Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
637036 | 6dhr RC | 30470 | cing | 1-original | 4 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 H1 GLY 1 HN GLY 1 -6.912 3.858 -1.364
2 HA2 GLY 1 2HA GLY 1 -6.607 6.283 -1.126
3 HA3 GLY 1 1HA GLY 1 -8.266 6.361 -0.561
4 H LEU 2 HN LEU 2 -7.794 3.914 1.131
5 HA LEU 2 HA LEU 2 -6.364 5.353 3.268
6 HB2 LEU 2 2HB LEU 2 -8.656 3.407 3.446
7 HB3 LEU 2 1HB LEU 2 -7.743 3.934 4.842
8 HG LEU 2 HG LEU 2 -9.416 5.697 3.052
9 HD11 LEU 2 1HD1 LEU 2 -10.748 4.200 4.450
10 HD12 LEU 2 2HD1 LEU 2 -10.887 5.870 4.996
11 HD13 LEU 2 3HD1 LEU 2 -9.862 4.736 5.877
12 HD21 LEU 2 1HD2 LEU 2 -7.873 6.325 5.571
13 HD22 LEU 2 2HD2 LEU 2 -9.006 7.413 4.782
14 HD23 LEU 2 3HD2 LEU 2 -7.529 6.938 3.951
15 HA PRO 3 HA PRO 3 -3.425 2.040 3.416
16 HB2 PRO 3 2HB PRO 3 -2.451 2.318 5.906
17 HB3 PRO 3 1HB PRO 3 -2.193 3.563 4.680
18 HG2 PRO 3 2HG PRO 3 -4.249 3.471 6.859
19 HG3 PRO 3 1HG PRO 3 -3.175 4.805 6.401
20 HD2 PRO 3 2HD PRO 3 -5.743 4.679 5.577
21 HD3 PRO 3 1HD PRO 3 -4.459 5.385 4.575
22 H ILE 4 HN ILE 4 -5.939 1.071 3.671
23 HA ILE 4 HA ILE 4 -6.585 -0.387 6.011
24 HB ILE 4 HB ILE 4 -7.453 -0.834 3.143
25 HG12 ILE 4 2HG1 ILE 4 -7.954 1.427 3.840
26 HG13 ILE 4 1HG1 ILE 4 -9.443 0.501 3.727
27 HG21 ILE 4 1HG2 ILE 4 -7.957 -2.769 4.495
28 HG22 ILE 4 2HG2 ILE 4 -9.433 -1.913 4.040
29 HG23 ILE 4 3HG2 ILE 4 -8.786 -1.747 5.675
30 HD11 ILE 4 1HD1 ILE 4 -7.971 1.215 6.254
31 HD12 ILE 4 2HD1 ILE 4 -9.438 0.245 6.170
32 HD13 ILE 4 3HD1 ILE 4 -9.470 1.939 5.671
33 H CYS 5 HN CYS 5 -4.472 -1.023 3.357
34 HA CYS 5 HA CYS 5 -4.508 -3.831 3.298
35 HB2 CYS 5 2HB CYS 5 -2.146 -2.082 2.596
36 HB3 CYS 5 1HB CYS 5 -2.559 -3.662 1.943
37 H GLY 6 HN GLY 6 -2.638 -1.542 5.222
38 HA2 GLY 6 2HA GLY 6 -1.459 -1.895 7.176
39 HA3 GLY 6 1HA GLY 6 -1.939 -3.592 7.117
40 H GLU 7 HN GLU 7 -0.403 -1.798 4.554
41 HA GLU 7 HA GLU 7 2.023 -3.371 4.891
42 HB2 GLU 7 2HB GLU 7 0.529 -2.933 2.316
43 HB3 GLU 7 1HB GLU 7 2.135 -3.620 2.439
44 HG2 GLU 7 2HG GLU 7 1.190 -5.469 3.758
45 HG3 GLU 7 1HG GLU 7 -0.421 -4.791 3.488
46 H THR 8 HN THR 8 3.844 -2.417 4.129
47 HA THR 8 HA THR 8 3.640 0.406 3.460
48 HB THR 8 HB THR 8 6.131 0.269 4.161
49 HG1 THR 8 1HG THR 8 5.171 -1.849 5.751
50 HG21 THR 8 1HG2 THR 8 3.928 0.074 6.229
51 HG22 THR 8 2HG2 THR 8 4.477 1.542 5.417
52 HG23 THR 8 3HG2 THR 8 5.554 0.690 6.526
53 H CYS 9 HN CYS 9 5.055 1.087 1.734
54 HA CYS 9 HA CYS 9 6.206 -1.128 0.387
55 HB2 CYS 9 2HB CYS 9 5.373 -0.439 -1.835
56 HB3 CYS 9 1HB CYS 9 4.088 -0.908 -0.743
57 H LEU 10 HN LEU 10 8.062 -0.463 1.199
58 HA LEU 10 HA LEU 10 9.156 2.084 0.420
59 HB2 LEU 10 2HB LEU 10 9.673 0.927 2.595
60 HB3 LEU 10 1HB LEU 10 10.510 -0.303 1.674
61 HG LEU 10 HG LEU 10 12.098 1.416 0.874
62 HD11 LEU 10 1HD1 LEU 10 10.672 3.360 1.074
63 HD12 LEU 10 2HD1 LEU 10 12.145 3.584 2.022
64 HD13 LEU 10 3HD1 LEU 10 10.624 3.170 2.822
65 HD21 LEU 10 1HD2 LEU 10 13.256 1.677 3.033
66 HD22 LEU 10 2HD2 LEU 10 12.674 0.036 2.758
67 HD23 LEU 10 3HD2 LEU 10 11.799 1.108 3.852
68 H LEU 11 HN LEU 11 9.358 -1.305 -0.383
69 HA LEU 11 HA LEU 11 11.241 -0.923 -2.542
70 HB2 LEU 11 2HB LEU 11 9.514 -3.315 -1.850
71 HB3 LEU 11 1HB LEU 11 10.828 -3.298 -3.001
72 HG LEU 11 HG LEU 11 11.148 -2.858 -0.034
73 HD11 LEU 11 1HD1 LEU 11 10.445 -5.124 -0.492
74 HD12 LEU 11 2HD1 LEU 11 12.149 -5.098 -0.033
75 HD13 LEU 11 3HD1 LEU 11 11.690 -5.286 -1.726
76 HD21 LEU 11 1HD2 LEU 11 13.538 -3.148 -0.502
77 HD22 LEU 11 2HD2 LEU 11 12.880 -1.751 -1.348
78 HD23 LEU 11 3HD2 LEU 11 13.187 -3.249 -2.227
79 H GLY 12 HN GLY 12 7.819 -1.201 -2.035
80 HA2 GLY 12 2HA GLY 12 6.429 0.208 -3.481
81 HA3 GLY 12 1HA GLY 12 7.476 -0.261 -4.802
82 H LYS 13 HN LYS 13 6.287 -2.642 -2.468
83 HA LYS 13 HA LYS 13 4.309 -3.439 -4.442
84 HB2 LYS 13 2HB LYS 13 6.301 -4.800 -4.870
85 HB3 LYS 13 1HB LYS 13 6.289 -5.354 -3.199
86 HG2 LYS 13 2HG LYS 13 4.165 -6.453 -3.539
87 HG3 LYS 13 1HG LYS 13 4.071 -5.822 -5.179
88 HD2 LYS 13 2HD LYS 13 6.073 -7.110 -5.773
89 HD3 LYS 13 1HD LYS 13 6.137 -7.750 -4.125
90 HE2 LYS 13 2HE LYS 13 3.977 -8.780 -4.398
91 HE3 LYS 13 1HE LYS 13 3.804 -8.066 -5.998
92 HZ1 LYS 13 1HZ LYS 13 4.462 -10.373 -6.137
93 HZ2 LYS 13 2HZ LYS 13 5.842 -10.092 -5.217
94 HZ3 LYS 13 3HZ LYS 13 5.691 -9.387 -6.729
95 H CYS 14 HN CYS 14 2.454 -4.165 -3.694
96 HA CYS 14 HA CYS 14 2.123 -4.558 -0.811
97 HB2 CYS 14 2HB CYS 14 0.095 -3.483 -2.790
98 HB3 CYS 14 1HB CYS 14 -0.043 -3.517 -1.035
99 H TYR 15 HN TYR 15 0.860 -6.389 -0.318
100 HA TYR 15 HA TYR 15 0.521 -8.178 -2.596
101 HB2 TYR 15 2HB TYR 15 0.752 -8.760 0.349
102 HB3 TYR 15 1HB TYR 15 0.394 -9.990 -0.859
103 HD1 TYR 15 1HD TYR 15 2.079 -10.815 -2.328
104 HD2 TYR 15 2HD TYR 15 2.972 -7.639 0.347
105 HE1 TYR 15 1HE TYR 15 4.442 -11.075 -2.830
106 HE2 TYR 15 2HE TYR 15 5.366 -7.891 -0.143
107 HH TYR 15 HH TYR 15 6.942 -9.496 -1.060
108 H THR 16 HN THR 16 -1.276 -6.594 -0.111
109 HA THR 16 HA THR 16 -3.647 -8.027 -0.114
110 HB THR 16 HB THR 16 -3.244 -5.027 0.105
111 HG1 THR 16 1HG THR 16 -2.047 -6.013 1.621
112 HG21 THR 16 1HG2 THR 16 -5.538 -6.746 1.097
113 HG22 THR 16 2HG2 THR 16 -5.618 -5.590 -0.230
114 HG23 THR 16 3HG2 THR 16 -5.338 -5.024 1.416
115 HA PRO 17 HA PRO 17 -5.052 -7.351 -4.351
116 HB2 PRO 17 2HB PRO 17 -7.664 -8.101 -3.946
117 HB3 PRO 17 1HB PRO 17 -6.340 -9.241 -4.210
118 HG2 PRO 17 2HG PRO 17 -7.621 -8.389 -1.653
119 HG3 PRO 17 1HG PRO 17 -7.090 -10.002 -2.163
120 HD2 PRO 17 2HD PRO 17 -5.660 -8.484 -0.469
121 HD3 PRO 17 1HD PRO 17 -4.884 -9.574 -1.636
122 H GLY 18 HN GLY 18 -5.817 -5.584 -5.332
123 HA2 GLY 18 2HA GLY 18 -6.990 -3.644 -5.707
124 HA3 GLY 18 1HA GLY 18 -7.976 -4.030 -4.300
125 H CYS 19 HN CYS 19 -4.516 -3.826 -4.218
126 HA CYS 19 HA CYS 19 -4.802 -1.451 -2.535
127 HB2 CYS 19 2HB CYS 19 -4.229 -3.552 -1.307
128 HB3 CYS 19 1HB CYS 19 -2.763 -3.662 -2.269
129 H SER 20 HN SER 20 -3.553 0.214 -3.087
130 HA SER 20 HA SER 20 -1.731 -0.197 -5.336
131 HB2 SER 20 2HB SER 20 -3.223 2.301 -4.524
132 HB3 SER 20 1HB SER 20 -2.264 2.067 -5.989
133 HG SER 20 HG SER 20 -3.907 0.120 -6.085
134 H CYS 21 HN CYS 21 0.319 0.400 -5.020
135 HA CYS 21 HA CYS 21 1.182 1.277 -2.457
136 HB2 CYS 21 2HB CYS 21 2.596 -0.253 -3.656
137 HB3 CYS 21 1HB CYS 21 2.650 0.811 -5.054
138 H ARG 22 HN ARG 22 1.458 3.257 -1.808
139 HA ARG 22 HA ARG 22 2.156 5.289 -3.727
140 HB2 ARG 22 2HB ARG 22 -0.231 5.688 -3.171
141 HB3 ARG 22 1HB ARG 22 0.178 5.657 -1.460
142 HG2 ARG 22 2HG ARG 22 1.599 7.604 -1.762
143 HG3 ARG 22 1HG ARG 22 1.141 7.671 -3.464
144 HD2 ARG 22 2HD ARG 22 -1.143 8.083 -2.886
145 HD3 ARG 22 1HD ARG 22 -0.802 7.823 -1.173
146 HE ARG 22 HE ARG 22 0.880 9.815 -2.058
147 HH11 ARG 22 1HH1 ARG 22 -2.601 9.362 -1.778
148 HH12 ARG 22 2HH1 ARG 22 -2.946 10.976 -1.352
149 HH21 ARG 22 1HH2 ARG 22 0.445 12.053 -1.449
150 HH22 ARG 22 2HH2 ARG 22 -1.162 12.537 -1.166
151 H ARG 23 HN ARG 23 4.161 5.025 -3.197
152 HA ARG 23 HA ARG 23 5.230 4.152 -0.905
153 HB2 ARG 23 2HB ARG 23 6.583 6.058 -2.795
154 HB3 ARG 23 1HB ARG 23 7.398 5.055 -1.613
155 HG2 ARG 23 2HG ARG 23 6.557 3.047 -2.711
156 HG3 ARG 23 1HG ARG 23 5.758 4.041 -3.923
157 HD2 ARG 23 2HD ARG 23 7.968 4.957 -4.555
158 HD3 ARG 23 1HD ARG 23 8.702 3.853 -3.390
159 HE ARG 23 HE ARG 23 6.992 2.690 -5.406
160 HH11 ARG 23 1HH1 ARG 23 10.315 3.303 -4.363
161 HH12 ARG 23 2HH1 ARG 23 10.991 2.139 -5.412
162 HH21 ARG 23 1HH2 ARG 23 7.913 1.145 -6.817
163 HH22 ARG 23 2HH2 ARG 23 9.602 0.866 -6.833
164 HA PRO 24 HA PRO 24 6.600 4.023 0.359
165 HB2 PRO 24 2HB PRO 24 7.386 4.027 2.881
166 HB3 PRO 24 1HB PRO 24 8.179 5.052 1.680
167 HG2 PRO 24 2HG PRO 24 6.290 5.803 3.847
168 HG3 PRO 24 1HG PRO 24 7.602 6.741 3.119
169 HD2 PRO 24 2HD PRO 24 4.806 6.854 2.484
170 HD3 PRO 24 1HD PRO 24 6.130 7.744 1.710
171 H VAL 25 HN VAL 25 3.529 4.550 0.913
172 HA VAL 25 HA VAL 25 3.126 2.346 2.829
173 HB VAL 25 HB VAL 25 1.385 4.838 2.667
174 HG11 VAL 25 1HG1 VAL 25 0.145 2.888 3.391
175 HG12 VAL 25 2HG1 VAL 25 0.342 4.024 4.725
176 HG13 VAL 25 3HG1 VAL 25 1.340 2.572 4.649
177 HG21 VAL 25 1HG2 VAL 25 2.286 5.474 4.861
178 HG22 VAL 25 2HG2 VAL 25 3.543 5.433 3.624
179 HG23 VAL 25 3HG2 VAL 25 3.407 4.115 4.786
180 H CYS 26 HN CYS 26 1.248 1.015 2.377
181 HA CYS 26 HA CYS 26 0.336 1.213 -0.370
182 HB2 CYS 26 2HB CYS 26 -0.074 -0.881 1.763
183 HB3 CYS 26 1HB CYS 26 -0.705 -0.994 0.124
184 H TYR 27 HN TYR 27 -1.805 1.584 -0.938
185 HA TYR 27 HA TYR 27 -3.654 2.158 1.261
186 HB2 TYR 27 2HB TYR 27 -3.208 3.865 -1.196
187 HB3 TYR 27 1HB TYR 27 -4.534 4.081 -0.063
188 HD1 TYR 27 1HD TYR 27 -0.902 4.314 -0.504
189 HD2 TYR 27 2HD TYR 27 -4.182 5.224 2.016
190 HE1 TYR 27 1HE TYR 27 0.538 5.787 0.808
191 HE2 TYR 27 2HE TYR 27 -2.752 6.704 3.356
192 HH TYR 27 HH TYR 27 0.275 7.709 2.300
193 H LYS 28 HN LYS 28 -5.641 1.425 0.974
194 HA LYS 28 HA LYS 28 -6.265 0.161 -1.581
195 HB2 LYS 28 2HB LYS 28 -6.111 -1.407 0.322
196 HB3 LYS 28 1HB LYS 28 -7.297 -0.443 1.189
197 HG2 LYS 28 2HG LYS 28 -9.004 -1.016 -0.397
198 HG3 LYS 28 1HG LYS 28 -7.828 -1.855 -1.409
199 HD2 LYS 28 2HD LYS 28 -7.426 -3.472 0.362
200 HD3 LYS 28 1HD LYS 28 -8.553 -2.619 1.418
201 HE2 LYS 28 2HE LYS 28 -9.586 -4.583 0.389
202 HE3 LYS 28 1HE LYS 28 -10.374 -3.090 -0.111
203 HZ1 LYS 28 1HZ LYS 28 -10.070 -4.582 -1.928
204 HZ2 LYS 28 2HZ LYS 28 -8.415 -4.650 -1.741
205 HZ3 LYS 28 3HZ LYS 28 -9.174 -3.194 -2.210
206 H ASN 29 HN ASN 29 -7.317 1.648 -2.638
207 HA ASN 29 HA ASN 29 -8.933 3.031 -3.349
208 HB2 ASN 29 2HB ASN 29 -10.501 2.009 -0.963
209 HB3 ASN 29 1HB ASN 29 -11.178 3.020 -2.230
210 HD21 ASN 29 1HD2 ASN 29 -12.010 0.408 -1.419
211 HD22 ASN 29 2HD2 ASN 29 -11.841 -0.638 -2.784
Start of MODEL 2
1 H1 GLY 1 HN GLY 1 -6.447 4.171 -1.259
2 HA2 GLY 1 2HA GLY 1 -5.320 6.229 -0.805
3 HA3 GLY 1 1HA GLY 1 -6.877 7.045 -0.829
4 H LEU 2 HN LEU 2 -7.499 4.378 0.858
5 HA LEU 2 HA LEU 2 -6.844 5.704 3.382
6 HB2 LEU 2 2HB LEU 2 -9.040 3.718 2.734
7 HB3 LEU 2 1HB LEU 2 -8.650 4.228 4.356
8 HG LEU 2 HG LEU 2 -10.590 5.394 3.713
9 HD11 LEU 2 1HD1 LEU 2 -8.282 7.292 3.457
10 HD12 LEU 2 2HD1 LEU 2 -9.039 6.736 4.950
11 HD13 LEU 2 3HD1 LEU 2 -9.951 7.731 3.815
12 HD21 LEU 2 1HD2 LEU 2 -10.478 5.103 1.302
13 HD22 LEU 2 2HD2 LEU 2 -9.161 6.272 1.206
14 HD23 LEU 2 3HD2 LEU 2 -10.771 6.795 1.705
15 HA PRO 3 HA PRO 3 -4.173 2.290 4.119
16 HB2 PRO 3 2HB PRO 3 -3.777 2.606 6.800
17 HB3 PRO 3 1HB PRO 3 -2.988 3.610 5.580
18 HG2 PRO 3 2HG PRO 3 -5.300 4.239 7.336
