17 HE1 PHE 17 1.656 2.721 -11.143
144 HE2 PHE 17 HE2 PHE 17 -1.742 3.764 -13.554
145 HZ PHE 17 HZ PHE 17 -0.548 2.131 -12.119
146 H CYS 18 HN CYS 18 2.857 7.763 -16.031
147 HA CYS 18 HA CYS 18 3.118 5.241 -17.257
148 HB2 CYS 18 HB1 CYS 18 2.947 6.208 -19.367
149 HB3 CYS 18 HB2 CYS 18 1.872 7.135 -18.291
150 H LEU 19 HN LEU 19 5.624 7.771 -16.670
151 HA LEU 19 HA LEU 19 7.640 6.375 -18.069
152 HB2 LEU 19 HB1 LEU 19 7.755 8.355 -15.735
153 HB3 LEU 19 HB2 LEU 19 9.208 7.795 -16.621
154 HG LEU 19 HG LEU 19 6.855 9.238 -17.969
155 HD11 LEU 19 HD11 LEU 19 8.322 11.273 -17.926
156 HD12 LEU 19 HD12 LEU 19 9.530 10.372 -16.936
157 HD13 LEU 19 HD13 LEU 19 7.894 10.714 -16.262
158 HD21 LEU 19 HD21 LEU 19 8.530 9.645 -19.801
159 HD22 LEU 19 HD22 LEU 19 8.246 7.884 -19.548
160 HD23 LEU 19 HD23 LEU 19 9.740 8.660 -18.904
161 H VAL 20 HN VAL 20 6.816 6.277 -14.554
162 HA VAL 20 HA VAL 20 8.976 4.763 -13.773
163 HB VAL 20 HB VAL 20 6.210 5.131 -12.581
164 HG11 VAL 20 HG11 VAL 20 8.663 3.698 -11.337
165 HG12 VAL 20 HG12 VAL 20 7.237 4.276 -10.409
166 HG13 VAL 20 HG13 VAL 20 7.039 2.967 -11.623
167 HG21 VAL 20 HG21 VAL 20 9.031 6.184 -11.840
168 HG22 VAL 20 HG22 VAL 20 7.804 7.133 -12.750
169 HG23 VAL 20 HG23 VAL 20 7.485 6.643 -11.047
170 H THR 21 HN THR 21 5.820 3.428 -14.898
171 HA THR 21 HA THR 21 7.095 0.752 -14.618
172 HB THR 21 HB THR 21 5.154 -0.368 -14.392
173 HG1 THR 21 HG1 THR 21 3.976 0.466 -15.956
174 HG21 THR 21 HG21 THR 21 3.950 0.721 -12.530
175 HG22 THR 21 HG22 THR 21 4.592 2.341 -12.994
176 HG23 THR 21 HG23 THR 21 5.711 1.062 -12.388
177 H LYS 22 HN LYS 22 7.515 2.717 -16.874
178 HA LYS 22 HA LYS 22 7.659 2.771 -19.044
179 HB2 LYS 22 HB1 LYS 22 9.226 0.996 -18.473
180 HB3 LYS 22 HB2 LYS 22 7.946 -0.231 -18.676
181 HG2 LYS 22 HG1 LYS 22 9.533 -0.250 -20.561
182 HG3 LYS 22 HG2 LYS 22 7.869 0.112 -21.080
183 HD2 LYS 22 HD1 LYS 22 8.725 2.685 -20.876
184 HD3 LYS 22 HD2 LYS 22 10.327 1.931 -21.079
185 HE2 LYS 22 HE1 LYS 22 7.854 1.764 -22.957
186 HE3 LYS 22 HE2 LYS 22 9.370 2.697 -23.268
187 HZ1 LYS 22 HZ1 LYS 22 10.571 0.596 -23.323
188 HZ2 LYS 22 HZ2 LYS 22 9.307 0.602 -24.459
189 HZ3 LYS 22 HZ3 LYS 22 9.137 -0.259 -23.008
190 H LYS 23 HN LYS 23 5.133 3.306 -18.622
191 HA LYS 23 HA LYS 23 3.606 1.819 -20.682
192 HB2 LYS 23 HB1 LYS 23 2.546 3.908 -18.713
193 HB3 LYS 23 HB2 LYS 23 1.602 2.841 -19.800
194 HG2 LYS 23 HG1 LYS 23 2.475 0.838 -18.563
195 HG3 LYS 23 HG2 LYS 23 3.321 1.911 -17.413
196 HD2 LYS 23 HD1 LYS 23 0.279 1.918 -17.951
197 HD3 LYS 23 HD2 LYS 23 1.029 0.943 -16.663
198 HE2 LYS 23 HE1 LYS 23 1.182 4.043 -16.793
199 HE3 LYS 23 HE2 LYS 23 -0.050 3.104 -15.872
200 HZ1 LYS 23 HZ1 LYS 23 1.380 2.964 -14.223
201 HZ2 LYS 23 HZ2 LYS 23 2.571 3.770 -15.091
202 HZ3 LYS 23 HZ3 LYS 23 2.486 2.110 -15.179
203 H CYS 24 HN CYS 24 5.653 4.443 -20.425
204 HA CYS 24 HA CYS 24 4.295 5.972 -22.552
205 HB2 CYS 24 HB2 CYS 24 6.961 6.438 -21.102
206 HB3 CYS 24 HB1 CYS 24 6.357 7.451 -22.452
Start of MODEL 5
1 H1 PHE 1 HN PHE 1 0.268 0.802 1.267
2 HA PHE 1 HA PHE 1 0.573 2.998 0.215
3 HB2 PHE 1 HB1 PHE 1 2.453 0.788 -0.882
4 HB3 PHE 1 HB2 PHE 1 2.843 2.553 -0.821
5 HD1 PHE 1 HD1 PHE 1 2.737 3.702 1.496
6 HD2 PHE 1 HD2 PHE 1 2.937 -0.563 0.983
7 HE1 PHE 1 HE1 PHE 1 3.542 3.456 3.824
8 HE2 PHE 1 HE2 PHE 1 3.745 -0.801 3.312
9 HZ PHE 1 HZ PHE 1 4.044 1.207 4.733
10 H LEU 2 HN LEU 2 0.309 0.253 -2.028
11 HA LEU 2 HA LEU 2 0.275 1.803 -4.332
12 HB2 LEU 2 HB1 LEU 2 -0.275 -0.095 -5.612
13 HB3 LEU 2 HB2 LEU 2 0.964 -0.503 -4.399
14 HG LEU 2 HG LEU 2 -2.021 -1.204 -4.117
15 HD11 LEU 2 HD11 LEU 2 -1.053 -2.269 -6.141
16 HD12 LEU 2 HD12 LEU 2 -1.380 -3.487 -4.854
17 HD13 LEU 2 HD13 LEU 2 0.307 -2.931 -5.156
18 HD21 LEU 2 HD21 LEU 2 -1.172 -2.942 -2.493
19 HD22 LEU 2 HD22 LEU 2 -0.837 -1.282 -1.904
20 HD23 LEU 2 HD23 LEU 2 0.487 -2.267 -2.642
21 HA PRO 3 HA PRO 3 -4.344 1.741 -4.875
22 HB2 PRO 3 HB1 PRO 3 -6.122 1.989 -2.736
23 HB3 PRO 3 HB2 PRO 3 -5.544 0.398 -3.356
24 HG2 PRO 3 HG1 PRO 3 -4.408 1.985 -0.987
25 HG3 PRO 3 HG2 PRO 3 -4.891 0.243 -1.032
26 HD2 PRO 3 HD1 PRO 3 -2.276 1.027 -1.383
27 HD3 PRO 3 HD2 PRO 3 -2.975 -0.348 -2.353
28 H ILE 4 HN ILE 4 -3.266 3.656 -2.011
29 HA ILE 4 HA ILE 4 -4.563 6.023 -2.893
30 HB ILE 4 HB ILE 4 -3.134 7.228 -1.290
31 HG12 ILE 4 HG11 ILE 4 -2.001 4.436 -0.607
32 HG13 ILE 4 HG12 ILE 4 -1.087 5.747 -1.418
33 HG21 ILE 4 HG21 ILE 4 -5.379 6.192 -0.773
34 HG22 ILE 4 HG22 ILE 4 -4.546 4.693 -0.214
35 HG23 ILE 4 HG23 ILE 4 -4.299 6.245 0.659
36 HD11 ILE 4 HD1 ILE 4 -2.248 5.856 1.442
37 HD12 ILE 4 HD2 ILE 4 -0.520 5.728 0.970
38 HD13 ILE 4 HD3 ILE 4 -1.440 7.231 0.602
39 H LEU 5 HN LEU 5 -1.271 4.736 -3.463
40 HA LEU 5 HA LEU 5 -0.317 6.898 -4.950
41 HB2 LEU 5 HB1 LEU 5 0.956 4.988 -3.932
42 HB3 LEU 5 HB2 LEU 5 0.384 3.916 -5.235
43 HG LEU 5 HG LEU 5 1.935 6.513 -5.802
44 HD11 LEU 5 HD11 LEU 5 3.244 5.205 -4.138
45 HD12 LEU 5 HD12 LEU 5 4.049 5.186 -5.749
46 HD13 LEU 5 HD13 LEU 5 3.133 3.740 -5.181
47 HD21 LEU 5 HD21 LEU 5 1.689 3.850 -7.357
48 HD22 LEU 5 HD22 LEU 5 2.764 5.223 -7.816
49 HD23 LEU 5 HD23 LEU 5 0.980 5.438 -7.847
50 H ALA 6 HN ALA 6 -2.082 3.940 -6.079
51 HA ALA 6 HA ALA 6 -2.130 4.637 -8.787
52 HB1 ALA 6 HB1 ALA 6 -2.640 2.357 -7.880
53 HB2 ALA 6 HB2 ALA 6 -4.134 3.000 -7.116
54 HB3 ALA 6 HB3 ALA 6 -3.990 2.955 -8.916
55 H SER 7 HN SER 7 -4.497 5.398 -6.189
56 HA SER 7 HA SER 7 -6.353 6.742 -7.805
57 HB2 SER 7 HB1 SER 7 -6.749 5.960 -5.450
58 HB3 SER 7 HB2 SER 7 -5.682 7.272 -4.851
59 HG SER 7 HG1 SER 7 -7.976 7.768 -4.851
60 H LEU 8 HN LEU 8 -3.572 8.193 -5.926
61 HA LEU 8 HA LEU 8 -4.109 10.759 -6.980
62 HB2 LEU 8 HB1 LEU 8 -2.160 11.588 -5.933
63 HB3 LEU 8 HB2 LEU 8 -2.962 10.411 -4.858
64 HG LEU 8 HG LEU 8 -1.200 8.700 -5.888
65 HD11 LEU 8 HD11 LEU 8 1.037 9.762 -6.250
66 HD12 LEU 8 HD12 LEU 8 0.294 11.399 -6.154
67 HD13 LEU 8 HD13 LEU 8 -0.112 10.296 -7.525
68 HD21 LEU 8 HD21 LEU 8 0.301 9.214 -3.963
69 HD22 LEU 8 HD22 LEU 8 -1.434 9.303 -3.495
70 HD23 LEU 8 HD23 LEU 8 -0.492 10.820 -3.762
71 H ALA 9 HN ALA 9 -2.032 8.120 -8.202
72 HA ALA 9 HA ALA 9 -0.822 9.535 -10.264
73 HB1 ALA 9 HB1 ALA 9 -0.095 7.274 -9.546
74 HB2 ALA 9 HB2 ALA 9 -1.651 6.581 -10.115
75 HB3 ALA 9 HB3 ALA 9 -0.489 7.274 -11.306
76 H ALA 10 HN ALA 10 -3.987 7.749 -10.325
77 HA ALA 10 HA ALA 10 -4.598 8.485 -12.984
78 HB1 ALA 10 HB1 ALA 10 -6.929 7.805 -12.324
79 HB2 ALA 10 HB2 ALA 10 -5.708 6.620 -11.727
80 HB3 ALA 10 HB3 ALA 10 -6.421 7.812 -10.589
81 H LYS 11 HN LYS 11 -5.459 10.035 -9.867
82 HA LYS 11 HA LYS 11 -7.068 12.038 -10.923
83 HB2 LYS 11 HB1 LYS 11 -7.249 11.304 -8.661
84 HB3 LYS 11 HB2 LYS 11 -5.547 11.672 -8.309
85 HG2 LYS 11 HG1 LYS 11 -7.258 14.036 -9.128
86 HG3 LYS 11 HG2 LYS 11 -7.674 13.250 -7.575
87 HD2 LYS 11 HD1 LYS 11 -5.387 13.456 -6.731
88 HD3 LYS 11 HD2 LYS 11 -4.824 14.106 -8.306
89 HE2 LYS 11 HE1 LYS 11 -6.205 16.167 -8.003
90 HE3 LYS 11 HE2 LYS 11 -6.818 15.537 -6.418
91 HZ1 LYS 11 HZ1 LYS 11 -4.565 15.506 -5.601
92 HZ2 LYS 11 HZ2 LYS 11 -4.929 17.058 -6.180
93 HZ3 LYS 11 HZ3 LYS 11 -3.949 16.014 -7.087
94 H PHE 12 HN PHE 12 -3.523 12.265 -10.274
95 HA PHE 12 HA PHE 12 -3.446 14.310 -12.278
96 HB2 PHE 12 HB1 PHE 12 -2.667 16.236 -11.132
97 HB3 PHE 12 HB2 PHE 12 -4.217 15.746 -10.398
98 HD1 PHE 12 HD1 PHE 12 -2.516 17.755 -9.156
99 HD2 PHE 12 HD2 PHE 12 -2.328 13.473 -8.723
100 HE1 PHE 12 HE1 PHE 12 -1.491 18.013 -6.915
101 HE2 PHE 12 HE2 PHE 12 -1.323 13.742 -6.512
102 HZ PHE 12 HZ PHE 12 -0.899 16.003 -5.587
103 H GLY 13 HN GLY 13 -1.927 11.741 -11.055
104 HA2 GLY 13 HA1 GLY 13 0.784 12.779 -11.559
105 HA3 GLY 13 HA2 GLY 13 0.326 11.262 -10.760
106 HA PRO 14 HA PRO 14 -0.078 9.099 -14.436
107 HB2 PRO 14 HB1 PRO 14 -1.207 9.778 -16.893
108 HB3 PRO 14 HB2 PRO 14 -2.194 9.547 -15.399
109 HG2 PRO 14 HG1 PRO 14 -1.137 12.219 -16.491
110 HG3 PRO 14 HG2 PRO 14 -2.841 11.784 -16.045
111 HD2 PRO 14 HD1 PRO 14 -1.197 13.055 -14.232
112 HD3 PRO 14 HD2 PRO 14 -2.321 11.720 -13.708
113 H LYS 15 HN LYS 15 1.219 12.197 -15.351
114 HA LYS 15 HA LYS 15 2.743 11.409 -17.555
115 HB2 LYS 15 HB1 LYS 15 2.146 13.777 -16.414
116 HB3 LYS 15 HB2 LYS 15 3.764 13.605 -15.705
117 HG2 LYS 15 HG1 LYS 15 2.955 13.788 -18.692
118 HG3 LYS 15 HG2 LYS 15 3.798 14.993 -17.693
119 HD2 LYS 15 HD1 LYS 15 5.649 14.216 -18.754
120 HD3 LYS 15 HD2 LYS 15 5.619 13.035 -17.420
121 HE2 LYS 15 HE1 LYS 15 3.994 11.767 -19.359
122 HE3 LYS 15 HE2 LYS 15 5.109 12.711 -20.419
123 HZ1 LYS 15 HZ1 LYS 15 5.966 10.513 -19.917
124 HZ2 LYS 15 HZ2 LYS 15 5.828 10.819 -18.254
125 HZ3 LYS 15 HZ3 LYS 15 6.963 11.685 -19.177
126 H LEU 16 HN LEU 16 3.651 11.443 -14.054
127 HA LEU 16 HA LEU 16 6.210 10.235 -14.565
128 HB2 LEU 16 HB1 LEU 16 6.403 9.981 -12.126
129 HB3 LEU 16 HB2 LEU 16 6.211 11.661 -12.670
130 HG LEU 16 HG LEU 16 3.736 10.142 -11.726
131 HD11 LEU 16 HD11 LEU 16 5.466 9.654 -10.007
132 HD12 LEU 16 HD12 LEU 16 4.229 10.805 -9.384
133 HD13 LEU 16 HD13 LEU 16 5.850 11.411 -9.880
134 HD21 LEU 16 HD21 LEU 16 4.684 13.080 -11.469
135 HD22 LEU 16 HD22 LEU 16 3.131 12.422 -10.853
136 HD23 LEU 16 HD23 LEU 16 3.429 12.486 -12.625
137 H PHE 17 HN PHE 17 2.977 9.038 -13.506
138 HA PHE 17 HA PHE 17 3.772 6.464 -12.905
139 HB2 PHE 17 HB1 PHE 17 1.511 7.681 -12.495
140 HB3 PHE 17 HB2 PHE 17 1.069 7.242 -14.181
141 HD1 PHE 17 HD1 PHE 17 2.320 5.754 -10.934
142 HD2 PHE 17 HD2 PHE 17 0.015 5.160 -14.510
143 HE1 PHE 17 HE1 PHE 17 1.495 3.601 -10.044
144 HE2 PHE 17 HE2 PHE 17 -0.815 3.009 -13.616
145 HZ PHE 17 HZ PHE 17 -0.083 2.230 -11.377
146 H CYS 18 HN CYS 18 2.833 7.791 -16.063
147 HA CYS 18 HA CYS 18 2.962 5.558 -17.668
148 HB2 CYS 18 HB1 CYS 18 2.101 7.768 -18.337
149 HB3 CYS 18 HB2 CYS 18 3.709 8.502 -18.129
150 H LEU 19 HN LEU 19 5.801 7.561 -16.559
151 HA LEU 19 HA LEU 19 7.523 5.947 -18.263
152 HB2 LEU 19 HB1 LEU 19 9.372 7.262 -17.700
153 HB3 LEU 19 HB2 LEU 19 7.986 8.318 -18.075
154 HG LEU 19 HG LEU 19 7.740 8.272 -15.355
155 HD11 LEU 19 HD11 LEU 19 9.748 6.782 -14.996
156 HD12 LEU 19 HD12 LEU 19 9.988 8.420 -14.296
157 HD13 LEU 19 HD13 LEU 19 10.777 7.986 -15.853
158 HD21 LEU 19 HD21 LEU 19 8.993 10.427 -15.333
159 HD22 LEU 19 HD22 LEU 19 7.892 10.310 -16.756
160 HD23 LEU 19 HD23 LEU 19 9.677 10.056 -16.955
161 H VAL 20 HN VAL 20 6.827 6.177 -14.748
162 HA VAL 20 HA VAL 20 8.709 4.307 -13.909
163 HB VAL 20 HB VAL 20 6.022 5.150 -12.735
164 HG11 VAL 20 HG11 VAL 20 6.650 2.959 -11.696
165 HG12 VAL 20 HG12 VAL 20 8.343 3.535 -11.461
166 HG13 VAL 20 HG13 VAL 20 6.993 4.289 -10.542
167 HG21 VAL 20 HG21 VAL 20 8.952 5.971 -12.140
168 HG22 VAL 20 HG22 VAL 20 7.746 6.997 -13.001
169 HG23 VAL 20 HG23 VAL 20 7.497 6.570 -11.271
170 H THR 21 HN THR 21 5.316 3.737 -14.989
171 HA THR 21 HA THR 21 5.674 0.877 -14.495
172 HB THR 21 HB THR 21 3.343 0.606 -15.158
173 HG1 THR 21 HG1 THR 21 3.236 3.410 -15.364
174 HG21 THR 21 HG21 THR 21 3.900 1.268 -12.794
175 HG22 THR 21 HG22 THR 21 2.308 1.912 -13.333
176 HG23 THR 21 HG23 THR 21 3.727 3.006 -13.235
177 H LYS 22 HN LYS 22 6.954 2.611 -16.820
178 HA LYS 22 HA LYS 22 7.307 2.575 -18.969
179 HB2 LYS 22 HB1 LYS 22 8.746 0.809 -18.217
180 HB3 LYS 22 HB2 LYS 22 7.458 -0.403 -18.438
181 HG2 LYS 22 HG1 LYS 22 9.207 -0.483 -20.219
182 HG3 LYS 22 HG2 LYS 22 7.564 -0.228 -20.859
183 HD2 LYS 22 HD1 LYS 22 8.064 2.248 -21.099
184 HD3 LYS 22 HD2 LYS 22 9.749 1.927 -20.556
185 HE2 LYS 22 HE1 LYS 22 10.109 0.443 -22.560
186 HE3 LYS 22 HE2 LYS 22 8.376 0.648 -23.031
187 HZ1 LYS 22 HZ1 LYS 22 8.800 3.033 -23.244
188 HZ2 LYS 22 HZ2 LYS 22 9.738 2.113 -24.305
189 HZ3 LYS 22 HZ3 LYS 22 10.442 2.795 -22.921
190 H LYS 23 HN LYS 23 4.977 3.412 -19.090
191 HA LYS 23 HA LYS 23 3.682 1.897 -21.292
192 HB2 LYS 23 HB1 LYS 23 2.540 4.035 -19.410
193 HB3 LYS 23 HB2 LYS 23 1.642 3.259 -20.756
194 HG2 LYS 23 HG1 LYS 23 2.815 1.768 -18.323
195 HG3 LYS 23 HG2 LYS 23 1.130 2.323 -18.436
196 HD2 LYS 23 HD1 LYS 23 0.492 0.743 -19.991
197 HD3 LYS 23 HD2 LYS 23 2.082 0.617 -20.767
198 HE2 LYS 23 HE1 LYS 23 1.418 -0.589 -17.991
199 HE3 LYS 23 HE2 LYS 23 1.415 -1.479 -19.566
200 HZ1 LYS 23 HZ1 LYS 23 3.820 -0.506 -19.729
201 HZ2 LYS 23 HZ2 LYS 23 3.524 -1.871 -18.766
202 HZ3 LYS 23 HZ3 LYS 23 3.714 -0.345 -18.088
203 H CYS 24 HN CYS 24 5.654 4.608 -20.553
204 HA CYS 24 HA CYS 24 4.878 6.042 -22.950
205 HB2 CYS 24 HB1 CYS 24 7.327 6.356 -21.138
206 HB3 CYS 24 HB2 CYS 24 6.935 7.428 -22.523
Start of MODEL 6
1 H1 PHE 1 HN PHE 1 3.646 -0.029 -1.055
2 HA PHE 1 HA PHE 1 0.941 -0.927 -0.626
3 HB2 PHE 1 HB1 PHE 1 1.835 0.027 1.584
4 HB3 PHE 1 HB2 PHE 1 2.098 1.594 0.753
5 HD1 PHE 1 HD1 PHE 1 0.343 3.159 0.885
6 HD2 PHE 1 HD2 PHE 1 -0.569 -1.006 1.403
7 HE1 PHE 1 HE1 PHE 1 -1.982 3.745 1.523
8 HE2 PHE 1 HE2 PHE 1 -2.894 -0.422 2.021
9 HZ PHE 1 HZ PHE 1 -3.600 1.953 2.091
10 H LEU 2 HN LEU 2 -0.607 0.298 -1.852
11 HA LEU 2 HA LEU 2 0.385 2.448 -3.511
12 HB2 LEU 2 HB1 LEU 2 0.398 1.393 -5.622
13 HB3 LEU 2 HB2 LEU 2 1.374 0.370 -4.544
14 HG LEU 2 HG LEU 2 -1.538 -0.211 -5.396
15 HD11 LEU 2 HD11 LEU 2 -0.534 -1.928 -6.884
16 HD12 LEU 2 HD12 LEU 2 1.119 -1.407 -6.388
17 HD13 LEU 2 HD13 LEU 2 0.055 -0.274 -7.305
18 HD21 LEU 2 HD21 LEU 2 0.510 -1.971 -3.897
19 HD22 LEU 2 HD22 LEU 2 -1.047 -2.555 -4.589
20 HD23 LEU 2 HD23 LEU 2 -1.061 -1.363 -3.245
21 HA PRO 3 HA PRO 3 -4.162 1.844 -4.667
22 HB2 PRO 3 HB1 PRO 3 -6.003 2.140 -2.580
23 HB3 PRO 3 HB2 PRO 3 -5.355 0.546 -3.114
24 HG2 PRO 3 HG1 PRO 3 -4.335 2.279 -0.797
25 HG3 PRO 3 HG2 PRO 3 -4.740 0.518 -0.777
26 HD2 PRO 3 HD1 PRO 3 -2.155 1.408 -1.105
27 HD3 PRO 3 HD2 PRO 3 -2.761 -0.040 -2.040
28 H ILE 4 HN ILE 4 -3.225 3.955 -1.922
29 HA ILE 4 HA ILE 4 -4.495 6.267 -2.913
30 HB ILE 4 HB ILE 4 -2.971 7.532 -1.442
31 HG12 ILE 4 HG11 ILE 4 -1.755 4.773 -0.753
32 HG13 ILE 4 HG12 ILE 4 -0.916 6.086 -1.648
33 HG21 ILE 4 HG21 ILE 4 -4.273 5.036 -0.154
34 HG22 ILE 4 HG22 ILE 4 -3.990 6.635 0.617
35 HG23 ILE 4 HG23 ILE 4 -5.165 6.495 -0.729
36 HD11 ILE 4 HD1 ILE 4 -0.201 6.126 0.699
37 HD12 ILE 4 HD2 ILE 4 -1.160 7.606 0.347
38 HD13 ILE 4 HD3 ILE 4 -1.897 6.251 1.274
39 H LEU 5 HN LEU 5 -1.299 4.880 -3.598
40 HA LEU 5 HA LEU 5 -0.298 6.999 -5.156
41 HB2 LEU 5 HB1 LEU 5 0.962 5.124 -4.031
42 HB3 LEU 5 HB2 LEU 5 0.396 4.004 -5.301
43 HG LEU 5 HG LEU 5 1.978 6.566 -5.932
44 HD11 LEU 5 HD11 LEU 5 3.262 5.270 -4.239
45 HD12 LEU 5 HD12 LEU 5 4.061 5.186 -5.850
46 HD13 LEU 5 HD13 LEU 5 3.111 3.781 -5.240
47 HD21 LEU 5 HD21 LEU 5 2.782 5.214 -7.913
48 HD22 LEU 5 HD22 LEU 5 1.005 5.472 -7.955
49 HD23 LEU 5 HD23 LEU 5 1.674 3.877 -7.430
50 H ALA 6 HN ALA 6 -2.080 3.996 -6.080
51 HA ALA 6 HA ALA 6 -2.188 4.518 -8.825
52 HB1 ALA 6 HB1 ALA 6 -4.172 3.022 -7.000
53 HB2 ALA 6 HB2 ALA 6 -4.070 2.852 -8.794
54 HB3 ALA 6 HB3 ALA 6 -2.703 2.309 -7.751
55 H SER 7 HN SER 7 -4.472 5.470 -6.225
56 HA SER 7 HA SER 7 -6.350 6.758 -7.862
57 HB2 SER 7 HB1 SER 7 -6.694 6.103 -5.467
58 HB3 SER 7 HB2 SER 7 -5.582 7.416 -4.958
59 HG SER 7 HG1 SER 7 -7.920 7.875 -4.946
60 H LEU 8 HN LEU 8 -3.492 8.275 -6.146
61 HA LEU 8 HA LEU 8 -4.024 10.786 -7.339
62 HB2 LEU 8 HB1 LEU 8 -2.024 11.630 -6.397
63 HB3 LEU 8 HB2 LEU 8 -2.840 10.559 -5.224
64 HG LEU 8 HG LEU 8 -1.132 8.734 -6.185
65 HD11 LEU 8 HD11 LEU 8 -0.040 10.221 -7.917
66 HD12 LEU 8 HD12 LEU 8 1.123 9.745 -6.627
67 HD13 LEU 8 HD13 LEU 8 0.394 11.392 -6.618
68 HD21 LEU 8 HD21 LEU 8 0.406 9.330 -4.306
69 HD22 LEU 8 HD22 LEU 8 -1.323 9.474 -3.822
70 HD23 LEU 8 HD23 LEU 8 -0.361 10.956 -4.189
71 H ALA 9 HN ALA 9 -1.990 8.065 -8.437
72 HA ALA 9 HA ALA 9 -0.793 9.332 -10.595
73 HB1 ALA 9 HB1 ALA 9 -1.674 6.409 -10.237
74 HB2 ALA 9 HB2 ALA 9 -0.523 6.992 -11.498
75 HB3 ALA 9 HB3 ALA 9 -0.092 7.109 -9.749
76 H ALA 10 HN ALA 10 -3.997 7.641 -10.487
77 HA ALA 10 HA ALA 10 -4.643 8.261 -13.182
78 HB1 ALA 10 HB1 ALA 10 -6.968 7.655 -12.448
79 HB2 ALA 10 HB2 ALA 10 -5.761 6.465 -11.836
80 HB3 ALA 10 HB3 ALA 10 -6.424 7.712 -10.726
81 H LYS 11 HN LYS 11 -5.373 9.958 -10.100
82 HA LYS 11 HA LYS 11 -7.043 11.884 -11.206
83 HB2 LYS 11 HB1 LYS 11 -6.873 11.115 -8.810
84 HB3 LYS 11 HB2 LYS 11 -5.359 12.050 -8.652
85 HG2 LYS 11 HG1 LYS 11 -6.680 14.170 -9.143
86 HG3 LYS 11 HG2 LYS 11 -8.162 13.177 -9.304
87 HD2 LYS 11 HD1 LYS 11 -7.872 12.362 -6.948
88 HD3 LYS 11 HD2 LYS 11 -6.393 13.365 -6.783
89 HE2 LYS 11 HE1 LYS 11 -7.765 15.461 -7.107
90 HE3 LYS 11 HE2 LYS 11 -9.256 14.453 -7.292
91 HZ1 LYS 11 HZ1 LYS 11 -7.500 14.564 -4.882
92 HZ2 LYS 11 HZ2 LYS 11 -8.883 13.603 -5.059
93 HZ3 LYS 11 HZ3 LYS 11 -9.021 15.292 -5.050
94 H PHE 12 HN PHE 12 -3.507 12.183 -10.573
95 HA PHE 12 HA PHE 12 -3.450 14.363 -12.506
96 HB2 PHE 12 HB1 PHE 12 -2.436 16.053 -10.973
97 HB3 PHE 12 HB2 PHE 12 -4.099 15.613 -10.470
98 HD1 PHE 12 HD1 PHE 12 -4.503 14.455 -8.393
99 HD2 PHE 12 HD2 PHE 12 -0.490 15.280 -9.645
100 HE1 PHE 12 HE1 PHE 12 -3.682 13.944 -6.097
101 HE2 PHE 12 HE2 PHE 12 0.335 14.772 -7.367
102 HZ PHE 12 HZ PHE 12 -1.261 14.110 -5.590
103 H GLY 13 HN GLY 13 -1.909 11.691 -11.181
104 HA2 GLY 13 HA1 GLY 13 0.771 12.641 -11.883
105 HA3 GLY 13 HA2 GLY 13 0.310 11.139 -11.058
106 HA PRO 14 HA PRO 14 -0.287 8.963 -14.708
107 HB2 PRO 14 HB1 PRO 14 -1.327 9.708 -17.196
108 HB3 PRO 14 HB2 PRO 14 -2.341 9.488 -15.718
109 HG2 PRO 14 HG1 PRO 14 -1.180 12.135 -16.759
110 HG3 PRO 14 HG2 PRO 14 -2.900 11.757 -16.327
111 HD2 PRO 14 HD1 PRO 14 -1.232 12.945 -14.496
112 HD3 PRO 14 HD2 PRO 14 -2.384 11.628 -13.981
113 H LYS 15 HN LYS 15 1.210 11.965 -15.807
114 HA LYS 15 HA LYS 15 2.738 10.819 -17.882
115 HB2 LYS 15 HB1 LYS 15 2.173 13.292 -17.307
116 HB3 LYS 15 HB2 LYS 15 3.644 13.283 -16.303
117 HG2 LYS 15 HG1 LYS 15 3.548 12.492 -19.296
118 HG3 LYS 15 HG2 LYS 15 3.716 14.187 -18.742
119 HD2 LYS 15 HD1 LYS 15 5.876 13.662 -17.615
120 HD3 LYS 15 HD2 LYS 15 5.702 11.937 -18.033
121 HE2 LYS 15 HE1 LYS 15 7.321 12.985 -19.559
122 HE3 LYS 15 HE2 LYS 15 5.863 12.425 -20.468
123 HZ1 LYS 15 HZ1 LYS 15 5.037 14.688 -20.434
124 HZ2 LYS 15 HZ2 LYS 15 6.571 14.625 -21.147
125 HZ3 LYS 15 HZ3 LYS 15 6.395 15.222 -19.571
126 H LEU 16 HN LEU 16 3.622 11.305 -14.390
127 HA LEU 16 HA LEU 16 6.146 10.006 -14.743
128 HB2 LEU 16 HB1 LEU 16 6.292 9.907 -12.291
129 HB3 LEU 16 HB2 LEU 16 6.115 11.547 -12.947
130 HG LEU 16 HG LEU 16 3.618 10.098 -11.954
131 HD11 LEU 16 HD11 LEU 16 4.068 10.908 -9.650
132 HD12 LEU 16 HD12 LEU 16 5.700 11.478 -10.153
133 HD13 LEU 16 HD13 LEU 16 5.313 9.717 -10.174
134 HD21 LEU 16 HD21 LEU 16 4.578 13.042 -11.889
135 HD22 LEU 16 HD22 LEU 16 3.021 12.441 -11.230
136 HD23 LEU 16 HD23 LEU 16 3.323 12.371 -13.002
137 H PHE 17 HN PHE 17 2.896 8.880 -13.703
138 HA PHE 17 HA PHE 17 3.688 6.285 -13.077
139 HB2 PHE 17 HB1 PHE 17 1.473 7.342 -12.498
140 HB3 PHE 17 HB2 PHE 17 1.016 7.303 -14.234
141 HD1 PHE 17 HD1 PHE 17 2.636 4.681 -11.997
142 HD2 PHE 17 HD2 PHE 17 -0.797 5.818 -14.324
143 HE1 PHE 17 HE1 PHE 17 1.641 2.464 -11.611
144 HE2 PHE 17 HE2 PHE 17 -1.804 3.596 -13.912
145 HZ PHE 17 HZ PHE 17 -0.582 1.911 -12.562
146 H CYS 18 HN CYS 18 2.859 7.671 -16.266
147 HA CYS 18 HA CYS 18 2.937 5.342 -17.783
148 HB2 CYS 18 HB1 CYS 18 2.106 7.583 -18.526
149 HB3 CYS 18 HB2 CYS 18 3.774 8.207 -18.515
150 H LEU 19 HN LEU 19 5.734 7.576 -17.021
151 HA LEU 19 HA LEU 19 7.490 5.867 -18.475