19 HG3 PRO 3 1HG PRO 3 -4.043 5.309 6.704
20 HD2 PRO 3 2HD PRO 3 -6.629 5.107 5.712
21 HD3 PRO 3 1HD PRO 3 -5.236 5.771 4.841
22 H ILE 4 HN ILE 4 -6.288 1.164 3.650
23 HA ILE 4 HA ILE 4 -7.659 -0.149 5.802
24 HB ILE 4 HB ILE 4 -7.489 -0.984 2.894
25 HG12 ILE 4 2HG1 ILE 4 -8.339 1.314 3.038
26 HG13 ILE 4 1HG1 ILE 4 -9.620 0.215 2.549
27 HG21 ILE 4 1HG2 ILE 4 -8.307 -2.770 4.288
28 HG22 ILE 4 2HG2 ILE 4 -9.636 -2.129 3.317
29 HG23 ILE 4 3HG2 ILE 4 -9.499 -1.696 5.019
30 HD11 ILE 4 1HD1 ILE 4 -9.216 1.374 5.297
31 HD12 ILE 4 2HD1 ILE 4 -10.498 0.256 4.828
32 HD13 ILE 4 3HD1 ILE 4 -10.432 1.868 4.118
33 H CYS 5 HN CYS 5 -5.224 -1.061 3.429
34 HA CYS 5 HA CYS 5 -4.737 -3.620 4.538
35 HB2 CYS 5 2HB CYS 5 -3.008 -1.966 2.678
36 HB3 CYS 5 1HB CYS 5 -2.953 -3.715 2.882
37 H GLY 6 HN GLY 6 -2.769 -0.600 4.456
38 HA2 GLY 6 2HA GLY 6 -1.575 0.377 6.153
39 HA3 GLY 6 1HA GLY 6 -2.141 -0.885 7.234
40 H GLU 7 HN GLU 7 -0.702 -2.029 4.388
41 HA GLU 7 HA GLU 7 1.582 -2.881 5.931
42 HB2 GLU 7 2HB GLU 7 2.077 -4.350 3.972
43 HB3 GLU 7 1HB GLU 7 0.520 -4.673 4.712
44 HG2 GLU 7 2HG GLU 7 -0.564 -3.392 2.904
45 HG3 GLU 7 1HG GLU 7 1.018 -3.139 2.168
46 H THR 8 HN THR 8 3.717 -2.625 5.071
47 HA THR 8 HA THR 8 3.897 -0.103 3.711
48 HB THR 8 HB THR 8 6.357 -0.409 4.491
49 HG1 THR 8 1HG THR 8 6.511 -2.349 5.356
50 HG21 THR 8 1HG2 THR 8 4.037 0.052 6.351
51 HG22 THR 8 2HG2 THR 8 4.840 1.264 5.352
52 HG23 THR 8 3HG2 THR 8 5.703 0.520 6.708
53 H CYS 9 HN CYS 9 4.831 0.155 1.848
54 HA CYS 9 HA CYS 9 6.051 -2.141 0.599
55 HB2 CYS 9 2HB CYS 9 4.787 -1.627 -1.504
56 HB3 CYS 9 1HB CYS 9 3.792 -2.240 -0.189
57 H LEU 10 HN LEU 10 7.913 -1.021 1.125
58 HA LEU 10 HA LEU 10 8.455 1.581 0.057
59 HB2 LEU 10 2HB LEU 10 9.525 0.642 2.111
60 HB3 LEU 10 1HB LEU 10 10.383 -0.500 1.098
61 HG LEU 10 HG LEU 10 11.536 1.392 -0.012
62 HD11 LEU 10 1HD1 LEU 10 9.859 3.110 0.347
63 HD12 LEU 10 2HD1 LEU 10 11.417 3.608 1.012
64 HD13 LEU 10 3HD1 LEU 10 10.142 3.033 2.085
65 HD21 LEU 10 1HD2 LEU 10 11.791 1.321 2.992
66 HD22 LEU 10 2HD2 LEU 10 13.000 1.945 1.869
67 HD23 LEU 10 3HD2 LEU 10 12.591 0.231 1.861
68 H LEU 11 HN LEU 11 8.560 -1.610 -1.032
69 HA LEU 11 HA LEU 11 10.466 -1.298 -3.130
70 HB2 LEU 11 2HB LEU 11 8.340 -3.390 -2.721
71 HB3 LEU 11 1HB LEU 11 9.602 -3.461 -3.935
72 HG LEU 11 HG LEU 11 10.021 -3.516 -0.945
73 HD11 LEU 11 1HD1 LEU 11 10.323 -5.661 -3.033
74 HD12 LEU 11 2HD1 LEU 11 9.073 -5.579 -1.790
75 HD13 LEU 11 3HD1 LEU 11 10.762 -5.807 -1.333
76 HD21 LEU 11 1HD2 LEU 11 12.369 -4.002 -1.517
77 HD22 LEU 11 2HD2 LEU 11 11.871 -2.399 -2.044
78 HD23 LEU 11 3HD2 LEU 11 11.996 -3.710 -3.216
79 H GLY 12 HN GLY 12 7.133 -0.485 -2.806
80 HA2 GLY 12 2HA GLY 12 6.224 1.069 -4.370
81 HA3 GLY 12 1HA GLY 12 7.185 0.308 -5.629
82 H LYS 13 HN LYS 13 5.930 -2.179 -3.898
83 HA LYS 13 HA LYS 13 3.330 -2.157 -5.221
84 HB2 LYS 13 2HB LYS 13 5.005 -3.377 -6.660
85 HB3 LYS 13 1HB LYS 13 5.228 -4.501 -5.330
86 HG2 LYS 13 2HG LYS 13 2.809 -5.073 -5.478
87 HG3 LYS 13 1HG LYS 13 2.695 -4.041 -6.902
88 HD2 LYS 13 2HD LYS 13 2.965 -6.264 -7.697
89 HD3 LYS 13 1HD LYS 13 4.513 -5.455 -7.931
90 HE2 LYS 13 2HE LYS 13 4.940 -7.649 -7.050
91 HE3 LYS 13 1HE LYS 13 5.299 -6.482 -5.787
92 HZ1 LYS 13 1HZ LYS 13 3.087 -6.991 -4.788
93 HZ2 LYS 13 2HZ LYS 13 4.040 -8.369 -4.925
94 HZ3 LYS 13 3HZ LYS 13 2.827 -8.109 -6.021
95 H CYS 14 HN CYS 14 1.792 -3.305 -4.038
96 HA CYS 14 HA CYS 14 2.510 -3.904 -1.307
97 HB2 CYS 14 2HB CYS 14 -0.149 -4.124 -2.732
98 HB3 CYS 14 1HB CYS 14 0.113 -4.209 -0.996
99 H TYR 15 HN TYR 15 1.561 -5.933 -0.375
100 HA TYR 15 HA TYR 15 2.042 -8.131 -2.201
101 HB2 TYR 15 2HB TYR 15 2.304 -7.920 0.796
102 HB3 TYR 15 1HB TYR 15 2.293 -9.475 -0.033
103 HD1 TYR 15 1HD TYR 15 4.139 -6.259 0.244
104 HD2 TYR 15 2HD TYR 15 4.203 -10.264 -1.173
105 HE1 TYR 15 1HE TYR 15 6.522 -6.021 -0.301
106 HE2 TYR 15 2HE TYR 15 6.581 -10.046 -1.710
107 HH TYR 15 HH TYR 15 8.124 -8.114 -2.297
108 H THR 16 HN THR 16 -0.331 -6.611 -0.223
109 HA THR 16 HA THR 16 -2.242 -8.733 -0.703
110 HB THR 16 HB THR 16 -2.654 -5.908 0.357
111 HG1 THR 16 1HG THR 16 -1.633 -6.935 1.906
112 HG21 THR 16 1HG2 THR 16 -4.874 -6.687 1.082
113 HG22 THR 16 2HG2 THR 16 -4.574 -8.255 0.339
114 HG23 THR 16 3HG2 THR 16 -4.714 -6.816 -0.669
115 HA PRO 17 HA PRO 17 -2.936 -7.065 -4.810
116 HB2 PRO 17 2HB PRO 17 -4.816 -8.866 -5.596
117 HB3 PRO 17 1HB PRO 17 -3.090 -9.240 -5.560
118 HG2 PRO 17 2HG PRO 17 -5.224 -9.952 -3.596
119 HG3 PRO 17 1HG PRO 17 -3.860 -10.925 -4.171
120 HD2 PRO 17 2HD PRO 17 -3.888 -9.628 -1.772
121 HD3 PRO 17 1HD PRO 17 -2.400 -9.979 -2.673
122 H GLY 18 HN GLY 18 -4.235 -5.450 -5.388
123 HA2 GLY 18 2HA GLY 18 -6.413 -4.550 -5.831
124 HA3 GLY 18 1HA GLY 18 -7.012 -5.425 -4.425
125 H CYS 19 HN CYS 19 -4.071 -4.126 -3.739
126 HA CYS 19 HA CYS 19 -5.274 -1.732 -2.550
127 HB2 CYS 19 2HB CYS 19 -4.514 -3.832 -1.105
128 HB3 CYS 19 1HB CYS 19 -2.913 -3.166 -1.375
129 H SER 20 HN SER 20 -4.166 0.133 -3.137
130 HA SER 20 HA SER 20 -2.070 -0.277 -5.088
131 HB2 SER 20 2HB SER 20 -4.006 1.148 -5.684
132 HB3 SER 20 1HB SER 20 -3.587 2.235 -4.363
133 HG SER 20 HG SER 20 -2.834 2.844 -6.482
134 H CYS 21 HN CYS 21 -0.059 0.541 -4.903
135 HA CYS 21 HA CYS 21 0.718 1.101 -2.164
136 HB2 CYS 21 2HB CYS 21 1.854 -0.751 -3.226
137 HB3 CYS 21 1HB CYS 21 2.365 0.290 -4.549
138 H ARG 22 HN ARG 22 0.960 3.127 -1.625
139 HA ARG 22 HA ARG 22 2.215 4.919 -3.558
140 HB2 ARG 22 2HB ARG 22 0.455 5.620 -1.178
141 HB3 ARG 22 1HB ARG 22 1.247 6.772 -2.223
142 HG2 ARG 22 2HG ARG 22 -0.883 4.848 -3.146
143 HG3 ARG 22 1HG ARG 22 -1.188 6.507 -2.644
144 HD2 ARG 22 2HD ARG 22 -1.105 6.486 -5.035
145 HD3 ARG 22 1HD ARG 22 0.371 7.252 -4.468
146 HE ARG 22 HE ARG 22 0.857 4.509 -4.876
147 HH11 ARG 22 1HH1 ARG 22 0.264 7.442 -6.773
148 HH12 ARG 22 2HH1 ARG 22 1.045 6.839 -8.163
149 HH21 ARG 22 1HH2 ARG 22 1.951 3.732 -6.753
150 HH22 ARG 22 2HH2 ARG 22 2.022 4.716 -8.149
151 H ARG 23 HN ARG 23 4.199 4.171 -3.047
152 HA ARG 23 HA ARG 23 5.055 3.232 -0.691
153 HB2 ARG 23 2HB ARG 23 7.381 3.534 -1.431
154 HB3 ARG 23 1HB ARG 23 6.347 2.862 -2.674
155 HG2 ARG 23 2HG ARG 23 6.277 5.027 -3.794
156 HG3 ARG 23 1HG ARG 23 7.268 5.723 -2.510
157 HD2 ARG 23 2HD ARG 23 9.051 4.112 -3.031
158 HD3 ARG 23 1HD ARG 23 8.072 3.468 -4.343
159 HE ARG 23 HE ARG 23 8.247 6.093 -4.918
160 HH11 ARG 23 1HH1 ARG 23 10.627 3.539 -4.315
161 HH12 ARG 23 2HH1 ARG 23 11.889 4.288 -5.163
162 HH21 ARG 23 1HH2 ARG 23 9.982 7.098 -6.175
163 HH22 ARG 23 2HH2 ARG 23 11.506 6.344 -6.276
164 HA PRO 24 HA PRO 24 6.405 2.817 0.603
165 HB2 PRO 24 2HB PRO 24 7.039 2.738 3.148
166 HB3 PRO 24 1HB PRO 24 8.099 3.536 1.979
167 HG2 PRO 24 2HG PRO 24 6.246 4.743 3.973
168 HG3 PRO 24 1HG PRO 24 7.822 5.319 3.409
169 HD2 PRO 24 2HD PRO 24 5.272 6.160 2.494
170 HD3 PRO 24 1HD PRO 24 6.848 6.560 1.780
171 H VAL 25 HN VAL 25 3.534 4.240 1.262
172 HA VAL 25 HA VAL 25 2.738 2.125 3.141
173 HB VAL 25 HB VAL 25 1.334 4.793 2.789
174 HG11 VAL 25 1HG1 VAL 25 0.137 4.188 4.845
175 HG12 VAL 25 2HG1 VAL 25 0.961 2.627 4.859
176 HG13 VAL 25 3HG1 VAL 25 -0.154 3.023 3.552
177 HG21 VAL 25 1HG2 VAL 25 3.534 5.141 3.791
178 HG22 VAL 25 2HG2 VAL 25 3.184 3.910 5.007
179 HG23 VAL 25 3HG2 VAL 25 2.258 5.409 4.980
180 H CYS 26 HN CYS 26 1.114 0.789 2.607
181 HA CYS 26 HA CYS 26 0.110 0.988 -0.101
182 HB2 CYS 26 2HB CYS 26 1.090 -1.108 0.767
183 HB3 CYS 26 1HB CYS 26 -0.195 -1.181 1.965
184 H TYR 27 HN TYR 27 -1.895 1.636 -0.591
185 HA TYR 27 HA TYR 27 -3.816 2.056 1.599
186 HB2 TYR 27 2HB TYR 27 -3.239 3.871 -0.737
187 HB3 TYR 27 1HB TYR 27 -4.578 4.064 0.376
188 HD1 TYR 27 1HD TYR 27 -1.073 4.615 -0.233
189 HD2 TYR 27 2HD TYR 27 -4.105 4.729 2.722
190 HE1 TYR 27 1HE TYR 27 0.338 6.074 1.143
191 HE2 TYR 27 2HE TYR 27 -2.720 6.177 4.112
192 HH TYR 27 HH TYR 27 -0.325 6.690 4.385
193 H LYS 28 HN LYS 28 -5.892 1.660 1.112
194 HA LYS 28 HA LYS 28 -6.475 0.672 -1.563
195 HB2 LYS 28 2HB LYS 28 -6.866 -1.113 -0.021
196 HB3 LYS 28 1HB LYS 28 -7.677 -0.037 1.117
197 HG2 LYS 28 2HG LYS 28 -9.568 0.190 -0.387
198 HG3 LYS 28 1HG LYS 28 -8.733 -0.782 -1.596
199 HD2 LYS 28 2HD LYS 28 -9.367 -1.845 1.144
200 HD3 LYS 28 1HD LYS 28 -10.521 -1.946 -0.186
201 HE2 LYS 28 2HE LYS 28 -7.711 -3.051 -0.262
202 HE3 LYS 28 1HE LYS 28 -9.148 -3.999 0.108
203 HZ1 LYS 28 1HZ LYS 28 -10.021 -3.474 -2.087
204 HZ2 LYS 28 2HZ LYS 28 -8.531 -4.211 -2.225
205 HZ3 LYS 28 3HZ LYS 28 -8.664 -2.570 -2.477
206 H ASN 29 HN ASN 29 -7.318 2.190 -2.671
207 HA ASN 29 HA ASN 29 -8.514 3.912 -3.424
208 HB2 ASN 29 2HB ASN 29 -10.322 3.370 -1.044
209 HB3 ASN 29 1HB ASN 29 -10.679 4.559 -2.286
210 HD21 ASN 29 1HD2 ASN 29 -12.519 3.578 -3.011
211 HD22 ASN 29 2HD2 ASN 29 -12.513 2.088 -3.870
Start of MODEL 3
1 H1 GLY 1 HN GLY 1 -6.751 3.746 -1.036
2 HA2 GLY 1 2HA GLY 1 -5.870 6.077 -0.963
3 HA3 GLY 1 1HA GLY 1 -7.543 6.583 -0.790
4 H LEU 2 HN LEU 2 -7.583 3.922 0.992
5 HA LEU 2 HA LEU 2 -6.717 5.358 3.394
6 HB2 LEU 2 2HB LEU 2 -8.779 3.167 3.076
7 HB3 LEU 2 1HB LEU 2 -8.202 3.705 4.636
8 HG LEU 2 HG LEU 2 -10.313 4.667 4.296
9 HD11 LEU 2 1HD1 LEU 2 -8.737 6.174 5.300
10 HD12 LEU 2 2HD1 LEU 2 -9.918 7.049 4.329
11 HD13 LEU 2 3HD1 LEU 2 -8.287 6.800 3.712
12 HD21 LEU 2 1HD2 LEU 2 -10.883 6.050 2.342
13 HD22 LEU 2 2HD2 LEU 2 -10.568 4.364 1.930
14 HD23 LEU 2 3HD2 LEU 2 -9.346 5.594 1.604
15 HA PRO 3 HA PRO 3 -3.575 2.271 3.832
16 HB2 PRO 3 2HB PRO 3 -3.458 2.599 6.706
17 HB3 PRO 3 1HB PRO 3 -2.369 3.262 5.489
18 HG2 PRO 3 2HG PRO 3 -4.051 4.802 7.004
19 HG3 PRO 3 1HG PRO 3 -3.493 5.258 5.388
20 HD2 PRO 3 2HD PRO 3 -6.085 4.026 6.230
21 HD3 PRO 3 1HD PRO 3 -5.785 5.345 5.081
22 H ILE 4 HN ILE 4 -6.193 1.195 3.871
23 HA ILE 4 HA ILE 4 -6.917 -0.430 6.058
24 HB ILE 4 HB ILE 4 -7.497 -0.998 3.135
25 HG12 ILE 4 2HG1 ILE 4 -8.138 1.298 3.685
26 HG13 ILE 4 1HG1 ILE 4 -9.559 0.301 3.406
27 HG21 ILE 4 1HG2 ILE 4 -9.521 -2.104 3.954
28 HG22 ILE 4 2HG2 ILE 4 -9.022 -1.785 5.614
29 HG23 ILE 4 3HG2 ILE 4 -8.058 -2.855 4.597
30 HD11 ILE 4 1HD1 ILE 4 -9.889 0.134 5.830
31 HD12 ILE 4 2HD1 ILE 4 -9.904 1.806 5.269
32 HD13 ILE 4 3HD1 ILE 4 -8.478 1.164 6.085
33 H CYS 5 HN CYS 5 -4.670 -0.969 3.453
34 HA CYS 5 HA CYS 5 -4.439 -3.791 3.759
35 HB2 CYS 5 2HB CYS 5 -2.449 -1.871 2.546
36 HB3 CYS 5 1HB CYS 5 -2.604 -3.598 2.212
37 H GLY 6 HN GLY 6 -2.911 -0.995 5.205
38 HA2 GLY 6 2HA GLY 6 -1.661 -0.787 7.085
39 HA3 GLY 6 1HA GLY 6 -1.873 -2.506 7.363
40 H GLU 7 HN GLU 7 -0.638 -2.094 4.338