152 HB2 LEU 19 HB1 LEU 19 9.299 7.304 -17.884
153 HB3 LEU 19 HB2 LEU 19 7.868 8.229 -18.409
154 HG LEU 19 HG LEU 19 7.441 8.345 -15.725
155 HD11 LEU 19 HD11 LEU 19 10.521 8.298 -16.007
156 HD12 LEU 19 HD12 LEU 19 9.548 7.060 -15.136
157 HD13 LEU 19 HD13 LEU 19 9.594 8.755 -14.534
158 HD21 LEU 19 HD21 LEU 19 8.499 10.604 -15.797
159 HD22 LEU 19 HD22 LEU 19 7.531 10.266 -17.283
160 HD23 LEU 19 HD23 LEU 19 9.337 10.165 -17.332
161 H VAL 20 HN VAL 20 6.827 6.128 -14.954
162 HA VAL 20 HA VAL 20 8.946 4.587 -14.102
163 HB VAL 20 HB VAL 20 6.208 5.122 -12.906
164 HG11 VAL 20 HG11 VAL 20 6.982 2.994 -11.832
165 HG12 VAL 20 HG12 VAL 20 8.632 3.687 -11.608
166 HG13 VAL 20 HG13 VAL 20 7.236 4.363 -10.699
167 HG21 VAL 20 HG21 VAL 20 7.837 7.066 -13.204
168 HG22 VAL 20 HG22 VAL 20 7.557 6.673 -11.469
169 HG23 VAL 20 HG23 VAL 20 9.071 6.137 -12.278
170 H THR 21 HN THR 21 5.720 3.323 -15.118
171 HA THR 21 HA THR 21 6.881 0.620 -14.696
172 HB THR 21 HB THR 21 4.903 -0.404 -14.470
173 HG1 THR 21 HG1 THR 21 3.849 0.349 -16.169
174 HG21 THR 21 HG21 THR 21 4.333 2.418 -13.320
175 HG22 THR 21 HG22 THR 21 5.389 1.171 -12.554
176 HG23 THR 21 HG23 THR 21 3.631 0.852 -12.767
177 H LYS 22 HN LYS 22 7.447 2.488 -17.029
178 HA LYS 22 HA LYS 22 7.652 2.439 -19.205
179 HB2 LYS 22 HB1 LYS 22 9.232 0.788 -18.547
180 HB3 LYS 22 HB2 LYS 22 7.993 -0.493 -18.546
181 HG2 LYS 22 HG1 LYS 22 9.622 -0.629 -20.455
182 HG3 LYS 22 HG2 LYS 22 7.902 -0.626 -20.903
183 HD2 LYS 22 HD1 LYS 22 8.121 1.882 -21.443
184 HD3 LYS 22 HD2 LYS 22 9.901 1.690 -21.250
185 HE2 LYS 22 HE1 LYS 22 9.892 -0.024 -23.109
186 HE3 LYS 22 HE2 LYS 22 8.087 0.057 -23.179
187 HZ1 LYS 22 HZ1 LYS 22 9.031 1.386 -24.902
188 HZ2 LYS 22 HZ2 LYS 22 9.972 2.280 -23.806
189 HZ3 LYS 22 HZ3 LYS 22 8.286 2.399 -23.776
190 H LYS 23 HN LYS 23 5.092 3.019 -18.908
191 HA LYS 23 HA LYS 23 3.616 1.333 -20.842
192 HB2 LYS 23 HB1 LYS 23 2.674 3.691 -19.131
193 HB3 LYS 23 HB2 LYS 23 1.652 2.686 -20.213
194 HG2 LYS 23 HG1 LYS 23 2.263 0.649 -18.884
195 HG3 LYS 23 HG2 LYS 23 3.160 1.668 -17.726
196 HD2 LYS 23 HD1 LYS 23 0.160 1.960 -18.418
197 HD3 LYS 23 HD2 LYS 23 0.744 0.954 -17.068
198 HE2 LYS 23 HE1 LYS 23 1.219 4.014 -17.279
199 HE3 LYS 23 HE2 LYS 23 -0.134 3.238 -16.375
200 HZ1 LYS 23 HZ1 LYS 23 2.466 3.699 -15.483
201 HZ2 LYS 23 HZ2 LYS 23 2.332 2.048 -15.609
202 HZ3 LYS 23 HZ3 LYS 23 1.218 2.913 -14.678
203 H CYS 24 HN CYS 24 5.704 3.969 -20.863
204 HA CYS 24 HA CYS 24 4.381 5.316 -23.101
205 HB2 CYS 24 HB1 CYS 24 7.100 5.840 -21.790
206 HB3 CYS 24 HB2 CYS 24 6.373 6.830 -23.099
Start of MODEL 7
1 H1 PHE 1 HN PHE 1 2.862 -2.251 -1.880
2 HA PHE 1 HA PHE 1 0.873 -1.947 -3.481
3 HB2 PHE 1 HB1 PHE 1 0.668 -3.081 -1.257
4 HB3 PHE 1 HB2 PHE 1 0.596 -1.488 -0.436
5 HD1 PHE 1 HD1 PHE 1 -1.410 -2.176 0.667
6 HD2 PHE 1 HD2 PHE 1 -1.346 -2.043 -3.641
7 HE1 PHE 1 HE1 PHE 1 -3.877 -2.281 0.617
8 HE2 PHE 1 HE2 PHE 1 -3.797 -2.143 -3.674
9 HZ PHE 1 HZ PHE 1 -5.077 -2.260 -1.552
10 H LEU 2 HN LEU 2 0.992 0.552 -0.929
11 HA LEU 2 HA LEU 2 0.238 2.639 -0.847
12 HB2 LEU 2 HB1 LEU 2 1.972 2.819 -3.333
13 HB3 LEU 2 HB2 LEU 2 1.351 4.221 -2.406
14 HG LEU 2 HG LEU 2 2.501 3.213 -0.322
15 HD11 LEU 2 HD11 LEU 2 4.644 1.967 -0.843
16 HD12 LEU 2 HD12 LEU 2 4.071 1.726 -2.533
17 HD13 LEU 2 HD13 LEU 2 3.188 0.965 -1.157
18 HD21 LEU 2 HD21 LEU 2 4.167 4.331 -2.659
19 HD22 LEU 2 HD22 LEU 2 4.613 4.381 -0.915
20 HD23 LEU 2 HD23 LEU 2 3.181 5.304 -1.499
21 HA PRO 3 HA PRO 3 -3.019 2.116 -4.122
22 HB2 PRO 3 HB1 PRO 3 -5.360 2.066 -2.560
23 HB3 PRO 3 HB2 PRO 3 -4.303 0.627 -2.817
24 HG2 PRO 3 HG1 PRO 3 -4.217 2.578 -0.446
25 HG3 PRO 3 HG2 PRO 3 -4.306 0.770 -0.404
26 HD2 PRO 3 HD1 PRO 3 -1.889 2.057 -0.169
27 HD3 PRO 3 HD2 PRO 3 -2.034 0.548 -1.181
28 H ILE 4 HN ILE 4 -3.097 4.450 -1.433
29 HA ILE 4 HA ILE 4 -4.660 6.386 -2.746
30 HB ILE 4 HB ILE 4 -3.669 8.008 -1.152
31 HG12 ILE 4 HG11 ILE 4 -2.092 5.570 -0.085
32 HG13 ILE 4 HG12 ILE 4 -1.370 6.974 -0.944
33 HG21 ILE 4 HG21 ILE 4 -5.714 6.589 -0.727
34 HG22 ILE 4 HG22 ILE 4 -4.674 5.343 0.061
35 HG23 ILE 4 HG23 ILE 4 -4.823 6.985 0.778
36 HD11 ILE 4 HD1 ILE 4 -2.830 7.077 1.774
37 HD12 ILE 4 HD2 ILE 4 -1.071 7.269 1.474
38 HD13 ILE 4 HD3 ILE 4 -2.224 8.512 0.870
39 H LEU 5 HN LEU 5 -1.152 5.737 -2.924
40 HA LEU 5 HA LEU 5 -0.544 8.035 -4.480
41 HB2 LEU 5 HB1 LEU 5 1.075 6.737 -3.080
42 HB3 LEU 5 HB2 LEU 5 1.020 5.403 -4.268
43 HG LEU 5 HG LEU 5 1.720 8.253 -5.154
44 HD11 LEU 5 HD11 LEU 5 4.116 7.845 -4.638
45 HD12 LEU 5 HD12 LEU 5 3.700 6.268 -3.874
46 HD13 LEU 5 HD13 LEU 5 3.124 7.809 -3.135
47 HD21 LEU 5 HD21 LEU 5 2.663 5.464 -6.103
48 HD22 LEU 5 HD22 LEU 5 3.227 7.038 -6.773
49 HD23 LEU 5 HD23 LEU 5 1.511 6.543 -6.978
50 H ALA 6 HN ALA 6 -1.316 4.614 -5.304
51 HA ALA 6 HA ALA 6 -1.124 4.905 -8.080
52 HB1 ALA 6 HB1 ALA 6 -1.262 2.714 -6.860
53 HB2 ALA 6 HB2 ALA 6 -2.966 3.077 -6.417
54 HB3 ALA 6 HB3 ALA 6 -2.519 2.823 -8.147
55 H SER 7 HN SER 7 -3.967 5.413 -5.948
56 HA SER 7 HA SER 7 -5.788 6.140 -7.957
57 HB2 SER 7 HB1 SER 7 -6.371 5.543 -5.586
58 HB3 SER 7 HB2 SER 7 -5.694 7.113 -5.041
59 HG SER 7 HG1 SER 7 -8.014 7.092 -5.402
60 H LEU 8 HN LEU 8 -3.680 8.368 -5.949
61 HA LEU 8 HA LEU 8 -4.595 10.617 -7.381
62 HB2 LEU 8 HB1 LEU 8 -3.093 11.988 -6.213
63 HB3 LEU 8 HB2 LEU 8 -3.699 10.728 -5.101
64 HG LEU 8 HG LEU 8 -1.436 9.479 -5.769
65 HD11 LEU 8 HD11 LEU 8 -0.608 11.206 -7.432
66 HD12 LEU 8 HD12 LEU 8 0.478 11.059 -6.008
67 HD13 LEU 8 HD13 LEU 8 -0.652 12.452 -6.126
68 HD21 LEU 8 HD21 LEU 8 -1.576 11.855 -3.802
69 HD22 LEU 8 HD22 LEU 8 -0.377 10.510 -3.755
70 HD23 LEU 8 HD23 LEU 8 -2.123 10.165 -3.481
71 H ALA 9 HN ALA 9 -1.821 8.456 -7.988
72 HA ALA 9 HA ALA 9 -0.683 9.910 -10.063
73 HB1 ALA 9 HB1 ALA 9 0.413 7.754 -10.658
74 HB2 ALA 9 HB2 ALA 9 0.417 8.008 -8.877
75 HB3 ALA 9 HB3 ALA 9 -0.767 6.872 -9.611
76 H ALA 10 HN ALA 10 -3.332 7.424 -10.228
77 HA ALA 10 HA ALA 10 -3.688 7.695 -13.026
78 HB1 ALA 10 HB1 ALA 10 -5.911 6.623 -12.555
79 HB2 ALA 10 HB2 ALA 10 -4.586 5.797 -11.652
80 HB3 ALA 10 HB3 ALA 10 -5.674 6.938 -10.793
81 H LYS 11 HN LYS 11 -5.275 9.370 -10.284
82 HA LYS 11 HA LYS 11 -7.064 10.876 -11.782
83 HB2 LYS 11 HB1 LYS 11 -7.478 10.383 -9.509
84 HB3 LYS 11 HB2 LYS 11 -5.913 11.031 -8.977
85 HG2 LYS 11 HG1 LYS 11 -7.788 13.043 -10.244
86 HG3 LYS 11 HG2 LYS 11 -8.311 12.329 -8.688
87 HD2 LYS 11 HD1 LYS 11 -6.219 12.927 -7.577
88 HD3 LYS 11 HD2 LYS 11 -5.520 13.523 -9.116
89 HE2 LYS 11 HE1 LYS 11 -7.195 15.383 -9.204
90 HE3 LYS 11 HE2 LYS 11 -7.936 14.798 -7.658
91 HZ1 LYS 11 HZ1 LYS 11 -5.817 15.146 -6.569
92 HZ2 LYS 11 HZ2 LYS 11 -6.329 16.584 -7.309
93 HZ3 LYS 11 HZ3 LYS 11 -5.099 15.654 -8.009
94 H PHE 12 HN PHE 12 -3.756 11.926 -10.744
95 HA PHE 12 HA PHE 12 -3.871 13.761 -12.961
96 HB2 PHE 12 HB1 PHE 12 -3.589 15.876 -11.960
97 HB3 PHE 12 HB2 PHE 12 -5.072 15.140 -11.293
98 HD1 PHE 12 HD1 PHE 12 -3.936 17.549 -10.133
99 HD2 PHE 12 HD2 PHE 12 -2.897 13.457 -9.289
100 HE1 PHE 12 HE1 PHE 12 -3.183 18.195 -7.863
101 HE2 PHE 12 HE2 PHE 12 -2.173 14.103 -7.045
102 HZ PHE 12 HZ PHE 12 -2.308 16.467 -6.312
103 H GLY 13 HN GLY 13 -2.054 11.565 -11.634
104 HA2 GLY 13 HA1 GLY 13 0.469 12.996 -12.230
105 HA3 GLY 13 HA2 GLY 13 0.285 11.494 -11.294
106 HA PRO 14 HA PRO 14 -0.324 9.006 -14.727
107 HB2 PRO 14 HB1 PRO 14 -1.434 9.503 -17.253
108 HB3 PRO 14 HB2 PRO 14 -2.414 9.339 -15.747
109 HG2 PRO 14 HG1 PRO 14 -1.401 11.961 -16.990
110 HG3 PRO 14 HG2 PRO 14 -3.098 11.526 -16.518
111 HD2 PRO 14 HD1 PRO 14 -1.511 12.925 -14.769
112 HD3 PRO 14 HD2 PRO 14 -2.553 11.549 -14.175
113 H LYS 15 HN LYS 15 0.995 11.958 -16.124
114 HA LYS 15 HA LYS 15 2.485 10.765 -18.177
115 HB2 LYS 15 HB1 LYS 15 1.904 13.320 -17.377
116 HB3 LYS 15 HB2 LYS 15 3.616 13.266 -16.899
117 HG2 LYS 15 HG1 LYS 15 2.443 12.637 -19.700
118 HG3 LYS 15 HG2 LYS 15 3.106 14.215 -19.189
119 HD2 LYS 15 HD1 LYS 15 5.356 13.167 -18.828
120 HD3 LYS 15 HD2 LYS 15 4.712 11.596 -19.420
121 HE2 LYS 15 HE1 LYS 15 4.175 12.639 -21.652
122 HE3 LYS 15 HE2 LYS 15 4.783 14.234 -21.059
123 HZ1 LYS 15 HZ1 LYS 15 6.421 13.063 -22.368
124 HZ2 LYS 15 HZ2 LYS 15 6.394 11.738 -21.312
125 HZ3 LYS 15 HZ3 LYS 15 6.960 13.245 -20.774
126 H LEU 16 HN LEU 16 3.499 11.492 -14.781
127 HA LEU 16 HA LEU 16 6.058 10.246 -15.149
128 HB2 LEU 16 HB1 LEU 16 6.332 10.432 -12.713
129 HB3 LEU 16 HB2 LEU 16 6.059 11.987 -13.528
130 HG LEU 16 HG LEU 16 3.680 10.564 -12.242
131 HD11 LEU 16 HD11 LEU 16 5.792 12.219 -10.730
132 HD12 LEU 16 HD12 LEU 16 5.482 10.454 -10.534
133 HD13 LEU 16 HD13 LEU 16 4.216 11.648 -10.071
134 HD21 LEU 16 HD21 LEU 16 4.496 13.537 -12.536
135 HD22 LEU 16 HD22 LEU 16 2.994 12.933 -11.756
136 HD23 LEU 16 HD23 LEU 16 3.236 12.697 -13.522
137 H PHE 17 HN PHE 17 2.887 9.204 -13.846
138 HA PHE 17 HA PHE 17 3.721 6.774 -12.824
139 HB2 PHE 17 HB1 PHE 17 1.485 8.018 -12.531
140 HB3 PHE 17 HB2 PHE 17 1.028 7.469 -14.173
141 HD1 PHE 17 HD1 PHE 17 2.792 5.334 -11.594
142 HD2 PHE 17 HD2 PHE 17 -0.965 6.354 -13.437
143 HE1 PHE 17 HE1 PHE 17 1.721 3.439 -10.470
144 HE2 PHE 17 HE2 PHE 17 -2.036 4.450 -12.284
145 HZ PHE 17 HZ PHE 17 -0.693 2.985 -10.799
146 H CYS 18 HN CYS 18 2.663 7.560 -16.134
147 HA CYS 18 HA CYS 18 2.761 5.050 -17.301
148 HB2 CYS 18 HB1 CYS 18 1.740 7.089 -18.286
149 HB3 CYS 18 HB2 CYS 18 3.338 7.853 -18.421
150 H LEU 19 HN LEU 19 5.514 7.436 -16.980
151 HA LEU 19 HA LEU 19 7.236 5.603 -18.366
152 HB2 LEU 19 HB1 LEU 19 9.027 7.132 -18.126
153 HB3 LEU 19 HB2 LEU 19 7.538 7.972 -18.635
154 HG LEU 19 HG LEU 19 7.333 8.449 -15.977
155 HD11 LEU 19 HD11 LEU 19 10.386 8.319 -16.468
156 HD12 LEU 19 HD12 LEU 19 9.473 7.226 -15.368
157 HD13 LEU 19 HD13 LEU 19 9.569 8.985 -15.009
158 HD21 LEU 19 HD21 LEU 19 7.324 10.149 -17.777
159 HD22 LEU 19 HD22 LEU 19 9.124 10.017 -17.932
160 HD23 LEU 19 HD23 LEU 19 8.392 10.660 -16.416
161 H VAL 20 HN VAL 20 6.809 6.378 -14.873
162 HA VAL 20 HA VAL 20 8.861 4.720 -13.956
163 HB VAL 20 HB VAL 20 6.268 5.658 -12.653
164 HG11 VAL 20 HG11 VAL 20 7.454 5.114 -10.464
165 HG12 VAL 20 HG12 VAL 20 7.045 3.633 -11.392
166 HG13 VAL 20 HG13 VAL 20 8.735 4.262 -11.393
167 HG21 VAL 20 HG21 VAL 20 7.830 7.281 -11.536
168 HG22 VAL 20 HG22 VAL 20 9.217 6.590 -12.447
169 HG23 VAL 20 HG23 VAL 20 7.910 7.469 -13.322
170 H THR 21 HN THR 21 5.420 3.913 -14.585
171 HA THR 21 HA THR 21 6.057 1.106 -13.937
172 HB THR 21 HB THR 21 3.725 0.571 -14.037
173 HG1 THR 21 HG1 THR 21 3.367 3.363 -14.401
174 HG21 THR 21 HG21 THR 21 4.787 1.380 -11.904
175 HG22 THR 21 HG22 THR 21 3.047 1.828 -12.005
176 HG23 THR 21 HG23 THR 21 4.316 3.069 -12.304
177 H LYS 22 HN LYS 22 6.843 2.718 -16.427
178 HA LYS 22 HA LYS 22 7.674 2.120 -18.283
179 HB2 LYS 22 HB1 LYS 22 8.466 0.344 -16.777
180 HB3 LYS 22 HB2 LYS 22 7.120 -0.699 -17.295
181 HG2 LYS 22 HG1 LYS 22 9.165 -1.456 -18.237
182 HG3 LYS 22 HG2 LYS 22 8.119 -0.952 -19.565
183 HD2 LYS 22 HD1 LYS 22 10.485 0.671 -18.366
184 HD3 LYS 22 HD2 LYS 22 10.620 -0.441 -19.750
185 HE2 LYS 22 HE1 LYS 22 9.161 2.271 -19.700
186 HE3 LYS 22 HE2 LYS 22 10.613 1.798 -20.648
187 HZ1 LYS 22 HZ1 LYS 22 9.241 0.300 -21.952
188 HZ2 LYS 22 HZ2 LYS 22 8.517 1.845 -21.893
189 HZ3 LYS 22 HZ3 LYS 22 7.902 0.614 -20.953
190 H LYS 23 HN LYS 23 4.641 2.461 -18.444
191 HA LYS 23 HA LYS 23 4.062 0.909 -20.874
192 HB2 LYS 23 HB1 LYS 23 2.509 2.908 -19.212
193 HB3 LYS 23 HB2 LYS 23 1.993 2.559 -20.886
194 HG2 LYS 23 HG1 LYS 23 1.185 0.520 -20.465
195 HG3 LYS 23 HG2 LYS 23 2.549 0.041 -19.424
196 HD2 LYS 23 HD1 LYS 23 0.298 1.908 -18.474
197 HD3 LYS 23 HD2 LYS 23 0.251 0.118 -18.302
198 HE2 LYS 23 HE1 LYS 23 2.358 0.128 -16.959
199 HE3 LYS 23 HE2 LYS 23 2.495 1.912 -17.156
200 HZ1 LYS 23 HZ1 LYS 23 0.229 2.001 -16.053
201 HZ2 LYS 23 HZ2 LYS 23 1.601 1.617 -15.146
202 HZ3 LYS 23 HZ3 LYS 23 0.510 0.383 -15.577
203 H CYS 24 HN CYS 24 5.480 4.038 -20.111
204 HA CYS 24 HA CYS 24 5.084 4.974 -22.828
205 HB2 CYS 24 HB1 CYS 24 6.921 6.046 -20.632
206 HB3 CYS 24 HB2 CYS 24 6.630 6.836 -22.219
Start of MODEL 8
1 H1 PHE 1 HN PHE 1 0.091 0.613 1.005
2 HA PHE 1 HA PHE 1 0.152 2.870 0.037
3 HB2 PHE 1 HB1 PHE 1 2.356 0.962 -1.021
4 HB3 PHE 1 HB2 PHE 1 2.507 2.759 -0.892
5 HD1 PHE 1 HD1 PHE 1 2.121 3.805 1.449
6 HD2 PHE 1 HD2 PHE 1 2.938 -0.371 0.828
7 HE1 PHE 1 HE1 PHE 1 2.836 3.590 3.809
8 HE2 PHE 1 HE2 PHE 1 3.654 -0.578 3.190
9 HZ PHE 1 HZ PHE 1 3.600 1.401 4.681
10 H LEU 2 HN LEU 2 0.158 0.167 -2.220
11 HA LEU 2 HA LEU 2 0.241 1.609 -4.587
12 HB2 LEU 2 HB1 LEU 2 -0.990 -1.151 -4.056
13 HB3 LEU 2 HB2 LEU 2 -0.700 -0.452 -5.677
14 HG LEU 2 HG LEU 2 0.996 -2.005 -5.303
15 HD11 LEU 2 HD11 LEU 2 2.318 0.727 -4.774
16 HD12 LEU 2 HD12 LEU 2 1.737 0.137 -6.379
17 HD13 LEU 2 HD13 LEU 2 3.075 -0.720 -5.524
18 HD21 LEU 2 HD21 LEU 2 0.880 -2.194 -2.797
19 HD22 LEU 2 HD22 LEU 2 1.891 -0.697 -2.669
20 HD23 LEU 2 HD23 LEU 2 2.552 -2.162 -3.462
21 HA PRO 3 HA PRO 3 -4.361 1.646 -5.252
22 HB2 PRO 3 HB1 PRO 3 -6.205 1.756 -3.128
23 HB3 PRO 3 HB2 PRO 3 -5.657 0.231 -3.918
24 HG2 PRO 3 HG1 PRO 3 -4.536 1.507 -1.364
25 HG3 PRO 3 HG2 PRO 3 -5.046 -0.209 -1.620
26 HD2 PRO 3 HD1 PRO 3 -2.420 0.528 -1.808
27 HD3 PRO 3 HD2 PRO 3 -3.107 -0.655 -3.013
28 H ILE 4 HN ILE 4 -3.397 3.412 -2.252
29 HA ILE 4 HA ILE 4 -4.722 5.795 -3.061
30 HB ILE 4 HB ILE 4 -3.394 6.961 -1.358
31 HG12 ILE 4 HG11 ILE 4 -2.201 4.179 -0.750
32 HG13 ILE 4 HG12 ILE 4 -1.299 5.549 -1.473
33 HG21 ILE 4 HG21 ILE 4 -5.622 5.838 -0.970
34 HG22 ILE 4 HG22 ILE 4 -4.763 4.340 -0.444
35 HG23 ILE 4 HG23 ILE 4 -4.597 5.860 0.502
36 HD11 ILE 4 HD1 ILE 4 -0.816 5.448 0.932
37 HD12 ILE 4 HD2 ILE 4 -1.769 6.936 0.591
38 HD13 ILE 4 HD3 ILE 4 -2.562 5.505 1.345
39 H LEU 5 HN LEU 5 -1.376 4.613 -3.581
40 HA LEU 5 HA LEU 5 -0.433 6.866 -4.932
41 HB2 LEU 5 HB1 LEU 5 0.858 4.949 -3.966
42 HB3 LEU 5 HB2 LEU 5 0.344 3.914 -5.321
43 HG LEU 5 HG LEU 5 1.858 6.562 -5.745
44 HD11 LEU 5 HD11 LEU 5 3.089 3.786 -5.201
45 HD12 LEU 5 HD12 LEU 5 3.147 5.212 -4.099
46 HD13 LEU 5 HD13 LEU 5 3.994 5.270 -5.687
47 HD21 LEU 5 HD21 LEU 5 0.982 5.554 -7.858
48 HD22 LEU 5 HD22 LEU 5 1.705 3.960 -7.411
49 HD23 LEU 5 HD23 LEU 5 2.767 5.368 -7.783
50 H ALA 6 HN ALA 6 -2.085 3.927 -6.255
51 HA ALA 6 HA ALA 6 -2.072 4.755 -8.928
52 HB1 ALA 6 HB1 ALA 6 -3.884 3.038 -9.196
53 HB2 ALA 6 HB2 ALA 6 -2.551 2.421 -8.150
54 HB3 ALA 6 HB3 ALA 6 -4.082 2.989 -7.401
55 H SER 7 HN SER 7 -4.533 5.332 -6.368
56 HA SER 7 HA SER 7 -6.373 6.707 -7.978
57 HB2 SER 7 HB1 SER 7 -6.820 5.796 -5.676
58 HB3 SER 7 HB2 SER 7 -5.813 7.109 -4.981
59 HG SER 7 HG1 SER 7 -8.115 7.544 -5.031
60 H LEU 8 HN LEU 8 -3.691 8.128 -5.940
61 HA LEU 8 HA LEU 8 -4.274 10.732 -6.865
62 HB2 LEU 8 HB1 LEU 8 -2.370 11.556 -5.727
63 HB3 LEU 8 HB2 LEU 8 -3.171 10.304 -4.737
64 HG LEU 8 HG LEU 8 -1.338 8.694 -5.811
65 HD11 LEU 8 HD11 LEU 8 -0.249 10.415 -7.321
66 HD12 LEU 8 HD12 LEU 8 0.879 9.826 -6.050
67 HD13 LEU 8 HD13 LEU 8 0.098 11.437 -5.873
68 HD21 LEU 8 HD21 LEU 8 -1.655 9.153 -3.395
69 HD22 LEU 8 HD22 LEU 8 -0.746 10.705 -3.548
70 HD23 LEU 8 HD23 LEU 8 0.095 9.133 -3.816
71 H ALA 9 HN ALA 9 -2.057 8.239 -8.171
72 HA ALA 9 HA ALA 9 -0.887 9.833 -10.135
73 HB1 ALA 9 HB1 ALA 9 -1.549 6.830 -10.134
74 HB2 ALA 9 HB2 ALA 9 -0.406 7.641 -11.270
75 HB3 ALA 9 HB3 ALA 9 -0.045 7.581 -9.503
76 H ALA 10 HN ALA 10 -3.941 7.862 -10.349
77 HA ALA 10 HA ALA 10 -4.534 8.633 -12.990
78 HB1 ALA 10 HB1 ALA 10 -6.851 7.849 -12.394
79 HB2 ALA 10 HB2 ALA 10 -5.596 6.707 -11.783
80 HB3 ALA 10 HB3 ALA 10 -6.384 7.854 -10.648
81 H LYS 11 HN LYS 11 -5.495 10.101 -9.874
82 HA LYS 11 HA LYS 11 -7.113 12.114 -10.908
83 HB2 LYS 11 HB1 LYS 11 -7.323 11.348 -8.667
84 HB3 LYS 11 HB2 LYS 11 -5.615 11.665 -8.299
85 HG2 LYS 11 HG1 LYS 11 -7.234 14.107 -9.050
86 HG3 LYS 11 HG2 LYS 11 -7.720 13.275 -7.541
87 HD2 LYS 11 HD1 LYS 11 -5.446 13.350 -6.639
88 HD3 LYS 11 HD2 LYS 11 -4.820 14.047 -8.168
89 HE2 LYS 11 HE1 LYS 11 -6.134 16.146 -7.796
90 HE3 LYS 11 HE2 LYS 11 -6.805 15.464 -6.258
91 HZ1 LYS 11 HZ1 LYS 11 -3.912 15.886 -6.850
92 HZ2 LYS 11 HZ2 LYS 11 -4.562 15.298 -5.409
93 HZ3 LYS 11 HZ3 LYS 11 -4.877 16.894 -5.889
94 H PHE 12 HN PHE 12 -3.553 12.359 -10.220
95 HA PHE 12 HA PHE 12 -3.523 14.484 -12.153
96 HB2 PHE 12 HB1 PHE 12 -2.796 16.372 -10.937
97 HB3 PHE 12 HB2 PHE 12 -4.312 15.797 -10.190
98 HD1 PHE 12 HD1 PHE 12 -2.645 17.806 -8.898
99 HD2 PHE 12 HD2 PHE 12 -2.298 13.521 -8.675
100 HE1 PHE 12 HE1 PHE 12 -1.566 17.997 -6.676
101 HE2 PHE 12 HE2 PHE 12 -1.251 13.718 -6.475
102 HZ PHE 12 HZ PHE 12 -0.874 15.949 -5.457
103 H GLY 13 HN GLY 13 -1.964 11.860 -11.418
104 HA2 GLY 13 HA1 GLY 13 0.682 13.067 -12.032
105 HA3 GLY 13 HA2 GLY 13 0.444 11.728 -10.879
106 HA PRO 14 HA PRO 14 -0.239 9.072 -14.361
107 HB2 PRO 14 HB1 PRO 14 -1.267 9.661 -16.887
108 HB3 PRO 14 HB2 PRO 14 -2.300 9.589 -15.409
109 HG2 PRO 14 HG1 PRO 14 -1.051 12.114 -16.642
110 HG3 PRO 14 HG2 PRO 14 -2.788 11.818 -16.212
111 HD2 PRO 14 HD1 PRO 14 -1.118 13.104 -14.429
112 HD3 PRO 14 HD2 PRO 14 -2.319 11.859 -13.863
113 H LYS 15 HN LYS 15 1.228 12.025 -15.494
114 HA LYS 15 HA LYS 15 2.803 10.926 -17.554
115 HB2 LYS 15 HB1 LYS 15 2.198 13.440 -16.781
116 HB3 LYS 15 HB2 LYS 15 3.808 13.353 -16.027
117 HG2 LYS 15 HG1 LYS 15 3.066 12.920 -18.998
118 HG3 LYS 15 HG2 LYS 15 3.804 14.392 -18.282
119 HD2 LYS 15 HD1 LYS 15 5.823 12.989 -17.607
120 HD3 LYS 15 HD2 LYS 15 5.154 11.623 -18.536
121 HE2 LYS 15 HE1 LYS 15 5.964 14.394 -19.673
122 HE3 LYS 15 HE2 LYS 15 6.892 12.851 -19.842
123 HZ1 LYS 15 HZ1 LYS 15 4.155 13.389 -20.887
124 HZ2 LYS 15 HZ2 LYS 15 4.988 11.920 -21.022
125 HZ3 LYS 15 HZ3 LYS 15 5.580 13.309 -21.800
126 H LEU 16 HN LEU 16 3.616 11.422 -14.046
127 HA LEU 16 HA LEU 16 6.190 10.211 -14.381
128 HB2 LEU 16 HB1 LEU 16 6.427 10.283 -11.976
129 HB3 LEU 16 HB2 LEU 16 5.849 11.832 -12.632
130 HG LEU 16 HG LEU 16 3.429 10.806 -11.958
131 HD11 LEU 16 HD11 LEU 16 5.361 9.585 -9.874
132 HD12 LEU 16 HD12 LEU 16 4.364 8.629 -11.029
133 HD13 LEU 16 HD13 LEU 16 3.566 9.632 -9.764
134 HD21 LEU 16 HD21 LEU 16 3.607 12.111 -9.848
135 HD22 LEU 16 HD22 LEU 16 4.380 12.989 -11.220
136 HD23 LEU 16 HD23 LEU 16 5.400 12.137 -10.000
137 H PHE 17 HN PHE 17 2.966 8.990 -13.432
138 HA PHE 17 HA PHE 17 3.753 6.445 -12.698
139 HB2 PHE 17 HB1 PHE 17 1.506 7.657 -12.354
140 HB3 PHE 17 HB2 PHE 17 1.090 7.239 -14.050
141 HD1 PHE 17 HD1 PHE 17 2.107 5.769 -10.731
142 HD2 PHE 17 HD2 PHE 17 0.158 5.100 -14.499
143 HE1 PHE 17 HE1 PHE 17 1.253 3.600 -9.903
144 HE2 PHE 17 HE2 PHE 17 -0.700 2.932 -13.670
145 HZ PHE 17 HZ PHE 17 -0.159 2.182 -11.367
146 H CYS 18 HN CYS 18 2.815 7.591 -16.004
147 HA CYS 18 HA CYS 18 3.139 5.068 -17.185
148 HB2 CYS 18 HB1 CYS 18 2.953 6.070 -19.322
149 HB3 CYS 18 HB2 CYS 18 1.834 6.906 -18.215
150 H LEU 19 HN LEU 19 5.614 7.542 -16.464
151 HA LEU 19 HA LEU 19 7.673 6.197 -17.938
152 HB2 LEU 19 HB1 LEU 19 7.748 8.152 -15.577
153 HB3 LEU 19 HB2 LEU 19 9.212 7.586 -16.437
154 HG LEU 19 HG LEU 19 6.906 9.065 -17.827
155 HD11 LEU 19 HD11 LEU 19 8.351 11.107 -17.687
156 HD12 LEU 19 HD12 LEU 19 9.531 10.197 -16.671
157 HD13 LEU 19 HD13 LEU 19 7.867 10.511 -16.054
158 HD21 LEU 19 HD21 LEU 19 9.839 8.554 -18.654
159 HD22 LEU 19 HD22 LEU 19 8.635 9.510 -19.590
160 HD23 LEU 19 HD23 LEU 19 8.397 7.736 -19.360
161 H VAL 20 HN VAL 20 6.768 6.178 -14.440
162 HA VAL 20 HA VAL 20 8.716 4.365 -13.617
163 HB VAL 20 HB VAL 20 5.997 5.110 -12.459
164 HG11 VAL 20 HG11 VAL 20 8.305 3.476 -11.186
165 HG12 VAL 20 HG12 VAL 20 6.933 4.196 -10.273
166 HG13 VAL 20 HG13 VAL 20 6.620 2.896 -11.470
167 HG21 VAL 20 HG21 VAL 20 7.416 6.509 -10.933
168 HG22 VAL 20 HG22 VAL 20 8.904 5.932 -11.762
169 HG23 VAL 20 HG23 VAL 20 7.725 6.971 -12.644
170 H THR 21 HN THR 21 5.376 3.697 -14.732
171 HA THR 21 HA THR 21 5.789 0.843 -14.259
172 HB THR 21 HB THR 21 3.471 0.537 -15.015
173 HG1 THR 21 HG1 THR 21 3.312 3.344 -15.160
174 HG21 THR 21 HG21 THR 21 3.944 1.157 -12.622
175 HG22 THR 21 HG22 THR 21 2.364 1.792 -13.206
176 HG23 THR 21 HG23 THR 21 3.769 2.897 -13.034
177 H LYS 22 HN LYS 22 7.019 2.663 -16.566
178 HA LYS 22 HA LYS 22 7.371 2.688 -18.701
179 HB2 LYS 22 HB1 LYS 22 8.948 1.031 -17.943
180 HB3 LYS 22 HB2 LYS 22 7.784 -0.283 -18.256
181 HG2 LYS 22 HG1 LYS 22 9.579 -0.108 -19.994
182 HG3 LYS 22 HG2 LYS 22 7.936 0.036 -20.671
183 HD2 LYS 22 HD1 LYS 22 8.205 2.551 -20.755
184 HD3 LYS 22 HD2 LYS 22 9.890 2.367 -20.154
185 HE2 LYS 22 HE1 LYS 22 10.493 1.082 -22.228
186 HE3 LYS 22 HE2 LYS 22 8.764 1.109 -22.762
187 HZ1 LYS 22 HZ1 LYS 22 10.003 2.812 -23.874
188 HZ2 LYS 22 HZ2 LYS 22 10.532 3.484 -22.407
189 HZ3 LYS 22 HZ3 LYS 22 8.893 3.528 -22.818
190 H LYS 23 HN LYS 23 5.019 3.308 -18.818
191 HA LYS 23 HA LYS 23 3.849 1.781 -21.079
192 HB2 LYS 23 HB1 LYS 23 2.465 3.638 -19.060
193 HB3 LYS 23 HB2 LYS 23 1.661 2.840 -20.453
194 HG2 LYS 23 HG1 LYS 23 3.017 1.380 -18.100
195 HG3 LYS 23 HG2 LYS 23 1.275 1.715 -18.201
196 HD2 LYS 23 HD1 LYS 23 0.860 0.170 -19.882
197 HD3 LYS 23 HD2 LYS 23 2.488 0.250 -20.585
198 HE2 LYS 23 HE1 LYS 23 1.843 -1.145 -17.896
199 HE3 LYS 23 HE2 LYS 23 2.010 -1.957 -19.505
200 HZ1 LYS 23 HZ1 LYS 23 4.113 -2.140 -18.584
201 HZ2 LYS 23 HZ2 LYS 23 4.100 -0.605 -17.895
202 HZ3 LYS 23 HZ3 LYS 23 4.288 -0.740 -19.530
203 H CYS 24 HN CYS 24 5.508 4.659 -20.170
204 HA CYS 24 HA CYS 24 4.638 6.085 -22.544
205 HB2 CYS 24 HB2 CYS 24 7.009 6.521 -20.657
206 HB3 CYS 24 HB1 CYS 24 6.653 7.570 -22.070
Start of MODEL 9
1 H1 PHE 1 HN PHE 1 3.651 0.352 -0.851
2 HA PHE 1 HA PHE 1 1.513 -1.346 -1.565
3 HB2 PHE 1 HB1 PHE 1 1.182 0.512 0.881
4 HB3 PHE 1 HB2 PHE 1 -0.232 -0.135 -0.038
5 HD1 PHE 1 HD1 PHE 1 -0.688 -2.563 -0.106
6 HD2 PHE 1 HD2 PHE 1 2.429 -0.929 2.360
7 HE1 PHE 1 HE1 PHE 1 -0.641 -4.653 1.224
8 HE2 PHE 1 HE2 PHE 1 2.471 -3.017 3.689
9 HZ PHE 1 HZ PHE 1 0.938 -4.880 3.122
10 H LEU 2 HN LEU 2 -0.369 0.069 -2.452
11 HA LEU 2 HA LEU 2 0.575 2.700 -3.311
12 HB2 LEU 2 HB1 LEU 2 0.460 2.073 -5.752
13 HB3 LEU 2 HB2 LEU 2 1.768 1.332 -4.808
14 HG LEU 2 HG LEU 2 0.529 -0.819 -4.661
15 HD11 LEU 2 HD11 LEU 2 -1.493 0.520 -6.575
16 HD12 LEU 2 HD12 LEU 2 -1.847 -0.171 -4.943
17 HD13 LEU 2 HD13 LEU 2 -1.359 -1.255 -6.288
18 HD21 LEU 2 HD21 LEU 2 2.240 -0.379 -6.403
19 HD22 LEU 2 HD22 LEU 2 0.966 0.264 -7.509
20 HD23 LEU 2 HD23 LEU 2 0.946 -1.473 -7.017
21 HA PRO 3 HA PRO 3 -3.940 1.908 -4.593
22 HB2 PRO 3 HB1 PRO 3 -5.756 2.131 -2.477
23 HB3 PRO 3 HB2 PRO 3 -4.970 0.580 -2.947
24 HG2 PRO 3 HG1 PRO 3 -4.075 2.513 -0.736
25 HG3 PRO 3 HG2 PRO 3 -4.321 0.727 -0.626
26 HD2 PRO 3 HD1 PRO 3 -1.812 1.813 -1.069
27 HD3 PRO 3 HD2 PRO 3 -2.339 0.277 -1.898
28 H ILE 4 HN ILE 4 -3.459 4.212 -1.823
29 HA ILE 4 HA ILE 4 -4.904 6.272 -3.094
30 HB ILE 4 HB ILE 4 -3.952 7.805 -1.466
31 HG12 ILE 4 HG11 ILE 4 -2.297 5.387 -0.486
32 HG13 ILE 4 HG12 ILE 4 -1.647 6.870 -1.271
33 HG21 ILE 4 HG21 ILE 4 -4.898 5.116 -0.261
34 HG22 ILE 4 HG22 ILE 4 -5.090 6.756 0.448
35 HG23 ILE 4 HG23 ILE 4 -5.969 6.332 -1.056
36 HD11 ILE 4 HD1 ILE 4 -2.559 8.266 0.626
37 HD12 ILE 4 HD2 ILE 4 -3.086 6.757 1.457
38 HD13 ILE 4 HD3 ILE 4 -1.342 7.052 1.154
39 H LEU 5 HN LEU 5 -1.435 5.420 -3.242
40 HA LEU 5 HA LEU 5 -0.621 7.673 -4.704
41 HB2 LEU 5 HB1 LEU 5 0.572 4.834 -4.669
42 HB3 LEU 5 HB2 LEU 5 1.329 6.275 -5.409
43 HG LEU 5 HG LEU 5 2.480 6.068 -3.454
44 HD11 LEU 5 HD11 LEU 5 0.281 8.039 -2.584
45 HD12 LEU 5 HD12 LEU 5 1.627 8.411 -3.735
46 HD13 LEU 5 HD13 LEU 5 1.986 7.981 -2.024
47 HD21 LEU 5 HD21 LEU 5 1.577 5.708 -1.169
48 HD22 LEU 5 HD22 LEU 5 1.277 4.332 -2.272
49 HD23 LEU 5 HD23 LEU 5 -0.071 5.465 -1.843
50 H ALA 6 HN ALA 6 -1.789 4.462 -5.862
51 HA ALA 6 HA ALA 6 -1.582 5.045 -8.595
52 HB1 ALA 6 HB1 ALA 6 -3.181 3.114 -8.840
53 HB2 ALA 6 HB2 ALA 6 -1.885 2.747 -7.640
54 HB3 ALA 6 HB3 ALA 6 -3.526 3.202 -7.069
55 H SER 7 HN SER 7 -4.328 5.539 -6.324
56 HA SER 7 HA SER 7 -6.129 6.582 -8.212
57 HB2 SER 7 HB1 SER 7 -6.737 5.796 -5.912
58 HB3 SER 7 HB2 SER 7 -5.918 7.232 -5.214
59 HG SER 7 HG1 SER 7 -8.251 7.422 -5.536
60 H LEU 8 HN LEU 8 -3.824 8.433 -6.061
61 HA LEU 8 HA LEU 8 -4.612 10.872 -7.228
62 HB2 LEU 8 HB1 LEU 8 -2.923 12.007 -5.996
63 HB3 LEU 8 HB2 LEU 8 -3.685 10.743 -4.989
64 HG LEU 8 HG LEU 8 -1.591 9.284 -5.745
65 HD11 LEU 8 HD11 LEU 8 -0.542 11.031 -7.276
66 HD12 LEU 8 HD12 LEU 8 0.504 10.619 -5.874
67 HD13 LEU 8 HD13 LEU 8 -0.431 12.152 -5.864
68 HD21 LEU 8 HD21 LEU 8 -2.201 9.872 -3.415
69 HD22 LEU 8 HD22 LEU 8 -1.480 11.515 -3.613
70 HD23 LEU 8 HD23 LEU 8 -0.428 10.056 -3.663
71 H ALA 9 HN ALA 9 -1.955 8.645 -8.122
72 HA ALA 9 HA ALA 9 -0.837 10.257 -10.105
73 HB1 ALA 9 HB1 ALA 9 0.204 8.138 -10.903
74 HB2 ALA 9 HB2 ALA 9 0.270 8.253 -9.107
75 HB3 ALA 9 HB3 ALA 9 -0.956 7.194 -9.884
76 H ALA 10 HN ALA 10 -3.523 7.810 -10.405
77 HA ALA 10 HA ALA 10 -3.883 8.208 -13.167
78 HB1 ALA 10 HB1 ALA 10 -5.900 7.451 -10.960
79 HB2 ALA 10 HB2 ALA 10 -6.149 7.203 -12.732
80 HB3 ALA 10 HB3 ALA 10 -4.855 6.300 -11.859
81 H LYS 11 HN LYS 11 -5.373 9.857 -10.370
82 HA LYS 11 HA LYS 11 -7.067 11.519 -11.823
83 HB2 LYS 11 HB1 LYS 11 -7.251 10.845 -9.469
84 HB3 LYS 11 HB2 LYS 11 -5.854 11.844 -9.027
85 HG2 LYS 11 HG1 LYS 11 -8.378 12.982 -10.400
86 HG3 LYS 11 HG2 LYS 11 -8.430 12.619 -8.662
87 HD2 LYS 11 HD1 LYS 11 -6.417 14.622 -9.902
88 HD3 LYS 11 HD2 LYS 11 -8.052 15.032 -9.346
89 HE2 LYS 11 HE1 LYS 11 -6.596 15.651 -7.545
90 HE3 LYS 11 HE2 LYS 11 -7.501 14.178 -7.015
91 HZ1 LYS 11 HZ1 LYS 11 -4.701 14.340 -8.015
92 HZ2 LYS 11 HZ2 LYS 11 -5.535 12.890 -7.764
93 HZ3 LYS 11 HZ3 LYS 11 -5.216 13.939 -6.458
94 H PHE 12 HN PHE 12 -3.660 12.263 -10.804
95 HA PHE 12 HA PHE 12 -3.722 14.329 -12.840
96 HB2 PHE 12 HB1 PHE 12 -3.051 16.250 -11.453
97 HB3 PHE 12 HB2 PHE 12 -4.699 15.660 -11.125
98 HD1 PHE 12 HD1 PHE 12 -4.418 17.269 -9.176
99 HD2 PHE 12 HD2 PHE 12 -2.073 13.663 -9.470
100 HE1 PHE 12 HE1 PHE 12 -3.870 17.408 -6.766
101 HE2 PHE 12 HE2 PHE 12 -1.548 13.814 -7.098
102 HZ PHE 12 HZ PHE 12 -2.434 15.677 -5.721
103 H GLY 13 HN GLY 13 -1.994 11.847 -12.084
104 HA2 GLY 13 HA1 GLY 13 0.527 13.259 -12.746
105 HA3 GLY 13 HA2 GLY 13 0.435 11.904 -11.581
106 HA PRO 14 HA PRO 14 -0.499 9.307 -15.159
107 HB2 PRO 14 HB1 PRO 14 -1.294 10.127 -17.717
108 HB3 PRO 14 HB2 PRO 14 -2.430 10.018 -16.320
109 HG2 PRO 14 HG1 PRO 14 -0.946 12.532 -17.280
110 HG3 PRO 14 HG2 PRO 14 -2.721 12.326 -16.977
111 HD2 PRO 14 HD1 PRO 14 -1.094 13.373 -15.015
112 HD3 PRO 14 HD2 PRO 14 -2.398 12.172 -14.602
113 H LYS 15 HN LYS 15 1.273 12.178 -16.257
114 HA LYS 15 HA LYS 15 2.910 10.787 -18.095
115 HB2 LYS 15 HB1 LYS 15 2.466 13.424 -17.512
116 HB3 LYS 15 HB2 LYS 15 4.094 13.241 -16.814
117 HG2 LYS 15 HG1 LYS 15 3.215 12.515 -19.692
118 HG3 LYS 15 HG2 LYS 15 3.984 14.062 -19.209
119 HD2 LYS 15 HD1 LYS 15 6.081 12.851 -18.566
120 HD3 LYS 15 HD2 LYS 15 5.301 11.285 -18.908
121 HE2 LYS 15 HE1 LYS 15 6.806 11.855 -20.762
122 HE3 LYS 15 HE2 LYS 15 5.090 11.818 -21.328
123 HZ1 LYS 15 HZ1 LYS 15 5.041 14.223 -21.162
124 HZ2 LYS 15 HZ2 LYS 15 6.292 13.721 -22.186
125 HZ3 LYS 15 HZ3 LYS 15 6.647 14.265 -20.621
126 H LEU 16 HN LEU 16 3.487 11.536 -14.586
127 HA LEU 16 HA LEU 16 5.981 10.147 -14.599
128 HB2 LEU 16 HB1 LEU 16 5.992 10.322 -12.171
129 HB3 LEU 16 HB2 LEU 16 5.715 11.863 -13.013
130 HG LEU 16 HG LEU 16 3.145 11.398 -12.521
131 HD11 LEU 16 HD11 LEU 16 2.798 10.312 -10.288
132 HD12 LEU 16 HD12 LEU 16 4.527 9.825 -10.241
133 HD13 LEU 16 HD13 LEU 16 3.419 9.101 -11.462
134 HD21 LEU 16 HD21 LEU 16 4.483 13.327 -11.695
135 HD22 LEU 16 HD22 LEU 16 5.148 12.305 -10.367
136 HD23 LEU 16 HD23 LEU 16 3.391 12.691 -10.410
137 H PHE 17 HN PHE 17 2.619 9.147 -13.867
138 HA PHE 17 HA PHE 17 3.272 6.561 -13.084
139 HB2 PHE 17 HB1 PHE 17 1.025 7.716 -12.796
140 HB3 PHE 17 HB2 PHE 17 0.742 7.540 -14.558
141 HD1 PHE 17 HD1 PHE 17 2.086 5.139 -11.919
142 HD2 PHE 17 HD2 PHE 17 -1.019 6.006 -14.764
143 HE1 PHE 17 HE1 PHE 17 1.061 2.948 -11.466
144 HE2 PHE 17 HE2 PHE 17 -2.061 3.814 -14.285
145 HZ PHE 17 HZ PHE 17 -1.017 2.276 -12.642
146 H CYS 18 HN CYS 18 2.724 7.807 -16.440
147 HA CYS 18 HA CYS 18 3.019 5.253 -17.578
148 HB2 CYS 18 HB1 CYS 18 2.971 6.152 -19.709
149 HB3 CYS 18 HB2 CYS 18 1.881 7.157 -18.723
150 H LEU 19 HN LEU 19 5.584 7.760 -16.958
151 HA LEU 19 HA LEU 19 7.491 6.151 -18.298
152 HB2 LEU 19 HB1 LEU 19 9.187 7.664 -17.674
153 HB3 LEU 19 HB2 LEU 19 7.711 8.548 -18.145
154 HG LEU 19 HG LEU 19 7.296 8.558 -15.472
155 HD11 LEU 19 HD11 LEU 19 9.439 8.959 -14.251
156 HD12 LEU 19 HD12 LEU 19 10.381 8.564 -15.732
157 HD13 LEU 19 HD13 LEU 19 9.423 7.285 -14.906
158 HD21 LEU 19 HD21 LEU 19 7.400 10.547 -16.967
159 HD22 LEU 19 HD22 LEU 19 9.206 10.457 -16.976
160 HD23 LEU 19 HD23 LEU 19 8.330 10.831 -15.447
161 H VAL 20 HN VAL 20 6.702 6.310 -14.788
162 HA VAL 20 HA VAL 20 8.884 4.878 -13.913
163 HB VAL 20 HB VAL 20 6.093 5.214 -12.767
164 HG11 VAL 20 HG11 VAL 20 8.591 3.937 -11.445
165 HG12 VAL 20 HG12 VAL 20 7.137 4.499 -10.552
166 HG13 VAL 20 HG13 VAL 20 6.999 3.130 -11.706
167 HG21 VAL 20 HG21 VAL 20 8.865 6.420 -12.079
168 HG22 VAL 20 HG22 VAL 20 7.583 7.272 -13.012
169 HG23 VAL 20 HG23 VAL 20 7.305 6.835 -11.288
170 H THR 21 HN THR 21 5.762 3.438 -14.999
171 HA THR 21 HA THR 21 7.080 0.795 -14.639
172 HB THR 21 HB THR 21 5.126 -0.347 -14.509
173 HG1 THR 21 HG1 THR 21 4.012 0.476 -16.117
174 HG21 THR 21 HG21 THR 21 3.848 0.740 -12.698
175 HG22 THR 21 HG22 THR 21 4.499 2.363 -13.139
176 HG23 THR 21 HG23 THR 21 5.599 1.092 -12.487
177 H LYS 22 HN LYS 22 7.570 2.745 -16.865
178 HA LYS 22 HA LYS 22 7.721 2.906 -19.017
179 HB2 LYS 22 HB1 LYS 22 9.362 1.173 -18.351
180 HB3 LYS 22 HB2 LYS 22 8.252 -0.083 -18.951
181 HG2 LYS 22 HG1 LYS 22 8.694 2.069 -20.970
182 HG3 LYS 22 HG2 LYS 22 10.253 1.427 -20.398
183 HD2 LYS 22 HD1 LYS 22 9.979 -0.638 -21.353
184 HD3 LYS 22 HD2 LYS 22 8.234 -0.713 -21.016
185 HE2 LYS 22 HE1 LYS 22 9.466 0.959 -23.319
186 HE3 LYS 22 HE2 LYS 22 8.743 -0.694 -23.474
187 HZ1 LYS 22 HZ1 LYS 22 7.414 1.875 -23.078
188 HZ2 LYS 22 HZ2 LYS 22 6.837 0.622 -22.145
189 HZ3 LYS 22 HZ3 LYS 22 6.870 0.463 -23.837
190 H LYS 23 HN LYS 23 5.136 3.172 -18.711
191 HA LYS 23 HA LYS 23 3.807 1.563 -20.798
192 HB2 LYS 23 HB1 LYS 23 2.650 3.770 -19.013
193 HB3 LYS 23 HB2 LYS 23 1.744 2.679 -20.113
194 HG2 LYS 23 HG1 LYS 23 2.519 0.706 -18.769
195 HG3 LYS 23 HG2 LYS 23 3.326 1.804 -17.613
196 HD2 LYS 23 HD1 LYS 23 0.314 1.843 -18.294
197 HD3 LYS 23 HD2 LYS 23 0.982 0.879 -16.955
198 HE2 LYS 23 HE1 LYS 23 1.224 3.967 -17.131
199 HE3 LYS 23 HE2 LYS 23 -0.093 3.089 -16.271
200 HZ1 LYS 23 HZ1 LYS 23 2.451 2.094 -15.447
201 HZ2 LYS 23 HZ2 LYS 23 1.222 2.827 -14.541
202 HZ3 LYS 23 HZ3 LYS 23 2.409 3.753 -15.288
203 H CYS 24 HN CYS 24 5.645 4.424 -20.445
204 HA CYS 24 HA CYS 24 4.556 5.671 -22.851
205 HB2 CYS 24 HB2 CYS 24 7.119 6.257 -21.267
206 HB3 CYS 24 HB1 CYS 24 6.562 7.190 -22.694
Start of MODEL 10
1 H1 PHE 1 HN PHE 1 1.452 -2.019 -0.303
2 HA PHE 1 HA PHE 1 0.826 -2.182 -2.717
3 HB2 PHE 1 HB1 PHE 1 -1.428 -1.437 -0.723
4 HB3 PHE 1 HB2 PHE 1 -1.680 -2.300 -2.292
5 HD1 PHE 1 HD1 PHE 1 -0.381 -4.502 -2.647
6 HD2 PHE 1 HD2 PHE 1 -0.938 -2.690 1.210
7 HE1 PHE 1 HE1 PHE 1 0.089 -6.678 -1.554
8 HE2 PHE 1 HE2 PHE 1 -0.469 -4.863 2.298
9 HZ PHE 1 HZ PHE 1 0.047 -6.856 0.920
10 H LEU 2 HN LEU 2 0.644 0.784 -1.122
11 HA LEU 2 HA LEU 2 0.230 2.915 -1.687
12 HB2 LEU 2 HB1 LEU 2 1.577 1.723 -4.116
13 HB3 LEU 2 HB2 LEU 2 1.137 3.443 -4.135
14 HG LEU 2 HG LEU 2 2.429 3.799 -1.995
15 HD11 LEU 2 HD11 LEU 2 3.521 0.976 -2.610
16 HD12 LEU 2 HD12 LEU 2 2.680 1.496 -1.100
17 HD13 LEU 2 HD13 LEU 2 4.295 2.167 -1.503
18 HD21 LEU 2 HD21 LEU 2 3.973 2.785 -4.462
19 HD22 LEU 2 HD22 LEU 2 4.610 3.891 -3.189
20 HD23 LEU 2 HD23 LEU 2 3.263 4.433 -4.259
21 HA PRO 3 HA PRO 3 -3.528 2.129 -4.400
22 HB2 PRO 3 HB1 PRO 3 -5.711 2.239 -2.654
23 HB3 PRO 3 HB2 PRO 3 -4.716 0.754 -2.888
24 HG2 PRO 3 HG1 PRO 3 -4.406 2.851 -0.664
25 HG3 PRO 3 HG2 PRO 3 -4.529 1.054 -0.497
26 HD2 PRO 3 HD1 PRO 3 -2.063 2.316 -0.548
27 HD3 PRO 3 HD2 PRO 3 -2.330 0.720 -1.385
28 H ILE 4 HN ILE 4 -3.487 4.519 -1.712
29 HA ILE 4 HA ILE 4 -4.976 6.474 -3.093
30 HB ILE 4 HB ILE 4 -4.015 8.088 -1.450
31 HG12 ILE 4 HG11 ILE 4 -2.670 5.584 -0.233
32 HG13 ILE 4 HG12 ILE 4 -1.793 6.894 -1.097
33 HG21 ILE 4 HG21 ILE 4 -6.151 6.783 -1.169
34 HG22 ILE 4 HG22 ILE 4 -5.236 5.471 -0.335
35 HG23 ILE 4 HG23 ILE 4 -5.343 7.108 0.399
36 HD11 ILE 4 HD1 ILE 4 -2.633 8.566 0.598
37 HD12 ILE 4 HD2 ILE 4 -3.414 7.224 1.510
38 HD13 ILE 4 HD3 ILE 4 -1.629 7.265 1.328
39 H LEU 5 HN LEU 5 -1.475 5.811 -3.062
40 HA LEU 5 HA LEU 5 -0.703 8.028 -4.634
41 HB2 LEU 5 HB1 LEU 5 0.492 5.352 -3.885
42 HB3 LEU 5 HB2 LEU 5 1.242 6.247 -5.241
43 HG LEU 5 HG LEU 5 2.427 6.601 -3.149
44 HD11 LEU 5 HD11 LEU 5 2.486 8.341 -4.929
45 HD12 LEU 5 HD12 LEU 5 2.664 9.049 -3.282
46 HD13 LEU 5 HD13 LEU 5 1.097 9.194 -4.153
47 HD21 LEU 5 HD21 LEU 5 0.550 6.478 -1.503
48 HD22 LEU 5 HD22 LEU 5 -0.047 8.088 -2.077
49 HD23 LEU 5 HD23 LEU 5 1.562 7.951 -1.291
50 H ALA 6 HN ALA 6 -1.657 4.663 -5.582
51 HA ALA 6 HA ALA 6 -1.389 5.064 -8.338
52 HB1 ALA 6 HB1 ALA 6 -1.641 2.832 -7.217
53 HB2 ALA 6 HB2 ALA 6 -3.331 3.251 -6.775
54 HB3 ALA 6 HB3 ALA 6 -2.876 3.053 -8.512
55 H SER 7 HN SER 7 -4.244 5.601 -6.225
56 HA SER 7 HA SER 7 -6.005 6.451 -8.236
57 HB2 SER 7 HB1 SER 7 -6.646 5.804 -5.893
58 HB3 SER 7 HB2 SER 7 -5.936 7.340 -5.293
59 HG SER 7 HG1 SER 7 -8.252 7.387 -5.697
60 H LEU 8 HN LEU 8 -3.860 8.546 -6.140
61 HA LEU 8 HA LEU 8 -4.649 10.865 -7.544
62 HB2 LEU 8 HB1 LEU 8 -3.072 12.145 -6.339
63 HB3 LEU 8 HB2 LEU 8 -3.853 10.952 -5.263
64 HG LEU 8 HG LEU 8 -1.684 9.498 -5.778
65 HD11 LEU 8 HD11 LEU 8 -0.609 12.381 -6.123
66 HD12 LEU 8 HD12 LEU 8 -0.594 11.105 -7.401
67 HD13 LEU 8 HD13 LEU 8 0.382 10.896 -5.907
68 HD21 LEU 8 HD21 LEU 8 -0.663 10.465 -3.704
69 HD22 LEU 8 HD22 LEU 8 -2.445 10.272 -3.546
70 HD23 LEU 8 HD23 LEU 8 -1.736 11.905 -3.845
71 H ALA 9 HN ALA 9 -1.972 8.576 -8.161
72 HA ALA 9 HA ALA 9 -0.748 10.031 -10.193
73 HB1 ALA 9 HB1 ALA 9 -1.017 6.989 -9.853
74 HB2 ALA 9 HB2 ALA 9 0.186 7.826 -10.909
75 HB3 ALA 9 HB3 ALA 9 0.258 8.021 -9.120
76 H ALA 10 HN ALA 10 -3.526 7.689 -10.452
77 HA ALA 10 HA ALA 10 -3.857 8.063 -13.232
78 HB1 ALA 10 HB1 ALA 10 -6.138 7.100 -12.803
79 HB2 ALA 10 HB2 ALA 10 -4.865 6.184 -11.914
80 HB3 ALA 10 HB3 ALA 10 -5.897 7.358 -11.031
81 H LYS 11 HN LYS 11 -5.366 9.751 -10.461
82 HA LYS 11 HA LYS 11 -7.053 11.405 -11.920
83 HB2 LYS 11 HB1 LYS 11 -7.504 10.893 -9.662
84 HB3 LYS 11 HB2 LYS 11 -5.897 11.413 -9.114
85 HG2 LYS 11 HG1 LYS 11 -7.630 13.585 -10.324
86 HG3 LYS 11 HG2 LYS 11 -8.194 12.870 -8.783
87 HD2 LYS 11 HD1 LYS 11 -6.058 13.292 -7.672
88 HD3 LYS 11 HD2 LYS 11 -5.330 13.883 -9.200
89 HE2 LYS 11 HE1 LYS 11 -6.878 15.852 -9.223
90 HE3 LYS 11 HE2 LYS 11 -7.648 15.274 -7.688
91 HZ1 LYS 11 HZ1 LYS 11 -5.505 15.450 -6.606
92 HZ2 LYS 11 HZ2 LYS 11 -5.925 16.939 -7.300
93 HZ3 LYS 11 HZ3 LYS 11 -4.763 15.952 -8.036
94 H PHE 12 HN PHE 12 -3.677 12.217 -10.881
95 HA PHE 12 HA PHE 12 -3.690 14.099 -13.063
96 HB2 PHE 12 HB1 PHE 12 -3.284 16.178 -12.020
97 HB3 PHE 12 HB2 PHE 12 -4.802 15.515 -11.356
98 HD1 PHE 12 HD1 PHE 12 -3.518 17.830 -10.156
99 HD2 PHE 12 HD2 PHE 12 -2.717 13.667 -9.403
100 HE1 PHE 12 HE1 PHE 12 -2.709 18.384 -7.880
101 HE2 PHE 12 HE2 PHE 12 -1.938 14.222 -7.155
102 HZ PHE 12 HZ PHE 12 -1.924 16.576 -6.373
103 H GLY 13 HN GLY 13 -1.965 11.807 -11.693
104 HA2 GLY 13 HA1 GLY 13 0.621 13.129 -12.268
105 HA3 GLY 13 HA2 GLY 13 0.358 11.663 -11.295
106 HA PRO 14 HA PRO 14 -0.226 9.053 -14.532
107 HB2 PRO 14 HB1 PRO 14 -1.418 9.325 -17.052
108 HB3 PRO 14 HB2 PRO 14 -2.350 9.358 -15.507
109 HG2 PRO 14 HG1 PRO 14 -1.291 11.804 -17.042
110 HG3 PRO 14 HG2 PRO 14 -2.991 11.470 -16.497
111 HD2 PRO 14 HD1 PRO 14 -1.343 12.987 -14.912
112 HD3 PRO 14 HD2 PRO 14 -2.393 11.685 -14.182
113 H LYS 15 HN LYS 15 1.217 11.837 -16.074
114 HA LYS 15 HA LYS 15 2.784 10.400 -17.964
115 HB2 LYS 15 HB1 LYS 15 2.384 12.884 -18.060
116 HB3 LYS 15 HB2 LYS 15 3.382 13.074 -16.596
117 HG2 LYS 15 HG1 LYS 15 4.717 13.679 -18.539
118 HG3 LYS 15 HG2 LYS 15 5.386 12.206 -17.799
119 HD2 LYS 15 HD1 LYS 15 5.512 11.980 -20.177
120 HD3 LYS 15 HD2 LYS 15 4.303 10.800 -19.590
121 HE2 LYS 15 HE1 LYS 15 2.437 12.300 -20.385
122 HE3 LYS 15 HE2 LYS 15 3.643 13.559 -20.864
123 HZ1 LYS 15 HZ1 LYS 15 2.917 12.229 -22.738
124 HZ2 LYS 15 HZ2 LYS 15 3.463 10.805 -22.002
125 HZ3 LYS 15 HZ3 LYS 15 4.568 12.007 -22.453
126 H LEU 16 HN LEU 16 3.333 11.188 -14.508
127 HA LEU 16 HA LEU 16 5.969 10.134 -14.378
128 HB2 LEU 16 HB1 LEU 16 4.974 11.769 -12.792
129 HB3 LEU 16 HB2 LEU 16 3.831 10.538 -12.195
130 HG LEU 16 HG LEU 16 6.857 10.050 -12.079
131 HD11 LEU 16 HD11 LEU 16 6.927 11.152 -9.844
132 HD12 LEU 16 HD12 LEU 16 5.221 11.691 -10.043
133 HD13 LEU 16 HD13 LEU 16 6.506 12.331 -11.138
134 HD21 LEU 16 HD21 LEU 16 6.251 8.822 -9.960
135 HD22 LEU 16 HD22 LEU 16 5.414 8.120 -11.383
136 HD23 LEU 16 HD23 LEU 16 4.514 9.196 -10.244
137 H PHE 17 HN PHE 17 2.721 8.752 -13.692
138 HA PHE 17 HA PHE 17 3.592 6.205 -12.957
139 HB2 PHE 17 HB1 PHE 17 1.255 7.280 -12.694
140 HB3 PHE 17 HB2 PHE 17 0.956 6.904 -14.424
141 HD1 PHE 17 HD1 PHE 17 1.815 5.399 -11.085
142 HD2 PHE 17 HD2 PHE 17 0.262 4.701 -15.026
143 HE1 PHE 17 HE1 PHE 17 1.086 3.140 -10.394
144 HE2 PHE 17 HE2 PHE 17 -0.472 2.438 -14.335
145 HZ PHE 17 HZ PHE 17 -0.061 1.656 -12.016
146 H CYS 18 HN CYS 18 2.784 7.488 -16.172
147 HA CYS 18 HA CYS 18 3.156 5.205 -17.702
148 HB2 CYS 18 HB1 CYS 18 2.055 7.306 -18.444
149 HB3 CYS 18 HB2 CYS 18 3.606 8.177 -18.336
150 H LEU 19 HN LEU 19 5.704 7.693 -16.802
151 HA LEU 19 HA LEU 19 7.654 6.131 -18.224
152 HB2 LEU 19 HB1 LEU 19 9.312 7.706 -17.613
153 HB3 LEU 19 HB2 LEU 19 7.828 8.527 -18.160
154 HG LEU 19 HG LEU 19 7.358 8.609 -15.479
155 HD11 LEU 19 HD11 LEU 19 9.463 9.180 -14.271
156 HD12 LEU 19 HD12 LEU 19 10.436 8.807 -15.738
157 HD13 LEU 19 HD13 LEU 19 9.562 7.489 -14.879
158 HD21 LEU 19 HD21 LEU 19 7.331 10.535 -17.051
159 HD22 LEU 19 HD22 LEU 19 9.138 10.569 -17.057
160 HD23 LEU 19 HD23 LEU 19 8.235 10.940 -15.543
161 H VAL 20 HN VAL 20 6.912 6.451 -14.694
162 HA VAL 20 HA VAL 20 9.042 4.855 -13.856
163 HB VAL 20 HB VAL 20 6.367 5.503 -12.552
164 HG11 VAL 20 HG11 VAL 20 7.229 3.417 -11.462
165 HG12 VAL 20 HG12 VAL 20 8.881 4.136 -11.356
166 HG13 VAL 20 HG13 VAL 20 7.529 4.825 -10.390