41 HA GLU 7 HA GLU 7 1.941 -3.076 5.226
42 HB2 GLU 7 2HB GLU 7 0.857 -2.759 2.441
43 HB3 GLU 7 1HB GLU 7 2.335 -3.575 2.895
44 HG2 GLU 7 2HG GLU 7 1.031 -5.216 4.114
45 HG3 GLU 7 1HG GLU 7 -0.454 -4.411 3.592
46 H THR 8 HN THR 8 3.850 -2.258 4.334
47 HA THR 8 HA THR 8 3.696 0.479 3.411
48 HB THR 8 HB THR 8 6.146 0.423 4.299
49 HG1 THR 8 1HG THR 8 5.010 -1.255 6.258
50 HG21 THR 8 1HG2 THR 8 5.356 1.263 6.500
51 HG22 THR 8 2HG2 THR 8 3.734 0.658 6.098
52 HG23 THR 8 3HG2 THR 8 4.472 1.934 5.127
53 H CYS 9 HN CYS 9 4.694 0.842 1.526
54 HA CYS 9 HA CYS 9 5.891 -1.540 0.388
55 HB2 CYS 9 2HB CYS 9 5.092 -0.829 -1.858
56 HB3 CYS 9 1HB CYS 9 3.812 -1.233 -0.724
57 H LEU 10 HN LEU 10 7.834 -0.838 1.246
58 HA LEU 10 HA LEU 10 9.202 1.379 0.030
59 HB2 LEU 10 2HB LEU 10 10.332 -1.020 1.475
60 HB3 LEU 10 1HB LEU 10 11.205 0.443 1.079
61 HG LEU 10 HG LEU 10 8.944 0.185 3.054
62 HD11 LEU 10 1HD1 LEU 10 10.681 0.727 4.694
63 HD12 LEU 10 2HD1 LEU 10 11.878 0.728 3.400
64 HD13 LEU 10 3HD1 LEU 10 11.035 -0.760 3.815
65 HD21 LEU 10 1HD2 LEU 10 10.566 2.605 2.265
66 HD22 LEU 10 2HD2 LEU 10 9.417 2.534 3.599
67 HD23 LEU 10 3HD2 LEU 10 8.851 2.356 1.939
68 H LEU 11 HN LEU 11 8.747 -1.999 -0.524
69 HA LEU 11 HA LEU 11 10.725 -2.302 -2.559
70 HB2 LEU 11 2HB LEU 11 8.286 -3.972 -1.955
71 HB3 LEU 11 1HB LEU 11 9.606 -4.429 -3.013
72 HG LEU 11 HG LEU 11 9.870 -3.969 -0.044
73 HD11 LEU 11 1HD1 LEU 11 8.530 -5.936 -0.539
74 HD12 LEU 11 2HD1 LEU 11 10.111 -6.391 0.092
75 HD13 LEU 11 3HD1 LEU 11 9.779 -6.524 -1.636
76 HD21 LEU 11 1HD2 LEU 11 11.813 -5.048 -2.087
77 HD22 LEU 11 2HD2 LEU 11 12.074 -5.002 -0.345
78 HD23 LEU 11 3HD2 LEU 11 11.931 -3.498 -1.250
79 H GLY 12 HN GLY 12 7.597 -0.963 -2.487
80 HA2 GLY 12 2HA GLY 12 6.808 0.395 -4.267
81 HA3 GLY 12 1HA GLY 12 7.717 -0.609 -5.387
82 H LYS 13 HN LYS 13 6.410 -2.878 -3.604
83 HA LYS 13 HA LYS 13 3.798 -2.838 -4.919
84 HB2 LYS 13 2HB LYS 13 5.285 -4.206 -6.301
85 HB3 LYS 13 1HB LYS 13 5.741 -5.163 -4.904
86 HG2 LYS 13 2HG LYS 13 3.365 -5.883 -4.697
87 HG3 LYS 13 1HG LYS 13 3.026 -5.034 -6.201
88 HD2 LYS 13 2HD LYS 13 4.644 -6.470 -7.365
89 HD3 LYS 13 1HD LYS 13 4.974 -7.311 -5.851
90 HE2 LYS 13 2HE LYS 13 2.648 -8.024 -5.719
91 HE3 LYS 13 1HE LYS 13 2.287 -7.171 -7.214
92 HZ1 LYS 13 1HZ LYS 13 4.119 -9.485 -6.914
93 HZ2 LYS 13 2HZ LYS 13 3.841 -8.643 -8.356
94 HZ3 LYS 13 3HZ LYS 13 2.591 -9.484 -7.633
95 H CYS 14 HN CYS 14 2.188 -3.674 -3.724
96 HA CYS 14 HA CYS 14 2.748 -4.367 -0.947
97 HB2 CYS 14 2HB CYS 14 0.132 -3.776 -2.342
98 HB3 CYS 14 1HB CYS 14 0.418 -3.840 -0.604
99 H TYR 15 HN TYR 15 1.400 -6.215 -0.042
100 HA TYR 15 HA TYR 15 1.337 -8.320 -2.044
101 HB2 TYR 15 2HB TYR 15 1.340 -8.510 0.972
102 HB3 TYR 15 1HB TYR 15 1.409 -9.876 -0.141
103 HD1 TYR 15 1HD TYR 15 3.264 -7.216 1.453
104 HD2 TYR 15 2HD TYR 15 3.421 -10.209 -1.542
105 HE1 TYR 15 1HE TYR 15 5.709 -6.977 1.359
106 HE2 TYR 15 2HE TYR 15 5.851 -9.997 -1.652
107 HH TYR 15 HH TYR 15 7.525 -8.222 -1.151
108 H THR 16 HN THR 16 -0.718 -6.262 -0.411
109 HA THR 16 HA THR 16 -2.984 -8.039 -0.430
110 HB THR 16 HB THR 16 -2.922 -5.025 -0.108
111 HG1 THR 16 1HG THR 16 -1.644 -5.791 1.434
112 HG21 THR 16 1HG2 THR 16 -4.910 -7.108 0.833
113 HG22 THR 16 2HG2 THR 16 -5.154 -6.002 -0.517
114 HG23 THR 16 3HG2 THR 16 -5.019 -5.371 1.126
115 HA PRO 17 HA PRO 17 -3.700 -6.945 -4.803
116 HB2 PRO 17 2HB PRO 17 -6.026 -8.710 -4.580
117 HB3 PRO 17 1HB PRO 17 -4.600 -8.889 -5.602
118 HG2 PRO 17 2HG PRO 17 -5.068 -10.509 -3.491
119 HG3 PRO 17 1HG PRO 17 -3.435 -10.060 -4.013
120 HD2 PRO 17 2HD PRO 17 -5.055 -8.967 -1.737
121 HD3 PRO 17 1HD PRO 17 -3.328 -9.385 -1.825
122 H GLY 18 HN GLY 18 -4.908 -5.343 -5.538
123 HA2 GLY 18 2HA GLY 18 -6.822 -4.011 -5.821
124 HA3 GLY 18 1HA GLY 18 -7.541 -4.798 -4.414
125 H CYS 19 HN CYS 19 -4.326 -3.751 -4.160
126 HA CYS 19 HA CYS 19 -5.139 -1.459 -2.519
127 HB2 CYS 19 2HB CYS 19 -4.233 -3.535 -1.354
128 HB3 CYS 19 1HB CYS 19 -2.706 -3.209 -2.159
129 H SER 20 HN SER 20 -3.929 0.436 -2.867
130 HA SER 20 HA SER 20 -2.209 0.372 -5.206
131 HB2 SER 20 2HB SER 20 -4.227 1.780 -5.360
132 HB3 SER 20 1HB SER 20 -3.721 2.662 -3.924
133 HG SER 20 HG SER 20 -2.200 2.509 -6.326
134 H CYS 21 HN CYS 21 -0.144 0.571 -4.872
135 HA CYS 21 HA CYS 21 0.944 1.325 -2.340
136 HB2 CYS 21 2HB CYS 21 2.102 -0.406 -3.531
137 HB3 CYS 21 1HB CYS 21 2.234 0.597 -4.972
138 H ARG 22 HN ARG 22 0.921 3.361 -1.799
139 HA ARG 22 HA ARG 22 2.049 5.262 -3.695
140 HB2 ARG 22 2HB ARG 22 0.094 5.921 -1.445
141 HB3 ARG 22 1HB ARG 22 0.743 7.043 -2.624
142 HG2 ARG 22 2HG ARG 22 -1.097 4.743 -3.276
143 HG3 ARG 22 1HG ARG 22 -1.596 6.422 -3.093
144 HD2 ARG 22 2HD ARG 22 -0.312 7.076 -5.024
145 HD3 ARG 22 1HD ARG 22 0.442 5.485 -5.119
146 HE ARG 22 HE ARG 22 -2.047 4.758 -5.402
147 HH11 ARG 22 1HH1 ARG 22 -0.508 7.546 -6.968
148 HH12 ARG 22 2HH1 ARG 22 -1.518 7.482 -8.332
149 HH21 ARG 22 1HH2 ARG 22 -3.388 4.697 -7.244
150 HH22 ARG 22 2HH2 ARG 22 -3.197 5.812 -8.508
151 H ARG 23 HN ARG 23 4.048 4.795 -3.025
152 HA ARG 23 HA ARG 23 4.671 3.937 -0.496
153 HB2 ARG 23 2HB ARG 23 7.040 4.079 -1.064
154 HB3 ARG 23 1HB ARG 23 6.114 3.425 -2.393
155 HG2 ARG 23 2HG ARG 23 6.290 5.530 -3.564
156 HG3 ARG 23 1HG ARG 23 7.150 6.237 -2.189
157 HD2 ARG 23 2HD ARG 23 8.064 3.878 -3.835
158 HD3 ARG 23 1HD ARG 23 8.714 5.514 -3.921
159 HE ARG 23 HE ARG 23 9.019 4.868 -1.324
160 HH11 ARG 23 1HH1 ARG 23 10.091 3.364 -4.334
161 HH12 ARG 23 2HH1 ARG 23 11.468 2.619 -3.664
162 HH21 ARG 23 1HH2 ARG 23 10.891 3.858 -0.377
163 HH22 ARG 23 2HH2 ARG 23 11.919 2.874 -1.317
164 HA PRO 24 HA PRO 24 6.368 3.758 0.754
165 HB2 PRO 24 2HB PRO 24 6.818 3.829 3.354
166 HB3 PRO 24 1HB PRO 24 7.834 4.733 2.225
167 HG2 PRO 24 2HG PRO 24 5.667 5.717 4.025
168 HG3 PRO 24 1HG PRO 24 7.198 6.492 3.587
169 HD2 PRO 24 2HD PRO 24 4.682 7.015 2.437
170 HD3 PRO 24 1HD PRO 24 6.253 7.516 1.785
171 H VAL 25 HN VAL 25 3.208 4.591 1.156
172 HA VAL 25 HA VAL 25 2.732 2.312 2.958
173 HB VAL 25 HB VAL 25 1.083 4.867 2.896
174 HG11 VAL 25 1HG1 VAL 25 -0.113 3.953 4.829
175 HG12 VAL 25 2HG1 VAL 25 0.797 2.450 4.682
176 HG13 VAL 25 3HG1 VAL 25 -0.317 2.935 3.402
177 HG21 VAL 25 1HG2 VAL 25 3.236 5.199 3.985
178 HG22 VAL 25 2HG2 VAL 25 2.929 3.813 5.035
179 HG23 VAL 25 3HG2 VAL 25 1.918 5.253 5.156
180 H CYS 26 HN CYS 26 1.037 0.934 2.504
181 HA CYS 26 HA CYS 26 0.022 1.049 -0.205
182 HB2 CYS 26 2HB CYS 26 -0.235 -1.032 1.953
183 HB3 CYS 26 1HB CYS 26 -0.841 -1.208 0.309
184 H TYR 27 HN TYR 27 -1.830 1.959 -0.660
185 HA TYR 27 HA TYR 27 -3.824 2.289 1.462
186 HB2 TYR 27 2HB TYR 27 -3.221 4.073 -0.903
187 HB3 TYR 27 1HB TYR 27 -4.576 4.284 0.189
188 HD1 TYR 27 1HD TYR 27 -4.205 5.134 2.467
189 HD2 TYR 27 2HD TYR 27 -0.980 4.679 -0.258
190 HE1 TYR 27 1HE TYR 27 -2.827 6.589 3.871
191 HE2 TYR 27 2HE TYR 27 0.414 6.127 1.137
192 HH TYR 27 HH TYR 27 -0.395 6.984 4.301
193 H LYS 28 HN LYS 28 -5.585 1.205 1.113
194 HA LYS 28 HA LYS 28 -6.264 0.214 -1.543
195 HB2 LYS 28 2HB LYS 28 -6.440 -1.356 0.352
196 HB3 LYS 28 1HB LYS 28 -7.574 -0.271 1.162
197 HG2 LYS 28 2HG LYS 28 -9.131 -0.605 -0.753
198 HG3 LYS 28 1HG LYS 28 -8.005 -1.788 -1.407
199 HD2 LYS 28 2HD LYS 28 -9.379 -1.976 1.283
200 HD3 LYS 28 1HD LYS 28 -9.876 -2.833 -0.170
201 HE2 LYS 28 2HE LYS 28 -7.656 -3.973 -0.187
202 HE3 LYS 28 1HE LYS 28 -7.275 -3.172 1.336
203 HZ1 LYS 28 1HZ LYS 28 -9.498 -5.075 0.865
204 HZ2 LYS 28 2HZ LYS 28 -9.239 -4.285 2.316
205 HZ3 LYS 28 3HZ LYS 28 -8.119 -5.408 1.770
206 H ASN 29 HN ASN 29 -7.268 1.663 -2.738
207 HA ASN 29 HA ASN 29 -8.652 3.248 -3.511
208 HB2 ASN 29 2HB ASN 29 -10.312 2.531 -1.085
209 HB3 ASN 29 1HB ASN 29 -10.820 3.747 -2.245
210 HD21 ASN 29 1HD2 ASN 29 -12.607 2.618 -2.855
211 HD22 ASN 29 2HD2 ASN 29 -12.567 1.197 -3.819
Start of MODEL 4
1 H1 GLY 1 HN GLY 1 -6.638 3.875 -1.155
2 HA2 GLY 1 2HA GLY 1 -5.550 5.966 -0.692
3 HA3 GLY 1 1HA GLY 1 -7.139 6.706 -0.550
4 H LEU 2 HN LEU 2 -7.559 3.914 0.992
5 HA LEU 2 HA LEU 2 -6.880 5.122 3.567
6 HB2 LEU 2 2HB LEU 2 -8.880 2.950 2.888
7 HB3 LEU 2 1HB LEU 2 -8.504 3.448 4.520
8 HG LEU 2 HG LEU 2 -10.565 4.409 3.995
9 HD11 LEU 2 1HD1 LEU 2 -10.212 6.807 4.069
10 HD12 LEU 2 2HD1 LEU 2 -8.521 6.562 3.641
11 HD13 LEU 2 3HD1 LEU 2 -9.146 5.925 5.164
12 HD21 LEU 2 1HD2 LEU 2 -9.401 5.442 1.410
13 HD22 LEU 2 2HD2 LEU 2 -11.024 5.783 2.014
14 HD23 LEU 2 3HD2 LEU 2 -10.573 4.134 1.581
15 HA PRO 3 HA PRO 3 -3.714 2.010 4.103
16 HB2 PRO 3 2HB PRO 3 -3.386 2.207 6.782
17 HB3 PRO 3 1HB PRO 3 -2.854 3.481 5.675
18 HG2 PRO 3 2HG PRO 3 -5.372 3.309 7.293
19 HG3 PRO 3 1HG PRO 3 -4.258 4.677 7.110
20 HD2 PRO 3 2HD PRO 3 -6.553 4.526 5.703
21 HD3 PRO 3 1HD PRO 3 -5.075 5.225 5.017
22 H ILE 4 HN ILE 4 -6.297 0.954 3.893
23 HA ILE 4 HA ILE 4 -7.140 -0.732 6.019
24 HB ILE 4 HB ILE 4 -7.679 -0.854 3.045
25 HG12 ILE 4 2HG1 ILE 4 -8.434 1.218 4.031
26 HG13 ILE 4 1HG1 ILE 4 -9.821 0.224 3.597
27 HG21 ILE 4 1HG2 ILE 4 -9.636 -2.209 3.548
28 HG22 ILE 4 2HG2 ILE 4 -9.151 -2.269 5.245
29 HG23 ILE 4 3HG2 ILE 4 -8.133 -3.012 4.008
30 HD11 ILE 4 1HD1 ILE 4 -10.178 1.311 5.721
31 HD12 ILE 4 2HD1 ILE 4 -8.691 0.628 6.364
32 HD13 ILE 4 3HD1 ILE 4 -10.045 -0.430 5.963
33 H CYS 5 HN CYS 5 -4.817 -1.079 3.487
34 HA CYS 5 HA CYS 5 -4.654 -3.876 3.339
35 HB2 CYS 5 2HB CYS 5 -2.408 -1.941 2.784
36 HB3 CYS 5 1HB CYS 5 -2.759 -3.481 2.000
37 H GLY 6 HN GLY 6 -2.778 -1.456 5.194
38 HA2 GLY 6 2HA GLY 6 -1.805 -1.708 7.257
39 HA3 GLY 6 1HA GLY 6 -2.207 -3.421 7.230
40 H GLU 7 HN GLU 7 -0.593 -1.830 4.634
41 HA GLU 7 HA GLU 7 1.953 -2.915 5.412
42 HB2 GLU 7 2HB GLU 7 2.202 -3.899 3.069
43 HB3 GLU 7 1HB GLU 7 1.183 -4.780 4.195
44 HG2 GLU 7 2HG GLU 7 -0.782 -3.669 3.142
45 HG3 GLU 7 1HG GLU 7 0.320 -3.013 1.930
46 H THR 8 HN THR 8 3.680 -2.144 3.941
47 HA THR 8 HA THR 8 2.968 0.522 2.994
48 HB THR 8 HB THR 8 5.338 1.131 3.629
49 HG1 THR 8 1HG THR 8 5.364 -0.914 5.473
50 HG21 THR 8 1HG2 THR 8 4.834 1.368 6.020
51 HG22 THR 8 2HG2 THR 8 3.473 0.254 5.828
52 HG23 THR 8 3HG2 THR 8 3.464 1.820 5.003
53 H CYS 9 HN CYS 9 5.011 1.330 1.650
54 HA CYS 9 HA CYS 9 5.715 -0.807 -0.175
55 HB2 CYS 9 2HB CYS 9 5.087 2.054 -0.895
56 HB3 CYS 9 1HB CYS 9 5.870 0.892 -1.960
57 H LEU 10 HN LEU 10 7.567 -0.988 1.238
58 HA LEU 10 HA LEU 10 9.524 1.125 0.816
59 HB2 LEU 10 2HB LEU 10 9.748 -1.462 2.359
60 HB3 LEU 10 1HB LEU 10 11.014 -0.260 2.245
61 HG LEU 10 HG LEU 10 8.321 0.144 3.553
62 HD11 LEU 10 1HD1 LEU 10 9.769 -1.335 4.821
63 HD12 LEU 10 2HD1 LEU 10 9.595 0.225 5.626