167 HG21 VAL 20 HG21 VAL 20 7.822 7.085 -11.227
168 HG22 VAL 20 HG22 VAL 20 9.252 6.583 -12.196
169 HG23 VAL 20 HG23 VAL 20 7.890 7.467 -12.982
170 H THR 21 HN THR 21 5.690 3.849 -14.718
171 HA THR 21 HA THR 21 6.479 1.089 -14.072
172 HB THR 21 HB THR 21 4.260 0.386 -14.263
173 HG1 THR 21 HG1 THR 21 3.521 3.004 -15.008
174 HG21 THR 21 HG21 THR 21 3.137 1.792 -12.570
175 HG22 THR 21 HG22 THR 21 4.256 3.160 -12.887
176 HG23 THR 21 HG23 THR 21 4.884 1.633 -12.167
177 H LYS 22 HN LYS 22 7.250 2.841 -16.596
178 HA LYS 22 HA LYS 22 7.612 2.607 -18.710
179 HB2 LYS 22 HB1 LYS 22 9.044 0.818 -17.697
180 HB3 LYS 22 HB2 LYS 22 7.792 -0.374 -18.146
181 HG2 LYS 22 HG1 LYS 22 9.540 -0.504 -19.786
182 HG3 LYS 22 HG2 LYS 22 8.127 0.250 -20.586
183 HD2 LYS 22 HD1 LYS 22 9.236 2.551 -20.087
184 HD3 LYS 22 HD2 LYS 22 10.701 1.659 -19.608
185 HE2 LYS 22 HE1 LYS 22 9.286 1.638 -22.377
186 HE3 LYS 22 HE2 LYS 22 10.819 2.504 -21.972
187 HZ1 LYS 22 HZ1 LYS 22 11.217 0.417 -23.099
188 HZ2 LYS 22 HZ2 LYS 22 10.385 -0.439 -21.893
189 HZ3 LYS 22 HZ3 LYS 22 11.836 0.360 -21.518
190 H LYS 23 HN LYS 23 5.180 3.281 -18.865
191 HA LYS 23 HA LYS 23 4.061 1.581 -21.048
192 HB2 LYS 23 HB1 LYS 23 2.946 4.008 -19.528
193 HB3 LYS 23 HB2 LYS 23 2.334 3.549 -21.142
194 HG2 LYS 23 HG1 LYS 23 0.800 2.757 -19.553
195 HG3 LYS 23 HG2 LYS 23 1.563 1.355 -20.343
196 HD2 LYS 23 HD1 LYS 23 2.859 2.292 -17.779
197 HD3 LYS 23 HD2 LYS 23 1.176 1.712 -17.602
198 HE2 LYS 23 HE1 LYS 23 1.710 -0.491 -18.543
199 HE3 LYS 23 HE2 LYS 23 3.385 0.036 -18.973
200 HZ1 LYS 23 HZ1 LYS 23 2.810 0.571 -16.244
201 HZ2 LYS 23 HZ2 LYS 23 4.058 -0.264 -16.928
202 HZ3 LYS 23 HZ3 LYS 23 2.614 -1.095 -16.589
203 H CYS 24 HN CYS 24 5.891 4.514 -20.246
204 HA CYS 24 HA CYS 24 5.612 5.562 -22.933
205 HB2 CYS 24 HB1 CYS 24 7.400 6.429 -20.601
206 HB3 CYS 24 HB2 CYS 24 7.271 7.299 -22.163
Start of MODEL 11
1 H1 PHE 1 HN PHE 1 0.558 -1.633 0.166
2 HA PHE 1 HA PHE 1 0.825 0.702 0.778
3 HB2 PHE 1 HB1 PHE 1 2.943 -0.267 -1.270
4 HB3 PHE 1 HB2 PHE 1 3.194 1.041 -0.048
5 HD1 PHE 1 HD1 PHE 1 2.862 0.440 2.429
6 HD2 PHE 1 HD2 PHE 1 3.338 -2.513 -0.657
7 HE1 PHE 1 HE1 PHE 1 3.503 -1.237 4.132
8 HE2 PHE 1 HE2 PHE 1 3.981 -4.191 1.053
9 HZ PHE 1 HZ PHE 1 4.061 -3.551 3.447
10 H LEU 2 HN LEU 2 0.366 -0.023 -2.595
11 HA LEU 2 HA LEU 2 0.723 2.753 -3.381
12 HB2 LEU 2 HB1 LEU 2 0.116 0.304 -5.111
13 HB3 LEU 2 HB2 LEU 2 0.592 1.934 -5.676
14 HG LEU 2 HG LEU 2 2.712 1.485 -4.062
15 HD11 LEU 2 HD11 LEU 2 1.948 -1.332 -5.093
16 HD12 LEU 2 HD12 LEU 2 2.036 -0.843 -3.359
17 HD13 LEU 2 HD13 LEU 2 3.526 -0.866 -4.363
18 HD21 LEU 2 HD21 LEU 2 2.763 2.126 -6.464
19 HD22 LEU 2 HD22 LEU 2 2.390 0.423 -6.939
20 HD23 LEU 2 HD23 LEU 2 3.947 0.812 -6.118
21 HA PRO 3 HA PRO 3 -3.740 2.034 -4.866
22 HB2 PRO 3 HB1 PRO 3 -5.758 2.031 -2.937
23 HB3 PRO 3 HB2 PRO 3 -4.889 0.539 -3.459
24 HG2 PRO 3 HG1 PRO 3 -4.275 2.281 -1.009
25 HG3 PRO 3 HG2 PRO 3 -4.473 0.485 -1.081
26 HD2 PRO 3 HD1 PRO 3 -1.990 1.701 -1.165
27 HD3 PRO 3 HD2 PRO 3 -2.332 0.204 -2.146
28 H ILE 4 HN ILE 4 -3.312 4.108 -1.939
29 HA ILE 4 HA ILE 4 -4.814 6.239 -3.035
30 HB ILE 4 HB ILE 4 -3.899 7.663 -1.313
31 HG12 ILE 4 HG11 ILE 4 -2.122 5.249 -0.562
32 HG13 ILE 4 HG12 ILE 4 -1.571 6.838 -1.201
33 HG21 ILE 4 HG21 ILE 4 -4.976 6.448 0.534
34 HG22 ILE 4 HG22 ILE 4 -5.855 6.083 -0.985
35 HG23 ILE 4 HG23 ILE 4 -4.725 4.866 -0.278
36 HD11 ILE 4 HD1 ILE 4 -2.950 6.371 1.519
37 HD12 ILE 4 HD2 ILE 4 -1.231 6.791 1.224
38 HD13 ILE 4 HD3 ILE 4 -2.522 7.983 0.838
39 H LEU 5 HN LEU 5 -1.315 5.462 -3.263
40 HA LEU 5 HA LEU 5 -0.590 7.786 -4.673
41 HB2 LEU 5 HB1 LEU 5 0.624 4.955 -4.742
42 HB3 LEU 5 HB2 LEU 5 1.320 6.373 -5.580
43 HG LEU 5 HG LEU 5 2.625 6.122 -3.707
44 HD11 LEU 5 HD11 LEU 5 0.643 8.304 -2.826
45 HD12 LEU 5 HD12 LEU 5 1.909 8.504 -4.105
46 HD13 LEU 5 HD13 LEU 5 2.380 8.165 -2.398
47 HD21 LEU 5 HD21 LEU 5 0.190 5.932 -1.839
48 HD22 LEU 5 HD22 LEU 5 1.921 5.908 -1.369
49 HD23 LEU 5 HD23 LEU 5 1.257 4.568 -2.359
50 H ALA 6 HN ALA 6 -1.724 4.585 -5.889
51 HA ALA 6 HA ALA 6 -1.579 5.241 -8.609
52 HB1 ALA 6 HB1 ALA 6 -3.119 3.278 -8.892
53 HB2 ALA 6 HB2 ALA 6 -1.812 2.914 -7.705
54 HB3 ALA 6 HB3 ALA 6 -3.464 3.311 -7.119
55 H SER 7 HN SER 7 -4.327 5.590 -6.308
56 HA SER 7 HA SER 7 -6.154 6.665 -8.150
57 HB2 SER 7 HB1 SER 7 -6.735 5.777 -5.878
58 HB3 SER 7 HB2 SER 7 -5.943 7.202 -5.129
59 HG SER 7 HG1 SER 7 -8.272 7.372 -5.421
60 H LEU 8 HN LEU 8 -3.874 8.468 -5.932
61 HA LEU 8 HA LEU 8 -4.762 10.930 -6.938
62 HB2 LEU 8 HB1 LEU 8 -3.133 12.061 -5.646
63 HB3 LEU 8 HB2 LEU 8 -3.760 10.665 -4.726
64 HG LEU 8 HG LEU 8 -1.589 9.437 -5.640
65 HD11 LEU 8 HD11 LEU 8 0.390 10.950 -5.744
66 HD12 LEU 8 HD12 LEU 8 -0.671 12.395 -5.633
67 HD13 LEU 8 HD13 LEU 8 -0.726 11.336 -7.098
68 HD21 LEU 8 HD21 LEU 8 -2.146 9.842 -3.258
69 HD22 LEU 8 HD22 LEU 8 -1.566 11.545 -3.383
70 HD23 LEU 8 HD23 LEU 8 -0.404 10.182 -3.559
71 H ALA 9 HN ALA 9 -2.051 8.864 -8.003
72 HA ALA 9 HA ALA 9 -1.029 10.606 -9.935
73 HB1 ALA 9 HB1 ALA 9 -0.987 7.536 -9.816
74 HB2 ALA 9 HB2 ALA 9 0.094 8.571 -10.832
75 HB3 ALA 9 HB3 ALA 9 0.204 8.630 -9.034
76 H ALA 10 HN ALA 10 -3.579 8.005 -10.302
77 HA ALA 10 HA ALA 10 -3.945 8.428 -13.044
78 HB1 ALA 10 HB1 ALA 10 -5.958 7.574 -10.867
79 HB2 ALA 10 HB2 ALA 10 -6.175 7.327 -12.644
80 HB3 ALA 10 HB3 ALA 10 -4.855 6.475 -11.762
81 H LYS 11 HN LYS 11 -5.491 9.994 -10.258
82 HA LYS 11 HA LYS 11 -7.207 11.667 -11.667
83 HB2 LYS 11 HB1 LYS 11 -7.478 10.968 -9.393
84 HB3 LYS 11 HB2 LYS 11 -6.013 11.788 -8.855
85 HG2 LYS 11 HG1 LYS 11 -8.393 13.286 -10.146
86 HG3 LYS 11 HG2 LYS 11 -8.481 12.767 -8.447
87 HD2 LYS 11 HD1 LYS 11 -6.402 14.762 -9.574
88 HD3 LYS 11 HD2 LYS 11 -7.908 15.138 -8.712
89 HE2 LYS 11 HE1 LYS 11 -6.330 15.351 -6.992
90 HE3 LYS 11 HE2 LYS 11 -7.002 13.696 -6.718
91 HZ1 LYS 11 HZ1 LYS 11 -5.026 12.917 -8.100
92 HZ2 LYS 11 HZ2 LYS 11 -4.661 13.572 -6.573
93 HZ3 LYS 11 HZ3 LYS 11 -4.419 14.474 -7.974
94 H PHE 12 HN PHE 12 -3.742 12.383 -10.850
95 HA PHE 12 HA PHE 12 -3.975 14.495 -12.817
96 HB2 PHE 12 HB1 PHE 12 -3.252 16.424 -11.475
97 HB3 PHE 12 HB2 PHE 12 -4.842 15.789 -10.991
98 HD1 PHE 12 HD1 PHE 12 -4.461 17.363 -9.052
99 HD2 PHE 12 HD2 PHE 12 -1.985 13.870 -9.610
100 HE1 PHE 12 HE1 PHE 12 -3.702 17.499 -6.701
101 HE2 PHE 12 HE2 PHE 12 -1.236 14.038 -7.305
102 HZ PHE 12 HZ PHE 12 -2.085 15.837 -5.824
103 H GLY 13 HN GLY 13 -2.059 12.069 -12.067
104 HA2 GLY 13 HA1 GLY 13 0.295 13.523 -13.045
105 HA3 GLY 13 HA2 GLY 13 0.403 12.545 -11.545
106 HA PRO 14 HA PRO 14 -0.217 9.048 -14.349
107 HB2 PRO 14 HB1 PRO 14 -1.148 9.115 -16.986
108 HB3 PRO 14 HB2 PRO 14 -2.247 9.256 -15.562
109 HG2 PRO 14 HG1 PRO 14 -1.038 11.574 -17.178
110 HG3 PRO 14 HG2 PRO 14 -2.783 11.279 -16.781
111 HD2 PRO 14 HD1 PRO 14 -1.275 12.946 -15.191
112 HD3 PRO 14 HD2 PRO 14 -2.430 11.750 -14.449
113 H LYS 15 HN LYS 15 1.302 11.787 -15.830
114 HA LYS 15 HA LYS 15 2.941 10.451 -17.671
115 HB2 LYS 15 HB1 LYS 15 2.414 12.907 -17.550
116 HB3 LYS 15 HB2 LYS 15 3.625 13.085 -16.249
117 HG2 LYS 15 HG1 LYS 15 4.330 11.750 -18.927
118 HG3 LYS 15 HG2 LYS 15 4.140 13.514 -18.903
119 HD2 LYS 15 HD1 LYS 15 6.091 11.965 -17.068
120 HD3 LYS 15 HD2 LYS 15 6.543 12.563 -18.676
121 HE2 LYS 15 HE1 LYS 15 5.597 14.370 -16.337
122 HE3 LYS 15 HE2 LYS 15 7.316 14.068 -16.804
123 HZ1 LYS 15 HZ1 LYS 15 5.227 15.270 -18.554
124 HZ2 LYS 15 HZ2 LYS 15 6.839 14.985 -18.980
125 HZ3 LYS 15 HZ3 LYS 15 6.474 16.108 -17.765
126 H LEU 16 HN LEU 16 3.603 11.147 -14.167
127 HA LEU 16 HA LEU 16 6.176 9.883 -14.315
128 HB2 LEU 16 HB1 LEU 16 6.114 9.847 -11.834
129 HB3 LEU 16 HB2 LEU 16 6.034 11.462 -12.567
130 HG LEU 16 HG LEU 16 3.395 10.148 -11.824
131 HD11 LEU 16 HD11 LEU 16 4.843 9.630 -9.871
132 HD12 LEU 16 HD12 LEU 16 3.626 10.894 -9.466
133 HD13 LEU 16 HD13 LEU 16 5.340 11.360 -9.764
134 HD21 LEU 16 HD21 LEU 16 2.835 12.497 -11.170
135 HD22 LEU 16 HD22 LEU 16 3.425 12.456 -12.872
136 HD23 LEU 16 HD23 LEU 16 4.513 13.022 -11.543
137 H PHE 17 HN PHE 17 2.874 8.766 -13.477
138 HA PHE 17 HA PHE 17 3.637 6.230 -12.601
139 HB2 PHE 17 HB1 PHE 17 1.369 7.489 -12.382
140 HB3 PHE 17 HB2 PHE 17 0.999 6.936 -14.051
141 HD1 PHE 17 HD1 PHE 17 1.620 5.900 -10.528
142 HD2 PHE 17 HD2 PHE 17 0.478 4.582 -14.452
143 HE1 PHE 17 HE1 PHE 17 0.825 3.760 -9.575
144 HE2 PHE 17 HE2 PHE 17 -0.318 2.440 -13.501
145 HZ PHE 17 HZ PHE 17 -0.147 2.027 -11.060
146 H CYS 18 HN CYS 18 2.754 7.302 -15.940
147 HA CYS 18 HA CYS 18 3.047 4.761 -17.063
148 HB2 CYS 18 HB1 CYS 18 2.800 5.709 -19.219
149 HB3 CYS 18 HB2 CYS 18 1.713 6.569 -18.098
150 H LEU 19 HN LEU 19 5.599 7.294 -16.612
151 HA LEU 19 HA LEU 19 7.445 5.704 -18.112
152 HB2 LEU 19 HB1 LEU 19 9.187 7.185 -17.576
153 HB3 LEU 19 HB2 LEU 19 7.706 8.088 -17.994
154 HG LEU 19 HG LEU 19 7.388 8.194 -15.338
155 HD11 LEU 19 HD11 LEU 19 10.465 8.009 -15.640
156 HD12 LEU 19 HD12 LEU 19 9.447 6.816 -14.760
157 HD13 LEU 19 HD13 LEU 19 9.571 8.504 -14.158
158 HD21 LEU 19 HD21 LEU 19 8.541 10.401 -15.383
159 HD22 LEU 19 HD22 LEU 19 7.583 10.124 -16.890
160 HD23 LEU 19 HD23 LEU 19 9.381 9.941 -16.912
161 H VAL 20 HN VAL 20 6.796 5.912 -14.571
162 HA VAL 20 HA VAL 20 8.798 4.121 -13.796
163 HB VAL 20 HB VAL 20 6.128 4.878 -12.541
164 HG11 VAL 20 HG11 VAL 20 8.471 3.228 -11.353
165 HG12 VAL 20 HG12 VAL 20 7.139 3.958 -10.390
166 HG13 VAL 20 HG13 VAL 20 6.772 2.660 -11.573
167 HG21 VAL 20 HG21 VAL 20 7.620 6.263 -11.069
168 HG22 VAL 20 HG22 VAL 20 9.068 5.681 -11.964
169 HG23 VAL 20 HG23 VAL 20 7.853 6.725 -12.791
170 H THR 21 HN THR 21 5.422 3.440 -14.790
171 HA THR 21 HA THR 21 5.878 0.575 -14.409
172 HB THR 21 HB THR 21 3.535 0.279 -15.128
173 HG1 THR 21 HG1 THR 21 3.360 3.089 -15.096
174 HG21 THR 21 HG21 THR 21 3.902 2.523 -13.021
175 HG22 THR 21 HG22 THR 21 4.082 0.757 -12.718
176 HG23 THR 21 HG23 THR 21 2.484 1.433 -13.199
177 H LYS 22 HN LYS 22 7.094 2.432 -16.606
178 HA LYS 22 HA LYS 22 7.419 2.627 -18.732
179 HB2 LYS 22 HB1 LYS 22 9.057 0.971 -17.929
180 HB3 LYS 22 HB2 LYS 22 8.005 -0.348 -18.511
181 HG2 LYS 22 HG1 LYS 22 9.852 0.057 -20.080
182 HG3 LYS 22 HG2 LYS 22 8.293 0.435 -20.868
183 HD2 LYS 22 HD1 LYS 22 8.750 2.936 -20.392
184 HD3 LYS 22 HD2 LYS 22 10.306 2.448 -19.668
185 HE2 LYS 22 HE1 LYS 22 10.723 3.265 -21.937
186 HE3 LYS 22 HE2 LYS 22 11.013 1.479 -21.927
187 HZ1 LYS 22 HZ1 LYS 22 8.770 1.194 -22.824
188 HZ2 LYS 22 HZ2 LYS 22 9.706 2.186 -23.836
189 HZ3 LYS 22 HZ3 LYS 22 8.531 2.864 -22.832
190 H LYS 23 HN LYS 23 4.979 3.003 -18.855
191 HA LYS 23 HA LYS 23 3.913 1.412 -21.121
192 HB2 LYS 23 HB1 LYS 23 2.507 3.447 -19.317
193 HB3 LYS 23 HB2 LYS 23 1.714 2.434 -20.558
194 HG2 LYS 23 HG1 LYS 23 3.114 1.292 -18.031
195 HG3 LYS 23 HG2 LYS 23 1.440 1.855 -18.068
196 HD2 LYS 23 HD1 LYS 23 1.338 -0.498 -18.257
197 HD3 LYS 23 HD2 LYS 23 0.801 0.216 -19.797
198 HE2 LYS 23 HE1 LYS 23 2.149 -1.876 -20.094
199 HE3 LYS 23 HE2 LYS 23 2.910 -0.468 -20.918
200 HZ1 LYS 23 HZ1 LYS 23 4.102 -2.153 -19.082
201 HZ2 LYS 23 HZ2 LYS 23 3.873 -0.704 -18.233
202 HZ3 LYS 23 HZ3 LYS 23 4.688 -0.680 -19.673
203 H CYS 24 HN CYS 24 5.429 4.416 -20.237
204 HA CYS 24 HA CYS 24 4.588 5.769 -22.647
205 HB2 CYS 24 HB2 CYS 24 6.936 6.337 -20.756
206 HB3 CYS 24 HB1 CYS 24 6.442 7.388 -22.124
Start of MODEL 12
1 H1 PHE 1 HN PHE 1 1.644 -2.185 -0.572
2 HA PHE 1 HA PHE 1 1.035 -2.017 -2.994
3 HB2 PHE 1 HB1 PHE 1 -1.242 -1.575 -0.934
4 HB3 PHE 1 HB2 PHE 1 -1.476 -2.209 -2.611
5 HD1 PHE 1 HD1 PHE 1 -0.191 -4.339 -3.264
6 HD2 PHE 1 HD2 PHE 1 -0.734 -3.080 0.809
7 HE1 PHE 1 HE1 PHE 1 0.272 -6.647 -2.485
8 HE2 PHE 1 HE2 PHE 1 -0.271 -5.383 1.584
9 HZ PHE 1 HZ PHE 1 0.234 -7.168 -0.059
10 H LEU 2 HN LEU 2 0.578 0.668 -0.927
11 HA LEU 2 HA LEU 2 -0.065 2.797 -1.161
12 HB2 LEU 2 HB1 LEU 2 1.553 2.533 -3.716
13 HB3 LEU 2 HB2 LEU 2 1.232 4.062 -2.832
14 HG LEU 2 HG LEU 2 2.812 1.665 -1.729
15 HD11 LEU 2 HD11 LEU 2 3.980 2.839 -3.597
16 HD12 LEU 2 HD12 LEU 2 4.802 3.113 -2.016
17 HD13 LEU 2 HD13 LEU 2 3.781 4.413 -2.733
18 HD21 LEU 2 HD21 LEU 2 3.503 3.262 0.085
19 HD22 LEU 2 HD22 LEU 2 1.738 2.942 0.135
20 HD23 LEU 2 HD23 LEU 2 2.359 4.492 -0.557
21 HA PRO 3 HA PRO 3 -3.409 2.274 -4.394
22 HB2 PRO 3 HB1 PRO 3 -5.702 2.451 -2.779
23 HB3 PRO 3 HB2 PRO 3 -4.795 0.913 -3.038
24 HG2 PRO 3 HG1 PRO 3 -4.471 2.880 -0.700
25 HG3 PRO 3 HG2 PRO 3 -4.735 1.091 -0.621
26 HD2 PRO 3 HD1 PRO 3 -2.201 2.155 -0.458
27 HD3 PRO 3 HD2 PRO 3 -2.501 0.639 -1.423
28 H ILE 4 HN ILE 4 -3.068 4.580 -1.736
29 HA ILE 4 HA ILE 4 -4.459 6.716 -2.899
30 HB ILE 4 HB ILE 4 -3.092 8.165 -1.414
31 HG12 ILE 4 HG11 ILE 4 -1.765 5.516 -0.523
32 HG13 ILE 4 HG12 ILE 4 -0.951 6.817 -1.458
33 HG21 ILE 4 HG21 ILE 4 -5.257 7.036 -0.774
34 HG22 ILE 4 HG22 ILE 4 -4.323 5.646 -0.101
35 HG23 ILE 4 HG23 ILE 4 -4.166 7.282 0.627
36 HD11 ILE 4 HD1 ILE 4 -2.082 7.086 1.402
37 HD12 ILE 4 HD2 ILE 4 -0.355 7.034 0.914
38 HD13 ILE 4 HD3 ILE 4 -1.379 8.434 0.436
39 H LEU 5 HN LEU 5 -1.123 5.572 -3.486
40 HA LEU 5 HA LEU 5 -0.333 7.823 -5.030
41 HB2 LEU 5 HB1 LEU 5 1.188 6.229 -3.850
42 HB3 LEU 5 HB2 LEU 5 0.792 4.963 -5.044
43 HG LEU 5 HG LEU 5 1.915 7.690 -5.905
44 HD11 LEU 5 HD11 LEU 5 3.404 6.835 -4.093
45 HD12 LEU 5 HD12 LEU 5 4.221 6.769 -5.697
46 HD13 LEU 5 HD13 LEU 5 3.562 5.261 -4.960
47 HD21 LEU 5 HD21 LEU 5 1.187 6.206 -7.788
48 HD22 LEU 5 HD22 LEU 5 2.161 4.848 -7.104
49 HD23 LEU 5 HD23 LEU 5 2.980 6.319 -7.744
50 H ALA 6 HN ALA 6 -1.716 4.606 -5.859
51 HA ALA 6 HA ALA 6 -1.793 5.015 -8.640
52 HB1 ALA 6 HB1 ALA 6 -2.080 2.791 -7.517
53 HB2 ALA 6 HB2 ALA 6 -3.646 3.346 -6.826
54 HB3 ALA 6 HB3 ALA 6 -3.466 3.147 -8.611
55 H SER 7 HN SER 7 -4.259 5.747 -6.136
56 HA SER 7 HA SER 7 -6.198 6.820 -7.857
57 HB2 SER 7 HB1 SER 7 -6.559 6.155 -5.459
58 HB3 SER 7 HB2 SER 7 -5.623 7.597 -4.938
59 HG SER 7 HG1 SER 7 -7.962 7.865 -4.999
60 H LEU 8 HN LEU 8 -3.565 8.627 -6.066
61 HA LEU 8 HA LEU 8 -4.340 11.064 -7.241
62 HB2 LEU 8 HB1 LEU 8 -2.551 12.140 -6.205
63 HB3 LEU 8 HB2 LEU 8 -3.108 10.850 -5.106
64 HG LEU 8 HG LEU 8 -1.114 9.459 -6.220
65 HD11 LEU 8 HD11 LEU 8 0.880 10.881 -6.649
66 HD12 LEU 8 HD12 LEU 8 -0.135 12.377 -6.532
67 HD13 LEU 8 HD13 LEU 8 -0.399 11.188 -7.883
68 HD21 LEU 8 HD21 LEU 8 -1.360 10.033 -3.809
69 HD22 LEU 8 HD22 LEU 8 -0.698 11.682 -4.118
70 HD23 LEU 8 HD23 LEU 8 0.348 10.232 -4.347
71 H ALA 9 HN ALA 9 -1.996 8.597 -8.359
72 HA ALA 9 HA ALA 9 -0.986 10.041 -10.515
73 HB1 ALA 9 HB1 ALA 9 -1.474 7.022 -10.190
74 HB2 ALA 9 HB2 ALA 9 -0.416 7.774 -11.444
75 HB3 ALA 9 HB3 ALA 9 0.004 7.915 -9.694
76 H ALA 10 HN ALA 10 -3.892 7.865 -10.407
77 HA ALA 10 HA ALA 10 -4.662 8.308 -13.069
78 HB1 ALA 10 HB1 ALA 10 -6.873 7.407 -12.280
79 HB2 ALA 10 HB2 ALA 10 -5.501 6.444 -11.616
80 HB3 ALA 10 HB3 ALA 10 -6.338 7.639 -10.569
81 H LYS 11 HN LYS 11 -5.593 10.047 -10.082
82 HA LYS 11 HA LYS 11 -7.449 11.793 -11.181
83 HB2 LYS 11 HB1 LYS 11 -7.139 11.342 -8.761
84 HB3 LYS 11 HB2 LYS 11 -5.489 12.010 -8.837
85 HG2 LYS 11 HG1 LYS 11 -6.487 14.291 -9.389
86 HG3 LYS 11 HG2 LYS 11 -8.115 13.596 -9.090
87 HD2 LYS 11 HD1 LYS 11 -7.509 13.039 -6.765
88 HD3 LYS 11 HD2 LYS 11 -5.798 13.452 -7.043
89 HE2 LYS 11 HE1 LYS 11 -8.152 15.467 -7.067
90 HE3 LYS 11 HE2 LYS 11 -6.954 15.237 -5.730
91 HZ1 LYS 11 HZ1 LYS 11 -6.352 16.091 -8.518
92 HZ2 LYS 11 HZ2 LYS 11 -5.197 15.828 -7.327
93 HZ3 LYS 11 HZ3 LYS 11 -6.326 17.077 -7.134
94 H PHE 12 HN PHE 12 -3.904 12.373 -10.776
95 HA PHE 12 HA PHE 12 -3.968 14.293 -12.878
96 HB2 PHE 12 HB1 PHE 12 -3.473 16.368 -11.788
97 HB3 PHE 12 HB2 PHE 12 -5.051 15.751 -11.240
98 HD1 PHE 12 HD1 PHE 12 -3.669 18.002 -9.946
99 HD2 PHE 12 HD2 PHE 12 -3.315 13.787 -9.137
100 HE1 PHE 12 HE1 PHE 12 -3.040 18.492 -7.602
101 HE2 PHE 12 HE2 PHE 12 -2.694 14.285 -6.826
102 HZ PHE 12 HZ PHE 12 -2.554 16.630 -6.037
103 H GLY 13 HN GLY 13 -2.239 11.951 -11.705
104 HA2 GLY 13 HA1 GLY 13 0.323 13.328 -12.321
105 HA3 GLY 13 HA2 GLY 13 0.130 12.121 -11.021
106 HA PRO 14 HA PRO 14 -0.166 9.044 -14.190
107 HB2 PRO 14 HB1 PRO 14 -1.041 9.261 -16.825
108 HB3 PRO 14 HB2 PRO 14 -2.171 9.354 -15.422
109 HG2 PRO 14 HG1 PRO 14 -0.894 11.733 -16.895
110 HG3 PRO 14 HG2 PRO 14 -2.652 11.438 -16.558
111 HD2 PRO 14 HD1 PRO 14 -1.158 13.002 -14.840
112 HD3 PRO 14 HD2 PRO 14 -2.367 11.794 -14.209
113 H LYS 15 HN LYS 15 1.315 11.891 -15.575
114 HA LYS 15 HA LYS 15 2.893 10.645 -17.514
115 HB2 LYS 15 HB1 LYS 15 2.333 13.192 -16.940
116 HB3 LYS 15 HB2 LYS 15 3.906 13.155 -16.108
117 HG2 LYS 15 HG1 LYS 15 3.310 12.501 -19.080
118 HG3 LYS 15 HG2 LYS 15 3.965 14.041 -18.454
119 HD2 LYS 15 HD1 LYS 15 6.021 12.819 -17.641
120 HD3 LYS 15 HD2 LYS 15 5.380 11.309 -18.376
121 HE2 LYS 15 HE1 LYS 15 5.387 12.390 -20.651
122 HE3 LYS 15 HE2 LYS 15 6.088 13.893 -19.928
123 HZ1 LYS 15 HZ1 LYS 15 7.322 11.182 -19.813
124 HZ2 LYS 15 HZ2 LYS 15 7.994 12.623 -19.227
125 HZ3 LYS 15 HZ3 LYS 15 7.758 12.417 -20.893
126 H LEU 16 HN LEU 16 3.737 11.326 -14.055
127 HA LEU 16 HA LEU 16 6.317 10.137 -14.273
128 HB2 LEU 16 HB1 LEU 16 6.284 10.092 -11.779
129 HB3 LEU 16 HB2 LEU 16 6.097 11.703 -12.501
130 HG LEU 16 HG LEU 16 3.561 10.208 -11.716
131 HD11 LEU 16 HD11 LEU 16 3.772 11.012 -9.379
132 HD12 LEU 16 HD12 LEU 16 5.438 11.607 -9.715
133 HD13 LEU 16 HD13 LEU 16 5.079 9.841 -9.781
134 HD21 LEU 16 HD21 LEU 16 3.365 12.490 -12.794
135 HD22 LEU 16 HD22 LEU 16 4.451 13.166 -11.517
136 HD23 LEU 16 HD23 LEU 16 2.836 12.516 -11.075
137 H PHE 17 HN PHE 17 3.107 8.868 -13.319
138 HA PHE 17 HA PHE 17 3.953 6.351 -12.500
139 HB2 PHE 17 HB1 PHE 17 1.675 7.555 -12.194
140 HB3 PHE 17 HB2 PHE 17 1.262 7.036 -13.863
141 HD1 PHE 17 HD1 PHE 17 2.074 5.899 -10.400
142 HD2 PHE 17 HD2 PHE 17 0.680 4.718 -14.287
143 HE1 PHE 17 HE1 PHE 17 1.317 3.736 -9.469
144 HE2 PHE 17 HE2 PHE 17 -0.077 2.553 -13.357
145 HZ PHE 17 HZ PHE 17 0.237 2.061 -10.944
146 H CYS 18 HN CYS 18 2.957 7.463 -15.757
147 HA CYS 18 HA CYS 18 3.313 5.115 -17.185
148 HB2 CYS 18 HB1 CYS 18 3.565 8.087 -17.835
149 HB3 CYS 18 HB2 CYS 18 4.031 6.896 -19.077
150 H LEU 19 HN LEU 19 5.856 7.508 -16.251
151 HA LEU 19 HA LEU 19 7.885 6.142 -17.746
152 HB2 LEU 19 HB1 LEU 19 8.046 8.087 -15.380
153 HB3 LEU 19 HB2 LEU 19 9.469 7.510 -16.301
154 HG LEU 19 HG LEU 19 7.137 9.105 -17.512
155 HD11 LEU 19 HD11 LEU 19 8.413 10.435 -15.836
156 HD12 LEU 19 HD12 LEU 19 8.757 11.036 -17.503
157 HD13 LEU 19 HD13 LEU 19 9.959 10.002 -16.644
158 HD21 LEU 19 HD21 LEU 19 8.773 9.442 -19.442
159 HD22 LEU 19 HD22 LEU 19 8.266 7.728 -19.233
160 HD23 LEU 19 HD23 LEU 19 9.883 8.268 -18.649
161 H VAL 20 HN VAL 20 6.970 6.082 -14.257
162 HA VAL 20 HA VAL 20 8.946 4.285 -13.443
163 HB VAL 20 HB VAL 20 6.197 4.947 -12.298
164 HG11 VAL 20 HG11 VAL 20 6.880 2.734 -11.347
165 HG12 VAL 20 HG12 VAL 20 8.544 3.359 -11.037
166 HG13 VAL 20 HG13 VAL 20 7.142 4.018 -10.123
167 HG21 VAL 20 HG21 VAL 20 7.567 6.354 -10.732
168 HG22 VAL 20 HG22 VAL 20 9.074 5.845 -11.571
169 HG23 VAL 20 HG23 VAL 20 7.862 6.864 -12.431
170 H THR 21 HN THR 21 5.613 3.604 -14.578
171 HA THR 21 HA THR 21 6.105 0.734 -14.255
172 HB THR 21 HB THR 21 3.770 0.407 -14.912
173 HG1 THR 21 HG1 THR 21 3.562 3.225 -14.901
174 HG21 THR 21 HG21 THR 21 4.363 0.898 -12.508