64 HD13 LEU 10 3HD1 LEU 10 11.073 -0.148 4.739
65 HD21 LEU 10 1HD2 LEU 10 10.712 1.979 3.344
66 HD22 LEU 10 2HD2 LEU 10 9.293 2.269 4.344
67 HD23 LEU 10 3HD2 LEU 10 9.135 2.226 2.589
68 H LEU 11 HN LEU 11 8.661 -2.010 -0.325
69 HA LEU 11 HA LEU 11 11.047 -2.160 -2.004
70 HB2 LEU 11 2HB LEU 11 8.722 -4.086 -1.733
71 HB3 LEU 11 1HB LEU 11 10.151 -4.353 -2.701
72 HG LEU 11 HG LEU 11 10.123 -4.102 0.303
73 HD11 LEU 11 1HD1 LEU 11 9.036 -6.141 -0.438
74 HD12 LEU 11 2HD1 LEU 11 10.604 -6.501 0.284
75 HD13 LEU 11 3HD1 LEU 11 10.414 -6.519 -1.470
76 HD21 LEU 11 1HD2 LEU 11 12.343 -4.840 -1.606
77 HD22 LEU 11 2HD2 LEU 11 12.439 -4.901 0.153
78 HD23 LEU 11 3HD2 LEU 11 12.231 -3.353 -0.664
79 H GLY 12 HN GLY 12 7.761 -1.267 -2.084
80 HA2 GLY 12 2HA GLY 12 7.003 0.304 -3.758
81 HA3 GLY 12 1HA GLY 12 8.106 -0.455 -4.893
82 H LYS 13 HN LYS 13 6.325 -2.596 -2.945
83 HA LYS 13 HA LYS 13 4.254 -2.904 -4.966
84 HB2 LYS 13 2HB LYS 13 6.085 -4.420 -5.652
85 HB3 LYS 13 1HB LYS 13 6.025 -5.193 -4.074
86 HG2 LYS 13 2HG LYS 13 3.676 -5.856 -4.548
87 HG3 LYS 13 1HG LYS 13 3.857 -5.190 -6.168
88 HD2 LYS 13 2HD LYS 13 5.665 -6.783 -6.613
89 HD3 LYS 13 1HD LYS 13 5.483 -7.434 -4.982
90 HE2 LYS 13 2HE LYS 13 3.369 -7.441 -7.128
91 HE3 LYS 13 1HE LYS 13 4.359 -8.821 -6.661
92 HZ1 LYS 13 1HZ LYS 13 3.368 -8.757 -4.464
93 HZ2 LYS 13 2HZ LYS 13 2.182 -8.898 -5.621
94 HZ3 LYS 13 3HZ LYS 13 2.418 -7.421 -4.869
95 H CYS 14 HN CYS 14 2.353 -3.599 -4.134
96 HA CYS 14 HA CYS 14 2.219 -4.026 -1.280
97 HB2 CYS 14 2HB CYS 14 0.047 -3.804 -3.384
98 HB3 CYS 14 1HB CYS 14 -0.232 -3.958 -1.653
99 H TYR 15 HN TYR 15 0.972 -5.849 -0.513
100 HA TYR 15 HA TYR 15 1.374 -8.197 -2.209
101 HB2 TYR 15 2HB TYR 15 1.617 -7.923 0.787
102 HB3 TYR 15 1HB TYR 15 1.619 -9.474 -0.051
103 HD1 TYR 15 1HD TYR 15 3.385 -9.781 -1.864
104 HD2 TYR 15 2HD TYR 15 3.650 -6.780 1.108
105 HE1 TYR 15 1HE TYR 15 5.794 -9.613 -2.286
106 HE2 TYR 15 2HE TYR 15 6.077 -6.586 0.704
107 HH TYR 15 HH TYR 15 7.595 -7.876 -1.999
108 H THR 16 HN THR 16 -0.769 -6.412 -0.177
109 HA THR 16 HA THR 16 -2.846 -8.402 -0.309
110 HB THR 16 HB THR 16 -2.914 -5.494 0.573
111 HG1 THR 16 1HG THR 16 -1.634 -6.666 1.958
112 HG21 THR 16 1HG2 THR 16 -5.030 -6.078 1.696
113 HG22 THR 16 2HG2 THR 16 -4.938 -7.705 1.027
114 HG23 THR 16 3HG2 THR 16 -5.156 -6.323 -0.046
115 HA PRO 17 HA PRO 17 -4.070 -7.058 -4.407
116 HB2 PRO 17 2HB PRO 17 -6.421 -8.431 -4.551
117 HB3 PRO 17 1HB PRO 17 -4.846 -9.195 -4.781
118 HG2 PRO 17 2HG PRO 17 -6.585 -9.138 -2.349
119 HG3 PRO 17 1HG PRO 17 -5.657 -10.487 -3.029
120 HD2 PRO 17 2HD PRO 17 -4.796 -9.051 -0.908
121 HD3 PRO 17 1HD PRO 17 -3.677 -9.761 -2.092
122 H GLY 18 HN GLY 18 -5.375 -5.513 -5.260
123 HA2 GLY 18 2HA GLY 18 -7.210 -4.058 -5.406
124 HA3 GLY 18 1HA GLY 18 -7.734 -4.594 -3.816
125 H CYS 19 HN CYS 19 -4.544 -4.000 -3.609
126 HA CYS 19 HA CYS 19 -5.041 -1.387 -2.422
127 HB2 CYS 19 2HB CYS 19 -2.947 -3.477 -1.937
128 HB3 CYS 19 1HB CYS 19 -2.864 -1.858 -1.256
129 H SER 20 HN SER 20 -4.224 0.359 -3.310
130 HA SER 20 HA SER 20 -2.342 0.078 -5.483
131 HB2 SER 20 2HB SER 20 -2.890 2.522 -5.829
132 HB3 SER 20 1HB SER 20 -4.240 1.406 -6.025
133 HG SER 20 HG SER 20 -3.996 2.209 -3.455
134 H CYS 21 HN CYS 21 -0.285 0.474 -5.233
135 HA CYS 21 HA CYS 21 0.824 1.189 -2.725
136 HB2 CYS 21 2HB CYS 21 1.850 -0.472 -4.180
137 HB3 CYS 21 1HB CYS 21 2.069 0.733 -5.440
138 H ARG 22 HN ARG 22 1.378 3.164 -2.011
139 HA ARG 22 HA ARG 22 1.982 5.307 -3.916
140 HB2 ARG 22 2HB ARG 22 0.317 5.715 -1.420
141 HB3 ARG 22 1HB ARG 22 0.740 6.912 -2.619
142 HG2 ARG 22 2HG ARG 22 -0.709 5.828 -4.247
143 HG3 ARG 22 1HG ARG 22 -1.132 4.596 -3.050
144 HD2 ARG 22 2HD ARG 22 -1.958 6.380 -1.557
145 HD3 ARG 22 1HD ARG 22 -1.599 7.555 -2.815
146 HE ARG 22 HE ARG 22 -3.292 5.583 -3.845
147 HH11 ARG 22 1HH1 ARG 22 -3.295 8.293 -1.572
148 HH12 ARG 22 2HH1 ARG 22 -4.936 8.677 -1.765
149 HH21 ARG 22 1HH2 ARG 22 -5.609 6.069 -4.119
150 HH22 ARG 22 2HH2 ARG 22 -6.301 7.349 -3.261
151 H ARG 23 HN ARG 23 4.115 5.304 -3.413
152 HA ARG 23 HA ARG 23 5.170 4.289 -1.082
153 HB2 ARG 23 2HB ARG 23 6.565 6.191 -2.948
154 HB3 ARG 23 1HB ARG 23 7.352 5.183 -1.751
155 HG2 ARG 23 2HG ARG 23 6.401 3.184 -2.928
156 HG3 ARG 23 1HG ARG 23 5.874 4.278 -4.206
157 HD2 ARG 23 2HD ARG 23 8.702 3.797 -3.285
158 HD3 ARG 23 1HD ARG 23 7.989 3.263 -4.802
159 HE ARG 23 HE ARG 23 7.828 6.088 -4.518
160 HH11 ARG 23 1HH1 ARG 23 10.020 3.471 -5.437
161 HH12 ARG 23 2HH1 ARG 23 11.097 4.481 -6.275
162 HH21 ARG 23 1HH2 ARG 23 9.307 7.458 -5.637
163 HH22 ARG 23 2HH2 ARG 23 10.718 6.805 -6.355
164 HA PRO 24 HA PRO 24 6.609 4.155 0.179
165 HB2 PRO 24 2HB PRO 24 7.433 4.146 2.681
166 HB3 PRO 24 1HB PRO 24 8.180 5.227 1.498
167 HG2 PRO 24 2HG PRO 24 6.248 5.853 3.674
168 HG3 PRO 24 1HG PRO 24 7.561 6.846 3.020
169 HD2 PRO 24 2HD PRO 24 4.795 6.976 2.339
170 HD3 PRO 24 1HD PRO 24 6.135 7.848 1.578
171 H VAL 25 HN VAL 25 3.565 4.634 0.746
172 HA VAL 25 HA VAL 25 3.235 2.470 2.721
173 HB VAL 25 HB VAL 25 1.220 4.696 2.321
174 HG11 VAL 25 1HG1 VAL 25 1.578 2.766 4.606
175 HG12 VAL 25 2HG1 VAL 25 0.310 2.731 3.381
176 HG13 VAL 25 3HG1 VAL 25 0.384 4.061 4.534
177 HG21 VAL 25 1HG2 VAL 25 2.060 5.797 4.342
178 HG22 VAL 25 2HG2 VAL 25 3.269 5.763 3.056
179 HG23 VAL 25 3HG2 VAL 25 3.387 4.636 4.408
180 H CYS 26 HN CYS 26 1.025 1.280 2.357
181 HA CYS 26 HA CYS 26 0.335 1.382 -0.475
182 HB2 CYS 26 2HB CYS 26 1.329 -0.783 0.323
183 HB3 CYS 26 1HB CYS 26 0.033 -0.887 1.504
184 H TYR 27 HN TYR 27 -1.825 1.796 -0.937
185 HA TYR 27 HA TYR 27 -3.608 2.049 1.374
186 HB2 TYR 27 2HB TYR 27 -3.180 4.110 -0.790
187 HB3 TYR 27 1HB TYR 27 -4.540 4.121 0.314
188 HD1 TYR 27 1HD TYR 27 -4.085 4.447 2.779
189 HD2 TYR 27 2HD TYR 27 -1.101 5.033 -0.177
190 HE1 TYR 27 1HE TYR 27 -2.804 5.800 4.364
191 HE2 TYR 27 2HE TYR 27 0.201 6.396 1.397
192 HH TYR 27 HH TYR 27 -0.202 7.742 3.442
193 H LYS 28 HN LYS 28 -5.606 1.357 1.050
194 HA LYS 28 HA LYS 28 -6.360 0.435 -1.623
195 HB2 LYS 28 2HB LYS 28 -6.385 -1.220 0.246
196 HB3 LYS 28 1HB LYS 28 -7.531 -0.191 1.091
197 HG2 LYS 28 2HG LYS 28 -9.124 -0.506 -0.774
198 HG3 LYS 28 1HG LYS 28 -7.981 -1.635 -1.502
199 HD2 LYS 28 2HD LYS 28 -8.102 -3.070 0.436
200 HD3 LYS 28 1HD LYS 28 -9.164 -1.923 1.250
201 HE2 LYS 28 2HE LYS 28 -10.820 -2.241 -0.557
202 HE3 LYS 28 1HE LYS 28 -9.770 -3.468 -1.265
203 HZ1 LYS 28 1HZ LYS 28 -9.981 -4.767 0.755
204 HZ2 LYS 28 2HZ LYS 28 -11.522 -4.419 0.134
205 HZ3 LYS 28 3HZ LYS 28 -10.931 -3.564 1.450
206 H ASN 29 HN ASN 29 -7.473 1.978 -2.629
207 HA ASN 29 HA ASN 29 -8.957 3.621 -3.155
208 HB2 ASN 29 2HB ASN 29 -10.264 3.013 -0.477
209 HB3 ASN 29 1HB ASN 29 -10.933 4.086 -1.693
210 HD21 ASN 29 1HD2 ASN 29 -11.859 3.192 -3.522
211 HD22 ASN 29 2HD2 ASN 29 -12.233 1.504 -3.635
Start of MODEL 5
1 H1 GLY 1 HN GLY 1 -7.351 4.530 -1.096
2 HA2 GLY 1 2HA GLY 1 -6.641 6.717 -0.554
3 HA3 GLY 1 1HA GLY 1 -8.232 7.035 0.116
4 H LEU 2 HN LEU 2 -7.925 4.304 1.522
5 HA LEU 2 HA LEU 2 -6.461 5.449 3.791
6 HB2 LEU 2 2HB LEU 2 -8.743 3.475 3.724
7 HB3 LEU 2 1HB LEU 2 -7.800 3.767 5.164
8 HG LEU 2 HG LEU 2 -9.827 4.956 5.387
9 HD11 LEU 2 1HD1 LEU 2 -9.131 7.253 5.611
10 HD12 LEU 2 2HD1 LEU 2 -7.717 6.936 4.615
11 HD13 LEU 2 3HD1 LEU 2 -7.887 6.139 6.181
12 HD21 LEU 2 1HD2 LEU 2 -10.634 6.621 3.796
13 HD22 LEU 2 2HD2 LEU 2 -10.529 5.022 3.055
14 HD23 LEU 2 3HD2 LEU 2 -9.298 6.236 2.712
15 HA PRO 3 HA PRO 3 -3.551 2.129 3.427
16 HB2 PRO 3 2HB PRO 3 -2.455 2.121 5.870
17 HB3 PRO 3 1HB PRO 3 -2.250 3.504 4.790
18 HG2 PRO 3 2HG PRO 3 -4.176 3.159 7.058
19 HG3 PRO 3 1HG PRO 3 -3.139 4.545 6.675
20 HD2 PRO 3 2HD PRO 3 -5.777 4.426 6.014
21 HD3 PRO 3 1HD PRO 3 -4.580 5.328 5.062
22 H ILE 4 HN ILE 4 -6.021 1.145 3.633
23 HA ILE 4 HA ILE 4 -6.810 -0.425 5.819
24 HB ILE 4 HB ILE 4 -7.389 -0.795 2.873
25 HG12 ILE 4 2HG1 ILE 4 -8.075 1.393 3.673
26 HG13 ILE 4 1HG1 ILE 4 -9.485 0.407 3.317
27 HG21 ILE 4 1HG2 ILE 4 -9.393 -2.015 3.511
28 HG22 ILE 4 2HG2 ILE 4 -8.880 -1.969 5.203
29 HG23 ILE 4 3HG2 ILE 4 -7.913 -2.839 4.003
30 HD11 ILE 4 1HD1 ILE 4 -9.755 -0.032 5.723
31 HD12 ILE 4 2HD1 ILE 4 -9.825 1.687 5.340
32 HD13 ILE 4 3HD1 ILE 4 -8.367 1.006 6.055
33 H CYS 5 HN CYS 5 -4.553 -1.092 3.269
34 HA CYS 5 HA CYS 5 -4.458 -3.897 3.774
35 HB2 CYS 5 2HB CYS 5 -2.647 -2.123 2.156
36 HB3 CYS 5 1HB CYS 5 -2.594 -3.887 2.153
37 H GLY 6 HN GLY 6 -2.965 -1.147 5.175
38 HA2 GLY 6 2HA GLY 6 -1.756 -1.046 7.123
39 HA3 GLY 6 1HA GLY 6 -1.739 -2.799 7.162
40 H GLU 7 HN GLU 7 -0.525 -3.339 4.809
41 HA GLU 7 HA GLU 7 2.169 -3.144 5.474
42 HB2 GLU 7 2HB GLU 7 2.595 -4.269 3.355
43 HB3 GLU 7 1HB GLU 7 1.263 -5.020 4.214
44 HG2 GLU 7 2HG GLU 7 -0.308 -3.839 2.725
45 HG3 GLU 7 1HG GLU 7 1.067 -3.175 1.842
46 H THR 8 HN THR 8 3.853 -2.242 4.274
47 HA THR 8 HA THR 8 3.107 0.362 3.220
48 HB THR 8 HB THR 8 5.478 0.987 3.892
49 HG1 THR 8 1HG THR 8 5.734 -1.558 4.316
50 HG21 THR 8 1HG2 THR 8 3.540 0.135 6.038
51 HG22 THR 8 2HG2 THR 8 3.536 1.682 5.183
52 HG23 THR 8 3HG2 THR 8 4.875 1.269 6.263
53 H CYS 9 HN CYS 9 5.120 1.191 1.913
54 HA CYS 9 HA CYS 9 5.742 -0.869 -0.034
55 HB2 CYS 9 2HB CYS 9 5.081 2.024 -0.434
56 HB3 CYS 9 1HB CYS 9 5.906 1.078 -1.662
57 H LEU 10 HN LEU 10 7.586 -1.130 1.481
58 HA LEU 10 HA LEU 10 9.557 0.966 1.294
59 HB2 LEU 10 2HB LEU 10 9.283 -0.531 3.321
60 HB3 LEU 10 1HB LEU 10 9.916 -1.839 2.346
61 HG LEU 10 HG LEU 10 12.067 -0.689 2.146
62 HD11 LEU 10 1HD1 LEU 10 12.488 1.348 3.467
63 HD12 LEU 10 2HD1 LEU 10 10.766 1.425 3.863
64 HD13 LEU 10 3HD1 LEU 10 11.297 1.611 2.195
65 HD21 LEU 10 1HD2 LEU 10 11.710 -2.193 4.048
66 HD22 LEU 10 2HD2 LEU 10 11.069 -0.848 4.987
67 HD23 LEU 10 3HD2 LEU 10 12.761 -0.847 4.492
68 H LEU 11 HN LEU 11 8.756 -2.068 -0.174
69 HA LEU 11 HA LEU 11 11.051 -1.983 -1.977
70 HB2 LEU 11 2HB LEU 11 8.685 -3.863 -1.839
71 HB3 LEU 11 1HB LEU 11 10.074 -4.051 -2.882
72 HG LEU 11 HG LEU 11 10.214 -4.108 0.128
73 HD11 LEU 11 1HD1 LEU 11 10.198 -6.384 -1.851
74 HD12 LEU 11 2HD1 LEU 11 8.902 -5.986 -0.726
75 HD13 LEU 11 3HD1 LEU 11 10.465 -6.522 -0.114
76 HD21 LEU 11 1HD2 LEU 11 12.426 -5.070 -0.294
77 HD22 LEU 11 2HD2 LEU 11 12.288 -3.434 -0.933
78 HD23 LEU 11 3HD2 LEU 11 12.206 -4.818 -2.025
79 H GLY 12 HN GLY 12 7.685 -1.334 -1.782
80 HA2 GLY 12 2HA GLY 12 6.591 0.274 -3.252
81 HA3 GLY 12 1HA GLY 12 7.735 -0.198 -4.501
82 H LYS 13 HN LYS 13 6.141 -2.476 -2.429
83 HA LYS 13 HA LYS 13 4.582 -3.423 -4.706
84 HB2 LYS 13 2HB LYS 13 6.730 -4.623 -4.586
85 HB3 LYS 13 1HB LYS 13 6.375 -5.073 -2.930
86 HG2 LYS 13 2HG LYS 13 4.444 -6.366 -3.715
87 HG3 LYS 13 1HG LYS 13 4.856 -5.935 -5.378
88 HD2 LYS 13 2HD LYS 13 7.081 -6.971 -5.045
89 HD3 LYS 13 1HD LYS 13 6.563 -7.480 -3.439
90 HE2 LYS 13 2HE LYS 13 6.351 -9.297 -5.049
91 HE3 LYS 13 1HE LYS 13 4.780 -8.807 -4.417
92 HZ1 LYS 13 1HZ LYS 13 5.896 -7.933 -7.032
93 HZ2 LYS 13 2HZ LYS 13 4.366 -7.579 -6.447
94 HZ3 LYS 13 3HZ LYS 13 4.766 -9.156 -6.836
95 H CYS 14 HN CYS 14 2.600 -4.085 -4.107
96 HA CYS 14 HA CYS 14 1.976 -4.320 -1.254
97 HB2 CYS 14 2HB CYS 14 0.200 -3.671 -3.614
98 HB3 CYS 14 1HB CYS 14 -0.381 -3.936 -1.975
99 H TYR 15 HN TYR 15 1.545 -6.276 -0.558
100 HA TYR 15 HA TYR 15 1.371 -8.410 -2.485
101 HB2 TYR 15 2HB TYR 15 1.542 -8.440 0.523
102 HB3 TYR 15 1HB TYR 15 1.435 -9.889 -0.475
103 HD1 TYR 15 1HD TYR 15 3.355 -10.809 -1.478
104 HD2 TYR 15 2HD TYR 15 3.554 -6.904 0.195
105 HE1 TYR 15 1HE TYR 15 5.783 -10.809 -1.781
106 HE2 TYR 15 2HE TYR 15 5.973 -6.888 -0.101
107 HH TYR 15 HH TYR 15 7.789 -8.594 -0.291
108 H THR 16 HN THR 16 -0.725 -6.784 -0.207
109 HA THR 16 HA THR 16 -2.920 -8.549 -0.538
110 HB THR 16 HB THR 16 -3.019 -5.568 0.029
111 HG1 THR 16 1HG THR 16 -1.738 -6.558 1.567
112 HG21 THR 16 1HG2 THR 16 -5.192 -6.555 -0.552
113 HG22 THR 16 2HG2 THR 16 -5.152 -6.091 1.148
114 HG23 THR 16 3HG2 THR 16 -4.974 -7.786 0.693
115 HA PRO 17 HA PRO 17 -3.642 -7.315 -4.795
116 HB2 PRO 17 2HB PRO 17 -5.785 -8.924 -5.251
117 HB3 PRO 17 1HB PRO 17 -4.126 -9.522 -5.263
118 HG2 PRO 17 2HG PRO 17 -6.191 -9.716 -3.118
119 HG3 PRO 17 1HG PRO 17 -4.996 -10.917 -3.635
120 HD2 PRO 17 2HD PRO 17 -4.715 -9.343 -1.420
121 HD3 PRO 17 1HD PRO 17 -3.345 -10.003 -2.335
122 H GLY 18 HN GLY 18 -4.812 -5.656 -5.556
123 HA2 GLY 18 2HA GLY 18 -6.766 -4.403 -5.905
124 HA3 GLY 18 1HA GLY 18 -7.481 -5.164 -4.490
125 H CYS 19 HN CYS 19 -4.263 -3.917 -4.261
126 HA CYS 19 HA CYS 19 -5.311 -1.616 -2.773
127 HB2 CYS 19 2HB CYS 19 -4.128 -3.731 -1.620
128 HB3 CYS 19 1HB CYS 19 -2.685 -2.841 -2.087
129 H SER 20 HN SER 20 -3.820 0.305 -2.891
130 HA SER 20 HA SER 20 -2.301 0.201 -5.384
131 HB2 SER 20 2HB SER 20 -4.426 1.556 -5.408
132 HB3 SER 20 1HB SER 20 -3.722 2.579 -4.162
133 HG SER 20 HG SER 20 -2.983 2.234 -6.838
134 H CYS 21 HN CYS 21 -0.202 0.532 -5.164
135 HA CYS 21 HA CYS 21 0.882 1.276 -2.625
136 HB2 CYS 21 2HB CYS 21 1.938 -0.500 -3.921
137 HB3 CYS 21 1HB CYS 21 2.232 0.618 -5.247
138 H ARG 22 HN ARG 22 0.928 3.319 -2.058
139 HA ARG 22 HA ARG 22 1.896 5.288 -3.997
140 HB2 ARG 22 2HB ARG 22 0.191 5.829 -1.538
141 HB3 ARG 22 1HB ARG 22 0.738 7.012 -2.702
142 HG2 ARG 22 2HG ARG 22 -0.632 6.025 -4.438
143 HG3 ARG 22 1HG ARG 22 -1.163 4.764 -3.325
144 HD2 ARG 22 2HD ARG 22 -2.197 6.466 -1.900
145 HD3 ARG 22 1HD ARG 22 -1.654 7.723 -3.009
146 HE ARG 22 HE ARG 22 -3.096 5.935 -4.520
147 HH11 ARG 22 1HH1 ARG 22 -3.751 8.121 -1.828
148 HH12 ARG 22 2HH1 ARG 22 -5.391 8.341 -2.201
149 HH21 ARG 22 1HH2 ARG 22 -5.371 6.238 -5.061
150 HH22 ARG 22 2HH2 ARG 22 -6.332 7.256 -4.093
151 H ARG 23 HN ARG 23 3.914 4.691 -3.550
152 HA ARG 23 HA ARG 23 5.046 3.851 -1.263
153 HB2 ARG 23 2HB ARG 23 5.890 3.827 -3.637
154 HB3 ARG 23 1HB ARG 23 6.410 5.485 -3.347
155 HG2 ARG 23 2HG ARG 23 7.915 4.778 -1.687
156 HG3 ARG 23 1HG ARG 23 7.361 3.102 -1.820
157 HD2 ARG 23 2HD ARG 23 8.034 3.174 -4.239
158 HD3 ARG 23 1HD ARG 23 8.787 4.734 -3.916
159 HE ARG 23 HE ARG 23 9.906 3.232 -2.062
160 HH11 ARG 23 1HH1 ARG 23 9.553 2.698 -5.568
161 HH12 ARG 23 2HH1 ARG 23 10.887 1.650 -5.658
162 HH21 ARG 23 1HH2 ARG 23 11.736 1.745 -2.235
163 HH22 ARG 23 2HH2 ARG 23 12.130 1.094 -3.756
164 HA PRO 24 HA PRO 24 6.501 3.796 0.038
165 HB2 PRO 24 2HB PRO 24 7.223 3.969 2.560
166 HB3 PRO 24 1HB PRO 24 8.111 4.841 1.306
167 HG2 PRO 24 2HG PRO 24 6.115 5.866 3.266
168 HG3 PRO 24 1HG PRO 24 7.591 6.638 2.666
169 HD2 PRO 24 2HD PRO 24 4.958 7.065 1.711
170 HD3 PRO 24 1HD PRO 24 6.459 7.605 0.935
171 H VAL 25 HN VAL 25 3.416 4.615 0.578
172 HA VAL 25 HA VAL 25 3.024 2.483 2.572
173 HB VAL 25 HB VAL 25 1.229 4.924 2.370
174 HG11 VAL 25 1HG1 VAL 25 1.377 2.783 4.481
175 HG12 VAL 25 2HG1 VAL 25 0.120 2.965 3.258
176 HG13 VAL 25 3HG1 VAL 25 0.314 4.192 4.509
177 HG21 VAL 25 1HG2 VAL 25 3.401 5.673 3.174
178 HG22 VAL 25 2HG2 VAL 25 3.400 4.408 4.402
179 HG23 VAL 25 3HG2 VAL 25 2.219 5.717 4.484
180 H CYS 26 HN CYS 26 1.017 1.201 2.260
181 HA CYS 26 HA CYS 26 0.166 1.358 -0.516
182 HB2 CYS 26 2HB CYS 26 1.237 -0.754 0.363
183 HB3 CYS 26 1HB CYS 26 -0.134 -0.925 1.447
184 H TYR 27 HN TYR 27 -1.836 2.065 -0.935
185 HA TYR 27 HA TYR 27 -3.707 2.337 1.319
186 HB2 TYR 27 2HB TYR 27 -3.238 4.263 -0.959
187 HB3 TYR 27 1HB TYR 27 -4.567 4.379 0.180
188 HD1 TYR 27 1HD TYR 27 -1.057 4.957 -0.383
189 HD2 TYR 27 2HD TYR 27 -4.114 4.941 2.533
190 HE1 TYR 27 1HE TYR 27 0.370 6.295 1.094
191 HE2 TYR 27 2HE TYR 27 -2.719 6.259 4.040
192 HH TYR 27 HH TYR 27 -0.335 6.657 4.392
193 H LYS 28 HN LYS 28 -5.777 1.885 0.980
194 HA LYS 28 HA LYS 28 -6.619 1.033 -1.679
195 HB2 LYS 28 2HB LYS 28 -6.292 -0.894 -0.209
196 HB3 LYS 28 1HB LYS 28 -7.272 -0.115 1.023
197 HG2 LYS 28 2HG LYS 28 -9.217 -0.242 -0.428
198 HG3 LYS 28 1HG LYS 28 -8.239 -1.033 -1.671
199 HD2 LYS 28 2HD LYS 28 -7.741 -2.846 -0.099
200 HD3 LYS 28 1HD LYS 28 -8.759 -2.063 1.110
201 HE2 LYS 28 2HE LYS 28 -9.965 -3.836 0.013
202 HE3 LYS 28 1HE LYS 28 -10.678 -2.272 -0.369
203 HZ1 LYS 28 1HZ LYS 28 -9.591 -2.324 -2.524
204 HZ2 LYS 28 2HZ LYS 28 -10.489 -3.733 -2.326
205 HZ3 LYS 28 3HZ LYS 28 -8.820 -3.774 -2.138
206 H ASN 29 HN ASN 29 -8.091 2.462 -2.320
207 HA ASN 29 HA ASN 29 -9.915 3.828 -2.393
208 HB2 ASN 29 2HB ASN 29 -11.010 1.883 -1.216
209 HB3 ASN 29 1HB ASN 29 -10.591 2.622 0.318
210 HD21 ASN 29 1HD2 ASN 29 -12.675 2.702 0.943
211 HD22 ASN 29 2HD2 ASN 29 -13.853 3.790 0.299
Start of MODEL 6
1 H1 GLY 1 HN GLY 1 -6.820 3.580 -1.678
2 HA2 GLY 1 2HA GLY 1 -5.831 5.727 -1.527
3 HA3 GLY 1 1HA GLY 1 -7.438 6.426 -1.381
4 H LEU 2 HN LEU 2 -7.565 3.839 0.598
5 HA LEU 2 HA LEU 2 -6.827 5.503 2.899
6 HB2 LEU 2 2HB LEU 2 -8.794 3.221 2.768
7 HB3 LEU 2 1HB LEU 2 -8.408 4.130 4.212
8 HG LEU 2 HG LEU 2 -9.340 6.158 2.878
9 HD11 LEU 2 1HD1 LEU 2 -9.472 5.117 0.707
10 HD12 LEU 2 2HD1 LEU 2 -11.087 5.564 1.266
11 HD13 LEU 2 3HD1 LEU 2 -10.561 3.886 1.338
12 HD21 LEU 2 1HD2 LEU 2 -10.361 5.206 4.841
13 HD22 LEU 2 2HD2 LEU 2 -11.124 3.949 3.866
14 HD23 LEU 2 3HD2 LEU 2 -11.595 5.640 3.657
15 HA PRO 3 HA PRO 3 -3.690 2.500 3.939
16 HB2 PRO 3 2HB PRO 3 -3.197 3.229 6.478
17 HB3 PRO 3 1HB PRO 3 -2.807 4.302 5.129
18 HG2 PRO 3 2HG PRO 3 -5.199 4.336 6.937
19 HG3 PRO 3 1HG PRO 3 -4.164 5.686 6.438
20 HD2 PRO 3 2HD PRO 3 -6.554 5.157 5.254
21 HD3 PRO 3 1HD PRO 3 -5.183 5.871 4.381
22 H ILE 4 HN ILE 4 -6.266 1.463 4.023
23 HA ILE 4 HA ILE 4 -7.001 0.239 6.500
24 HB ILE 4 HB ILE 4 -7.861 -0.346 3.661
25 HG12 ILE 4 2HG1 ILE 4 -8.399 1.904 4.305
26 HG13 ILE 4 1HG1 ILE 4 -9.878 0.956 4.225
27 HG21 ILE 4 1HG2 ILE 4 -9.166 -1.265 6.212
28 HG22 ILE 4 2HG2 ILE 4 -8.304 -2.266 5.039
29 HG23 ILE 4 3HG2 ILE 4 -9.807 -1.470 4.575
30 HD11 ILE 4 1HD1 ILE 4 -9.932 2.441 6.128
31 HD12 ILE 4 2HD1 ILE 4 -8.412 1.791 6.726
32 HD13 ILE 4 3HD1 ILE 4 -9.853 0.771 6.690
33 H CYS 5 HN CYS 5 -4.949 -0.664 3.848
34 HA CYS 5 HA CYS 5 -4.987 -3.455 4.107
35 HB2 CYS 5 2HB CYS 5 -2.618 -1.817 3.203
36 HB3 CYS 5 1HB CYS 5 -3.082 -3.436 2.678
37 H GLY 6 HN GLY 6 -3.103 -0.956 5.734
38 HA2 GLY 6 2HA GLY 6 -2.049 -0.986 7.759
39 HA3 GLY 6 1HA GLY 6 -2.634 -2.626 7.998
40 H GLU 7 HN GLU 7 -0.806 -1.663 5.218
41 HA GLU 7 HA GLU 7 1.543 -2.950 6.283
42 HB2 GLU 7 2HB GLU 7 1.740 -4.388 4.294
43 HB3 GLU 7 1HB GLU 7 0.351 -4.773 5.298
44 HG2 GLU 7 2HG GLU 7 -1.034 -3.427 3.701
45 HG3 GLU 7 1HG GLU 7 0.381 -3.360 2.649
46 H THR 8 HN THR 8 3.398 -2.681 4.882
47 HA THR 8 HA THR 8 3.241 -0.124 3.520
48 HB THR 8 HB THR 8 5.789 -0.244 3.949
49 HG1 THR 8 1HG THR 8 5.098 -1.737 6.216
50 HG21 THR 8 1HG2 THR 8 3.846 0.188 6.222
51 HG22 THR 8 2HG2 THR 8 4.320 1.375 4.996
52 HG23 THR 8 3HG2 THR 8 5.512 0.780 6.151
53 H CYS 9 HN CYS 9 4.895 0.137 1.827
54 HA CYS 9 HA CYS 9 5.728 -2.251 0.525
55 HB2 CYS 9 2HB CYS 9 4.697 -1.568 -1.654
56 HB3 CYS 9 1HB CYS 9 3.548 -2.038 -0.406
57 H LEU 10 HN LEU 10 7.754 -1.461 1.056
58 HA LEU 10 HA LEU 10 8.676 1.115 0.214
59 HB2 LEU 10 2HB LEU 10 10.152 -1.262 1.327
60 HB3 LEU 10 1HB LEU 10 10.961 0.213 0.863
61 HG LEU 10 HG LEU 10 9.588 1.428 2.580
62 HD11 LEU 10 1HD1 LEU 10 8.816 -1.337 3.483
63 HD12 LEU 10 2HD1 LEU 10 7.736 -0.135 2.779
64 HD13 LEU 10 3HD1 LEU 10 8.497 0.173 4.341
65 HD21 LEU 10 1HD2 LEU 10 11.869 0.784 3.032
66 HD22 LEU 10 2HD2 LEU 10 11.340 -0.815 3.553
67 HD23 LEU 10 3HD2 LEU 10 10.883 0.614 4.482
68 H LEU 11 HN LEU 11 8.373 -1.838 -1.377
69 HA LEU 11 HA LEU 11 10.517 -1.348 -3.281
70 HB2 LEU 11 2HB LEU 11 8.322 -3.420 -3.383
71 HB3 LEU 11 1HB LEU 11 9.757 -3.375 -4.374
72 HG LEU 11 HG LEU 11 9.730 -3.834 -1.392
73 HD11 LEU 11 1HD1 LEU 11 10.233 -5.741 -3.667
74 HD12 LEU 11 2HD1 LEU 11 8.807 -5.712 -2.631
75 HD13 LEU 11 3HD1 LEU 11 10.385 -6.108 -1.948
76 HD21 LEU 11 1HD2 LEU 11 11.980 -3.897 -3.391
77 HD22 LEU 11 2HD2 LEU 11 12.077 -4.408 -1.707
78 HD23 LEU 11 3HD2 LEU 11 11.760 -2.716 -2.092
79 H GLY 12 HN GLY 12 7.312 -0.451 -2.851
80 HA2 GLY 12 2HA GLY 12 6.080 1.002 -4.221
81 HA3 GLY 12 1HA GLY 12 7.168 0.623 -5.555
82 H LYS 13 HN LYS 13 6.023 -2.011 -3.751
83 HA LYS 13 HA LYS 13 3.785 -2.538 -5.524
84 HB2 LYS 13 2HB LYS 13 5.762 -3.635 -6.551
85 HB3 LYS 13 1HB LYS 13 6.129 -4.421 -5.034
86 HG2 LYS 13 2HG LYS 13 3.523 -4.965 -6.425
87 HG3 LYS 13 1HG LYS 13 5.002 -5.752 -6.967
88 HD2 LYS 13 2HD LYS 13 5.321 -6.704 -4.731
89 HD3 LYS 13 1HD LYS 13 3.873 -5.876 -4.165
90 HE2 LYS 13 2HE LYS 13 3.925 -7.949 -6.364
91 HE3 LYS 13 1HE LYS 13 3.497 -8.274 -4.686
92 HZ1 LYS 13 1HZ LYS 13 1.525 -7.964 -6.029
93 HZ2 LYS 13 2HZ LYS 13 2.058 -6.456 -6.535
94 HZ3 LYS 13 3HZ LYS 13 1.659 -6.698 -4.914
95 H CYS 14 HN CYS 14 2.106 -3.009 -4.239
96 HA CYS 14 HA CYS 14 2.632 -3.484 -1.445
97 HB2 CYS 14 2HB CYS 14 0.746 -1.992 -2.286
98 HB3 CYS 14 1HB CYS 14 -0.051 -3.479 -2.809
99 H TYR 15 HN TYR 15 1.867 -5.292 -0.282
100 HA TYR 15 HA TYR 15 2.298 -7.638 -1.830
101 HB2 TYR 15 2HB TYR 15 2.020 -7.191 1.137
102 HB3 TYR 15 1HB TYR 15 2.260 -8.789 0.423
103 HD1 TYR 15 1HD TYR 15 4.401 -9.454 -0.406
104 HD2 TYR 15 2HD TYR 15 3.802 -5.472 0.951