175 HG22 THR 21 HG22 THR 21 2.731 1.512 -12.955
176 HG23 THR 21 HG23 THR 21 4.108 2.656 -12.806
177 H LYS 22 HN LYS 22 7.146 2.773 -16.472
178 HA LYS 22 HA LYS 22 7.623 2.855 -18.588
179 HB2 LYS 22 HB1 LYS 22 9.101 1.063 -17.646
180 HB3 LYS 22 HB2 LYS 22 7.972 -0.159 -18.286
181 HG2 LYS 22 HG1 LYS 22 9.852 -0.026 -19.775
182 HG3 LYS 22 HG2 LYS 22 8.454 0.686 -20.640
183 HD2 LYS 22 HD1 LYS 22 9.295 3.004 -19.991
184 HD3 LYS 22 HD2 LYS 22 10.731 2.257 -19.246
185 HE2 LYS 22 HE1 LYS 22 9.911 2.112 -22.243
186 HE3 LYS 22 HE2 LYS 22 11.194 3.178 -21.547
187 HZ1 LYS 22 HZ1 LYS 22 12.384 1.192 -20.851
188 HZ2 LYS 22 HZ2 LYS 22 12.117 1.188 -22.526
189 HZ3 LYS 22 HZ3 LYS 22 11.181 0.200 -21.517
190 H LYS 23 HN LYS 23 5.205 3.382 -18.850
191 HA LYS 23 HA LYS 23 3.988 1.516 -20.834
192 HB2 LYS 23 HB1 LYS 23 2.647 3.574 -19.001
193 HB3 LYS 23 HB2 LYS 23 1.781 2.508 -20.143
194 HG2 LYS 23 HG1 LYS 23 3.446 1.428 -17.774
195 HG3 LYS 23 HG2 LYS 23 1.775 1.984 -17.622
196 HD2 LYS 23 HD1 LYS 23 1.647 -0.364 -17.791
197 HD3 LYS 23 HD2 LYS 23 0.955 0.338 -19.274
198 HE2 LYS 23 HE1 LYS 23 2.282 -1.758 -19.677
199 HE3 LYS 23 HE2 LYS 23 2.940 -0.357 -20.598
200 HZ1 LYS 23 HZ1 LYS 23 4.381 -1.986 -18.967
201 HZ2 LYS 23 HZ2 LYS 23 4.131 -0.628 -17.979
202 HZ3 LYS 23 HZ3 LYS 23 4.822 -0.433 -19.468
203 H CYS 24 HN CYS 24 4.751 5.004 -20.238
204 HA CYS 24 HA CYS 24 4.521 5.436 -23.055
205 HB2 CYS 24 HB1 CYS 24 2.657 7.112 -23.010
206 HB3 CYS 24 HB2 CYS 24 2.119 5.457 -22.649
Start of MODEL 13
1 H1 PHE 1 HN PHE 1 0.251 -1.158 0.631
2 HA PHE 1 HA PHE 1 0.345 1.278 0.774
3 HB2 PHE 1 HB1 PHE 1 2.600 0.055 -0.967
4 HB3 PHE 1 HB2 PHE 1 2.728 1.581 -0.008
5 HD1 PHE 1 HD1 PHE 1 2.245 1.411 2.537
6 HD2 PHE 1 HD2 PHE 1 3.155 -1.985 0.062
7 HE1 PHE 1 HE1 PHE 1 2.894 0.119 4.545
8 HE2 PHE 1 HE2 PHE 1 3.807 -3.274 2.077
9 HZ PHE 1 HZ PHE 1 3.673 -2.222 4.318
10 H LEU 2 HN LEU 2 0.062 -0.157 -2.374
11 HA LEU 2 HA LEU 2 0.382 2.365 -3.738
12 HB2 LEU 2 HB1 LEU 2 -0.226 -0.407 -4.878
13 HB3 LEU 2 HB2 LEU 2 0.190 1.063 -5.810
14 HG LEU 2 HG LEU 2 2.348 1.065 -4.195
15 HD11 LEU 2 HD11 LEU 2 1.664 -1.939 -4.486
16 HD12 LEU 2 HD12 LEU 2 1.777 -1.036 -2.929
17 HD13 LEU 2 HD13 LEU 2 3.242 -1.264 -3.941
18 HD21 LEU 2 HD21 LEU 2 2.023 -0.670 -6.721
19 HD22 LEU 2 HD22 LEU 2 3.577 -0.044 -6.053
20 HD23 LEU 2 HD23 LEU 2 2.341 1.109 -6.679
21 HA PRO 3 HA PRO 3 -4.120 1.826 -5.078
22 HB2 PRO 3 HB1 PRO 3 -6.097 1.988 -3.108
23 HB3 PRO 3 HB2 PRO 3 -5.399 0.430 -3.688
24 HG2 PRO 3 HG1 PRO 3 -4.562 2.031 -1.211
25 HG3 PRO 3 HG2 PRO 3 -4.943 0.267 -1.321
26 HD2 PRO 3 HD1 PRO 3 -2.367 1.221 -1.410
27 HD3 PRO 3 HD2 PRO 3 -2.853 -0.195 -2.449
28 H ILE 4 HN ILE 4 -3.283 3.793 -2.199
29 HA ILE 4 HA ILE 4 -4.582 6.135 -3.110
30 HB ILE 4 HB ILE 4 -2.998 7.326 -1.545
31 HG12 ILE 4 HG11 ILE 4 -2.198 4.454 -0.719
32 HG13 ILE 4 HG12 ILE 4 -1.138 5.550 -1.660
33 HG21 ILE 4 HG21 ILE 4 -4.686 4.966 -0.468
34 HG22 ILE 4 HG22 ILE 4 -4.256 6.471 0.418
35 HG23 ILE 4 HG23 ILE 4 -5.333 6.560 -1.013
36 HD11 ILE 4 HD1 ILE 4 -0.524 5.651 0.715
37 HD12 ILE 4 HD2 ILE 4 -1.215 7.236 0.217
38 HD13 ILE 4 HD3 ILE 4 -2.201 6.083 1.189
39 H LEU 5 HN LEU 5 -1.256 4.915 -3.684
40 HA LEU 5 HA LEU 5 -0.375 7.082 -5.240
41 HB2 LEU 5 HB1 LEU 5 0.407 4.137 -5.050
42 HB3 LEU 5 HB2 LEU 5 1.118 5.161 -6.329
43 HG LEU 5 HG LEU 5 2.615 4.925 -4.438
44 HD11 LEU 5 HD11 LEU 5 1.638 7.832 -4.750
45 HD12 LEU 5 HD12 LEU 5 2.723 6.953 -5.895
46 HD13 LEU 5 HD13 LEU 5 3.263 7.288 -4.207
47 HD21 LEU 5 HD21 LEU 5 2.277 6.002 -2.265
48 HD22 LEU 5 HD22 LEU 5 0.983 4.785 -2.542
49 HD23 LEU 5 HD23 LEU 5 0.633 6.550 -2.732
50 H ALA 6 HN ALA 6 -2.079 4.061 -6.231
51 HA ALA 6 HA ALA 6 -2.141 4.643 -8.973
52 HB1 ALA 6 HB1 ALA 6 -4.128 3.052 -7.236
53 HB2 ALA 6 HB2 ALA 6 -3.974 2.931 -9.030
54 HB3 ALA 6 HB3 ALA 6 -2.623 2.393 -7.964
55 H SER 7 HN SER 7 -4.508 5.469 -6.395
56 HA SER 7 HA SER 7 -6.373 6.749 -8.050
57 HB2 SER 7 HB1 SER 7 -6.754 6.033 -5.664
58 HB3 SER 7 HB2 SER 7 -5.720 7.394 -5.115
59 HG SER 7 HG1 SER 7 -8.001 7.868 -5.131
60 H LEU 8 HN LEU 8 -3.619 8.291 -6.195
61 HA LEU 8 HA LEU 8 -4.191 10.819 -7.305
62 HB2 LEU 8 HB1 LEU 8 -2.248 11.691 -6.268
63 HB3 LEU 8 HB2 LEU 8 -3.074 10.550 -5.178
64 HG LEU 8 HG LEU 8 -1.301 8.800 -6.111
65 HD11 LEU 8 HD11 LEU 8 0.203 11.484 -6.449
66 HD12 LEU 8 HD12 LEU 8 -0.169 10.324 -7.781
67 HD13 LEU 8 HD13 LEU 8 0.951 9.847 -6.456
68 HD21 LEU 8 HD21 LEU 8 0.163 9.396 -4.164
69 HD22 LEU 8 HD22 LEU 8 -1.585 9.494 -3.746
70 HD23 LEU 8 HD23 LEU 8 -0.645 11.002 -4.051
71 H ALA 9 HN ALA 9 -2.082 8.201 -8.483
72 HA ALA 9 HA ALA 9 -0.887 9.570 -10.585
73 HB1 ALA 9 HB1 ALA 9 -0.162 7.322 -9.850
74 HB2 ALA 9 HB2 ALA 9 -1.744 6.630 -10.349
75 HB3 ALA 9 HB3 ALA 9 -0.615 7.274 -11.598
76 H ALA 10 HN ALA 10 -4.070 7.831 -10.557
77 HA ALA 10 HA ALA 10 -4.740 8.582 -13.213
78 HB1 ALA 10 HB1 ALA 10 -7.054 7.909 -12.503
79 HB2 ALA 10 HB2 ALA 10 -5.831 6.704 -11.955
80 HB3 ALA 10 HB3 ALA 10 -6.503 7.885 -10.783
81 H LYS 11 HN LYS 11 -5.461 10.101 -10.045
82 HA LYS 11 HA LYS 11 -7.158 12.049 -11.008
83 HB2 LYS 11 HB1 LYS 11 -6.946 11.160 -8.685
84 HB3 LYS 11 HB2 LYS 11 -5.467 12.125 -8.445
85 HG2 LYS 11 HG1 LYS 11 -8.140 13.402 -9.266
86 HG3 LYS 11 HG2 LYS 11 -7.838 12.941 -7.572
87 HD2 LYS 11 HD1 LYS 11 -6.322 14.575 -7.123
88 HD3 LYS 11 HD2 LYS 11 -5.578 14.521 -8.727
89 HE2 LYS 11 HE1 LYS 11 -8.229 15.966 -8.035
90 HE3 LYS 11 HE2 LYS 11 -6.617 16.721 -8.368
91 HZ1 LYS 11 HZ1 LYS 11 -6.803 15.363 -10.551
92 HZ2 LYS 11 HZ2 LYS 11 -7.668 16.819 -10.410
93 HZ3 LYS 11 HZ3 LYS 11 -8.438 15.312 -10.220
94 H PHE 12 HN PHE 12 -3.619 12.362 -10.530
95 HA PHE 12 HA PHE 12 -3.588 14.361 -12.572
96 HB2 PHE 12 HB1 PHE 12 -2.460 16.229 -11.226
97 HB3 PHE 12 HB2 PHE 12 -4.218 16.009 -11.039
98 HD1 PHE 12 HD1 PHE 12 -4.056 17.475 -9.070
99 HD2 PHE 12 HD2 PHE 12 -1.992 13.686 -9.144
100 HE1 PHE 12 HE1 PHE 12 -3.815 17.537 -6.606
101 HE2 PHE 12 HE2 PHE 12 -1.747 13.783 -6.717
102 HZ PHE 12 HZ PHE 12 -2.671 15.682 -5.429
103 H GLY 13 HN GLY 13 -2.002 11.843 -11.182
104 HA2 GLY 13 HA1 GLY 13 0.669 12.870 -11.826
105 HA3 GLY 13 HA2 GLY 13 0.234 11.370 -10.986
106 HA PRO 14 HA PRO 14 -0.247 9.174 -14.646
107 HB2 PRO 14 HB1 PRO 14 -1.263 9.873 -17.147
108 HB3 PRO 14 HB2 PRO 14 -2.299 9.719 -15.676
109 HG2 PRO 14 HG1 PRO 14 -1.059 12.314 -16.763
110 HG3 PRO 14 HG2 PRO 14 -2.801 11.983 -16.375
111 HD2 PRO 14 HD1 PRO 14 -1.161 13.177 -14.516
112 HD3 PRO 14 HD2 PRO 14 -2.353 11.888 -14.015
113 H LYS 15 HN LYS 15 1.366 12.145 -15.549
114 HA LYS 15 HA LYS 15 2.927 11.095 -17.681
115 HB2 LYS 15 HB1 LYS 15 3.475 13.375 -15.714
116 HB3 LYS 15 HB2 LYS 15 4.475 13.081 -17.161
117 HG2 LYS 15 HG1 LYS 15 1.449 13.542 -17.499
118 HG3 LYS 15 HG2 LYS 15 2.530 14.892 -17.081
119 HD2 LYS 15 HD1 LYS 15 2.298 14.981 -19.406
120 HD3 LYS 15 HD2 LYS 15 3.970 14.438 -19.065
121 HE2 LYS 15 HE1 LYS 15 3.354 12.087 -19.716
122 HE3 LYS 15 HE2 LYS 15 1.630 12.592 -19.941
123 HZ1 LYS 15 HZ1 LYS 15 2.832 12.519 -22.031
124 HZ2 LYS 15 HZ2 LYS 15 3.970 13.641 -21.470
125 HZ3 LYS 15 HZ3 LYS 15 2.357 14.103 -21.679
126 H LEU 16 HN LEU 16 3.704 11.329 -14.123
127 HA LEU 16 HA LEU 16 6.172 9.952 -14.477
128 HB2 LEU 16 HB1 LEU 16 6.211 9.701 -12.022
129 HB3 LEU 16 HB2 LEU 16 6.113 11.381 -12.589
130 HG LEU 16 HG LEU 16 3.522 9.974 -11.802
131 HD11 LEU 16 HD11 LEU 16 5.112 9.397 -9.977
132 HD12 LEU 16 HD12 LEU 16 3.893 10.605 -9.427
133 HD13 LEU 16 HD13 LEU 16 5.570 11.133 -9.815
134 HD21 LEU 16 HD21 LEU 16 3.391 12.331 -12.706
135 HD22 LEU 16 HD22 LEU 16 4.595 12.860 -11.467
136 HD23 LEU 16 HD23 LEU 16 2.975 12.280 -10.955
137 H PHE 17 HN PHE 17 2.867 8.884 -13.594
138 HA PHE 17 HA PHE 17 3.541 6.225 -13.119
139 HB2 PHE 17 HB1 PHE 17 1.366 7.339 -12.515
140 HB3 PHE 17 HB2 PHE 17 0.934 7.416 -14.257
141 HD1 PHE 17 HD1 PHE 17 2.441 4.577 -12.216
142 HD2 PHE 17 HD2 PHE 17 -0.980 6.049 -14.371
143 HE1 PHE 17 HE1 PHE 17 1.340 2.395 -11.960
144 HE2 PHE 17 HE2 PHE 17 -2.091 3.857 -14.089
145 HZ PHE 17 HZ PHE 17 -0.928 2.021 -12.893
146 H CYS 18 HN CYS 18 2.893 7.847 -16.237
147 HA CYS 18 HA CYS 18 2.941 5.573 -17.873
148 HB2 CYS 18 HB1 CYS 18 2.186 7.886 -18.496
149 HB3 CYS 18 HB2 CYS 18 3.884 8.431 -18.476
150 H LEU 19 HN LEU 19 5.758 7.721 -16.900
151 HA LEU 19 HA LEU 19 7.522 6.068 -18.401
152 HB2 LEU 19 HB1 LEU 19 9.327 7.450 -17.716
153 HB3 LEU 19 HB2 LEU 19 7.911 8.430 -18.171
154 HG LEU 19 HG LEU 19 7.490 8.346 -15.478
155 HD11 LEU 19 HD11 LEU 19 9.655 8.659 -14.280
156 HD12 LEU 19 HD12 LEU 19 10.567 8.306 -15.790
157 HD13 LEU 19 HD13 LEU 19 9.596 7.011 -15.002
158 HD21 LEU 19 HD21 LEU 19 9.391 10.270 -16.956
159 HD22 LEU 19 HD22 LEU 19 8.559 10.600 -15.393
160 HD23 LEU 19 HD23 LEU 19 7.589 10.382 -16.899
161 H VAL 20 HN VAL 20 6.814 6.155 -14.878
162 HA VAL 20 HA VAL 20 8.917 4.565 -14.079
163 HB VAL 20 HB VAL 20 6.172 5.056 -12.873
164 HG11 VAL 20 HG11 VAL 20 7.202 4.221 -10.695
165 HG12 VAL 20 HG12 VAL 20 6.957 2.894 -11.880
166 HG13 VAL 20 HG13 VAL 20 8.603 3.588 -11.627
167 HG21 VAL 20 HG21 VAL 20 9.028 6.068 -12.211
168 HG22 VAL 20 HG22 VAL 20 7.781 7.023 -13.091
169 HG23 VAL 20 HG23 VAL 20 7.514 6.556 -11.373
170 H THR 21 HN THR 21 5.695 3.383 -15.191
171 HA THR 21 HA THR 21 6.680 0.652 -14.657
172 HB THR 21 HB THR 21 4.587 -0.238 -14.831
173 HG1 THR 21 HG1 THR 21 3.897 0.679 -16.650
174 HG21 THR 21 HG21 THR 21 3.197 1.085 -13.284
175 HG22 THR 21 HG22 THR 21 4.102 2.595 -13.672
176 HG23 THR 21 HG23 THR 21 4.924 1.245 -12.804
177 H LYS 22 HN LYS 22 7.590 2.492 -17.011
178 HA LYS 22 HA LYS 22 7.867 2.490 -19.182
179 HB2 LYS 22 HB1 LYS 22 9.425 0.792 -18.608
180 HB3 LYS 22 HB2 LYS 22 8.166 -0.470 -18.633
181 HG2 LYS 22 HG1 LYS 22 9.774 -0.545 -20.583
182 HG3 LYS 22 HG2 LYS 22 8.042 -0.524 -20.986
183 HD2 LYS 22 HD1 LYS 22 8.263 2.015 -21.419
184 HD3 LYS 22 HD2 LYS 22 10.045 1.788 -21.326
185 HE2 LYS 22 HE1 LYS 22 9.935 0.201 -23.271
186 HE3 LYS 22 HE2 LYS 22 8.128 0.223 -23.210
187 HZ1 LYS 22 HZ1 LYS 22 8.944 1.655 -24.937
188 HZ2 LYS 22 HZ2 LYS 22 9.869 2.561 -23.837
189 HZ3 LYS 22 HZ3 LYS 22 8.180 2.567 -23.742
190 H LYS 23 HN LYS 23 5.351 3.060 -18.759
191 HA LYS 23 HA LYS 23 3.678 1.429 -20.553
192 HB2 LYS 23 HB1 LYS 23 3.014 1.712 -18.247
193 HB3 LYS 23 HB2 LYS 23 3.150 3.500 -18.358
194 HG2 LYS 23 HG1 LYS 23 1.155 3.578 -19.808
195 HG3 LYS 23 HG2 LYS 23 1.172 1.807 -20.010
196 HD2 LYS 23 HD1 LYS 23 -0.595 2.528 -18.477
197 HD3 LYS 23 HD2 LYS 23 0.535 1.416 -17.669
198 HE2 LYS 23 HE1 LYS 23 0.902 4.468 -17.372
199 HE3 LYS 23 HE2 LYS 23 -0.410 3.635 -16.463
200 HZ1 LYS 23 HZ1 LYS 23 2.197 3.852 -15.677
201 HZ2 LYS 23 HZ2 LYS 23 2.123 2.273 -16.176
202 HZ3 LYS 23 HZ3 LYS 23 1.030 2.840 -15.020
203 H CYS 24 HN CYS 24 5.693 4.071 -20.721
204 HA CYS 24 HA CYS 24 4.183 5.379 -22.876
205 HB2 CYS 24 HB1 CYS 24 7.018 5.893 -21.815
206 HB3 CYS 24 HB2 CYS 24 6.231 6.821 -23.134
Start of MODEL 14
1 H1 PHE 1 HN PHE 1 1.754 -2.303 -1.023
2 HA PHE 1 HA PHE 1 0.702 -2.278 -3.302
3 HB2 PHE 1 HB1 PHE 1 -1.043 -1.356 -0.909
4 HB3 PHE 1 HB2 PHE 1 -1.680 -2.111 -2.424
5 HD1 PHE 1 HD1 PHE 1 -0.744 -4.438 -3.058
6 HD2 PHE 1 HD2 PHE 1 -0.402 -2.745 0.878
7 HE1 PHE 1 HE1 PHE 1 -0.376 -6.701 -2.112
8 HE2 PHE 1 HE2 PHE 1 -0.035 -5.003 1.818
9 HZ PHE 1 HZ PHE 1 -0.019 -6.982 0.327
10 H LEU 2 HN LEU 2 1.006 0.613 -1.510
11 HA LEU 2 HA LEU 2 0.684 2.792 -1.885
12 HB2 LEU 2 HB1 LEU 2 1.464 1.973 -4.714
13 HB3 LEU 2 HB2 LEU 2 1.667 3.611 -4.015
14 HG LEU 2 HG LEU 2 3.086 1.064 -3.035
15 HD11 LEU 2 HD11 LEU 2 3.840 1.802 -5.290
16 HD12 LEU 2 HD12 LEU 2 5.115 2.083 -4.044
17 HD13 LEU 2 HD13 LEU 2 4.135 3.468 -4.655
18 HD21 LEU 2 HD21 LEU 2 2.804 2.703 -1.158
19 HD22 LEU 2 HD22 LEU 2 3.479 4.015 -2.201
20 HD23 LEU 2 HD23 LEU 2 4.513 2.630 -1.704
21 HA PRO 3 HA PRO 3 -3.262 2.292 -4.366
22 HB2 PRO 3 HB1 PRO 3 -5.323 2.517 -2.483
23 HB3 PRO 3 HB2 PRO 3 -4.409 0.989 -2.766
24 HG2 PRO 3 HG1 PRO 3 -3.860 3.092 -0.595
25 HG3 PRO 3 HG2 PRO 3 -4.051 1.305 -0.395
26 HD2 PRO 3 HD1 PRO 3 -1.542 2.447 -0.624
27 HD3 PRO 3 HD2 PRO 3 -1.936 0.863 -1.434
28 H ILE 4 HN ILE 4 -2.939 4.746 -1.742
29 HA ILE 4 HA ILE 4 -4.508 6.663 -3.090
30 HB ILE 4 HB ILE 4 -3.673 8.321 -1.556
31 HG12 ILE 4 HG11 ILE 4 -1.766 6.117 -0.535
32 HG13 ILE 4 HG12 ILE 4 -1.304 7.642 -1.373
33 HG21 ILE 4 HG21 ILE 4 -4.343 5.630 -0.181
34 HG22 ILE 4 HG22 ILE 4 -4.678 7.285 0.433
35 HG23 ILE 4 HG23 ILE 4 -5.538 6.689 -1.022
36 HD11 ILE 4 HD1 ILE 4 -0.953 7.919 1.039
37 HD12 ILE 4 HD2 ILE 4 -2.310 8.979 0.518
38 HD13 ILE 4 HD3 ILE 4 -2.646 7.444 1.400
39 H LEU 5 HN LEU 5 -1.022 5.924 -3.337
40 HA LEU 5 HA LEU 5 -0.362 8.143 -4.956
41 HB2 LEU 5 HB1 LEU 5 0.903 5.345 -4.845
42 HB3 LEU 5 HB2 LEU 5 1.574 6.744 -5.730
43 HG LEU 5 HG LEU 5 2.861 6.527 -3.810
44 HD11 LEU 5 HD11 LEU 5 0.918 8.823 -3.151
45 HD12 LEU 5 HD12 LEU 5 2.228 8.889 -4.395
46 HD13 LEU 5 HD13 LEU 5 2.637 8.674 -2.653
47 HD21 LEU 5 HD21 LEU 5 1.339 5.122 -2.394
48 HD22 LEU 5 HD22 LEU 5 0.424 6.618 -1.943
49 HD23 LEU 5 HD23 LEU 5 2.152 6.452 -1.494
50 H ALA 6 HN ALA 6 -1.482 4.818 -5.796
51 HA ALA 6 HA ALA 6 -1.478 5.202 -8.578
52 HB1 ALA 6 HB1 ALA 6 -3.270 3.419 -6.813
53 HB2 ALA 6 HB2 ALA 6 -3.009 3.214 -8.588
54 HB3 ALA 6 HB3 ALA 6 -1.644 2.974 -7.434
55 H SER 7 HN SER 7 -4.068 5.784 -6.165
56 HA SER 7 HA SER 7 -6.024 6.685 -7.960
57 HB2 SER 7 HB1 SER 7 -6.398 6.044 -5.549
58 HB3 SER 7 HB2 SER 7 -5.625 7.587 -5.050
59 HG SER 7 HG1 SER 7 -7.951 7.675 -5.190
60 H LEU 8 HN LEU 8 -3.596 8.723 -6.123
61 HA LEU 8 HA LEU 8 -4.510 11.073 -7.366
62 HB2 LEU 8 HB1 LEU 8 -2.849 12.294 -6.290
63 HB3 LEU 8 HB2 LEU 8 -3.353 10.986 -5.191
64 HG LEU 8 HG LEU 8 -1.226 9.718 -6.183
65 HD11 LEU 8 HD11 LEU 8 -0.550 11.471 -7.878
66 HD12 LEU 8 HD12 LEU 8 0.689 11.287 -6.588
67 HD13 LEU 8 HD13 LEU 8 -0.438 12.689 -6.551
68 HD21 LEU 8 HD21 LEU 8 -1.080 12.024 -4.136
69 HD22 LEU 8 HD22 LEU 8 0.112 10.682 -4.289
70 HD23 LEU 8 HD23 LEU 8 -1.588 10.325 -3.806
71 H ALA 9 HN ALA 9 -1.995 8.754 -8.383
72 HA ALA 9 HA ALA 9 -1.018 10.212 -10.548
73 HB1 ALA 9 HB1 ALA 9 0.052 8.145 -9.674
74 HB2 ALA 9 HB2 ALA 9 -1.360 7.175 -10.217
75 HB3 ALA 9 HB3 ALA 9 -0.302 7.990 -11.436
76 H ALA 10 HN ALA 10 -3.856 7.942 -10.440
77 HA ALA 10 HA ALA 10 -4.630 8.424 -13.117
78 HB1 ALA 10 HB1 ALA 10 -5.423 6.491 -11.728
79 HB2 ALA 10 HB2 ALA 10 -6.292 7.630 -10.646
80 HB3 ALA 10 HB3 ALA 10 -6.816 7.444 -12.365
81 H LYS 11 HN LYS 11 -5.577 10.040 -10.072
82 HA LYS 11 HA LYS 11 -7.516 11.684 -11.149
83 HB2 LYS 11 HB1 LYS 11 -7.167 10.998 -8.769
84 HB3 LYS 11 HB2 LYS 11 -5.827 12.165 -8.630
85 HG2 LYS 11 HG1 LYS 11 -8.657 13.012 -9.482
86 HG3 LYS 11 HG2 LYS 11 -8.277 12.722 -7.767
87 HD2 LYS 11 HD1 LYS 11 -6.996 14.573 -7.466
88 HD3 LYS 11 HD2 LYS 11 -6.253 14.487 -9.070
89 HE2 LYS 11 HE1 LYS 11 -9.065 15.632 -8.465
90 HE3 LYS 11 HE2 LYS 11 -7.564 16.558 -8.878
91 HZ1 LYS 11 HZ1 LYS 11 -8.634 16.348 -10.908
92 HZ2 LYS 11 HZ2 LYS 11 -9.183 14.768 -10.585
93 HZ3 LYS 11 HZ3 LYS 11 -7.574 15.021 -10.941
94 H PHE 12 HN PHE 12 -4.033 12.460 -10.758
95 HA PHE 12 HA PHE 12 -4.257 14.301 -12.922
96 HB2 PHE 12 HB1 PHE 12 -3.422 16.405 -11.726
97 HB3 PHE 12 HB2 PHE 12 -5.129 15.949 -11.504
98 HD1 PHE 12 HD1 PHE 12 -5.114 17.616 -9.667
99 HD2 PHE 12 HD2 PHE 12 -2.659 14.075 -9.447
100 HE1 PHE 12 HE1 PHE 12 -4.897 17.894 -7.214
101 HE2 PHE 12 HE2 PHE 12 -2.451 14.377 -7.037
102 HZ PHE 12 HZ PHE 12 -3.575 16.265 -5.898
103 H GLY 13 HN GLY 13 -2.266 12.194 -11.276
104 HA2 GLY 13 HA1 GLY 13 0.165 13.569 -12.296
105 HA3 GLY 13 HA2 GLY 13 0.071 12.330 -11.023
106 HA PRO 14 HA PRO 14 -0.493 9.301 -14.094
107 HB2 PRO 14 HB1 PRO 14 -1.356 9.472 -16.747
108 HB3 PRO 14 HB2 PRO 14 -2.456 9.689 -15.334
109 HG2 PRO 14 HG1 PRO 14 -1.042 11.928 -16.900
110 HG3 PRO 14 HG2 PRO 14 -2.812 11.762 -16.533
111 HD2 PRO 14 HD1 PRO 14 -1.224 13.278 -14.875
112 HD3 PRO 14 HD2 PRO 14 -2.459 12.126 -14.188
113 H LYS 15 HN LYS 15 1.200 11.882 -15.822
114 HA LYS 15 HA LYS 15 2.573 10.215 -17.600
115 HB2 LYS 15 HB1 LYS 15 2.230 12.820 -17.546
116 HB3 LYS 15 HB2 LYS 15 3.815 12.851 -16.733
117 HG2 LYS 15 HG1 LYS 15 3.174 11.546 -19.479
118 HG3 LYS 15 HG2 LYS 15 3.783 13.215 -19.249
119 HD2 LYS 15 HD1 LYS 15 5.845 12.294 -18.122
120 HD3 LYS 15 HD2 LYS 15 5.345 10.638 -18.567
121 HE2 LYS 15 HE1 LYS 15 5.858 12.924 -20.594
122 HE3 LYS 15 HE2 LYS 15 7.078 11.677 -20.118
123 HZ1 LYS 15 HZ1 LYS 15 5.760 9.982 -21.037
124 HZ2 LYS 15 HZ2 LYS 15 5.813 11.206 -22.188
125 HZ3 LYS 15 HZ3 LYS 15 4.414 10.986 -21.250
126 H LEU 16 HN LEU 16 3.595 11.257 -14.293
127 HA LEU 16 HA LEU 16 6.145 10.051 -14.478
128 HB2 LEU 16 HB1 LEU 16 6.327 10.368 -12.074
129 HB3 LEU 16 HB2 LEU 16 5.692 11.813 -12.894
130 HG LEU 16 HG LEU 16 3.311 10.630 -12.173
131 HD11 LEU 16 HD11 LEU 16 4.464 8.754 -10.899
132 HD12 LEU 16 HD12 LEU 16 3.494 9.831 -9.828
133 HD13 LEU 16 HD13 LEU 16 5.283 9.992 -9.882
134 HD21 LEU 16 HD21 LEU 16 3.984 13.001 -11.784
135 HD22 LEU 16 HD22 LEU 16 5.043 12.478 -10.418
136 HD23 LEU 16 HD23 LEU 16 3.259 12.266 -10.306
137 H PHE 17 HN PHE 17 3.021 8.737 -13.253
138 HA PHE 17 HA PHE 17 4.042 6.213 -12.568
139 HB2 PHE 17 HB1 PHE 17 1.831 7.204 -11.834
140 HB3 PHE 17 HB2 PHE 17 1.211 7.034 -13.511
141 HD1 PHE 17 HD1 PHE 17 2.938 4.934 -10.856
142 HD2 PHE 17 HD2 PHE 17 -0.135 5.158 -13.848
143 HE1 PHE 17 HE1 PHE 17 2.181 2.664 -10.245
144 HE2 PHE 17 HE2 PHE 17 -0.903 2.887 -13.227
145 HZ PHE 17 HZ PHE 17 0.259 1.635 -11.424
146 H CYS 18 HN CYS 18 2.675 7.436 -15.613
147 HA CYS 18 HA CYS 18 2.798 5.094 -17.108
148 HB2 CYS 18 HB1 CYS 18 1.516 7.204 -17.596
149 HB3 CYS 18 HB2 CYS 18 3.047 8.009 -18.024
150 H LEU 19 HN LEU 19 5.401 7.633 -16.737
151 HA LEU 19 HA LEU 19 7.125 6.137 -18.466
152 HB2 LEU 19 HB1 LEU 19 8.814 7.722 -18.152
153 HB3 LEU 19 HB2 LEU 19 7.253 8.580 -18.268
154 HG LEU 19 HG LEU 19 7.408 8.474 -15.570
155 HD11 LEU 19 HD11 LEU 19 9.619 7.228 -15.504
156 HD12 LEU 19 HD12 LEU 19 9.750 8.876 -14.801
157 HD13 LEU 19 HD13 LEU 19 10.373 8.555 -16.459
158 HD21 LEU 19 HD21 LEU 19 8.923 10.481 -17.356
159 HD22 LEU 19 HD22 LEU 19 8.415 10.760 -15.650
160 HD23 LEU 19 HD23 LEU 19 7.163 10.530 -16.926
161 H VAL 20 HN VAL 20 6.910 6.289 -14.858
162 HA VAL 20 HA VAL 20 9.105 4.612 -14.410
163 HB VAL 20 HB VAL 20 6.608 5.198 -12.770
164 HG11 VAL 20 HG11 VAL 20 7.946 4.264 -10.814
165 HG12 VAL 20 HG12 VAL 20 7.473 2.983 -11.977
166 HG13 VAL 20 HG13 VAL 20 9.160 3.624 -11.975
167 HG21 VAL 20 HG21 VAL 20 9.566 6.113 -12.576
168 HG22 VAL 20 HG22 VAL 20 8.212 7.122 -13.206
169 HG23 VAL 20 HG23 VAL 20 8.230 6.614 -11.480
170 H THR 21 HN THR 21 5.663 3.771 -14.938
171 HA THR 21 HA THR 21 6.382 0.937 -14.846
172 HB THR 21 HB THR 21 4.094 0.359 -15.083
173 HG1 THR 21 HG1 THR 21 3.565 3.136 -15.077
174 HG21 THR 21 HG21 THR 21 4.985 0.964 -12.811
175 HG22 THR 21 HG22 THR 21 3.234 1.352 -12.974
176 HG23 THR 21 HG23 THR 21 4.455 2.666 -13.050
177 H LYS 22 HN LYS 22 7.582 2.524 -16.907
178 HA LYS 22 HA LYS 22 8.423 2.221 -18.859
179 HB2 LYS 22 HB1 LYS 22 8.689 -0.060 -18.182
180 HB3 LYS 22 HB2 LYS 22 6.996 -0.447 -18.590
181 HG2 LYS 22 HG1 LYS 22 8.467 -1.494 -20.209
182 HG3 LYS 22 HG2 LYS 22 7.430 -0.270 -20.985
183 HD2 LYS 22 HD1 LYS 22 9.459 1.354 -20.796
184 HD3 LYS 22 HD2 LYS 22 10.448 -0.088 -20.392
185 HE2 LYS 22 HE1 LYS 22 9.883 -1.124 -22.599
186 HE3 LYS 22 HE2 LYS 22 8.665 0.171 -22.926
187 HZ1 LYS 22 HZ1 LYS 22 11.599 0.607 -22.645
188 HZ2 LYS 22 HZ2 LYS 22 10.417 1.783 -22.970
189 HZ3 LYS 22 HZ3 LYS 22 10.721 0.558 -24.097
190 H LYS 23 HN LYS 23 4.964 2.299 -18.931
191 HA LYS 23 HA LYS 23 4.559 1.853 -21.630
192 HB2 LYS 23 HB1 LYS 23 2.675 3.800 -20.304
193 HB3 LYS 23 HB2 LYS 23 2.347 2.368 -21.321
194 HG2 LYS 23 HG1 LYS 23 3.163 0.967 -19.264
195 HG3 LYS 23 HG2 LYS 23 3.126 2.524 -18.353
196 HD2 LYS 23 HD1 LYS 23 0.643 2.718 -19.266
197 HD3 LYS 23 HD2 LYS 23 0.801 0.983 -19.638
198 HE2 LYS 23 HE1 LYS 23 0.766 2.406 -16.909
199 HE3 LYS 23 HE2 LYS 23 -0.237 1.017 -17.481
200 HZ1 LYS 23 HZ1 LYS 23 2.173 -0.075 -17.614
201 HZ2 LYS 23 HZ2 LYS 23 1.302 -0.014 -16.142
202 HZ3 LYS 23 HZ3 LYS 23 2.500 1.125 -16.476
203 H CYS 24 HN CYS 24 5.141 5.042 -20.106
204 HA CYS 24 HA CYS 24 5.928 6.009 -22.749
205 HB2 CYS 24 HB1 CYS 24 4.450 7.905 -22.918
206 HB3 CYS 24 HB2 CYS 24 3.482 6.423 -22.764
Start of MODEL 15
1 H1 PHE 1 HN PHE 1 3.460 0.476 -0.652
2 HA PHE 1 HA PHE 1 1.328 -1.216 -1.393
3 HB2 PHE 1 HB1 PHE 1 0.965 0.649 1.041
4 HB3 PHE 1 HB2 PHE 1 -0.439 0.020 0.094
5 HD1 PHE 1 HD1 PHE 1 -0.932 -2.396 0.024
6 HD2 PHE 1 HD2 PHE 1 2.178 -0.814 2.533
7 HE1 PHE 1 HE1 PHE 1 -0.933 -4.490 1.349
8 HE2 PHE 1 HE2 PHE 1 2.172 -2.905 3.857
9 HZ PHE 1 HZ PHE 1 0.618 -4.744 3.267
10 H LEU 2 HN LEU 2 -0.535 0.204 -2.309
11 HA LEU 2 HA LEU 2 0.432 2.807 -3.193
12 HB2 LEU 2 HB1 LEU 2 0.639 2.307 -5.498
13 HB3 LEU 2 HB2 LEU 2 1.589 1.089 -4.621
14 HG LEU 2 HG LEU 2 -1.223 0.624 -5.808
15 HD11 LEU 2 HD11 LEU 2 0.475 1.120 -7.553
16 HD12 LEU 2 HD12 LEU 2 -0.036 -0.611 -7.608
17 HD13 LEU 2 HD13 LEU 2 1.553 -0.162 -6.881
18 HD21 LEU 2 HD21 LEU 2 -0.636 -1.827 -5.592
19 HD22 LEU 2 HD22 LEU 2 -0.817 -1.020 -3.998
20 HD23 LEU 2 HD23 LEU 2 0.832 -1.370 -4.652
21 HA PRO 3 HA PRO 3 -4.120 2.111 -4.488
22 HB2 PRO 3 HB1 PRO 3 -5.872 2.502 -2.349
23 HB3 PRO 3 HB2 PRO 3 -5.181 0.891 -2.764
24 HG2 PRO 3 HG1 PRO 3 -4.136 2.866 -0.658
25 HG3 PRO 3 HG2 PRO 3 -4.481 1.104 -0.461
26 HD2 PRO 3 HD1 PRO 3 -1.926 2.036 -1.001
27 HD3 PRO 3 HD2 PRO 3 -2.545 0.483 -1.729
28 H ILE 4 HN ILE 4 -3.249 4.434 -1.867
29 HA ILE 4 HA ILE 4 -4.601 6.615 -3.022
30 HB ILE 4 HB ILE 4 -3.164 8.035 -1.589
31 HG12 ILE 4 HG11 ILE 4 -1.907 5.363 -0.670
32 HG13 ILE 4 HG12 ILE 4 -1.066 6.626 -1.634
33 HG21 ILE 4 HG21 ILE 4 -4.235 7.226 0.484
34 HG22 ILE 4 HG22 ILE 4 -5.355 6.988 -0.895
35 HG23 ILE 4 HG23 ILE 4 -4.454 5.583 -0.209
36 HD11 ILE 4 HD1 ILE 4 -2.152 6.968 1.235
37 HD12 ILE 4 HD2 ILE 4 -0.435 6.861 0.725
38 HD13 ILE 4 HD3 ILE 4 -1.426 8.282 0.241
39 H LEU 5 HN LEU 5 -1.330 5.352 -3.572
40 HA LEU 5 HA LEU 5 -0.390 7.455 -5.192
41 HB2 LEU 5 HB1 LEU 5 0.956 5.733 -3.984
42 HB3 LEU 5 HB2 LEU 5 0.428 4.491 -5.153
43 HG LEU 5 HG LEU 5 1.875 7.052 -6.045
44 HD11 LEU 5 HD11 LEU 5 3.183 4.441 -5.048
45 HD12 LEU 5 HD12 LEU 5 3.236 6.041 -4.223
46 HD13 LEU 5 HD13 LEU 5 4.041 5.827 -5.818
47 HD21 LEU 5 HD21 LEU 5 0.973 5.664 -7.923
48 HD22 LEU 5 HD22 LEU 5 1.754 4.192 -7.222
49 HD23 LEU 5 HD23 LEU 5 2.765 5.538 -7.865
50 H ALA 6 HN ALA 6 -2.035 4.356 -6.035
51 HA ALA 6 HA ALA 6 -2.113 4.780 -8.804
52 HB1 ALA 6 HB1 ALA 6 -4.052 3.255 -6.955
53 HB2 ALA 6 HB2 ALA 6 -3.924 3.036 -8.742
54 HB3 ALA 6 HB3 ALA 6 -2.546 2.584 -7.669
55 H SER 7 HN SER 7 -4.484 5.704 -6.265
56 HA SER 7 HA SER 7 -6.374 6.875 -7.980
57 HB2 SER 7 HB1 SER 7 -6.755 6.267 -5.572
58 HB3 SER 7 HB2 SER 7 -5.721 7.648 -5.077
59 HG SER 7 HG1 SER 7 -8.039 8.070 -5.127
60 H LEU 8 HN LEU 8 -3.621 8.534 -6.232
61 HA LEU 8 HA LEU 8 -4.228 10.999 -7.452
62 HB2 LEU 8 HB1 LEU 8 -2.284 11.944 -6.500
63 HB3 LEU 8 HB2 LEU 8 -3.033 10.819 -5.333
64 HG LEU 8 HG LEU 8 -1.233 9.101 -6.298
65 HD11 LEU 8 HD11 LEU 8 0.157 11.832 -6.750
66 HD12 LEU 8 HD12 LEU 8 -0.229 10.635 -8.045
67 HD13 LEU 8 HD13 LEU 8 0.961 10.222 -6.761
68 HD21 LEU 8 HD21 LEU 8 -0.566 11.372 -4.317
69 HD22 LEU 8 HD22 LEU 8 0.284 9.788 -4.432
70 HD23 LEU 8 HD23 LEU 8 -1.446 9.844 -3.937
71 H ALA 9 HN ALA 9 -2.071 8.358 -8.529
72 HA ALA 9 HA ALA 9 -0.948 9.662 -10.712
73 HB1 ALA 9 HB1 ALA 9 -0.134 7.486 -9.839
74 HB2 ALA 9 HB2 ALA 9 -1.677 6.702 -10.322
75 HB3 ALA 9 HB3 ALA 9 -0.556 7.335 -11.588
76 H ALA 10 HN ALA 10 -4.047 7.785 -10.558
77 HA ALA 10 HA ALA 10 -4.755 8.282 -13.249
78 HB1 ALA 10 HB1 ALA 10 -7.034 7.563 -12.471
79 HB2 ALA 10 HB2 ALA 10 -5.751 6.477 -11.818
80 HB3 ALA 10 HB3 ALA 10 -6.485 7.728 -10.758
81 H LYS 11 HN LYS 11 -5.587 10.051 -10.237
82 HA LYS 11 HA LYS 11 -7.341 11.887 -11.343
83 HB2 LYS 11 HB1 LYS 11 -7.091 11.386 -8.921
84 HB3 LYS 11 HB2 LYS 11 -5.428 12.025 -8.952
85 HG2 LYS 11 HG1 LYS 11 -6.382 14.329 -9.514
86 HG3 LYS 11 HG2 LYS 11 -8.025 13.652 -9.263
87 HD2 LYS 11 HD1 LYS 11 -7.493 13.085 -6.923
88 HD3 LYS 11 HD2 LYS 11 -5.771 13.484 -7.150
89 HE2 LYS 11 HE1 LYS 11 -8.110 15.515 -7.240
90 HE3 LYS 11 HE2 LYS 11 -6.948 15.280 -5.873
91 HZ1 LYS 11 HZ1 LYS 11 -5.148 15.860 -7.430
92 HZ2 LYS 11 HZ2 LYS 11 -6.273 17.115 -7.254
93 HZ3 LYS 11 HZ3 LYS 11 -6.278 16.139 -8.644
94 H PHE 12 HN PHE 12 -3.805 12.298 -10.885
95 HA PHE 12 HA PHE 12 -3.713 14.290 -12.915
96 HB2 PHE 12 HB1 PHE 12 -3.143 16.303 -11.734
97 HB3 PHE 12 HB2 PHE 12 -4.777 15.759 -11.281
98 HD1 PHE 12 HD1 PHE 12 -3.258 17.884 -9.867
99 HD2 PHE 12 HD2 PHE 12 -3.360 13.636 -9.133
100 HE1 PHE 12 HE1 PHE 12 -2.757 18.270 -7.475
101 HE2 PHE 12 HE2 PHE 12 -2.874 14.040 -6.773
102 HZ PHE 12 HZ PHE 12 -2.568 16.344 -5.924
103 H GLY 13 HN GLY 13 -2.124 11.939 -11.291
104 HA2 GLY 13 HA1 GLY 13 0.530 13.066 -11.873
105 HA3 GLY 13 HA2 GLY 13 0.130 11.603 -10.944
106 HA PRO 14 HA PRO 14 -0.211 9.174 -14.481
107 HB2 PRO 14 HB1 PRO 14 -1.163 9.712 -17.049
108 HB3 PRO 14 HB2 PRO 14 -2.243 9.610 -15.605
109 HG2 PRO 14 HG1 PRO 14 -1.031 12.171 -16.799
110 HG3 PRO 14 HG2 PRO 14 -2.775 11.817 -16.443
111 HD2 PRO 14 HD1 PRO 14 -1.228 13.156 -14.601
112 HD3 PRO 14 HD2 PRO 14 -2.401 11.862 -14.071
113 H LYS 15 HN LYS 15 1.307 12.138 -15.567
114 HA LYS 15 HA LYS 15 2.890 11.005 -17.606
115 HB2 LYS 15 HB1 LYS 15 2.329 13.505 -16.917
116 HB3 LYS 15 HB2 LYS 15 3.875 13.427 -16.036
117 HG2 LYS 15 HG1 LYS 15 3.458 12.771 -19.037
118 HG3 LYS 15 HG2 LYS 15 3.850 14.406 -18.416
119 HD2 LYS 15 HD1 LYS 15 6.047 13.605 -17.551
120 HD3 LYS 15 HD2 LYS 15 5.650 11.932 -18.023
121 HE2 LYS 15 HE1 LYS 15 7.213 12.879 -19.661
122 HE3 LYS 15 HE2 LYS 15 5.620 12.528 -20.437
123 HZ1 LYS 15 HZ1 LYS 15 6.500 14.669 -21.095
124 HZ2 LYS 15 HZ2 LYS 15 6.551 15.198 -19.486
125 HZ3 LYS 15 HZ3 LYS 15 5.061 14.862 -20.223
126 H LEU 16 HN LEU 16 3.668 11.445 -14.084
127 HA LEU 16 HA LEU 16 6.231 10.233 -14.345
128 HB2 LEU 16 HB1 LEU 16 6.229 10.043 -11.882
129 HB3 LEU 16 HB2 LEU 16 6.048 11.696 -12.503
130 HG LEU 16 HG LEU 16 3.511 10.185 -11.762
131 HD11 LEU 16 HD11 LEU 16 5.445 11.429 -9.713
132 HD12 LEU 16 HD12 LEU 16 5.058 9.677 -9.882
133 HD13 LEU 16 HD13 LEU 16 3.777 10.838 -9.380
134 HD21 LEU 16 HD21 LEU 16 4.459 13.111 -11.402
135 HD22 LEU 16 HD22 LEU 16 2.841 12.470 -10.959
136 HD23 LEU 16 HD23 LEU 16 3.332 12.531 -12.690
137 H PHE 17 HN PHE 17 3.001 8.966 -13.533
138 HA PHE 17 HA PHE 17 3.736 6.349 -12.929
139 HB2 PHE 17 HB1 PHE 17 1.495 7.440 -12.538
140 HB3 PHE 17 HB2 PHE 17 1.229 7.515 -14.309
141 HD1 PHE 17 HD1 PHE 17 2.392 4.716 -12.018
142 HD2 PHE 17 HD2 PHE 17 -0.612 6.165 -14.724
143 HE1 PHE 17 HE1 PHE 17 1.136 2.615 -11.749
144 HE2 PHE 17 HE2 PHE 17 -1.884 4.064 -14.440
145 HZ PHE 17 HZ PHE 17 -1.012 2.281 -12.941
146 H CYS 18 HN CYS 18 3.085 7.858 -16.103
147 HA CYS 18 HA CYS 18 3.063 5.601 -17.665
148 HB2 CYS 18 HB1 CYS 18 2.331 7.918 -18.294
149 HB3 CYS 18 HB2 CYS 18 4.040 8.416 -18.408
150 H LEU 19 HN LEU 19 6.061 7.653 -17.032
151 HA LEU 19 HA LEU 19 7.561 5.767 -18.585
152 HB2 LEU 19 HB1 LEU 19 9.526 6.906 -18.252
153 HB3 LEU 19 HB2 LEU 19 8.258 8.107 -18.603
154 HG LEU 19 HG LEU 19 9.289 7.505 -15.760
155 HD11 LEU 19 HD11 LEU 19 11.199 8.179 -17.190
156 HD12 LEU 19 HD12 LEU 19 10.773 9.478 -16.020
157 HD13 LEU 19 HD13 LEU 19 10.290 9.632 -17.752
158 HD21 LEU 19 HD21 LEU 19 8.439 9.799 -15.267
159 HD22 LEU 19 HD22 LEU 19 7.107 8.744 -15.860
160 HD23 LEU 19 HD23 LEU 19 7.847 9.964 -16.963
161 H VAL 20 HN VAL 20 7.177 6.204 -15.043
162 HA VAL 20 HA VAL 20 9.140 4.396 -14.277
163 HB VAL 20 HB VAL 20 6.571 5.294 -12.905
164 HG11 VAL 20 HG11 VAL 20 7.307 3.158 -11.813
165 HG12 VAL 20 HG12 VAL 20 9.008 3.751 -11.763
166 HG13 VAL 20 HG13 VAL 20 7.742 4.552 -10.769
167 HG21 VAL 20 HG21 VAL 20 8.249 7.115 -13.437
168 HG22 VAL 20 HG22 VAL 20 8.178 6.788 -11.672
169 HG23 VAL 20 HG23 VAL 20 9.544 6.139 -12.646
170 H THR 21 HN THR 21 5.760 3.746 -15.172
171 HA THR 21 HA THR 21 6.195 0.882 -14.574
172 HB THR 21 HB THR 21 3.836 0.516 -15.055
173 HG1 THR 21 HG1 THR 21 3.752 3.341 -15.312
174 HG21 THR 21 HG21 THR 21 4.644 1.151 -12.752
175 HG22 THR 21 HG22 THR 21 2.961 1.701 -13.070
176 HG23 THR 21 HG23 THR 21 4.325 2.883 -13.118
177 H LYS 22 HN LYS 22 7.244 2.583 -17.058
178 HA LYS 22 HA LYS 22 7.449 2.418 -19.229
179 HB2 LYS 22 HB1 LYS 22 8.932 0.701 -18.525
180 HB3 LYS 22 HB2 LYS 22 7.614 -0.497 -18.441
181 HG2 LYS 22 HG1 LYS 22 9.198 -0.806 -20.391
182 HG3 LYS 22 HG2 LYS 22 7.464 -0.733 -20.780
183 HD2 LYS 22 HD1 LYS 22 7.824 1.771 -21.393
184 HD3 LYS 22 HD2 LYS 22 9.587 1.419 -21.345
185 HE2 LYS 22 HE1 LYS 22 9.277 -0.297 -23.160
186 HE3 LYS 22 HE2 LYS 22 7.481 -0.126 -23.035
187 HZ1 LYS 22 HZ1 LYS 22 8.327 1.107 -24.893
188 HZ2 LYS 22 HZ2 LYS 22 9.370 2.011 -23.903
189 HZ3 LYS 22 HZ3 LYS 22 7.694 2.165 -23.744
190 H LYS 23 HN LYS 23 4.943 3.093 -18.769
191 HA LYS 23 HA LYS 23 3.211 1.447 -20.485
192 HB2 LYS 23 HB1 LYS 23 2.614 2.187 -18.149
193 HB3 LYS 23 HB2 LYS 23 2.613 3.889 -18.725
194 HG2 LYS 23 HG1 LYS 23 0.771 3.356 -20.315
195 HG3 LYS 23 HG2 LYS 23 0.789 1.644 -19.825
196 HD2 LYS 23 HD1 LYS 23 0.100 4.028 -17.953
197 HD3 LYS 23 HD2 LYS 23 -1.060 3.042 -18.874
198 HE2 LYS 23 HE1 LYS 23 -1.243 1.997 -16.824
199 HE3 LYS 23 HE2 LYS 23 -0.022 0.943 -17.633
200 HZ1 LYS 23 HZ1 LYS 23 0.633 1.465 -15.397
201 HZ2 LYS 23 HZ2 LYS 23 0.504 3.125 -15.653
202 HZ3 LYS 23 HZ3 LYS 23 1.711 2.240 -16.410
203 H CYS 24 HN CYS 24 5.350 4.034 -20.755
204 HA CYS 24 HA CYS 24 3.964 5.328 -22.973
205 HB2 CYS 24 HB1 CYS 24 6.837 5.673 -21.948
206 HB3 CYS 24 HB2 CYS 24 6.068 6.661 -23.235
Start of MODEL 16
1 H1 PHE 1 HN PHE 1 3.705 0.851 -0.596
2 HA PHE 1 HA PHE 1 1.641 -0.973 -1.175
3 HB2 PHE 1 HB1 PHE 1 1.202 1.061 1.108
4 HB3 PHE 1 HB2 PHE 1 -0.175 0.303 0.218
5 HD1 PHE 1 HD1 PHE 1 -0.575 -2.126 0.341
6 HD2 PHE 1 HD2 PHE 1 2.480 -0.235 2.699
7 HE1 PHE 1 HE1 PHE 1 -0.489 -4.109 1.824
8 HE2 PHE 1 HE2 PHE 1 2.561 -2.217 4.181
9 HZ PHE 1 HZ PHE 1 1.078 -4.154 3.744
10 H LEU 2 HN LEU 2 -0.291 0.309 -2.172
11 HA LEU 2 HA LEU 2 0.577 2.856 -3.281
12 HB2 LEU 2 HB1 LEU 2 0.615 2.111 -5.609
13 HB3 LEU 2 HB2 LEU 2 1.843 1.313 -4.611
14 HG LEU 2 HG LEU 2 0.908 -0.120 -6.324
15 HD11 LEU 2 HD11 LEU 2 1.841 -1.135 -4.232
16 HD12 LEU 2 HD12 LEU 2 0.646 -2.176 -5.089
17 HD13 LEU 2 HD13 LEU 2 0.158 -1.307 -3.595
18 HD21 LEU 2 HD21 LEU 2 -1.791 -0.191 -4.861
19 HD22 LEU 2 HD22 LEU 2 -1.312 -1.101 -6.333
20 HD23 LEU 2 HD23 LEU 2 -1.460 0.695 -6.400
21 HA PRO 3 HA PRO 3 -3.951 2.068 -4.497
22 HB2 PRO 3 HB1 PRO 3 -5.713 2.404 -2.357
23 HB3 PRO 3 HB2 PRO 3 -5.006 0.807 -2.800
24 HG2 PRO 3 HG1 PRO 3 -3.989 2.752 -0.654
25 HG3 PRO 3 HG2 PRO 3 -4.313 0.982 -0.492
26 HD2 PRO 3 HD1 PRO 3 -1.772 1.961 -1.003
27 HD3 PRO 3 HD2 PRO 3 -2.360 0.411 -1.766
28 H ILE 4 HN ILE 4 -3.050 4.340 -1.855
29 HA ILE 4 HA ILE 4 -4.414 6.551 -2.935
30 HB ILE 4 HB ILE 4 -2.921 7.932 -1.518
31 HG12 ILE 4 HG11 ILE 4 -1.669 5.230 -0.681
32 HG13 ILE 4 HG12 ILE 4 -0.841 6.502 -1.646
33 HG21 ILE 4 HG21 ILE 4 -3.943 7.099 0.570
34 HG22 ILE 4 HG22 ILE 4 -5.103 6.898 -0.781
35 HG23 ILE 4 HG23 ILE 4 -4.201 5.471 -0.145
36 HD11 ILE 4 HD1 ILE 4 -0.142 6.688 0.697
37 HD12 ILE 4 HD2 ILE 4 -1.130 8.128 0.266
38 HD13 ILE 4 HD3 ILE 4 -1.842 6.805 1.258
39 H LEU 5 HN LEU 5 -1.162 5.276 -3.599
40 HA LEU 5 HA LEU 5 -0.264 7.409 -5.204
41 HB2 LEU 5 HB1 LEU 5 1.109 5.651 -4.067
42 HB3 LEU 5 HB2 LEU 5 0.552 4.442 -5.256
43 HG LEU 5 HG LEU 5 1.981 7.025 -6.110
44 HD11 LEU 5 HD11 LEU 5 4.150 5.789 -5.970
45 HD12 LEU 5 HD12 LEU 5 3.305 4.384 -5.220
46 HD13 LEU 5 HD13 LEU 5 3.383 5.959 -4.350
47 HD21 LEU 5 HD21 LEU 5 2.824 5.562 -7.994
48 HD22 LEU 5 HD22 LEU 5 1.032 5.694 -8.004
49 HD23 LEU 5 HD23 LEU 5 1.824 4.201 -7.365
50 H ALA 6 HN ALA 6 -1.923 4.323 -6.065
51 HA ALA 6 HA ALA 6 -2.079 4.814 -8.824
52 HB1 ALA 6 HB1 ALA 6 -3.948 3.222 -6.958
53 HB2 ALA 6 HB2 ALA 6 -3.874 3.054 -8.755
54 HB3 ALA 6 HB3 ALA 6 -2.460 2.585 -7.740
55 H SER 7 HN SER 7 -4.377 5.648 -6.187
56 HA SER 7 HA SER 7 -6.326 6.842 -7.813
57 HB2 SER 7 HB1 SER 7 -6.616 6.180 -5.399
58 HB3 SER 7 HB2 SER 7 -5.604 7.583 -4.919
59 HG SER 7 HG1 SER 7 -7.902 7.989 -4.882
60 H LEU 8 HN LEU 8 -3.541 8.495 -6.104
61 HA LEU 8 HA LEU 8 -4.211 10.982 -7.232
62 HB2 LEU 8 HB1 LEU 8 -2.280 11.926 -6.287
63 HB3 LEU 8 HB2 LEU 8 -2.943 10.720 -5.154
64 HG LEU 8 HG LEU 8 -1.131 9.107 -6.263
65 HD11 LEU 8 HD11 LEU 8 -0.243 10.738 -7.982
66 HD12 LEU 8 HD12 LEU 8 1.009 10.319 -6.761
67 HD13 LEU 8 HD13 LEU 8 0.152 11.898 -6.656
68 HD21 LEU 8 HD21 LEU 8 -1.269 9.746 -3.866
69 HD22 LEU 8 HD22 LEU 8 -0.449 11.314 -4.217
70 HD23 LEU 8 HD23 LEU 8 0.442 9.762 -4.432
71 H ALA 9 HN ALA 9 -2.091 8.386 -8.466
72 HA ALA 9 HA ALA 9 -1.037 9.766 -10.639
73 HB1 ALA 9 HB1 ALA 9 -1.772 6.796 -10.349
74 HB2 ALA 9 HB2 ALA 9 -0.692 7.480 -11.623
75 HB3 ALA 9 HB3 ALA 9 -0.209 7.550 -9.886
76 H ALA 10 HN ALA 10 -4.136 7.878 -10.457
77 HA ALA 10 HA ALA 10 -4.957 8.555 -13.080
78 HB1 ALA 10 HB1 ALA 10 -6.583 7.843 -10.559
79 HB2 ALA 10 HB2 ALA 10 -7.207 7.797 -12.255
80 HB3 ALA 10 HB3 ALA 10 -5.905 6.665 -11.733
81 H LYS 11 HN LYS 11 -5.599 10.128 -9.928
82 HA LYS 11 HA LYS 11 -7.404 11.998 -10.861
83 HB2 LYS 11 HB1 LYS 11 -7.097 11.179 -8.538
84 HB3 LYS 11 HB2 LYS 11 -5.605 12.139 -8.377
85 HG2 LYS 11 HG1 LYS 11 -8.285 13.442 -9.118
86 HG3 LYS 11 HG2 LYS 11 -7.960 12.973 -7.429
87 HD2 LYS 11 HD1 LYS 11 -6.374 14.560 -7.016
88 HD3 LYS 11 HD2 LYS 11 -5.705 14.520 -8.655
89 HE2 LYS 11 HE1 LYS 11 -8.302 15.990 -7.828
90 HE3 LYS 11 HE2 LYS 11 -6.694 16.731 -8.213
91 HZ1 LYS 11 HZ1 LYS 11 -8.617 15.393 -10.007
92 HZ2 LYS 11 HZ2 LYS 11 -6.997 15.379 -10.401
93 HZ3 LYS 11 HZ3 LYS 11 -7.793 16.869 -10.218
94 H PHE 12 HN PHE 12 -3.862 12.392 -10.593
95 HA PHE 12 HA PHE 12 -3.935 14.300 -12.678
96 HB2 PHE 12 HB1 PHE 12 -2.892 16.307 -11.499
97 HB3 PHE 12 HB2 PHE 12 -4.626 16.015 -11.229
98 HD1 PHE 12 HD1 PHE 12 -4.269 17.741 -9.427
99 HD2 PHE 12 HD2 PHE 12 -2.426 13.845 -9.202
100 HE1 PHE 12 HE1 PHE 12 -3.968 18.002 -6.982
101 HE2 PHE 12 HE2 PHE 12 -2.139 14.128 -6.797
102 HZ PHE 12 HZ PHE 12 -2.916 16.187 -5.666
103 H GLY 13 HN GLY 13 -2.152 12.003 -11.049
104 HA2 GLY 13 HA1 GLY 13 0.421 13.164 -11.903
105 HA3 GLY 13 HA2 GLY 13 0.128 11.808 -10.792
106 HA PRO 14 HA PRO 14 -0.262 9.069 -14.145
107 HB2 PRO 14 HB1 PRO 14 -1.179 9.435 -16.748
108 HB3 PRO 14 HB2 PRO 14 -2.277 9.491 -15.317
109 HG2 PRO 14 HG1 PRO 14 -0.963 11.902 -16.701
110 HG3 PRO 14 HG2 PRO 14 -2.723 11.640 -16.342
111 HD2 PRO 14 HD1 PRO 14 -1.144 13.073 -14.590
112 HD3 PRO 14 HD2 PRO 14 -2.377 11.876 -13.981
113 H LYS 15 HN LYS 15 1.305 11.927 -15.386
114 HA LYS 15 HA LYS 15 2.830 10.718 -17.407
115 HB2 LYS 15 HB1 LYS 15 2.323 13.184 -16.979
116 HB3 LYS 15 HB2 LYS 15 3.679 13.210 -15.822
117 HG2 LYS 15 HG1 LYS 15 3.984 12.243 -18.740
118 HG3 LYS 15 HG2 LYS 15 3.954 13.990 -18.335
119 HD2 LYS 15 HD1 LYS 15 5.966 13.767 -16.902
120 HD3 LYS 15 HD2 LYS 15 5.970 11.999 -17.123
121 HE2 LYS 15 HE1 LYS 15 7.714 13.005 -18.541
122 HE3 LYS 15 HE2 LYS 15 6.441 12.220 -19.557
123 HZ1 LYS 15 HZ1 LYS 15 5.453 14.388 -19.903
124 HZ2 LYS 15 HZ2 LYS 15 7.072 14.387 -20.403
125 HZ3 LYS 15 HZ3 LYS 15 6.635 15.133 -18.944
126 H LEU 16 HN LEU 16 3.683 11.177 -13.919
127 HA LEU 16 HA LEU 16 6.230 9.928 -14.215
128 HB2 LEU 16 HB1 LEU 16 6.212 9.739 -11.733
129 HB3 LEU 16 HB2 LEU 16 6.083 11.395 -12.362
130 HG LEU 16 HG LEU 16 3.493 9.963 -11.648
131 HD11 LEU 16 HD11 LEU 16 3.748 10.601 -9.264
132 HD12 LEU 16 HD12 LEU 16 5.438 11.142 -9.571
133 HD13 LEU 16 HD13 LEU 16 5.000 9.402 -9.751
134 HD21 LEU 16 HD21 LEU 16 4.518 12.857 -11.260
135 HD22 LEU 16 HD22 LEU 16 2.874 12.255 -10.857
136 HD23 LEU 16 HD23 LEU 16 3.403 12.316 -12.576
137 H PHE 17 HN PHE 17 2.978 8.692 -13.310
138 HA PHE 17 HA PHE 17 3.798 6.098 -12.700
139 HB2 PHE 17 HB1 PHE 17 1.538 7.301 -12.268
140 HB3 PHE 17 HB2 PHE 17 1.101 6.930 -13.969
141 HD1 PHE 17 HD1 PHE 17 1.890 5.514 -10.613
142 HD2 PHE 17 HD2 PHE 17 0.524 4.645 -14.589
143 HE1 PHE 17 HE1 PHE 17 1.112 3.292 -9.856
144 HE2 PHE 17 HE2 PHE 17 -0.254 2.420 -13.836
145 HZ PHE 17 HZ PHE 17 0.034 1.741 -11.466
146 H CYS 18 HN CYS 18 2.808 7.511 -15.814
147 HA CYS 18 HA CYS 18 2.945 5.283 -17.442
148 HB2 CYS 18 HB1 CYS 18 1.917 7.489 -17.985
149 HB3 CYS 18 HB2 CYS 18 3.528 8.247 -18.017
150 H LEU 19 HN LEU 19 5.686 7.562 -16.625
151 HA LEU 19 HA LEU 19 7.449 6.005 -18.271
152 HB2 LEU 19 HB1 LEU 19 9.255 7.398 -17.643
153 HB3 LEU 19 HB2 LEU 19 7.807 8.359 -18.047
154 HG LEU 19 HG LEU 19 7.464 8.313 -15.367
155 HD11 LEU 19 HD11 LEU 19 9.542 6.933 -14.895
156 HD12 LEU 19 HD12 LEU 19 9.648 8.583 -14.190
157 HD13 LEU 19 HD13 LEU 19 10.539 8.194 -15.706
158 HD21 LEU 19 HD21 LEU 19 9.400 10.179 -16.872
159 HD22 LEU 19 HD22 LEU 19 8.582 10.537 -15.304
160 HD23 LEU 19 HD23 LEU 19 7.596 10.326 -16.803
161 H VAL 20 HN VAL 20 6.861 6.031 -14.710
162 HA VAL 20 HA VAL 20 8.873 4.203 -14.071
163 HB VAL 20 HB VAL 20 6.243 4.912 -12.712
164 HG11 VAL 20 HG11 VAL 20 6.881 2.646 -11.866
165 HG12 VAL 20 HG12 VAL 20 8.593 3.182 -11.664
166 HG13 VAL 20 HG13 VAL 20 7.295 3.881 -10.634
167 HG21 VAL 20 HG21 VAL 20 7.784 6.209 -11.212
168 HG22 VAL 20 HG22 VAL 20 9.204 5.656 -12.167
169 HG23 VAL 20 HG23 VAL 20 7.983 6.751 -12.915
170 H THR 21 HN THR 21 5.465 3.553 -15.001
171 HA THR 21 HA THR 21 5.970 0.679 -14.754
172 HB THR 21 HB THR 21 3.622 0.341 -15.316
173 HG1 THR 21 HG1 THR 21 3.383 3.153 -15.300
174 HG21 THR 21 HG21 THR 21 4.292 0.836 -12.935
175 HG22 THR 21 HG22 THR 21 2.638 1.433 -13.324
176 HG23 THR 21 HG23 THR 21 4.007 2.592 -13.221
177 H LYS 22 HN LYS 22 7.078 2.632 -16.916
178 HA LYS 22 HA LYS 22 7.380 2.858 -19.048
179 HB2 LYS 22 HB1 LYS 22 8.968 1.106 -18.355
180 HB3 LYS 22 HB2 LYS 22 7.817 -0.146 -18.898
181 HG2 LYS 22 HG1 LYS 22 9.581 0.123 -20.558
182 HG3 LYS 22 HG2 LYS 22 8.028 0.668 -21.262
183 HD2 LYS 22 HD1 LYS 22 8.728 3.089 -20.670
184 HD3 LYS 22 HD2 LYS 22 10.344 2.457 -20.261
185 HE2 LYS 22 HE1 LYS 22 8.885 2.290 -23.006
186 HE3 LYS 22 HE2 LYS 22 10.201 3.449 -22.581
187 HZ1 LYS 22 HZ1 LYS 22 11.681 1.567 -22.267
188 HZ2 LYS 22 HZ2 LYS 22 11.016 1.567 -23.828
189 HZ3 LYS 22 HZ3 LYS 22 10.436 0.482 -22.661
190 H LYS 23 HN LYS 23 4.971 3.403 -19.148