105 HE1 TYR 15 1HE TYR 15 6.806 -9.065 -0.512
106 HE2 TYR 15 2HE TYR 15 6.204 -5.071 0.862
107 HH TYR 15 HH TYR 15 8.301 -7.162 -0.770
108 H THR 16 HN THR 16 -0.369 -6.185 -0.089
109 HA THR 16 HA THR 16 -2.096 -8.364 -0.784
110 HB THR 16 HB THR 16 -2.650 -5.675 0.496
111 HG1 THR 16 1HG THR 16 -1.972 -6.767 2.137
112 HG21 THR 16 1HG2 THR 16 -4.660 -6.409 -0.742
113 HG22 THR 16 2HG2 THR 16 -4.915 -6.517 0.998
114 HG23 THR 16 3HG2 THR 16 -4.581 -7.975 0.065
115 HA PRO 17 HA PRO 17 -3.137 -6.720 -4.869
116 HB2 PRO 17 2HB PRO 17 -5.437 -8.553 -4.643
117 HB3 PRO 17 1HB PRO 17 -4.154 -8.526 -5.855
118 HG2 PRO 17 2HG PRO 17 -4.289 -10.462 -4.002
119 HG3 PRO 17 1HG PRO 17 -2.739 -9.828 -4.579
120 HD2 PRO 17 2HD PRO 17 -4.186 -9.249 -2.029
121 HD3 PRO 17 1HD PRO 17 -2.450 -9.491 -2.340
122 H GLY 18 HN GLY 18 -4.426 -5.038 -5.388
123 HA2 GLY 18 2HA GLY 18 -6.527 -3.951 -5.477
124 HA3 GLY 18 1HA GLY 18 -6.954 -4.701 -3.945
125 H CYS 19 HN CYS 19 -4.075 -3.971 -3.146
126 HA CYS 19 HA CYS 19 -4.792 -1.335 -2.162
127 HB2 CYS 19 2HB CYS 19 -2.537 -3.203 -1.408
128 HB3 CYS 19 1HB CYS 19 -2.775 -1.603 -0.724
129 H SER 20 HN SER 20 -4.089 0.427 -3.189
130 HA SER 20 HA SER 20 -2.105 0.251 -5.228
131 HB2 SER 20 2HB SER 20 -3.445 2.663 -3.968
132 HB3 SER 20 1HB SER 20 -2.551 2.647 -5.489
133 HG SER 20 HG SER 20 -4.300 2.027 -6.432
134 H CYS 21 HN CYS 21 0.020 0.812 -5.007
135 HA CYS 21 HA CYS 21 0.902 1.186 -2.289
136 HB2 CYS 21 2HB CYS 21 1.983 -0.576 -3.564
137 HB3 CYS 21 1HB CYS 21 2.456 0.586 -4.802
138 H ARG 22 HN ARG 22 1.010 3.179 -1.627
139 HA ARG 22 HA ARG 22 2.130 5.168 -3.455
140 HB2 ARG 22 2HB ARG 22 0.644 5.646 -0.852
141 HB3 ARG 22 1HB ARG 22 1.185 6.872 -1.982
142 HG2 ARG 22 2HG ARG 22 -0.940 4.812 -2.493
143 HG3 ARG 22 1HG ARG 22 -1.209 6.519 -2.153
144 HD2 ARG 22 2HD ARG 22 0.031 7.088 -4.202
145 HD3 ARG 22 1HD ARG 22 0.241 5.366 -4.523
146 HE ARG 22 HE ARG 22 -2.471 6.077 -4.123
147 HH11 ARG 22 1HH1 ARG 22 0.087 6.031 -6.582
148 HH12 ARG 22 2HH1 ARG 22 -1.016 5.963 -7.880
149 HH21 ARG 22 1HH2 ARG 22 -3.925 5.967 -5.886
150 HH22 ARG 22 2HH2 ARG 22 -3.336 5.948 -7.487
151 H ARG 23 HN ARG 23 4.135 4.545 -3.179
152 HA ARG 23 HA ARG 23 5.255 3.277 -1.128
153 HB2 ARG 23 2HB ARG 23 7.482 3.955 -1.986
154 HB3 ARG 23 1HB ARG 23 6.374 3.391 -3.228
155 HG2 ARG 23 2HG ARG 23 5.886 5.698 -3.832
156 HG3 ARG 23 1HG ARG 23 7.011 6.241 -2.583
157 HD2 ARG 23 2HD ARG 23 8.832 5.129 -3.718
158 HD3 ARG 23 1HD ARG 23 7.709 4.511 -4.934
159 HE ARG 23 HE ARG 23 7.931 7.388 -4.540
160 HH11 ARG 23 1HH1 ARG 23 8.589 4.566 -6.607
161 HH12 ARG 23 2HH1 ARG 23 8.944 5.513 -7.980
162 HH21 ARG 23 1HH2 ARG 23 8.462 8.659 -6.506
163 HH22 ARG 23 2HH2 ARG 23 8.879 7.810 -7.915
164 HA PRO 24 HA PRO 24 6.426 2.726 0.140
165 HB2 PRO 24 2HB PRO 24 7.332 2.363 2.590
166 HB3 PRO 24 1HB PRO 24 8.292 3.243 1.394
167 HG2 PRO 24 2HG PRO 24 6.785 4.276 3.733
168 HG3 PRO 24 1HG PRO 24 8.240 4.923 2.961
169 HD2 PRO 24 2HD PRO 24 5.510 5.728 2.542
170 HD3 PRO 24 1HD PRO 24 6.965 6.352 1.743
171 H VAL 25 HN VAL 25 3.626 3.936 0.880
172 HA VAL 25 HA VAL 25 2.867 1.941 2.908
173 HB VAL 25 HB VAL 25 1.679 4.715 2.578
174 HG11 VAL 25 1HG1 VAL 25 0.007 3.130 3.350
175 HG12 VAL 25 2HG1 VAL 25 0.451 4.233 4.657
176 HG13 VAL 25 3HG1 VAL 25 1.092 2.589 4.628
177 HG21 VAL 25 1HG2 VAL 25 3.448 3.613 4.752
178 HG22 VAL 25 2HG2 VAL 25 2.661 5.190 4.773
179 HG23 VAL 25 3HG2 VAL 25 3.889 4.833 3.557
180 H CYS 26 HN CYS 26 0.993 0.764 2.557
181 HA CYS 26 HA CYS 26 -0.081 0.810 -0.118
182 HB2 CYS 26 2HB CYS 26 -0.606 -0.939 2.274
183 HB3 CYS 26 1HB CYS 26 -1.403 -1.146 0.723
184 H TYR 27 HN TYR 27 -2.043 1.579 -0.708
185 HA TYR 27 HA TYR 27 -3.937 2.329 1.396
186 HB2 TYR 27 2HB TYR 27 -3.148 3.970 -1.019
187 HB3 TYR 27 1HB TYR 27 -4.557 4.303 -0.032
188 HD1 TYR 27 1HD TYR 27 -0.875 4.335 -0.108
189 HD2 TYR 27 2HD TYR 27 -4.337 5.410 2.096
190 HE1 TYR 27 1HE TYR 27 0.490 5.775 1.319
191 HE2 TYR 27 2HE TYR 27 -2.983 6.843 3.543
192 HH TYR 27 HH TYR 27 -0.664 7.045 4.236
193 H LYS 28 HN LYS 28 -5.722 1.164 1.087
194 HA LYS 28 HA LYS 28 -6.377 0.241 -1.600
195 HB2 LYS 28 2HB LYS 28 -6.469 -1.428 0.242
196 HB3 LYS 28 1HB LYS 28 -7.678 -0.441 1.054
197 HG2 LYS 28 2HG LYS 28 -9.192 -0.742 -0.851
198 HG3 LYS 28 1HG LYS 28 -7.986 -1.757 -1.636
199 HD2 LYS 28 2HD LYS 28 -8.129 -3.357 0.201
200 HD3 LYS 28 1HD LYS 28 -9.313 -2.327 1.013
201 HE2 LYS 28 2HE LYS 28 -9.669 -3.561 -1.716
202 HE3 LYS 28 1HE LYS 28 -10.357 -4.203 -0.226
203 HZ1 LYS 28 1HZ LYS 28 -11.936 -2.868 -1.512
204 HZ2 LYS 28 2HZ LYS 28 -10.977 -1.486 -1.327
205 HZ3 LYS 28 3HZ LYS 28 -11.672 -2.222 0.009
206 H ASN 29 HN ASN 29 -7.595 1.496 -2.738
207 HA ASN 29 HA ASN 29 -9.155 2.960 -3.453
208 HB2 ASN 29 2HB ASN 29 -10.468 2.519 -0.738
209 HB3 ASN 29 1HB ASN 29 -11.201 3.413 -2.061
210 HD21 ASN 29 1HD2 ASN 29 -11.952 2.264 -3.857
211 HD22 ASN 29 2HD2 ASN 29 -12.226 0.560 -3.807
Start of MODEL 7
1 H1 GLY 1 HN GLY 1 -8.407 3.775 0.087
2 HA2 GLY 1 2HA GLY 1 -7.649 6.230 -0.990
3 HA3 GLY 1 1HA GLY 1 -9.106 6.487 -0.033
4 H LEU 2 HN LEU 2 -8.610 4.535 1.931
5 HA LEU 2 HA LEU 2 -6.610 5.998 3.470
6 HB2 LEU 2 2HB LEU 2 -8.720 3.998 4.284
7 HB3 LEU 2 1HB LEU 2 -7.643 4.793 5.407
8 HG LEU 2 HG LEU 2 -9.733 6.155 3.702
9 HD11 LEU 2 1HD1 LEU 2 -10.884 6.538 5.822
10 HD12 LEU 2 2HD1 LEU 2 -9.656 5.590 6.660
11 HD13 LEU 2 3HD1 LEU 2 -10.711 4.817 5.476
12 HD21 LEU 2 1HD2 LEU 2 -7.895 7.270 5.826
13 HD22 LEU 2 2HD2 LEU 2 -9.216 8.144 5.053
14 HD23 LEU 2 3HD2 LEU 2 -7.830 7.628 4.099
15 HA PRO 3 HA PRO 3 -3.575 2.689 3.422
16 HB2 PRO 3 2HB PRO 3 -2.489 2.875 5.889
17 HB3 PRO 3 1HB PRO 3 -2.243 4.126 4.665
18 HG2 PRO 3 2HG PRO 3 -4.205 4.058 6.928
19 HG3 PRO 3 1HG PRO 3 -3.117 5.374 6.441
20 HD2 PRO 3 2HD PRO 3 -5.703 5.365 5.750
21 HD3 PRO 3 1HD PRO 3 -4.454 5.981 4.651
22 H ILE 4 HN ILE 4 -6.045 1.670 3.784
23 HA ILE 4 HA ILE 4 -6.695 0.275 6.116
24 HB ILE 4 HB ILE 4 -7.480 -0.316 3.259
25 HG12 ILE 4 2HG1 ILE 4 -8.074 1.938 3.918
26 HG13 ILE 4 1HG1 ILE 4 -9.527 0.960 3.791
27 HG21 ILE 4 1HG2 ILE 4 -9.434 -1.476 4.154
28 HG22 ILE 4 2HG2 ILE 4 -8.831 -1.231 5.789
29 HG23 ILE 4 3HG2 ILE 4 -7.934 -2.255 4.667
30 HD11 ILE 4 1HD1 ILE 4 -9.667 2.400 5.718
31 HD12 ILE 4 2HD1 ILE 4 -8.130 1.800 6.328
32 HD13 ILE 4 3HD1 ILE 4 -9.528 0.726 6.261
33 H CYS 5 HN CYS 5 -4.721 -0.758 3.383
34 HA CYS 5 HA CYS 5 -4.642 -3.491 4.141
35 HB2 CYS 5 2HB CYS 5 -2.664 -1.947 2.463
36 HB3 CYS 5 1HB CYS 5 -2.843 -3.701 2.513
37 H GLY 6 HN GLY 6 -2.632 -0.690 4.881
38 HA2 GLY 6 2HA GLY 6 -1.409 -0.360 6.810
39 HA3 GLY 6 1HA GLY 6 -1.666 -2.043 7.236
40 H GLU 7 HN GLU 7 -0.630 -2.450 4.294
41 HA GLU 7 HA GLU 7 1.983 -3.139 5.167
42 HB2 GLU 7 2HB GLU 7 0.880 -3.198 2.365
43 HB3 GLU 7 1HB GLU 7 2.349 -3.982 2.920
44 HG2 GLU 7 2HG GLU 7 0.975 -5.328 4.456
45 HG3 GLU 7 1HG GLU 7 -0.467 -4.630 3.714
46 H THR 8 HN THR 8 3.906 -2.511 4.049
47 HA THR 8 HA THR 8 3.762 0.236 3.123
48 HB THR 8 HB THR 8 6.154 0.425 4.028
49 HG1 THR 8 1HG THR 8 5.284 -1.930 5.345
50 HG21 THR 8 1HG2 THR 8 5.377 1.002 6.291
51 HG22 THR 8 2HG2 THR 8 3.857 0.157 5.967
52 HG23 THR 8 3HG2 THR 8 4.287 1.596 5.038
53 H CYS 9 HN CYS 9 4.677 0.679 1.282
54 HA CYS 9 HA CYS 9 5.831 -1.476 -0.263
55 HB2 CYS 9 2HB CYS 9 5.353 1.410 -1.026
56 HB3 CYS 9 1HB CYS 9 5.909 0.152 -2.111
57 H LEU 10 HN LEU 10 7.620 -1.600 1.238
58 HA LEU 10 HA LEU 10 9.523 0.539 1.328
59 HB2 LEU 10 2HB LEU 10 9.838 -2.351 2.139
60 HB3 LEU 10 1HB LEU 10 10.901 -1.036 2.590
61 HG LEU 10 HG LEU 10 8.016 -1.283 3.427
62 HD11 LEU 10 1HD1 LEU 10 10.543 -1.778 4.988
63 HD12 LEU 10 2HD1 LEU 10 9.415 -3.007 4.421
64 HD13 LEU 10 3HD1 LEU 10 8.899 -1.835 5.624
65 HD21 LEU 10 1HD2 LEU 10 10.179 0.656 4.263
66 HD22 LEU 10 2HD2 LEU 10 8.568 0.548 4.971
67 HD23 LEU 10 3HD2 LEU 10 8.757 1.038 3.292
68 H LEU 11 HN LEU 11 9.193 -2.576 -0.260
69 HA LEU 11 HA LEU 11 11.622 -2.186 -1.776
70 HB2 LEU 11 2HB LEU 11 9.524 -4.361 -1.944
71 HB3 LEU 11 1HB LEU 11 11.028 -4.332 -2.841
72 HG LEU 11 HG LEU 11 10.805 -4.530 0.162
73 HD11 LEU 11 1HD1 LEU 11 11.595 -6.822 -0.154
74 HD12 LEU 11 2HD1 LEU 11 11.515 -6.607 -1.903
75 HD13 LEU 11 3HD1 LEU 11 10.040 -6.557 -0.939
76 HD21 LEU 11 1HD2 LEU 11 12.846 -3.390 -0.540
77 HD22 LEU 11 2HD2 LEU 11 13.201 -4.699 -1.666
78 HD23 LEU 11 3HD2 LEU 11 13.209 -5.004 0.069
79 H GLY 12 HN GLY 12 8.198 -1.839 -2.116
80 HA2 GLY 12 2HA GLY 12 7.738 0.125 -3.640
81 HA3 GLY 12 1HA GLY 12 8.670 -0.765 -4.826
82 H LYS 13 HN LYS 13 7.041 -3.075 -3.240
83 HA LYS 13 HA LYS 13 4.770 -2.873 -5.089
84 HB2 LYS 13 2HB LYS 13 6.480 -4.513 -5.817
85 HB3 LYS 13 1HB LYS 13 6.293 -5.352 -4.289
86 HG2 LYS 13 2HG LYS 13 5.133 -6.484 -6.113
87 HG3 LYS 13 1HG LYS 13 4.013 -5.933 -4.869
88 HD2 LYS 13 2HD LYS 13 3.333 -4.077 -6.198
89 HD3 LYS 13 1HD LYS 13 4.598 -4.387 -7.386
90 HE2 LYS 13 2HE LYS 13 2.389 -6.325 -6.750
91 HE3 LYS 13 1HE LYS 13 2.292 -5.140 -8.050
92 HZ1 LYS 13 1HZ LYS 13 3.067 -7.352 -8.801
93 HZ2 LYS 13 2HZ LYS 13 4.443 -7.194 -7.849
94 HZ3 LYS 13 3HZ LYS 13 4.162 -6.120 -9.105
95 H CYS 14 HN CYS 14 2.788 -3.255 -4.211
96 HA CYS 14 HA CYS 14 2.684 -3.797 -1.368
97 HB2 CYS 14 2HB CYS 14 1.302 -1.975 -2.509
98 HB3 CYS 14 1HB CYS 14 0.381 -3.293 -3.249
99 H TYR 15 HN TYR 15 1.711 -5.656 -0.556
100 HA TYR 15 HA TYR 15 1.822 -7.808 -2.479
101 HB2 TYR 15 2HB TYR 15 1.760 -7.942 0.544
102 HB3 TYR 15 1HB TYR 15 2.129 -9.272 -0.561
103 HD1 TYR 15 1HD TYR 15 4.165 -8.996 -2.105
104 HD2 TYR 15 2HD TYR 15 3.479 -6.525 1.288
105 HE1 TYR 15 1HE TYR 15 6.510 -8.290 -2.156
106 HE2 TYR 15 2HE TYR 15 5.821 -5.812 1.256
107 HH TYR 15 HH TYR 15 7.975 -6.586 0.398
108 H THR 16 HN THR 16 -0.435 -6.043 -0.668
109 HA THR 16 HA THR 16 -2.519 -8.003 -0.788
110 HB THR 16 HB THR 16 -2.650 -5.031 -0.219
111 HG1 THR 16 1HG THR 16 -1.405 -6.064 1.289
112 HG21 THR 16 1HG2 THR 16 -4.816 -5.557 0.851
113 HG22 THR 16 2HG2 THR 16 -4.669 -7.234 0.318
114 HG23 THR 16 3HG2 THR 16 -4.841 -5.945 -0.869
115 HA PRO 17 HA PRO 17 -3.535 -6.903 -5.082
116 HB2 PRO 17 2HB PRO 17 -5.803 -8.721 -4.666
117 HB3 PRO 17 1HB PRO 17 -4.479 -8.850 -5.826
118 HG2 PRO 17 2HG PRO 17 -4.690 -10.513 -3.716
119 HG3 PRO 17 1HG PRO 17 -3.122 -9.990 -4.350
120 HD2 PRO 17 2HD PRO 17 -4.603 -9.012 -1.938
121 HD3 PRO 17 1HD PRO 17 -2.871 -9.340 -2.173
122 H GLY 18 HN GLY 18 -4.929 -5.387 -5.844
123 HA2 GLY 18 2HA GLY 18 -6.810 -4.044 -5.989
124 HA3 GLY 18 1HA GLY 18 -7.543 -4.973 -4.689
125 H CYS 19 HN CYS 19 -4.414 -3.796 -4.197
126 HA CYS 19 HA CYS 19 -5.439 -1.612 -2.537
127 HB2 CYS 19 2HB CYS 19 -4.561 -3.668 -1.310
128 HB3 CYS 19 1HB CYS 19 -2.985 -3.289 -1.988
129 H SER 20 HN SER 20 -4.391 0.312 -2.865
130 HA SER 20 HA SER 20 -2.723 0.367 -5.213
131 HB2 SER 20 2HB SER 20 -3.967 2.608 -3.637
132 HB3 SER 20 1HB SER 20 -3.313 2.685 -5.277
133 HG SER 20 HG SER 20 -5.019 0.717 -5.259
134 H CYS 21 HN CYS 21 -0.618 0.437 -4.972
135 HA CYS 21 HA CYS 21 0.605 1.013 -2.466
136 HB2 CYS 21 2HB CYS 21 1.596 -0.657 -3.948
137 HB3 CYS 21 1HB CYS 21 1.761 0.544 -5.217
138 H ARG 22 HN ARG 22 0.783 3.020 -1.768
139 HA ARG 22 HA ARG 22 1.555 5.113 -3.678
140 HB2 ARG 22 2HB ARG 22 0.195 5.562 -1.006
141 HB3 ARG 22 1HB ARG 22 0.481 6.725 -2.278
142 HG2 ARG 22 2HG ARG 22 -1.470 4.440 -2.436
143 HG3 ARG 22 1HG ARG 22 -1.884 6.102 -2.042
144 HD2 ARG 22 2HD ARG 22 -1.033 6.783 -4.259
145 HD3 ARG 22 1HD ARG 22 -0.741 5.076 -4.630
146 HE ARG 22 HE ARG 22 -3.397 5.709 -3.758
147 HH11 ARG 22 1HH1 ARG 22 -1.301 5.409 -6.608
148 HH12 ARG 22 2HH1 ARG 22 -2.591 5.061 -7.669
149 HH21 ARG 22 1HH2 ARG 22 -5.152 5.309 -5.234
150 HH22 ARG 22 2HH2 ARG 22 -4.851 5.052 -6.880
151 H ARG 23 HN ARG 23 3.696 4.564 -3.355
152 HA ARG 23 HA ARG 23 4.828 3.572 -1.090
153 HB2 ARG 23 2HB ARG 23 6.270 5.310 -3.086
154 HB3 ARG 23 1HB ARG 23 7.015 4.199 -1.967
155 HG2 ARG 23 2HG ARG 23 5.980 2.302 -3.038
156 HG3 ARG 23 1HG ARG 23 5.113 3.354 -4.146
157 HD2 ARG 23 2HD ARG 23 7.290 4.139 -5.026
158 HD3 ARG 23 1HD ARG 23 8.098 2.987 -3.960
159 HE ARG 23 HE ARG 23 6.111 1.832 -5.692
160 HH11 ARG 23 1HH1 ARG 23 9.549 2.566 -5.293
161 HH12 ARG 23 2HH1 ARG 23 10.057 1.542 -6.548
162 HH21 ARG 23 1HH2 ARG 23 6.840 0.368 -7.410
163 HH22 ARG 23 2HH2 ARG 23 8.501 0.267 -7.750
164 HA PRO 24 HA PRO 24 6.262 3.356 0.157
165 HB2 PRO 24 2HB PRO 24 7.023 3.345 2.676
166 HB3 PRO 24 1HB PRO 24 7.906 4.281 1.465
167 HG2 PRO 24 2HG PRO 24 6.014 5.218 3.568
168 HG3 PRO 24 1HG PRO 24 7.455 6.018 2.927
169 HD2 PRO 24 2HD PRO 24 4.758 6.471 2.154
170 HD3 PRO 24 1HD PRO 24 6.214 7.120 1.377
171 H VAL 25 HN VAL 25 3.191 4.190 0.792
172 HA VAL 25 HA VAL 25 2.757 1.989 2.707
173 HB VAL 25 HB VAL 25 1.177 4.594 2.732
174 HG11 VAL 25 1HG1 VAL 25 -0.176 2.721 3.463
175 HG12 VAL 25 2HG1 VAL 25 0.196 3.784 4.821
176 HG13 VAL 25 3HG1 VAL 25 1.063 2.260 4.630
177 HG21 VAL 25 1HG2 VAL 25 3.420 4.983 3.579
178 HG22 VAL 25 2HG2 VAL 25 3.256 3.622 4.687
179 HG23 VAL 25 3HG2 VAL 25 2.247 5.052 4.893
180 H CYS 26 HN CYS 26 0.849 0.767 2.454
181 HA CYS 26 HA CYS 26 -0.334 0.844 -0.192
182 HB2 CYS 26 2HB CYS 26 -0.579 -1.088 2.096
183 HB3 CYS 26 1HB CYS 26 -1.466 -1.247 0.588
184 H TYR 27 HN TYR 27 -2.088 1.989 -0.565
185 HA TYR 27 HA TYR 27 -4.037 2.421 1.587
186 HB2 TYR 27 2HB TYR 27 -3.482 4.078 -0.895
187 HB3 TYR 27 1HB TYR 27 -4.788 4.371 0.239
188 HD1 TYR 27 1HD TYR 27 -4.441 5.844 2.025
189 HD2 TYR 27 2HD TYR 27 -1.069 4.204 0.049
190 HE1 TYR 27 1HE TYR 27 -2.970 7.347 3.294
191 HE2 TYR 27 2HE TYR 27 0.406 5.695 1.295
192 HH TYR 27 HH TYR 27 -0.519 7.377 4.004
193 H LYS 28 HN LYS 28 -6.053 1.730 1.220
194 HA LYS 28 HA LYS 28 -6.582 0.628 -1.438
195 HB2 LYS 28 2HB LYS 28 -6.276 -1.171 0.271
196 HB3 LYS 28 1HB LYS 28 -7.601 -0.467 1.191
197 HG2 LYS 28 2HG LYS 28 -9.149 -0.933 -0.619
198 HG3 LYS 28 1HG LYS 28 -7.836 -1.554 -1.610
199 HD2 LYS 28 2HD LYS 28 -7.392 -3.272 0.148
200 HD3 LYS 28 1HD LYS 28 -8.836 -2.714 0.989
201 HE2 LYS 28 2HE LYS 28 -8.726 -3.859 -1.802
202 HE3 LYS 28 1HE LYS 28 -9.290 -4.704 -0.365
203 HZ1 LYS 28 1HZ LYS 28 -11.118 -3.127 -0.194
204 HZ2 LYS 28 2HZ LYS 28 -11.103 -3.816 -1.735
205 HZ3 LYS 28 3HZ LYS 28 -10.532 -2.266 -1.510
206 H ASN 29 HN ASN 29 -8.130 1.645 -2.354
207 HA ASN 29 HA ASN 29 -10.069 2.683 -2.775
208 HB2 ASN 29 2HB ASN 29 -11.165 1.329 -1.023
209 HB3 ASN 29 1HB ASN 29 -10.654 2.486 0.193
210 HD21 ASN 29 1HD2 ASN 29 -12.798 1.775 -2.322
211 HD22 ASN 29 2HD2 ASN 29 -13.883 3.105 -2.113
Start of MODEL 8
1 H1 GLY 1 HN GLY 1 -6.930 3.734 -1.399
2 HA2 GLY 1 2HA GLY 1 -6.121 5.889 -0.846
3 HA3 GLY 1 1HA GLY 1 -7.770 6.490 -0.907
4 H LEU 2 HN LEU 2 -8.000 3.775 0.840
5 HA LEU 2 HA LEU 2 -7.810 5.259 3.357
6 HB2 LEU 2 2HB LEU 2 -9.254 2.714 2.636
7 HB3 LEU 2 1HB LEU 2 -9.306 3.484 4.211
8 HG LEU 2 HG LEU 2 -10.389 4.669 1.651
9 HD11 LEU 2 1HD1 LEU 2 -12.584 4.186 2.620
10 HD12 LEU 2 2HD1 LEU 2 -11.802 3.348 3.962
11 HD13 LEU 2 3HD1 LEU 2 -11.659 2.715 2.323
12 HD21 LEU 2 1HD2 LEU 2 -11.464 6.287 3.146
13 HD22 LEU 2 2HD2 LEU 2 -9.708 6.364 3.270
14 HD23 LEU 2 3HD2 LEU 2 -10.646 5.555 4.526
15 HA PRO 3 HA PRO 3 -4.295 2.771 4.531
16 HB2 PRO 3 2HB PRO 3 -4.316 3.178 7.179
17 HB3 PRO 3 1HB PRO 3 -3.986 4.506 6.057
18 HG2 PRO 3 2HG PRO 3 -6.580 3.770 7.385
19 HG3 PRO 3 1HG PRO 3 -5.790 5.355 7.329
20 HD2 PRO 3 2HD PRO 3 -7.769 4.715 5.635
21 HD3 PRO 3 1HD PRO 3 -6.397 5.716 5.118
22 H ILE 4 HN ILE 4 -6.851 1.381 4.242
23 HA ILE 4 HA ILE 4 -7.560 -0.287 6.397
24 HB ILE 4 HB ILE 4 -7.770 -0.906 3.437
25 HG12 ILE 4 2HG1 ILE 4 -8.847 1.202 3.951
26 HG13 ILE 4 1HG1 ILE 4 -10.063 -0.015 3.591
27 HG21 ILE 4 1HG2 ILE 4 -9.634 -2.381 4.055
28 HG22 ILE 4 2HG2 ILE 4 -9.296 -2.077 5.759
29 HG23 ILE 4 3HG2 ILE 4 -8.102 -2.904 4.755
30 HD11 ILE 4 1HD1 ILE 4 -9.280 0.983 6.324
31 HD12 ILE 4 2HD1 ILE 4 -10.482 -0.265 5.995
32 HD13 ILE 4 3HD1 ILE 4 -10.747 1.388 5.434
33 H CYS 5 HN CYS 5 -5.305 -0.777 3.735
34 HA CYS 5 HA CYS 5 -4.591 -3.403 4.392
35 HB2 CYS 5 2HB CYS 5 -2.998 -1.335 2.875
36 HB3 CYS 5 1HB CYS 5 -2.743 -3.076 2.822
37 H GLY 6 HN GLY 6 -2.831 -0.317 4.954
38 HA2 GLY 6 2HA GLY 6 -1.457 0.285 6.687
39 HA3 GLY 6 1HA GLY 6 -1.909 -1.203 7.511
40 H GLU 7 HN GLU 7 -0.865 -1.681 4.382
41 HA GLU 7 HA GLU 7 1.572 -2.923 5.316
42 HB2 GLU 7 2HB GLU 7 0.205 -2.976 2.636
43 HB3 GLU 7 1HB GLU 7 1.726 -3.777 2.981
44 HG2 GLU 7 2HG GLU 7 -0.894 -4.323 4.308
45 HG3 GLU 7 1HG GLU 7 -0.116 -5.291 3.038
46 H THR 8 HN THR 8 3.363 -2.770 3.744
47 HA THR 8 HA THR 8 3.766 0.023 2.973
48 HB THR 8 HB THR 8 6.155 -0.264 3.744
49 HG1 THR 8 1HG THR 8 5.497 -2.691 4.122
50 HG21 THR 8 1HG2 THR 8 4.562 1.127 4.987
51 HG22 THR 8 2HG2 THR 8 5.628 0.272 6.104
52 HG23 THR 8 3HG2 THR 8 3.978 -0.297 5.850
53 H CYS 9 HN CYS 9 4.628 0.312 1.054
54 HA CYS 9 HA CYS 9 5.364 -1.962 -0.634
55 HB2 CYS 9 2HB CYS 9 5.462 0.992 -1.276
56 HB3 CYS 9 1HB CYS 9 5.573 -0.332 -2.420
57 H LEU 10 HN LEU 10 7.176 -2.214 1.067
58 HA LEU 10 HA LEU 10 9.219 -0.329 1.336
59 HB2 LEU 10 2HB LEU 10 9.336 -3.305 1.745
60 HB3 LEU 10 1HB LEU 10 10.586 -2.187 2.247
61 HG LEU 10 HG LEU 10 7.752 -2.220 3.289
62 HD11 LEU 10 1HD1 LEU 10 8.758 -3.032 5.356
63 HD12 LEU 10 2HD1 LEU 10 10.335 -3.095 4.567
64 HD13 LEU 10 3HD1 LEU 10 9.031 -4.149 4.021
65 HD21 LEU 10 1HD2 LEU 10 10.150 -0.577 4.119
66 HD22 LEU 10 2HD2 LEU 10 8.607 -0.632 4.963
67 HD23 LEU 10 3HD2 LEU 10 8.690 0.032 3.335
68 H LEU 11 HN LEU 11 8.911 -2.969 -0.960
69 HA LEU 11 HA LEU 11 11.522 -2.192 -2.017
70 HB2 LEU 11 2HB LEU 11 9.983 -4.733 -2.448
71 HB3 LEU 11 1HB LEU 11 11.526 -4.366 -3.193
72 HG LEU 11 HG LEU 11 11.021 -4.685 -0.232
73 HD11 LEU 11 1HD1 LEU 11 10.843 -6.778 -1.455
74 HD12 LEU 11 2HD1 LEU 11 12.294 -6.739 -0.456
75 HD13 LEU 11 3HD1 LEU 11 12.417 -6.489 -2.198
76 HD21 LEU 11 1HD2 LEU 11 13.470 -4.632 -0.038
77 HD22 LEU 11 2HD2 LEU 11 12.837 -3.111 -0.656
78 HD23 LEU 11 3HD2 LEU 11 13.599 -4.262 -1.757
79 H GLY 12 HN GLY 12 8.420 -1.421 -2.674
80 HA2 GLY 12 2HA GLY 12 8.536 0.173 -4.649
81 HA3 GLY 12 1HA GLY 12 9.018 -1.247 -5.555
82 H LYS 13 HN LYS 13 7.132 -3.031 -4.250
83 HA LYS 13 HA LYS 13 4.681 -1.980 -5.489
84 HB2 LYS 13 2HB LYS 13 5.651 -3.822 -6.792
85 HB3 LYS 13 1HB LYS 13 5.701 -4.830 -5.358
86 HG2 LYS 13 2HG LYS 13 3.234 -4.788 -5.256
87 HG3 LYS 13 1HG LYS 13 3.209 -3.819 -6.725
88 HD2 LYS 13 2HD LYS 13 4.189 -5.612 -7.982
89 HD3 LYS 13 1HD LYS 13 4.398 -6.579 -6.521
90 HE2 LYS 13 2HE LYS 13 1.757 -5.663 -7.663
91 HE3 LYS 13 1HE LYS 13 2.457 -7.262 -7.884
92 HZ1 LYS 13 1HZ LYS 13 0.785 -7.193 -6.118
93 HZ2 LYS 13 2HZ LYS 13 1.724 -6.119 -5.215
94 HZ3 LYS 13 3HZ LYS 13 2.283 -7.671 -5.550
95 H CYS 14 HN CYS 14 2.710 -2.548 -4.465
96 HA CYS 14 HA CYS 14 2.934 -2.983 -1.648
97 HB2 CYS 14 2HB CYS 14 1.242 -1.434 -2.546
98 HB3 CYS 14 1HB CYS 14 0.465 -2.776 -3.392
99 H TYR 15 HN TYR 15 2.260 -4.767 -0.588
100 HA TYR 15 HA TYR 15 2.490 -7.176 -2.133
101 HB2 TYR 15 2HB TYR 15 2.338 -6.794 0.856
102 HB3 TYR 15 1HB TYR 15 2.760 -8.291 0.024
103 HD1 TYR 15 1HD TYR 15 4.082 -5.339 1.490
104 HD2 TYR 15 2HD TYR 15 4.750 -8.121 -1.652
105 HE1 TYR 15 1HE TYR 15 6.407 -4.615 1.347
106 HE2 TYR 15 2HE TYR 15 7.074 -7.418 -1.792
107 HH TYR 15 HH TYR 15 8.367 -5.453 -1.284
108 H THR 16 HN THR 16 -0.042 -5.398 -0.599
109 HA THR 16 HA THR 16 -1.800 -7.688 -0.583
110 HB THR 16 HB THR 16 -2.378 -4.794 0.103
111 HG1 THR 16 1HG THR 16 -1.160 -6.884 1.430
112 HG21 THR 16 1HG2 THR 16 -3.880 -7.340 0.787
113 HG22 THR 16 2HG2 THR 16 -4.381 -6.162 -0.423
114 HG23 THR 16 3HG2 THR 16 -4.334 -5.705 1.278
115 HA PRO 17 HA PRO 17 -3.130 -6.570 -4.727
116 HB2 PRO 17 2HB PRO 17 -4.893 -8.596 -5.053
117 HB3 PRO 17 1HB PRO 17 -3.147 -8.835 -5.190
118 HG2 PRO 17 2HG PRO 17 -4.968 -9.428 -2.905
119 HG3 PRO 17 1HG PRO 17 -3.622 -10.389 -3.539
120 HD2 PRO 17 2HD PRO 17 -3.444 -8.814 -1.323
121 HD3 PRO 17 1HD PRO 17 -2.058 -9.176 -2.373
122 H GLY 18 HN GLY 18 -4.805 -5.368 -5.467
123 HA2 GLY 18 2HA GLY 18 -6.906 -4.355 -5.525
124 HA3 GLY 18 1HA GLY 18 -7.386 -5.339 -4.144
125 H CYS 19 HN CYS 19 -4.436 -3.651 -3.992
126 HA CYS 19 HA CYS 19 -5.573 -1.527 -2.351
127 HB2 CYS 19 2HB CYS 19 -4.748 -3.487 -0.975
128 HB3 CYS 19 1HB CYS 19 -3.158 -3.228 -1.667
129 H SER 20 HN SER 20 -4.671 0.410 -3.008
130 HA SER 20 HA SER 20 -2.732 0.221 -5.097
131 HB2 SER 20 2HB SER 20 -3.179 2.732 -5.303
132 HB3 SER 20 1HB SER 20 -4.516 1.651 -5.676
133 HG SER 20 HG SER 20 -4.388 2.403 -3.036
134 H CYS 21 HN CYS 21 -0.759 1.012 -5.107
135 HA CYS 21 HA CYS 21 0.451 1.265 -2.502
136 HB2 CYS 21 2HB CYS 21 1.455 -0.243 -4.138
137 HB3 CYS 21 1HB CYS 21 1.657 1.095 -5.255
138 H ARG 22 HN ARG 22 1.091 3.109 -1.653
139 HA ARG 22 HA ARG 22 1.729 5.358 -3.388
140 HB2 ARG 22 2HB ARG 22 -0.526 5.581 -2.182
141 HB3 ARG 22 1HB ARG 22 0.380 5.532 -0.681
142 HG2 ARG 22 2HG ARG 22 1.574 7.564 -1.356
143 HG3 ARG 22 1HG ARG 22 0.605 7.628 -2.828
144 HD2 ARG 22 2HD ARG 22 -0.386 7.824 0.012
145 HD3 ARG 22 1HD ARG 22 -0.349 9.107 -1.197