191 HA LYS 23 HA LYS 23 3.747 1.828 -21.348
192 HB2 LYS 23 HB1 LYS 23 2.553 4.014 -19.565
193 HB3 LYS 23 HB2 LYS 23 1.646 3.044 -20.760
194 HG2 LYS 23 HG1 LYS 23 3.033 1.822 -18.265
195 HG3 LYS 23 HG2 LYS 23 1.417 2.538 -18.237
196 HD2 LYS 23 HD1 LYS 23 1.110 0.195 -18.388
197 HD3 LYS 23 HD2 LYS 23 0.550 0.946 -19.903
198 HE2 LYS 23 HE1 LYS 23 1.705 -1.260 -20.239
199 HE3 LYS 23 HE2 LYS 23 2.515 0.073 -21.138
200 HZ1 LYS 23 HZ1 LYS 23 3.745 -1.666 -19.448
201 HZ2 LYS 23 HZ2 LYS 23 3.586 -0.286 -18.476
202 HZ3 LYS 23 HZ3 LYS 23 4.344 -0.170 -19.943
203 H CYS 24 HN CYS 24 5.542 4.671 -20.626
204 HA CYS 24 HA CYS 24 4.653 6.059 -23.031
205 HB2 CYS 24 HB1 CYS 24 6.946 6.686 -21.098
206 HB3 CYS 24 HB2 CYS 24 6.397 7.735 -22.448
Start of MODEL 17
1 H1 PHE 1 HN PHE 1 0.288 -0.045 1.153
2 HA PHE 1 HA PHE 1 0.719 2.313 0.692
3 HB2 PHE 1 HB1 PHE 1 2.658 0.433 -0.838
4 HB3 PHE 1 HB2 PHE 1 3.063 2.062 -0.168
5 HD1 PHE 1 HD1 PHE 1 2.726 2.371 2.406
6 HD2 PHE 1 HD2 PHE 1 2.980 -1.467 0.482
7 HE1 PHE 1 HE1 PHE 1 3.307 1.319 4.570
8 HE2 PHE 1 HE2 PHE 1 3.562 -2.512 2.651
9 HZ PHE 1 HZ PHE 1 3.719 -1.119 4.696
10 H LEU 2 HN LEU 2 0.632 0.199 -2.143
11 HA LEU 2 HA LEU 2 0.744 2.263 -4.019
12 HB2 LEU 2 HB1 LEU 2 0.450 0.702 -5.746
13 HB3 LEU 2 HB2 LEU 2 1.558 0.029 -4.522
14 HG LEU 2 HG LEU 2 -1.420 -0.733 -4.730
15 HD11 LEU 2 HD11 LEU 2 -0.647 -2.764 -5.943
16 HD12 LEU 2 HD12 LEU 2 1.042 -2.134 -5.936
17 HD13 LEU 2 HD13 LEU 2 -0.244 -1.261 -6.855
18 HD21 LEU 2 HD21 LEU 2 -0.445 -1.335 -2.506
19 HD22 LEU 2 HD22 LEU 2 0.971 -2.103 -3.324
20 HD23 LEU 2 HD23 LEU 2 -0.673 -2.809 -3.502
21 HA PRO 3 HA PRO 3 -3.773 1.776 -5.103
22 HB2 PRO 3 HB1 PRO 3 -5.774 1.835 -3.128
23 HB3 PRO 3 HB2 PRO 3 -5.020 0.321 -3.758
24 HG2 PRO 3 HG1 PRO 3 -4.225 1.879 -1.236
25 HG3 PRO 3 HG2 PRO 3 -4.557 0.109 -1.395
26 HD2 PRO 3 HD1 PRO 3 -2.005 1.093 -1.462
27 HD3 PRO 3 HD2 PRO 3 -2.485 -0.252 -2.596
28 H ILE 4 HN ILE 4 -3.205 3.806 -2.174
29 HA ILE 4 HA ILE 4 -4.663 6.017 -3.181
30 HB ILE 4 HB ILE 4 -3.412 7.366 -1.513
31 HG12 ILE 4 HG11 ILE 4 -2.094 4.674 -0.740
32 HG13 ILE 4 HG12 ILE 4 -1.245 6.055 -1.507
33 HG21 ILE 4 HG21 ILE 4 -5.593 6.163 -1.106
34 HG22 ILE 4 HG22 ILE 4 -4.678 4.734 -0.491
35 HG23 ILE 4 HG23 ILE 4 -4.598 6.305 0.378
36 HD11 ILE 4 HD1 ILE 4 -0.824 6.095 0.905
37 HD12 ILE 4 HD2 ILE 4 -1.841 7.515 0.467
38 HD13 ILE 4 HD3 ILE 4 -2.581 6.084 1.274
39 H LEU 5 HN LEU 5 -1.245 5.081 -3.500
40 HA LEU 5 HA LEU 5 -0.371 7.331 -4.921
41 HB2 LEU 5 HB1 LEU 5 0.961 5.561 -3.702
42 HB3 LEU 5 HB2 LEU 5 0.676 4.436 -5.053
43 HG LEU 5 HG LEU 5 2.026 7.184 -5.404
44 HD11 LEU 5 HD11 LEU 5 4.225 6.033 -5.147
45 HD12 LEU 5 HD12 LEU 5 3.378 4.496 -4.728
46 HD13 LEU 5 HD13 LEU 5 3.246 5.925 -3.640
47 HD21 LEU 5 HD21 LEU 5 2.175 4.574 -7.057
48 HD22 LEU 5 HD22 LEU 5 3.186 6.040 -7.341
49 HD23 LEU 5 HD23 LEU 5 1.407 6.127 -7.576
50 H ALA 6 HN ALA 6 -1.666 4.184 -6.092
51 HA ALA 6 HA ALA 6 -1.538 4.747 -8.825
52 HB1 ALA 6 HB1 ALA 6 -3.188 2.857 -9.019
53 HB2 ALA 6 HB2 ALA 6 -1.890 2.468 -7.825
54 HB3 ALA 6 HB3 ALA 6 -3.510 2.981 -7.246
55 H SER 7 HN SER 7 -4.184 5.387 -6.479
56 HA SER 7 HA SER 7 -6.022 6.435 -8.320
57 HB2 SER 7 HB1 SER 7 -6.524 5.743 -5.945
58 HB3 SER 7 HB2 SER 7 -5.690 7.223 -5.368
59 HG SER 7 HG1 SER 7 -7.982 7.475 -5.583
60 H LEU 8 HN LEU 8 -3.611 8.292 -6.281
61 HA LEU 8 HA LEU 8 -4.318 10.726 -7.519
62 HB2 LEU 8 HB1 LEU 8 -2.548 11.792 -6.333
63 HB3 LEU 8 HB2 LEU 8 -3.379 10.610 -5.293
64 HG LEU 8 HG LEU 8 -1.388 8.990 -6.016
65 HD11 LEU 8 HD11 LEU 8 -0.062 11.778 -6.226
66 HD12 LEU 8 HD12 LEU 8 -0.236 10.617 -7.596
67 HD13 LEU 8 HD13 LEU 8 0.792 10.196 -6.180
68 HD21 LEU 8 HD21 LEU 8 -1.108 11.252 -3.941
69 HD22 LEU 8 HD22 LEU 8 -0.174 9.712 -3.956
70 HD23 LEU 8 HD23 LEU 8 -1.957 9.678 -3.705
71 H ALA 9 HN ALA 9 -1.803 8.343 -8.368
72 HA ALA 9 HA ALA 9 -0.606 9.791 -10.415
73 HB1 ALA 9 HB1 ALA 9 0.331 7.722 -9.384
74 HB2 ALA 9 HB2 ALA 9 -0.990 6.756 -10.125
75 HB3 ALA 9 HB3 ALA 9 0.241 7.568 -11.174
76 H ALA 10 HN ALA 10 -3.514 7.640 -10.575
77 HA ALA 10 HA ALA 10 -3.993 8.122 -13.334
78 HB1 ALA 10 HB1 ALA 10 -6.277 7.230 -12.793
79 HB2 ALA 10 HB2 ALA 10 -4.992 6.217 -12.031
80 HB3 ALA 10 HB3 ALA 10 -5.908 7.392 -11.034
81 H LYS 11 HN LYS 11 -5.179 9.765 -10.370
82 HA LYS 11 HA LYS 11 -6.974 11.428 -11.633
83 HB2 LYS 11 HB1 LYS 11 -6.849 10.745 -9.218
84 HB3 LYS 11 HB2 LYS 11 -5.553 11.940 -8.958
85 HG2 LYS 11 HG1 LYS 11 -8.329 12.673 -10.090
86 HG3 LYS 11 HG2 LYS 11 -8.068 12.468 -8.342
87 HD2 LYS 11 HD1 LYS 11 -6.923 14.393 -8.025
88 HD3 LYS 11 HD2 LYS 11 -6.020 14.268 -9.542
89 HE2 LYS 11 HE1 LYS 11 -8.928 15.302 -9.276
90 HE3 LYS 11 HE2 LYS 11 -7.435 16.284 -9.575
91 HZ1 LYS 11 HZ1 LYS 11 -8.293 15.943 -11.688
92 HZ2 LYS 11 HZ2 LYS 11 -8.777 14.344 -11.361
93 HZ3 LYS 11 HZ3 LYS 11 -7.155 14.689 -11.562
94 H PHE 12 HN PHE 12 -3.536 12.197 -10.868
95 HA PHE 12 HA PHE 12 -3.665 14.187 -12.988
96 HB2 PHE 12 HB1 PHE 12 -2.648 16.046 -11.505
97 HB3 PHE 12 HB2 PHE 12 -4.392 15.695 -11.349
98 HD1 PHE 12 HD1 PHE 12 -4.685 16.708 -9.224
99 HD2 PHE 12 HD2 PHE 12 -1.654 13.673 -9.677
100 HE1 PHE 12 HE1 PHE 12 -4.433 16.565 -6.765
101 HE2 PHE 12 HE2 PHE 12 -1.408 13.565 -7.254
102 HZ PHE 12 HZ PHE 12 -2.801 14.986 -5.778
103 H GLY 13 HN GLY 13 -1.963 11.665 -11.931
104 HA2 GLY 13 HA1 GLY 13 0.665 12.925 -12.419
105 HA3 GLY 13 HA2 GLY 13 0.331 11.391 -11.587
106 HA PRO 14 HA PRO 14 -0.289 9.268 -15.351
107 HB2 PRO 14 HB1 PRO 14 -0.902 10.221 -17.922
108 HB3 PRO 14 HB2 PRO 14 -2.121 10.021 -16.606
109 HG2 PRO 14 HG1 PRO 14 -0.598 12.595 -17.315
110 HG3 PRO 14 HG2 PRO 14 -2.389 12.367 -17.140
111 HD2 PRO 14 HD1 PRO 14 -0.897 13.301 -15.028
112 HD3 PRO 14 HD2 PRO 14 -2.200 12.057 -14.750
113 H LYS 15 HN LYS 15 1.652 12.109 -16.335
114 HA LYS 15 HA LYS 15 3.361 10.624 -18.067
115 HB2 LYS 15 HB1 LYS 15 3.813 13.237 -16.540
116 HB3 LYS 15 HB2 LYS 15 4.966 12.588 -17.742
117 HG2 LYS 15 HG1 LYS 15 2.041 13.313 -18.414
118 HG3 LYS 15 HG2 LYS 15 3.431 14.428 -18.551
119 HD2 LYS 15 HD1 LYS 15 4.565 12.828 -20.128
120 HD3 LYS 15 HD2 LYS 15 3.098 11.788 -20.103
121 HE2 LYS 15 HE1 LYS 15 1.731 13.671 -21.068
122 HE3 LYS 15 HE2 LYS 15 3.177 14.753 -21.026
123 HZ1 LYS 15 HZ1 LYS 15 2.922 12.247 -22.630
124 HZ2 LYS 15 HZ2 LYS 15 4.275 13.267 -22.582
125 HZ3 LYS 15 HZ3 LYS 15 2.813 13.830 -23.211
126 H LEU 16 HN LEU 16 3.747 11.437 -14.530
127 HA LEU 16 HA LEU 16 6.176 9.964 -14.374
128 HB2 LEU 16 HB1 LEU 16 5.987 10.100 -11.936
129 HB3 LEU 16 HB2 LEU 16 6.009 11.671 -12.762
130 HG LEU 16 HG LEU 16 3.315 10.466 -11.985
131 HD11 LEU 16 HD11 LEU 16 3.515 11.490 -9.727
132 HD12 LEU 16 HD12 LEU 16 5.233 11.912 -10.058
133 HD13 LEU 16 HD13 LEU 16 4.731 10.184 -9.962
134 HD21 LEU 16 HD21 LEU 16 2.806 12.919 -11.569
135 HD22 LEU 16 HD22 LEU 16 3.310 12.632 -13.275
136 HD23 LEU 16 HD23 LEU 16 4.471 13.341 -12.086
137 H PHE 17 HN PHE 17 2.763 9.124 -13.838
138 HA PHE 17 HA PHE 17 3.126 6.558 -12.862
139 HB2 PHE 17 HB1 PHE 17 0.982 7.986 -13.140
140 HB3 PHE 17 HB2 PHE 17 0.969 7.524 -14.863
141 HD1 PHE 17 HD1 PHE 17 1.991 4.685 -12.832
142 HD2 PHE 17 HD2 PHE 17 -1.451 7.033 -13.935
143 HE1 PHE 17 HE1 PHE 17 0.521 2.872 -12.125
144 HE2 PHE 17 HE2 PHE 17 -2.927 5.198 -13.185
145 HZ PHE 17 HZ PHE 17 -1.941 3.110 -12.278
146 H CYS 18 HN CYS 18 2.971 7.649 -16.316
147 HA CYS 18 HA CYS 18 3.449 5.135 -17.478
148 HB2 CYS 18 HB1 CYS 18 3.936 8.023 -18.351
149 HB3 CYS 18 HB2 CYS 18 4.494 6.672 -19.370
150 H LEU 19 HN LEU 19 5.929 7.692 -16.613
151 HA LEU 19 HA LEU 19 7.949 6.143 -17.762
152 HB2 LEU 19 HB1 LEU 19 9.549 7.709 -17.072
153 HB3 LEU 19 HB2 LEU 19 8.053 8.570 -17.506
154 HG LEU 19 HG LEU 19 7.612 8.451 -14.849
155 HD11 LEU 19 HD11 LEU 19 10.700 8.471 -15.047
156 HD12 LEU 19 HD12 LEU 19 9.722 7.171 -14.272
157 HD13 LEU 19 HD13 LEU 19 9.731 8.828 -13.573
158 HD21 LEU 19 HD21 LEU 19 8.634 10.732 -14.702
159 HD22 LEU 19 HD22 LEU 19 7.743 10.510 -16.256
160 HD23 LEU 19 HD23 LEU 19 9.546 10.427 -16.225
161 H VAL 20 HN VAL 20 6.916 6.208 -14.305
162 HA VAL 20 HA VAL 20 8.954 4.442 -13.453
163 HB VAL 20 HB VAL 20 6.159 4.941 -12.338
164 HG11 VAL 20 HG11 VAL 20 7.164 4.022 -10.193
165 HG12 VAL 20 HG12 VAL 20 7.039 2.752 -11.453
166 HG13 VAL 20 HG13 VAL 20 8.631 3.526 -11.102
167 HG21 VAL 20 HG21 VAL 20 7.433 6.398 -10.727
168 HG22 VAL 20 HG22 VAL 20 8.956 6.066 -11.621
169 HG23 VAL 20 HG23 VAL 20 7.624 6.990 -12.411
170 H THR 21 HN THR 21 5.564 3.732 -14.461
171 HA THR 21 HA THR 21 5.844 0.938 -14.132
172 HB THR 21 HB THR 21 3.761 0.667 -15.453
173 HG1 THR 21 HG1 THR 21 3.750 3.492 -15.488
174 HG21 THR 21 HG21 THR 21 3.712 2.887 -13.292
175 HG22 THR 21 HG22 THR 21 3.722 1.113 -12.992
176 HG23 THR 21 HG23 THR 21 2.318 1.870 -13.823
177 H LYS 22 HN LYS 22 6.324 2.924 -16.991
178 HA LYS 22 HA LYS 22 7.479 2.554 -18.834
179 HB2 LYS 22 HB1 LYS 22 8.253 0.068 -17.711
180 HB3 LYS 22 HB2 LYS 22 7.381 -0.378 -19.176
181 HG2 LYS 22 HG1 LYS 22 9.365 -0.112 -20.177
182 HG3 LYS 22 HG2 LYS 22 8.982 1.619 -20.226
183 HD2 LYS 22 HD1 LYS 22 10.692 0.115 -18.100
184 HD3 LYS 22 HD2 LYS 22 11.298 1.086 -19.464
185 HE2 LYS 22 HE1 LYS 22 11.576 2.502 -17.560
186 HE3 LYS 22 HE2 LYS 22 10.143 3.150 -18.448
187 HZ1 LYS 22 HZ1 LYS 22 9.533 3.094 -16.244
188 HZ2 LYS 22 HZ2 LYS 22 10.187 1.570 -15.910
189 HZ3 LYS 22 HZ3 LYS 22 8.804 1.718 -16.868
190 H LYS 23 HN LYS 23 4.458 2.457 -18.186
191 HA LYS 23 HA LYS 23 3.240 1.212 -20.398
192 HB2 LYS 23 HB1 LYS 23 2.416 3.620 -18.700
193 HB3 LYS 23 HB2 LYS 23 1.389 2.980 -20.026
194 HG2 LYS 23 HG1 LYS 23 1.266 0.767 -18.988
195 HG3 LYS 23 HG2 LYS 23 2.255 1.297 -17.601
196 HD2 LYS 23 HD1 LYS 23 -0.438 2.556 -18.446
197 HD3 LYS 23 HD2 LYS 23 -0.272 1.243 -17.233
198 HE2 LYS 23 HE1 LYS 23 1.096 2.714 -15.750
199 HE3 LYS 23 HE2 LYS 23 0.988 4.068 -16.944
200 HZ1 LYS 23 HZ1 LYS 23 -0.635 4.190 -15.116
201 HZ2 LYS 23 HZ2 LYS 23 -1.341 2.748 -15.640
202 HZ3 LYS 23 HZ3 LYS 23 -1.373 4.113 -16.644
203 H CYS 24 HN CYS 24 4.844 4.406 -20.236
204 HA CYS 24 HA CYS 24 4.943 4.454 -23.056
205 HB2 CYS 24 HB2 CYS 24 3.735 6.625 -23.467
206 HB3 CYS 24 HB1 CYS 24 2.665 5.272 -23.036
Start of MODEL 18
1 H1 PHE 1 HN PHE 1 1.702 -2.083 -0.904
2 HA PHE 1 HA PHE 1 0.902 -1.914 -3.275
3 HB2 PHE 1 HB1 PHE 1 -1.161 -1.323 -1.034
4 HB3 PHE 1 HB2 PHE 1 -1.570 -1.971 -2.671
5 HD1 PHE 1 HD1 PHE 1 -0.446 -4.176 -3.386
6 HD2 PHE 1 HD2 PHE 1 -0.592 -2.823 0.691
7 HE1 PHE 1 HE1 PHE 1 -0.035 -6.491 -2.599
8 HE2 PHE 1 HE2 PHE 1 -0.180 -5.134 1.473
9 HZ PHE 1 HZ PHE 1 0.100 -6.969 -0.168
10 H LEU 2 HN LEU 2 0.717 0.809 -1.198
11 HA LEU 2 HA LEU 2 0.175 2.967 -1.410
12 HB2 LEU 2 HB1 LEU 2 1.581 2.598 -4.077
13 HB3 LEU 2 HB2 LEU 2 1.415 4.149 -3.187
14 HG LEU 2 HG LEU 2 2.926 1.668 -2.170
15 HD11 LEU 2 HD11 LEU 2 4.019 2.734 -4.148
16 HD12 LEU 2 HD12 LEU 2 4.979 2.960 -2.638
17 HD13 LEU 2 HD13 LEU 2 4.004 4.326 -3.291
18 HD21 LEU 2 HD21 LEU 2 2.755 4.536 -1.026
19 HD22 LEU 2 HD22 LEU 2 3.857 3.238 -0.446
20 HD23 LEU 2 HD23 LEU 2 2.082 3.044 -0.259
21 HA PRO 3 HA PRO 3 -3.365 2.456 -4.428
22 HB2 PRO 3 HB1 PRO 3 -5.582 2.658 -2.718
23 HB3 PRO 3 HB2 PRO 3 -4.675 1.121 -2.978
24 HG2 PRO 3 HG1 PRO 3 -4.265 3.147 -0.706
25 HG3 PRO 3 HG2 PRO 3 -4.511 1.359 -0.573
26 HD2 PRO 3 HD1 PRO 3 -1.977 2.442 -0.552
27 HD3 PRO 3 HD2 PRO 3 -2.315 0.901 -1.461
28 H ILE 4 HN ILE 4 -2.987 4.835 -1.814
29 HA ILE 4 HA ILE 4 -4.452 6.901 -3.024
30 HB ILE 4 HB ILE 4 -3.147 8.430 -1.571
31 HG12 ILE 4 HG11 ILE 4 -1.731 5.854 -0.608
32 HG13 ILE 4 HG12 ILE 4 -0.958 7.163 -1.566
33 HG21 ILE 4 HG21 ILE 4 -4.296 5.902 -0.203
34 HG22 ILE 4 HG22 ILE 4 -4.203 7.560 0.485
35 HG23 ILE 4 HG23 ILE 4 -5.274 7.240 -0.916
36 HD11 ILE 4 HD1 ILE 4 -0.390 7.456 0.804
37 HD12 ILE 4 HD2 ILE 4 -1.463 8.805 0.288
38 HD13 ILE 4 HD3 ILE 4 -2.121 7.453 1.279
39 H LEU 5 HN LEU 5 -1.074 5.870 -3.548
40 HA LEU 5 HA LEU 5 -0.364 8.092 -5.168
41 HB2 LEU 5 HB1 LEU 5 1.121 6.416 -3.871
42 HB3 LEU 5 HB2 LEU 5 0.936 5.321 -5.266
43 HG LEU 5 HG LEU 5 2.035 8.209 -5.376
44 HD11 LEU 5 HD11 LEU 5 3.442 6.752 -3.917
45 HD12 LEU 5 HD12 LEU 5 4.302 7.188 -5.438
46 HD13 LEU 5 HD13 LEU 5 3.582 5.546 -5.251
47 HD21 LEU 5 HD21 LEU 5 2.170 5.922 -7.448
48 HD22 LEU 5 HD22 LEU 5 3.130 7.447 -7.535
49 HD23 LEU 5 HD23 LEU 5 1.340 7.519 -7.642
50 H ALA 6 HN ALA 6 -1.604 4.787 -5.873
51 HA ALA 6 HA ALA 6 -1.695 5.058 -8.664
52 HB1 ALA 6 HB1 ALA 6 -3.517 3.438 -6.776
53 HB2 ALA 6 HB2 ALA 6 -3.316 3.148 -8.545
54 HB3 ALA 6 HB3 ALA 6 -1.932 2.888 -7.421
55 H SER 7 HN SER 7 -4.201 5.852 -6.214
56 HA SER 7 HA SER 7 -6.149 6.792 -7.996
57 HB2 SER 7 HB1 SER 7 -6.516 6.236 -5.575
58 HB3 SER 7 HB2 SER 7 -5.620 7.722 -5.115
59 HG SER 7 HG1 SER 7 -7.965 7.928 -5.212
60 H LEU 8 HN LEU 8 -3.583 8.767 -6.277
61 HA LEU 8 HA LEU 8 -4.428 11.117 -7.578
62 HB2 LEU 8 HB1 LEU 8 -2.639 12.295 -6.620
63 HB3 LEU 8 HB2 LEU 8 -3.214 11.084 -5.441
64 HG LEU 8 HG LEU 8 -1.207 9.621 -6.421
65 HD11 LEU 8 HD11 LEU 8 -0.205 12.510 -6.906
66 HD12 LEU 8 HD12 LEU 8 -0.443 11.265 -8.190
67 HD13 LEU 8 HD13 LEU 8 0.808 11.023 -6.920
68 HD21 LEU 8 HD21 LEU 8 -0.828 11.978 -4.463
69 HD22 LEU 8 HD22 LEU 8 0.225 10.520 -4.579
70 HD23 LEU 8 HD23 LEU 8 -1.491 10.349 -4.060
71 H ALA 9 HN ALA 9 -2.002 8.682 -8.559
72 HA ALA 9 HA ALA 9 -1.047 10.043 -10.800
73 HB1 ALA 9 HB1 ALA 9 0.038 8.020 -9.840
74 HB2 ALA 9 HB2 ALA 9 -1.383 7.028 -10.311
75 HB3 ALA 9 HB3 ALA 9 -0.342 7.776 -11.588
76 H ALA 10 HN ALA 10 -3.887 7.791 -10.538
77 HA ALA 10 HA ALA 10 -4.660 8.056 -13.233
78 HB1 ALA 10 HB1 ALA 10 -5.445 6.244 -11.683
79 HB2 ALA 10 HB2 ALA 10 -6.319 7.468 -10.702
80 HB3 ALA 10 HB3 ALA 10 -6.842 7.132 -12.398
81 H LYS 11 HN LYS 11 -5.661 9.914 -10.339
82 HA LYS 11 HA LYS 11 -7.600 11.500 -11.512
83 HB2 LYS 11 HB1 LYS 11 -7.246 11.197 -9.072
84 HB3 LYS 11 HB2 LYS 11 -5.645 11.970 -9.199
85 HG2 LYS 11 HG1 LYS 11 -6.813 14.140 -9.885
86 HG3 LYS 11 HG2 LYS 11 -8.381 13.348 -9.521
87 HD2 LYS 11 HD1 LYS 11 -7.727 13.002 -7.173
88 HD3 LYS 11 HD2 LYS 11 -6.048 13.505 -7.495
89 HE2 LYS 11 HE1 LYS 11 -8.529 15.355 -7.633
90 HE3 LYS 11 HE2 LYS 11 -7.307 15.300 -6.299
91 HZ1 LYS 11 HZ1 LYS 11 -6.811 17.073 -7.832
92 HZ2 LYS 11 HZ2 LYS 11 -6.792 15.997 -9.147
93 HZ3 LYS 11 HZ3 LYS 11 -5.607 15.888 -7.961
94 H PHE 12 HN PHE 12 -4.101 12.263 -11.202
95 HA PHE 12 HA PHE 12 -4.258 14.098 -13.372
96 HB2 PHE 12 HB1 PHE 12 -3.878 16.242 -12.362
97 HB3 PHE 12 HB2 PHE 12 -5.422 15.570 -11.784
98 HD1 PHE 12 HD1 PHE 12 -4.018 17.937 -10.614
99 HD2 PHE 12 HD2 PHE 12 -3.732 13.766 -9.568
100 HE1 PHE 12 HE1 PHE 12 -3.430 18.545 -8.288
101 HE2 PHE 12 HE2 PHE 12 -3.148 14.383 -7.279
102 HZ PHE 12 HZ PHE 12 -2.996 16.766 -6.615
103 H GLY 13 HN GLY 13 -2.369 12.063 -11.617
104 HA2 GLY 13 HA1 GLY 13 0.120 13.492 -12.317
105 HA3 GLY 13 HA2 GLY 13 -0.081 12.122 -11.203
106 HA PRO 14 HA PRO 14 -0.454 9.136 -14.204
107 HB2 PRO 14 HB1 PRO 14 -1.140 9.233 -16.936
108 HB3 PRO 14 HB2 PRO 14 -2.335 9.355 -15.588
109 HG2 PRO 14 HG1 PRO 14 -0.992 11.704 -17.051
110 HG3 PRO 14 HG2 PRO 14 -2.766 11.409 -16.799
111 HD2 PRO 14 HD1 PRO 14 -1.408 13.024 -15.053
112 HD3 PRO 14 HD2 PRO 14 -2.574 11.774 -14.417
113 H LYS 15 HN LYS 15 1.371 11.685 -15.750
114 HA LYS 15 HA LYS 15 3.007 10.021 -17.311
115 HB2 LYS 15 HB1 LYS 15 3.227 12.868 -16.391
116 HB3 LYS 15 HB2 LYS 15 4.691 12.091 -17.061
117 HG2 LYS 15 HG1 LYS 15 2.007 12.075 -18.551
118 HG3 LYS 15 HG2 LYS 15 3.239 13.361 -18.744
119 HD2 LYS 15 HD1 LYS 15 4.923 11.755 -19.520
120 HD3 LYS 15 HD2 LYS 15 3.820 10.368 -19.241
121 HE2 LYS 15 HE1 LYS 15 2.265 11.166 -21.016
122 HE3 LYS 15 HE2 LYS 15 3.297 12.625 -21.289
123 HZ1 LYS 15 HZ1 LYS 15 3.719 10.822 -22.888
124 HZ2 LYS 15 HZ2 LYS 15 4.229 9.801 -21.645
125 HZ3 LYS 15 HZ3 LYS 15 5.092 11.207 -21.979
126 H LEU 16 HN LEU 16 3.446 10.834 -13.800
127 HA LEU 16 HA LEU 16 6.049 9.701 -13.821
128 HB2 LEU 16 HB1 LEU 16 6.295 10.072 -11.664
129 HB3 LEU 16 HB2 LEU 16 5.032 11.276 -12.002
130 HG LEU 16 HG LEU 16 4.570 8.492 -10.731
131 HD11 LEU 16 HD11 LEU 16 4.861 11.243 -9.385
132 HD12 LEU 16 HD12 LEU 16 6.058 9.896 -9.327
133 HD13 LEU 16 HD13 LEU 16 4.438 9.695 -8.567
134 HD21 LEU 16 HD21 LEU 16 2.412 9.464 -9.912
135 HD22 LEU 16 HD22 LEU 16 2.446 9.432 -11.711
136 HD23 LEU 16 HD23 LEU 16 2.736 10.977 -10.827
137 H PHE 17 HN PHE 17 2.862 8.274 -13.185
138 HA PHE 17 HA PHE 17 3.735 5.662 -12.607
139 HB2 PHE 17 HB1 PHE 17 1.446 6.537 -12.122
140 HB3 PHE 17 HB2 PHE 17 1.142 6.771 -13.875
141 HD1 PHE 17 HD1 PHE 17 2.524 3.843 -11.881
142 HD2 PHE 17 HD2 PHE 17 -0.614 5.338 -14.403
143 HE1 PHE 17 HE1 PHE 17 1.420 1.644 -11.808
144 HE2 PHE 17 HE2 PHE 17 -1.737 3.138 -14.312
145 HZ PHE 17 HZ PHE 17 -0.725 1.283 -13.000
146 H CYS 18 HN CYS 18 2.842 7.213 -15.702
147 HA CYS 18 HA CYS 18 3.268 5.039 -17.388
148 HB2 CYS 18 HB1 CYS 18 3.332 8.058 -17.681
149 HB3 CYS 18 HB2 CYS 18 3.839 7.069 -19.066
150 H LEU 19 HN LEU 19 5.779 7.494 -16.359
151 HA LEU 19 HA LEU 19 7.692 6.170 -18.035
152 HB2 LEU 19 HB1 LEU 19 9.344 7.697 -17.292
153 HB3 LEU 19 HB2 LEU 19 7.821 8.554 -17.641
154 HG LEU 19 HG LEU 19 7.483 8.258 -14.962
155 HD11 LEU 19 HD11 LEU 19 9.639 8.673 -13.777
156 HD12 LEU 19 HD12 LEU 19 10.547 8.509 -15.321
157 HD13 LEU 19 HD13 LEU 19 9.714 7.081 -14.612
158 HD21 LEU 19 HD21 LEU 19 8.363 10.581 -14.735
159 HD22 LEU 19 HD22 LEU 19 7.394 10.389 -16.243
160 HD23 LEU 19 HD23 LEU 19 9.199 10.429 -16.323
161 H VAL 20 HN VAL 20 7.083 6.026 -14.470
162 HA VAL 20 HA VAL 20 9.224 4.328 -13.907
163 HB VAL 20 HB VAL 20 6.557 4.766 -12.501
164 HG11 VAL 20 HG11 VAL 20 7.429 2.539 -11.743
165 HG12 VAL 20 HG12 VAL 20 9.078 3.239 -11.536
166 HG13 VAL 20 HG13 VAL 20 7.730 3.769 -10.471
167 HG21 VAL 20 HG21 VAL 20 8.000 6.146 -10.971
168 HG22 VAL 20 HG22 VAL 20 9.442 5.775 -11.980
169 HG23 VAL 20 HG23 VAL 20 8.097 6.769 -12.654
170 H THR 21 HN THR 21 5.911 3.514 -14.923
171 HA THR 21 HA THR 21 6.636 0.653 -14.810
172 HB THR 21 HB THR 21 4.336 0.082 -15.202
173 HG1 THR 21 HG1 THR 21 3.929 2.885 -15.150
174 HG21 THR 21 HG21 THR 21 3.422 0.918 -13.058
175 HG22 THR 21 HG22 THR 21 4.630 2.256 -13.015
176 HG23 THR 21 HG23 THR 21 5.173 0.548 -12.869
177 H LYS 22 HN LYS 22 7.633 2.637 -16.930
178 HA LYS 22 HA LYS 22 8.290 2.542 -19.001
179 HB2 LYS 22 HB1 LYS 22 9.089 0.352 -18.441
180 HB3 LYS 22 HB2 LYS 22 7.475 -0.367 -18.663
181 HG2 LYS 22 HG1 LYS 22 8.883 -1.086 -20.466
182 HG3 LYS 22 HG2 LYS 22 7.567 -0.060 -21.092
183 HD2 LYS 22 HD1 LYS 22 9.230 1.890 -21.166
184 HD3 LYS 22 HD2 LYS 22 10.530 0.725 -20.734
185 HE2 LYS 22 HE1 LYS 22 10.054 -0.593 -22.827
186 HE3 LYS 22 HE2 LYS 22 8.650 0.483 -23.199
187 HZ1 LYS 22 HZ1 LYS 22 10.162 2.330 -23.394
188 HZ2 LYS 22 HZ2 LYS 22 10.602 1.086 -24.457
189 HZ3 LYS 22 HZ3 LYS 22 11.499 1.344 -23.040
190 H LYS 23 HN LYS 23 4.948 1.903 -18.602
191 HA LYS 23 HA LYS 23 4.057 1.364 -21.084
192 HB2 LYS 23 HB1 LYS 23 2.642 3.146 -19.018
193 HB3 LYS 23 HB2 LYS 23 1.854 2.328 -20.409
194 HG2 LYS 23 HG1 LYS 23 2.692 0.108 -19.478
195 HG3 LYS 23 HG2 LYS 23 3.121 0.946 -17.963
196 HD2 LYS 23 HD1 LYS 23 0.339 0.938 -19.314
197 HD3 LYS 23 HD2 LYS 23 0.804 -0.220 -18.048
198 HE2 LYS 23 HE1 LYS 23 0.723 2.861 -17.617
199 HE3 LYS 23 HE2 LYS 23 -0.646 1.737 -17.263
200 HZ1 LYS 23 HZ1 LYS 23 0.633 2.121 -15.286
201 HZ2 LYS 23 HZ2 LYS 23 2.063 1.658 -16.026
202 HZ3 LYS 23 HZ3 LYS 23 0.859 0.512 -15.778
203 H CYS 24 HN CYS 24 4.685 4.743 -20.023
204 HA CYS 24 HA CYS 24 4.673 5.523 -22.795
205 HB2 CYS 24 HB1 CYS 24 2.769 7.146 -22.776
206 HB3 CYS 24 HB2 CYS 24 2.275 5.446 -22.659
Start of MODEL 19
1 H1 PHE 1 HN PHE 1 3.473 -0.289 -1.257
2 HA PHE 1 HA PHE 1 0.751 -1.161 -0.869
3 HB2 PHE 1 HB1 PHE 1 1.656 -0.276 1.365
4 HB3 PHE 1 HB2 PHE 1 1.946 1.306 0.574
5 HD1 PHE 1 HD1 PHE 1 0.216 2.897 0.739
6 HD2 PHE 1 HD2 PHE 1 -0.764 -1.263 1.159
7 HE1 PHE 1 HE1 PHE 1 -2.099 3.507 1.389
8 HE2 PHE 1 HE2 PHE 1 -3.080 -0.655 1.789
9 HZ PHE 1 HZ PHE 1 -3.746 1.730 1.914
10 H LEU 2 HN LEU 2 -0.773 0.109 -2.075
11 HA LEU 2 HA LEU 2 0.250 2.296 -3.665
12 HB2 LEU 2 HB1 LEU 2 0.264 1.305 -5.806
13 HB3 LEU 2 HB2 LEU 2 1.221 0.238 -4.754
14 HG LEU 2 HG LEU 2 -1.691 -0.281 -5.642
15 HD11 LEU 2 HD11 LEU 2 -0.700 -1.965 -7.174
16 HD12 LEU 2 HD12 LEU 2 0.957 -1.481 -6.651
17 HD13 LEU 2 HD13 LEU 2 -0.087 -0.307 -7.541
18 HD21 LEU 2 HD21 LEU 2 -1.245 -1.502 -3.523
19 HD22 LEU 2 HD22 LEU 2 0.323 -2.111 -4.181
20 HD23 LEU 2 HD23 LEU 2 -1.235 -2.654 -4.901
21 HA PRO 3 HA PRO 3 -4.307 1.796 -4.841
22 HB2 PRO 3 HB1 PRO 3 -6.134 2.084 -2.740
23 HB3 PRO 3 HB2 PRO 3 -5.523 0.488 -3.313
24 HG2 PRO 3 HG1 PRO 3 -4.459 2.146 -0.961
25 HG3 PRO 3 HG2 PRO 3 -4.901 0.393 -0.979
26 HD2 PRO 3 HD1 PRO 3 -2.300 1.239 -1.296
27 HD3 PRO 3 HD2 PRO 3 -2.937 -0.178 -2.258
28 H ILE 4 HN ILE 4 -3.312 3.818 -2.049
29 HA ILE 4 HA ILE 4 -4.525 6.183 -2.978
30 HB ILE 4 HB ILE 4 -2.960 7.373 -1.487
31 HG12 ILE 4 HG11 ILE 4 -1.809 4.568 -0.874
32 HG13 ILE 4 HG12 ILE 4 -0.944 5.880 -1.746
33 HG21 ILE 4 HG21 ILE 4 -5.174 6.375 -0.783
34 HG22 ILE 4 HG22 ILE 4 -4.316 4.880 -0.251
35 HG23 ILE 4 HG23 ILE 4 -3.986 6.451 0.557
36 HD11 ILE 4 HD1 ILE 4 -0.210 5.847 0.596
37 HD12 ILE 4 HD2 ILE 4 -1.133 7.359 0.286
38 HD13 ILE 4 HD3 ILE 4 -1.898 6.002 1.187
39 H LEU 5 HN LEU 5 -1.371 4.731 -3.726
40 HA LEU 5 HA LEU 5 -0.329 6.867 -5.236
41 HB2 LEU 5 HB1 LEU 5 0.900 4.940 -4.178
42 HB3 LEU 5 HB2 LEU 5 0.291 3.862 -5.464
43 HG LEU 5 HG LEU 5 1.915 6.402 -6.070
44 HD11 LEU 5 HD11 LEU 5 3.010 3.589 -5.430
45 HD12 LEU 5 HD12 LEU 5 3.198 5.062 -4.412
46 HD13 LEU 5 HD13 LEU 5 3.976 4.987 -6.033
47 HD21 LEU 5 HD21 LEU 5 0.898 5.349 -8.096
48 HD22 LEU 5 HD22 LEU 5 1.549 3.738 -7.599
49 HD23 LEU 5 HD23 LEU 5 2.672 5.063 -8.080
50 H ALA 6 HN ALA 6 -2.198 3.939 -6.217
51 HA ALA 6 HA ALA 6 -2.323 4.536 -8.948
52 HB1 ALA 6 HB1 ALA 6 -4.241 2.914 -8.939
53 HB2 ALA 6 HB2 ALA 6 -2.876 2.310 -7.929
54 HB3 ALA 6 HB3 ALA 6 -4.319 3.035 -7.139
55 H SER 7 HN SER 7 -4.569 5.463 -6.295
56 HA SER 7 HA SER 7 -6.415 6.850 -7.890
57 HB2 SER 7 HB1 SER 7 -6.779 6.136 -5.510
58 HB3 SER 7 HB2 SER 7 -5.640 7.414 -4.969
59 HG SER 7 HG1 SER 7 -7.924 7.993 -4.928
60 H LEU 8 HN LEU 8 -3.518 8.230 -6.132
61 HA LEU 8 HA LEU 8 -3.990 10.791 -7.216
62 HB2 LEU 8 HB1 LEU 8 -1.957 11.555 -6.269
63 HB3 LEU 8 HB2 LEU 8 -2.778 10.445 -5.136
64 HG LEU 8 HG LEU 8 -1.133 8.631 -6.188
65 HD11 LEU 8 HD11 LEU 8 0.466 11.256 -6.565
66 HD12 LEU 8 HD12 LEU 8 -0.031 10.141 -7.895
67 HD13 LEU 8 HD13 LEU 8 1.137 9.588 -6.644
68 HD21 LEU 8 HD21 LEU 8 -1.256 9.298 -3.800
69 HD22 LEU 8 HD22 LEU 8 -0.261 10.765 -4.137
70 HD23 LEU 8 HD23 LEU 8 0.458 9.123 -4.324
71 H ALA 9 HN ALA 9 -2.044 8.066 -8.468
72 HA ALA 9 HA ALA 9 -0.883 9.399 -10.616
73 HB1 ALA 9 HB1 ALA 9 -0.196 7.129 -9.882
74 HB2 ALA 9 HB2 ALA 9 -1.808 6.481 -10.336
75 HB3 ALA 9 HB3 ALA 9 -0.695 7.088 -11.617
76 H ALA 10 HN ALA 10 -4.093 7.706 -10.481
77 HA ALA 10 HA ALA 10 -4.824 8.377 -13.120
78 HB1 ALA 10 HB1 ALA 10 -6.537 7.827 -10.616
79 HB2 ALA 10 HB2 ALA 10 -7.130 7.772 -12.322
80 HB3 ALA 10 HB3 ALA 10 -5.907 6.580 -11.746
81 H LYS 11 HN LYS 11 -5.467 10.062 -10.021
82 HA LYS 11 HA LYS 11 -7.115 12.064 -10.987
83 HB2 LYS 11 HB1 LYS 11 -6.820 11.446 -8.600
84 HB3 LYS 11 HB2 LYS 11 -5.115 11.958 -8.667
85 HG2 LYS 11 HG1 LYS 11 -5.903 14.349 -9.090
86 HG3 LYS 11 HG2 LYS 11 -7.587 13.790 -8.814
87 HD2 LYS 11 HD1 LYS 11 -7.025 13.065 -6.523
88 HD3 LYS 11 HD2 LYS 11 -5.287 13.352 -6.790
89 HE2 LYS 11 HE1 LYS 11 -7.476 15.545 -6.701
90 HE3 LYS 11 HE2 LYS 11 -6.291 15.160 -5.388
91 HZ1 LYS 11 HZ1 LYS 11 -5.528 17.009 -6.701
92 HZ2 LYS 11 HZ2 LYS 11 -5.648 16.107 -8.136
93 HZ3 LYS 11 HZ3 LYS 11 -4.503 15.688 -6.977
94 H PHE 12 HN PHE 12 -3.542 12.201 -10.649
95 HA PHE 12 HA PHE 12 -3.383 14.253 -12.614
96 HB2 PHE 12 HB1 PHE 12 -2.623 16.181 -11.390
97 HB3 PHE 12 HB2 PHE 12 -4.276 15.740 -10.899
98 HD1 PHE 12 HD1 PHE 12 -2.610 17.706 -9.459
99 HD2 PHE 12 HD2 PHE 12 -2.898 13.443 -8.884
100 HE1 PHE 12 HE1 PHE 12 -1.994 17.971 -7.078
101 HE2 PHE 12 HE2 PHE 12 -2.295 13.726 -6.534
102 HZ PHE 12 HZ PHE 12 -1.838 15.977 -5.610
103 H GLY 13 HN GLY 13 -1.873 11.755 -11.099
104 HA2 GLY 13 HA1 GLY 13 0.821 12.756 -11.708
105 HA3 GLY 13 HA2 GLY 13 0.358 11.266 -10.860
106 HA PRO 14 HA PRO 14 -0.164 8.933 -14.350
107 HB2 PRO 14 HB1 PRO 14 -1.334 9.446 -16.827
108 HB3 PRO 14 HB2 PRO 14 -2.284 9.403 -15.293
109 HG2 PRO 14 HG1 PRO 14 -1.125 11.912 -16.642
110 HG3 PRO 14 HG2 PRO 14 -2.838 11.604 -16.128
111 HD2 PRO 14 HD1 PRO 14 -1.102 12.939 -14.454
112 HD3 PRO 14 HD2 PRO 14 -2.269 11.697 -13.809
113 H LYS 15 HN LYS 15 1.246 11.870 -15.650
114 HA LYS 15 HA LYS 15 2.838 10.606 -17.635
115 HB2 LYS 15 HB1 LYS 15 2.375 13.048 -17.636
116 HB3 LYS 15 HB2 LYS 15 3.301 13.230 -16.125
117 HG2 LYS 15 HG1 LYS 15 4.599 13.978 -18.105
118 HG3 LYS 15 HG2 LYS 15 5.404 12.654 -17.227
119 HD2 LYS 15 HD1 LYS 15 5.663 12.366 -19.629
120 HD3 LYS 15 HD2 LYS 15 4.739 11.009 -18.926
121 HE2 LYS 15 HE1 LYS 15 2.584 12.027 -19.810
122 HE3 LYS 15 HE2 LYS 15 3.536 13.397 -20.511
123 HZ1 LYS 15 HZ1 LYS 15 3.873 10.511 -21.187
124 HZ2 LYS 15 HZ2 LYS 15 4.723 11.808 -21.872
125 HZ3 LYS 15 HZ3 LYS 15 3.056 11.662 -22.128
126 H LEU 16 HN LEU 16 3.465 11.287 -14.160
127 HA LEU 16 HA LEU 16 6.104 10.238 -14.165
128 HB2 LEU 16 HB1 LEU 16 5.145 11.812 -12.478
129 HB3 LEU 16 HB2 LEU 16 4.007 10.556 -11.921
130 HG LEU 16 HG LEU 16 6.025 11.064 -10.480
131 HD11 LEU 16 HD11 LEU 16 5.852 8.098 -11.272
132 HD12 LEU 16 HD12 LEU 16 4.699 8.969 -10.185
133 HD13 LEU 16 HD13 LEU 16 6.431 8.796 -9.724
134 HD21 LEU 16 HD21 LEU 16 7.756 11.271 -12.272
135 HD22 LEU 16 HD22 LEU 16 7.649 9.492 -12.574
136 HD23 LEU 16 HD23 LEU 16 8.225 10.102 -10.985
137 H PHE 17 HN PHE 17 2.891 8.832 -13.422
138 HA PHE 17 HA PHE 17 3.790 6.294 -12.745
139 HB2 PHE 17 HB1 PHE 17 1.486 7.359 -12.349
140 HB3 PHE 17 HB2 PHE 17 1.091 7.008 -14.068
141 HD1 PHE 17 HD1 PHE 17 2.365 5.351 -10.909
142 HD2 PHE 17 HD2 PHE 17 0.088 4.928 -14.525
143 HE1 PHE 17 HE1 PHE 17 1.655 3.095 -10.194
144 HE2 PHE 17 HE2 PHE 17 -0.633 2.670 -13.804
145 HZ PHE 17 HZ PHE 17 0.153 1.750 -11.637
146 H CYS 18 HN CYS 18 2.836 7.500 -16.024
147 HA CYS 18 HA CYS 18 3.320 5.017 -17.256
148 HB2 CYS 18 HB1 CYS 18 3.043 5.984 -19.369
149 HB3 CYS 18 HB2 CYS 18 1.878 6.766 -18.266
150 H LEU 19 HN LEU 19 5.617 7.714 -16.588
151 HA LEU 19 HA LEU 19 7.760 6.511 -18.025
152 HB2 LEU 19 HB1 LEU 19 7.619 8.439 -15.650
153 HB3 LEU 19 HB2 LEU 19 9.176 7.954 -16.390
154 HG LEU 19 HG LEU 19 6.932 9.235 -18.035
155 HD11 LEU 19 HD11 LEU 19 8.121 11.418 -17.726
156 HD12 LEU 19 HD12 LEU 19 9.241 10.638 -16.548
157 HD13 LEU 19 HD13 LEU 19 7.485 10.774 -16.164
158 HD21 LEU 19 HD21 LEU 19 9.994 9.077 -18.437
159 HD22 LEU 19 HD22 LEU 19 8.818 9.841 -19.563
160 HD23 LEU 19 HD23 LEU 19 8.795 8.053 -19.302
161 H VAL 20 HN VAL 20 6.930 6.360 -14.500
162 HA VAL 20 HA VAL 20 9.041 4.651 -13.838
163 HB VAL 20 HB VAL 20 6.381 5.221 -12.467
164 HG11 VAL 20 HG11 VAL 20 7.542 4.333 -10.380
165 HG12 VAL 20 HG12 VAL 20 7.220 3.032 -11.574
166 HG13 VAL 20 HG13 VAL 20 8.881 3.718 -11.411
167 HG21 VAL 20 HG21 VAL 20 7.950 7.187 -12.748
168 HG22 VAL 20 HG22 VAL 20 7.857 6.671 -11.028
169 HG23 VAL 20 HG23 VAL 20 9.284 6.216 -12.021
170 H THR 21 HN THR 21 5.666 3.810 -14.728
171 HA THR 21 HA THR 21 6.402 0.974 -14.414
172 HB THR 21 HB THR 21 4.138 0.366 -14.460
173 HG1 THR 21 HG1 THR 21 3.494 3.101 -14.764
174 HG21 THR 21 HG21 THR 21 3.299 1.567 -12.468
175 HG22 THR 21 HG22 THR 21 4.452 2.918 -12.735
176 HG23 THR 21 HG23 THR 21 5.070 1.282 -12.306
177 H LYS 22 HN LYS 22 7.145 2.856 -16.735
178 HA LYS 22 HA LYS 22 7.465 2.799 -18.863
179 HB2 LYS 22 HB1 LYS 22 8.813 0.896 -17.949
180 HB3 LYS 22 HB2 LYS 22 7.537 -0.218 -18.516
181 HG2 LYS 22 HG1 LYS 22 9.337 -0.276 -20.113
182 HG3 LYS 22 HG2 LYS 22 7.960 0.559 -20.892
183 HD2 LYS 22 HD1 LYS 22 9.127 2.798 -20.164
184 HD3 LYS 22 HD2 LYS 22 10.566 1.810 -19.807
185 HE2 LYS 22 HE1 LYS 22 9.096 2.133 -22.528
186 HE3 LYS 22 HE2 LYS 22 10.687 2.861 -22.081
187 HZ1 LYS 22 HZ1 LYS 22 11.579 0.622 -21.871
188 HZ2 LYS 22 HZ2 LYS 22 10.931 0.874 -23.422
189 HZ3 LYS 22 HZ3 LYS 22 10.074 -0.045 -22.283
190 H LYS 23 HN LYS 23 5.034 3.523 -18.958
191 HA LYS 23 HA LYS 23 4.113 2.166 -21.452
192 HB2 LYS 23 HB1 LYS 23 2.475 3.638 -19.350
193 HB3 LYS 23 HB2 LYS 23 2.020 3.784 -21.069
194 HG2 LYS 23 HG1 LYS 23 0.665 2.047 -20.215
195 HG3 LYS 23 HG2 LYS 23 1.841 1.364 -21.368
196 HD2 LYS 23 HD1 LYS 23 1.578 -0.163 -19.496
197 HD3 LYS 23 HD2 LYS 23 3.233 0.511 -19.481
198 HE2 LYS 23 HE1 LYS 23 2.459 2.199 -17.699
199 HE3 LYS 23 HE2 LYS 23 0.859 1.360 -17.659
200 HZ1 LYS 23 HZ1 LYS 23 2.497 0.696 -15.982
201 HZ2 LYS 23 HZ2 LYS 23 3.505 0.105 -17.154
202 HZ3 LYS 23 HZ3 LYS 23 1.988 -0.647 -16.927
203 H CYS 24 HN CYS 24 5.952 4.705 -20.229
204 HA CYS 24 HA CYS 24 5.490 6.279 -22.698
205 HB2 CYS 24 HB2 CYS 24 7.076 6.916 -20.159
206 HB3 CYS 24 HB1 CYS 24 7.106 7.933 -21.637
Start of MODEL 20
1 H1 PHE 1 HN PHE 1 0.171 -0.659 0.994
2 HA PHE 1 HA PHE 1 1.009 1.619 0.794
3 HB2 PHE 1 HB1 PHE 1 2.499 -0.410 -1.017
4 HB3 PHE 1 HB2 PHE 1 3.224 1.091 -0.315
5 HD1 PHE 1 HD1 PHE 1 3.128 1.347 2.264
6 HD2 PHE 1 HD2 PHE 1 2.579 -2.403 0.233
7 HE1 PHE 1 HE1 PHE 1 3.676 0.134 4.350
8 HE2 PHE 1 HE2 PHE 1 3.131 -3.612 2.325
9 HZ PHE 1 HZ PHE 1 3.677 -2.344 4.383
10 H LEU 2 HN LEU 2 0.060 0.014 -2.185
11 HA LEU 2 HA LEU 2 0.489 2.458 -3.708
12 HB2 LEU 2 HB1 LEU 2 0.377 1.192 -5.667
13 HB3 LEU 2 HB2 LEU 2 1.364 0.270 -4.503
14 HG LEU 2 HG LEU 2 -1.591 -0.315 -5.182
15 HD11 LEU 2 HD11 LEU 2 -0.092 -0.624 -7.142
16 HD12 LEU 2 HD12 LEU 2 -0.703 -2.205 -6.524
17 HD13 LEU 2 HD13 LEU 2 0.985 -1.689 -6.158
18 HD21 LEU 2 HD21 LEU 2 0.474 -1.975 -3.592
19 HD22 LEU 2 HD22 LEU 2 -1.120 -2.579 -4.166
20 HD23 LEU 2 HD23 LEU 2 -1.061 -1.264 -2.950
21 HA PRO 3 HA PRO 3 -4.081 1.864 -4.694
22 HB2 PRO 3 HB1 PRO 3 -5.954 2.120 -2.637
23 HB3 PRO 3 HB2 PRO 3 -5.213 0.546 -3.112
24 HG2 PRO 3 HG1 PRO 3 -4.329 2.398 -0.833
25 HG3 PRO 3 HG2 PRO 3 -4.631 0.617 -0.772
26 HD2 PRO 3 HD1 PRO 3 -2.096 1.659 -1.094
27 HD3 PRO 3 HD2 PRO 3 -2.595 0.142 -1.970
28 H ILE 4 HN ILE 4 -3.362 4.076 -1.937
29 HA ILE 4 HA ILE 4 -4.711 6.282 -3.039
30 HB ILE 4 HB ILE 4 -3.544 7.679 -1.503
31 HG12 ILE 4 HG11 ILE 4 -1.241 6.803 -1.514
32 HG13 ILE 4 HG12 ILE 4 -1.927 6.960 0.115
33 HG21 ILE 4 HG21 ILE 4 -4.380 6.630 0.573
34 HG22 ILE 4 HG22 ILE 4 -5.526 6.369 -0.789
35 HG23 ILE 4 HG23 ILE 4 -4.469 5.023 -0.223
36 HD11 ILE 4 HD1 ILE 4 -1.490 4.293 -1.389
37 HD12 ILE 4 HD2 ILE 4 -0.595 4.922 0.023
38 HD13 ILE 4 HD3 ILE 4 -2.313 4.456 0.219
39 H LEU 5 HN LEU 5 -1.384 5.110 -3.443
40 HA LEU 5 HA LEU 5 -0.406 7.218 -4.998
41 HB2 LEU 5 HB1 LEU 5 0.831 5.359 -3.796
42 HB3 LEU 5 HB2 LEU 5 0.393 4.249 -5.122
43 HG LEU 5 HG LEU 5 1.937 6.876 -5.571
44 HD11 LEU 5 HD11 LEU 5 3.103 4.097 -4.914
45 HD12 LEU 5 HD12 LEU 5 3.134 5.544 -3.842
46 HD13 LEU 5 HD13 LEU 5 4.048 5.557 -5.393
47 HD21 LEU 5 HD21 LEU 5 1.134 5.844 -7.694
48 HD22 LEU 5 HD22 LEU 5 1.801 4.242 -7.187
49 HD23 LEU 5 HD23 LEU 5 2.910 5.619 -7.541
50 H ALA 6 HN ALA 6 -2.025 4.149 -6.024
51 HA ALA 6 HA ALA 6 -2.015 4.696 -8.770
52 HB1 ALA 6 HB1 ALA 6 -3.814 2.941 -8.850
53 HB2 ALA 6 HB2 ALA 6 -2.473 2.450 -7.747
54 HB3 ALA 6 HB3 ALA 6 -4.007 3.082 -7.060
55 H SER 7 HN SER 7 -4.465 5.511 -6.272
56 HA SER 7 HA SER 7 -6.315 6.720 -8.001
57 HB2 SER 7 HB1 SER 7 -6.743 6.036 -5.611
58 HB3 SER 7 HB2 SER 7 -5.766 7.439 -5.063
59 HG SER 7 HG1 SER 7 -8.058 7.845 -5.158
60 H LEU 8 HN LEU 8 -3.641 8.352 -6.110
61 HA LEU 8 HA LEU 8 -4.229 10.852 -7.263
62 HB2 LEU 8 HB1 LEU 8 -2.358 11.774 -6.173
63 HB3 LEU 8 HB2 LEU 8 -3.119 10.570 -5.103
64 HG LEU 8 HG LEU 8 -1.250 8.938 -6.078
65 HD11 LEU 8 HD11 LEU 8 -0.216 10.568 -7.717
66 HD12 LEU 8 HD12 LEU 8 0.936 10.120 -6.410
67 HD13 LEU 8 HD13 LEU 8 0.097 11.711 -6.356
68 HD21 LEU 8 HD21 LEU 8 0.188 9.564 -4.131
69 HD22 LEU 8 HD22 LEU 8 -1.560 9.566 -3.696
70 HD23 LEU 8 HD23 LEU 8 -0.698 11.126 -3.974
71 H ALA 9 HN ALA 9 -2.043 8.255 -8.350
72 HA ALA 9 HA ALA 9 -0.843 9.613 -10.457
73 HB1 ALA 9 HB1 ALA 9 -0.448 7.319 -11.404
74 HB2 ALA 9 HB2 ALA 9 -0.078 7.400 -9.640
75 HB3 ALA 9 HB3 ALA 9 -1.612 6.650 -10.197
76 H ALA 10 HN ALA 10 -3.986 7.795 -10.452
77 HA ALA 10 HA ALA 10 -4.620 8.477 -13.134
78 HB1 ALA 10 HB1 ALA 10 -6.421 7.809 -10.724
79 HB2 ALA 10 HB2 ALA 10 -6.935 7.782 -12.455
80 HB3 ALA 10 HB3 ALA 10 -5.703 6.612 -11.853
81 H LYS 11 HN LYS 11 -5.425 10.060 -10.020
82 HA LYS 11 HA LYS 11 -7.133 11.959 -11.057
83 HB2 LYS 11 HB1 LYS 11 -6.951 11.133 -8.712
84 HB3 LYS 11 HB2 LYS 11 -5.482 12.113 -8.472
85 HG2 LYS 11 HG1 LYS 11 -8.146 13.360 -9.367
86 HG3 LYS 11 HG2 LYS 11 -7.881 12.932 -7.659
87 HD2 LYS 11 HD1 LYS 11 -6.372 14.574 -7.209
88 HD3 LYS 11 HD2 LYS 11 -5.602 14.497 -8.800
89 HE2 LYS 11 HE1 LYS 11 -8.268 15.944 -8.176
90 HE3 LYS 11 HE2 LYS 11 -6.653 16.700 -8.493
91 HZ1 LYS 11 HZ1 LYS 11 -8.442 15.263 -10.353
92 HZ2 LYS 11 HZ2 LYS 11 -6.801 15.299 -10.656
93 HZ3 LYS 11 HZ3 LYS 11 -7.660 16.761 -10.556
94 H PHE 12 HN PHE 12 -3.604 12.339 -10.534
95 HA PHE 12 HA PHE 12 -3.583 14.305 -12.612
96 HB2 PHE 12 HB1 PHE 12 -2.499 16.209 -11.285
97 HB3 PHE 12 HB2 PHE 12 -4.254 15.961 -11.099
98 HD1 PHE 12 HD1 PHE 12 -4.100 17.467 -9.152
99 HD2 PHE 12 HD2 PHE 12 -2.011 13.692 -9.165
100 HE1 PHE 12 HE1 PHE 12 -3.867 17.566 -6.688
101 HE2 PHE 12 HE2 PHE 12 -1.774 13.825 -6.740
102 HZ PHE 12 HZ PHE 12 -2.714 15.737 -5.482
103 H GLY 13 HN GLY 13 -1.974 11.828 -11.176
104 HA2 GLY 13 HA1 GLY 13 0.687 12.889 -11.834
105 HA3 GLY 13 HA2 GLY 13 0.278 11.405 -10.951
106 HA PRO 14 HA PRO 14 -0.245 9.069 -14.484
107 HB2 PRO 14 HB1 PRO 14 -1.269 9.655 -17.017
108 HB3 PRO 14 HB2 PRO 14 -2.297 9.552 -15.536
109 HG2 PRO 14 HG1 PRO 14 -1.088 12.106 -16.744
110 HG3 PRO 14 HG2 PRO 14 -2.821 11.780 -16.318
111 HD2 PRO 14 HD1 PRO 14 -1.170 13.068 -14.531
112 HD3 PRO 14 HD2 PRO 14 -2.344 11.792 -13.963
113 H LYS 15 HN LYS 15 1.270 12.003 -15.736
114 HA LYS 15 HA LYS 15 2.760 10.729 -17.766
115 HB2 LYS 15 HB1 LYS 15 2.245 13.286 -17.192
116 HB3 LYS 15 HB2 LYS 15 3.861 13.235 -16.445
117 HG2 LYS 15 HG1 LYS 15 3.157 12.416 -19.350
118 HG3 LYS 15 HG2 LYS 15 3.676 14.060 -18.863
119 HD2 LYS 15 HD1 LYS 15 5.908 13.193 -18.155
120 HD3 LYS 15 HD2 LYS 15 5.390 11.521 -18.495
121 HE2 LYS 15 HE1 LYS 15 6.838 12.300 -20.316
122 HE3 LYS 15 HE2 LYS 15 5.166 11.988 -20.924
123 HZ1 LYS 15 HZ1 LYS 15 6.075 14.045 -21.783
124 HZ2 LYS 15 HZ2 LYS 15 6.298 14.657 -20.219
125 HZ3 LYS 15 HZ3 LYS 15 4.734 14.356 -20.799
126 H LEU 16 HN LEU 16 3.702 11.408 -14.317
127 HA LEU 16 HA LEU 16 6.237 10.146 -14.638
128 HB2 LEU 16 HB1 LEU 16 6.373 10.116 -12.174
129 HB3 LEU 16 HB2 LEU 16 6.155 11.732 -12.879
130 HG LEU 16 HG LEU 16 3.684 10.249 -11.875
131 HD11 LEU 16 HD11 LEU 16 4.092 11.112 -9.581
132 HD12 LEU 16 HD12 LEU 16 5.718 11.705 -10.077
133 HD13 LEU 16 HD13 LEU 16 5.366 9.937 -10.069
134 HD21 LEU 16 HD21 LEU 16 4.582 13.213 -11.845
135 HD22 LEU 16 HD22 LEU 16 3.025 12.587 -11.209
136 HD23 LEU 16 HD23 LEU 16 3.363 12.499 -12.973
137 H PHE 17 HN PHE 17 3.040 8.959 -13.551
138 HA PHE 17 HA PHE 17 3.825 6.389 -12.837
139 HB2 PHE 17 HB1 PHE 17 1.603 7.464 -12.355
140 HB3 PHE 17 HB2 PHE 17 1.214 7.445 -14.105
141 HD1 PHE 17 HD1 PHE 17 2.645 4.732 -11.861
142 HD2 PHE 17 HD2 PHE 17 -0.683 6.083 -14.221
143 HE1 PHE 17 HE1 PHE 17 1.475 2.614 -11.423
144 HE2 PHE 17 HE2 PHE 17 -1.871 3.966 -13.756
145 HZ PHE 17 HZ PHE 17 -0.793 2.224 -12.345
146 H CYS 18 HN CYS 18 2.861 7.635 -16.047
147 HA CYS 18 HA CYS 18 3.050 5.309 -17.547
148 HB2 CYS 18 HB1 CYS 18 2.017 7.469 -18.261
149 HB3 CYS 18 HB2 CYS 18 3.619 8.248 -18.260
150 H LEU 19 HN LEU 19 5.679 7.685 -16.767
151 HA LEU 19 HA LEU 19 7.641 6.268 -18.272
152 HB2 LEU 19 HB1 LEU 19 7.843 8.281 -15.966
153 HB3 LEU 19 HB2 LEU 19 9.256 7.711 -16.908
154 HG LEU 19 HG LEU 19 6.852 9.153 -18.167
155 HD11 LEU 19 HD11 LEU 19 7.948 10.635 -16.500
156 HD12 LEU 19 HD12 LEU 19 8.313 11.191 -18.180
157 HD13 LEU 19 HD13 LEU 19 9.559 10.296 -17.234
158 HD21 LEU 19 HD21 LEU 19 8.449 9.555 -20.062
159 HD22 LEU 19 HD22 LEU 19 8.200 7.792 -19.783
160 HD23 LEU 19 HD23 LEU 19 9.707 8.593 -19.203
161 H VAL 20 HN VAL 20 6.985 6.352 -14.713
162 HA VAL 20 HA VAL 20 9.088 4.656 -14.025
163 HB VAL 20 HB VAL 20 6.497 5.372 -12.589
164 HG11 VAL 20 HG11 VAL 20 7.729 4.620 -10.490
165 HG12 VAL 20 HG12 VAL 20 7.343 3.240 -11.571
166 HG13 VAL 20 HG13 VAL 20 9.016 3.909 -11.524
167 HG21 VAL 20 HG21 VAL 20 8.038 6.904 -11.324
168 HG22 VAL 20 HG22 VAL 20 9.429 6.342 -12.314
169 HG23 VAL 20 HG23 VAL 20 8.098 7.283 -13.082
170 H THR 21 HN THR 21 5.715 3.833 -14.806
171 HA THR 21 HA THR 21 6.410 0.974 -14.374
172 HB THR 21 HB THR 21 4.050 0.444 -14.318
173 HG1 THR 21 HG1 THR 21 3.785 3.265 -14.489
174 HG21 THR 21 HG21 THR 21 3.576 1.482 -12.115
175 HG22 THR 21 HG22 THR 21 4.828 2.747 -12.395
176 HG23 THR 21 HG23 THR 21 5.314 1.025 -12.216
177 H LYS 22 HN LYS 22 7.041 2.741 -16.756
178 HA LYS 22 HA LYS 22 7.222 2.546 -18.913
179 HB2 LYS 22 HB1 LYS 22 8.680 0.860 -18.006
180 HB3 LYS 22 HB2 LYS 22 7.382 -0.363 -18.080
181 HG2 LYS 22 HG1 LYS 22 9.148 -0.621 -19.850
182 HG3 LYS 22 HG2 LYS 22 7.482 -0.512 -20.464
183 HD2 LYS 22 HD1 LYS 22 7.897 1.962 -20.989
184 HD3 LYS 22 HD2 LYS 22 9.628 1.696 -20.572
185 HE2 LYS 22 HE1 LYS 22 9.772 -0.035 -22.421
186 HE3 LYS 22 HE2 LYS 22 8.003 0.166 -22.737
187 HZ1 LYS 22 HZ1 LYS 22 8.461 2.516 -23.223
188 HZ2 LYS 22 HZ2 LYS 22 9.216 1.454 -24.299
189 HZ3 LYS 22 HZ3 LYS 22 10.119 2.234 -23.089
190 H LYS 23 HN LYS 23 4.725 3.267 -18.840
191 HA LYS 23 HA LYS 23 3.489 1.613 -20.999
192 HB2 LYS 23 HB1 LYS 23 2.271 3.802 -19.234
193 HB3 LYS 23 HB2 LYS 23 1.561 3.272 -20.788
194 HG2 LYS 23 HG1 LYS 23 0.351 1.869 -19.509
195 HG3 LYS 23 HG2 LYS 23 1.759 0.830 -19.832
196 HD2 LYS 23 HD1 LYS 23 1.299 0.528 -17.557
197 HD3 LYS 23 HD2 LYS 23 2.718 1.614 -17.549
198 HE2 LYS 23 HE1 LYS 23 1.255 3.581 -17.043
199 HE3 LYS 23 HE2 LYS 23 -0.229 2.570 -17.274
200 HZ1 LYS 23 HZ1 LYS 23 0.489 1.205 -15.404
201 HZ2 LYS 23 HZ2 LYS 23 0.357 2.836 -14.924
202 HZ3 LYS 23 HZ3 LYS 23 1.863 2.158 -15.212
203 H CYS 24 HN CYS 24 5.583 4.260 -20.515
204 HA CYS 24 HA CYS 24 4.702 5.627 -22.934
205 HB2 CYS 24 HB1 CYS 24 7.114 6.107 -21.121
206 HB3 CYS 24 HB2 CYS 24 6.699 7.109 -22.553