146 HE ARG 22 HE ARG 22 -1.877 6.932 -2.145
147 HH11 ARG 22 1HH1 ARG 22 -2.070 9.582 0.192
148 HH12 ARG 22 2HH1 ARG 22 -3.778 9.602 0.236
149 HH21 ARG 22 1HH2 ARG 22 -4.234 7.002 -2.113
150 HH22 ARG 22 2HH2 ARG 22 -5.019 8.162 -1.142
151 H ARG 23 HN ARG 23 3.822 4.332 -3.159
152 HA ARG 23 HA ARG 23 4.887 3.239 -0.972
153 HB2 ARG 23 2HB ARG 23 5.762 3.240 -3.363
154 HB3 ARG 23 1HB ARG 23 6.485 4.799 -2.963
155 HG2 ARG 23 2HG ARG 23 7.800 3.831 -1.274
156 HG3 ARG 23 1HG ARG 23 7.063 2.249 -1.520
157 HD2 ARG 23 2HD ARG 23 7.925 2.285 -3.864
158 HD3 ARG 23 1HD ARG 23 8.806 3.761 -3.458
159 HE ARG 23 HE ARG 23 9.371 1.770 -1.570
160 HH11 ARG 23 1HH1 ARG 23 10.128 2.553 -4.948
161 HH12 ARG 23 2HH1 ARG 23 11.597 1.708 -4.959
162 HH21 ARG 23 1HH2 ARG 23 11.398 0.547 -1.618
163 HH22 ARG 23 2HH2 ARG 23 12.326 0.565 -3.045
164 HA PRO 24 HA PRO 24 6.327 2.863 0.273
165 HB2 PRO 24 2HB PRO 24 6.998 2.733 2.808
166 HB3 PRO 24 1HB PRO 24 8.035 3.543 1.626
167 HG2 PRO 24 2HG PRO 24 6.189 4.734 3.649
168 HG3 PRO 24 1HG PRO 24 7.783 5.298 3.128
169 HD2 PRO 24 2HD PRO 24 5.289 6.228 2.186
170 HD3 PRO 24 1HD PRO 24 6.873 6.550 1.454
171 H VAL 25 HN VAL 25 3.414 4.213 1.007
172 HA VAL 25 HA VAL 25 2.701 2.059 2.894
173 HB VAL 25 HB VAL 25 1.310 4.747 2.633
174 HG11 VAL 25 1HG1 VAL 25 0.949 2.564 4.689
175 HG12 VAL 25 2HG1 VAL 25 -0.195 2.998 3.421
176 HG13 VAL 25 3HG1 VAL 25 0.160 4.142 4.717
177 HG21 VAL 25 1HG2 VAL 25 3.528 5.052 3.570
178 HG22 VAL 25 2HG2 VAL 25 3.221 3.786 4.759
179 HG23 VAL 25 3HG2 VAL 25 2.302 5.289 4.818
180 H CYS 26 HN CYS 26 0.836 0.879 2.550
181 HA CYS 26 HA CYS 26 -0.288 0.970 -0.140
182 HB2 CYS 26 2HB CYS 26 -0.543 -1.017 2.101
183 HB3 CYS 26 1HB CYS 26 -1.391 -1.156 0.570
184 H TYR 27 HN TYR 27 -2.147 1.952 -0.528
185 HA TYR 27 HA TYR 27 -4.078 2.272 1.648
186 HB2 TYR 27 2HB TYR 27 -3.396 4.130 -0.620
187 HB3 TYR 27 1HB TYR 27 -4.897 4.257 0.285
188 HD1 TYR 27 1HD TYR 27 -1.273 4.727 0.385
189 HD2 TYR 27 2HD TYR 27 -4.903 5.053 2.554
190 HE1 TYR 27 1HE TYR 27 -0.151 6.137 2.044
191 HE2 TYR 27 2HE TYR 27 -3.821 6.443 4.219
192 HH TYR 27 HH TYR 27 -0.778 7.813 3.654
193 H LYS 28 HN LYS 28 -5.880 1.253 1.313
194 HA LYS 28 HA LYS 28 -6.463 0.190 -1.337
195 HB2 LYS 28 2HB LYS 28 -6.595 -1.368 0.537
196 HB3 LYS 28 1HB LYS 28 -7.741 -0.310 1.357
197 HG2 LYS 28 2HG LYS 28 -9.343 -0.662 -0.439
198 HG3 LYS 28 1HG LYS 28 -8.190 -1.716 -1.258
199 HD2 LYS 28 2HD LYS 28 -8.228 -3.236 0.654
200 HD3 LYS 28 1HD LYS 28 -9.383 -2.175 1.470
201 HE2 LYS 28 2HE LYS 28 -10.546 -4.018 0.407
202 HE3 LYS 28 1HE LYS 28 -10.957 -2.488 -0.357
203 HZ1 LYS 28 1HZ LYS 28 -9.362 -3.015 -2.138
204 HZ2 LYS 28 2HZ LYS 28 -10.585 -4.150 -2.005
205 HZ3 LYS 28 3HZ LYS 28 -9.054 -4.507 -1.402
206 H ASN 29 HN ASN 29 -7.587 1.516 -2.595
207 HA ASN 29 HA ASN 29 -9.065 3.050 -3.343
208 HB2 ASN 29 2HB ASN 29 -10.688 1.420 -2.381
209 HB3 ASN 29 1HB ASN 29 -10.605 2.254 -0.842
210 HD21 ASN 29 1HD2 ASN 29 -12.768 2.562 -0.864
211 HD22 ASN 29 2HD2 ASN 29 -13.577 3.722 -1.857
Start of MODEL 9
1 H1 GLY 1 HN GLY 1 -8.250 4.193 -0.327
2 HA2 GLY 1 2HA GLY 1 -6.133 5.889 -1.169
3 HA3 GLY 1 1HA GLY 1 -7.620 6.804 -0.941
4 H LEU 2 HN LEU 2 -7.114 3.976 1.037
5 HA LEU 2 HA LEU 2 -6.365 5.704 3.258
6 HB2 LEU 2 2HB LEU 2 -8.611 3.702 3.189
7 HB3 LEU 2 1HB LEU 2 -8.002 4.438 4.658
8 HG LEU 2 HG LEU 2 -9.226 5.970 2.366
9 HD11 LEU 2 1HD1 LEU 2 -10.390 5.160 5.015
10 HD12 LEU 2 2HD1 LEU 2 -10.868 4.540 3.434
11 HD13 LEU 2 3HD1 LEU 2 -11.153 6.231 3.842
12 HD21 LEU 2 1HD2 LEU 2 -8.456 6.807 5.163
13 HD22 LEU 2 2HD2 LEU 2 -9.266 7.821 3.970
14 HD23 LEU 2 3HD2 LEU 2 -7.624 7.270 3.680
15 HA PRO 3 HA PRO 3 -3.642 2.287 4.003
16 HB2 PRO 3 2HB PRO 3 -3.127 3.058 6.722
17 HB3 PRO 3 1HB PRO 3 -2.121 3.371 5.309
18 HG2 PRO 3 2HG PRO 3 -3.477 5.313 6.757
19 HG3 PRO 3 1HG PRO 3 -2.880 5.502 5.103
20 HD2 PRO 3 2HD PRO 3 -5.638 4.928 6.076
21 HD3 PRO 3 1HD PRO 3 -5.091 5.890 4.683
22 H ILE 4 HN ILE 4 -5.172 0.692 3.989
23 HA ILE 4 HA ILE 4 -6.362 -0.031 6.589
24 HB ILE 4 HB ILE 4 -7.298 -0.844 3.827
25 HG12 ILE 4 2HG1 ILE 4 -7.629 1.571 4.161
26 HG13 ILE 4 1HG1 ILE 4 -9.165 0.718 4.130
27 HG21 ILE 4 1HG2 ILE 4 -8.614 -1.161 6.512
28 HG22 ILE 4 2HG2 ILE 4 -7.880 -2.442 5.541
29 HG23 ILE 4 3HG2 ILE 4 -9.308 -1.587 4.944
30 HD11 ILE 4 1HD1 ILE 4 -9.255 0.854 6.586
31 HD12 ILE 4 2HD1 ILE 4 -9.173 2.441 5.824
32 HD13 ILE 4 3HD1 ILE 4 -7.735 1.751 6.576
33 H CYS 5 HN CYS 5 -4.453 -1.119 3.911
34 HA CYS 5 HA CYS 5 -4.694 -3.896 4.237
35 HB2 CYS 5 2HB CYS 5 -2.449 -2.369 2.930
36 HB3 CYS 5 1HB CYS 5 -3.005 -4.002 2.562
37 H GLY 6 HN GLY 6 -2.522 -1.498 5.569
38 HA2 GLY 6 2HA GLY 6 -1.059 -1.693 7.358
39 HA3 GLY 6 1HA GLY 6 -1.525 -3.391 7.492
40 H GLU 7 HN GLU 7 -0.360 -1.686 4.707
41 HA GLU 7 HA GLU 7 2.103 -3.250 4.693
42 HB2 GLU 7 2HB GLU 7 0.142 -2.914 2.414
43 HB3 GLU 7 1HB GLU 7 1.787 -3.492 2.200
44 HG2 GLU 7 2HG GLU 7 1.352 -5.453 3.441
45 HG3 GLU 7 1HG GLU 7 -0.189 -4.827 4.013
46 H THR 8 HN THR 8 3.802 -2.224 3.600
47 HA THR 8 HA THR 8 3.306 0.537 2.884
48 HB THR 8 HB THR 8 5.660 0.929 3.952
49 HG1 THR 8 1HG THR 8 4.744 -1.198 5.567
50 HG21 THR 8 1HG2 THR 8 4.635 1.478 6.130
51 HG22 THR 8 2HG2 THR 8 3.215 0.525 5.693
52 HG23 THR 8 3HG2 THR 8 3.610 1.986 4.787
53 H CYS 9 HN CYS 9 4.552 1.268 1.204
54 HA CYS 9 HA CYS 9 5.755 -0.841 -0.343
55 HB2 CYS 9 2HB CYS 9 5.541 2.060 -1.169
56 HB3 CYS 9 1HB CYS 9 5.904 0.649 -2.162
57 H LEU 10 HN LEU 10 7.364 -1.054 1.323
58 HA LEU 10 HA LEU 10 9.508 0.899 1.247
59 HB2 LEU 10 2HB LEU 10 9.380 -1.801 2.609
60 HB3 LEU 10 1HB LEU 10 10.658 -0.620 2.813
61 HG LEU 10 HG LEU 10 7.786 -0.301 3.689
62 HD11 LEU 10 1HD1 LEU 10 9.027 -1.873 5.058
63 HD12 LEU 10 2HD1 LEU 10 8.707 -0.385 5.945
64 HD13 LEU 10 3HD1 LEU 10 10.312 -0.686 5.280
65 HD21 LEU 10 1HD2 LEU 10 8.560 1.765 4.777
66 HD22 LEU 10 2HD2 LEU 10 8.721 1.851 3.026
67 HD23 LEU 10 3HD2 LEU 10 10.144 1.560 4.029
68 H LEU 11 HN LEU 11 8.629 -2.230 0.025
69 HA LEU 11 HA LEU 11 11.142 -2.554 -1.365
70 HB2 LEU 11 2HB LEU 11 8.631 -4.254 -1.353
71 HB3 LEU 11 1HB LEU 11 10.068 -4.639 -2.261
72 HG LEU 11 HG LEU 11 11.298 -4.804 -0.049
73 HD11 LEU 11 1HD1 LEU 11 8.523 -4.773 1.107
74 HD12 LEU 11 2HD1 LEU 11 9.777 -3.560 1.363
75 HD13 LEU 11 3HD1 LEU 11 10.004 -5.201 1.967
76 HD21 LEU 11 1HD2 LEU 11 9.014 -6.695 -0.535
77 HD22 LEU 11 2HD2 LEU 11 10.453 -7.037 0.426
78 HD23 LEU 11 3HD2 LEU 11 10.596 -6.750 -1.310
79 H GLY 12 HN GLY 12 7.957 -1.415 -1.838
80 HA2 GLY 12 2HA GLY 12 7.840 0.318 -3.620
81 HA3 GLY 12 1HA GLY 12 8.624 -0.852 -4.665
82 H LYS 13 HN LYS 13 6.707 -2.808 -3.097
83 HA LYS 13 HA LYS 13 4.284 -2.161 -4.578
84 HB2 LYS 13 2HB LYS 13 5.678 -3.518 -6.104
85 HB3 LYS 13 1HB LYS 13 5.752 -4.789 -4.899
86 HG2 LYS 13 2HG LYS 13 4.155 -5.374 -6.602
87 HG3 LYS 13 1HG LYS 13 3.315 -5.070 -5.083
88 HD2 LYS 13 2HD LYS 13 2.729 -2.807 -5.874
89 HD3 LYS 13 1HD LYS 13 3.542 -3.145 -7.404
90 HE2 LYS 13 2HE LYS 13 1.153 -4.613 -6.287
91 HE3 LYS 13 1HE LYS 13 1.125 -3.444 -7.606
92 HZ1 LYS 13 1HZ LYS 13 2.511 -6.067 -7.622
93 HZ2 LYS 13 2HZ LYS 13 2.545 -4.952 -8.877
94 HZ3 LYS 13 3HZ LYS 13 1.098 -5.695 -8.444
95 H CYS 14 HN CYS 14 2.399 -3.085 -3.722
96 HA CYS 14 HA CYS 14 2.593 -4.170 -1.034
97 HB2 CYS 14 2HB CYS 14 0.114 -3.623 -2.679
98 HB3 CYS 14 1HB CYS 14 0.241 -3.740 -0.928
99 H TYR 15 HN TYR 15 1.071 -6.132 -0.606
100 HA TYR 15 HA TYR 15 1.494 -7.975 -2.835
101 HB2 TYR 15 2HB TYR 15 1.168 -8.524 0.101
102 HB3 TYR 15 1HB TYR 15 1.348 -9.767 -1.131
103 HD1 TYR 15 1HD TYR 15 3.073 -7.193 0.812
104 HD2 TYR 15 2HD TYR 15 3.462 -10.061 -2.301
105 HE1 TYR 15 1HE TYR 15 5.509 -6.987 0.934
106 HE2 TYR 15 2HE TYR 15 5.895 -9.872 -2.182
107 HH TYR 15 HH TYR 15 7.500 -8.324 0.342
108 H THR 16 HN THR 16 -0.921 -6.807 -0.590
109 HA THR 16 HA THR 16 -2.927 -8.627 -1.342
110 HB THR 16 HB THR 16 -3.226 -5.859 -0.180
111 HG1 THR 16 1HG THR 16 -2.271 -6.749 1.397
112 HG21 THR 16 1HG2 THR 16 -5.076 -8.251 -0.140
113 HG22 THR 16 2HG2 THR 16 -5.326 -6.766 -1.062
114 HG23 THR 16 3HG2 THR 16 -5.338 -6.725 0.704
115 HA PRO 17 HA PRO 17 -4.058 -6.659 -5.288
116 HB2 PRO 17 2HB PRO 17 -6.224 -8.658 -5.198
117 HB3 PRO 17 1HB PRO 17 -4.984 -8.434 -6.437
118 HG2 PRO 17 2HG PRO 17 -4.947 -10.551 -4.793
119 HG3 PRO 17 1HG PRO 17 -3.450 -9.763 -5.325
120 HD2 PRO 17 2HD PRO 17 -4.905 -9.502 -2.720
121 HD3 PRO 17 1HD PRO 17 -3.158 -9.654 -3.042
122 H GLY 18 HN GLY 18 -5.456 -5.000 -5.477
123 HA2 GLY 18 2HA GLY 18 -7.506 -3.869 -5.183
124 HA3 GLY 18 1HA GLY 18 -7.901 -4.973 -3.868
125 H CYS 19 HN CYS 19 -4.742 -3.834 -3.821
126 HA CYS 19 HA CYS 19 -5.355 -1.612 -2.049
127 HB2 CYS 19 2HB CYS 19 -4.689 -3.702 -0.779
128 HB3 CYS 19 1HB CYS 19 -3.161 -3.668 -1.648
129 H SER 20 HN SER 20 -4.354 0.156 -2.854
130 HA SER 20 HA SER 20 -2.580 -0.212 -5.114
131 HB2 SER 20 2HB SER 20 -3.873 2.269 -3.996
132 HB3 SER 20 1HB SER 20 -3.070 2.107 -5.563
133 HG SER 20 HG SER 20 -5.004 0.233 -5.102
134 H CYS 21 HN CYS 21 -0.534 0.743 -5.212
135 HA CYS 21 HA CYS 21 0.672 1.221 -2.618
136 HB2 CYS 21 2HB CYS 21 1.780 -0.443 -3.961
137 HB3 CYS 21 1HB CYS 21 1.850 0.655 -5.332
138 H ARG 22 HN ARG 22 0.888 3.231 -1.958
139 HA ARG 22 HA ARG 22 1.677 5.235 -3.919
140 HB2 ARG 22 2HB ARG 22 -0.636 5.711 -3.029
141 HB3 ARG 22 1HB ARG 22 0.039 5.696 -1.406
142 HG2 ARG 22 2HG ARG 22 -0.246 7.963 -2.055
143 HG3 ARG 22 1HG ARG 22 1.481 7.610 -2.042
144 HD2 ARG 22 2HD ARG 22 1.313 7.203 -4.513
145 HD3 ARG 22 1HD ARG 22 -0.338 7.796 -4.424
146 HE ARG 22 HE ARG 22 1.958 9.411 -3.593
147 HH11 ARG 22 1HH1 ARG 22 -1.045 9.059 -5.445
148 HH12 ARG 22 2HH1 ARG 22 -1.041 10.645 -6.041
149 HH21 ARG 22 1HH2 ARG 22 1.975 11.615 -4.421
150 HH22 ARG 22 2HH2 ARG 22 0.748 12.136 -5.467
151 H ARG 23 HN ARG 23 3.788 4.730 -3.511
152 HA ARG 23 HA ARG 23 4.891 3.947 -1.147
153 HB2 ARG 23 2HB ARG 23 7.111 4.562 -2.055
154 HB3 ARG 23 1HB ARG 23 6.115 3.664 -3.178
155 HG2 ARG 23 2HG ARG 23 5.586 5.736 -4.364
156 HG3 ARG 23 1HG ARG 23 6.594 6.638 -3.230
157 HD2 ARG 23 2HD ARG 23 8.543 5.339 -3.942
158 HD3 ARG 23 1HD ARG 23 7.515 4.421 -5.040
159 HE ARG 23 HE ARG 23 7.260 7.131 -5.644
160 HH11 ARG 23 1HH1 ARG 23 9.607 4.481 -5.971
161 HH12 ARG 23 2HH1 ARG 23 10.488 5.228 -7.214
162 HH21 ARG 23 1HH2 ARG 23 8.406 8.104 -7.381
163 HH22 ARG 23 2HH2 ARG 23 9.763 7.366 -8.084
164 HA PRO 24 HA PRO 24 6.349 3.797 0.174
165 HB2 PRO 24 2HB PRO 24 7.012 4.010 2.700
166 HB3 PRO 24 1HB PRO 24 7.920 4.888 1.464
167 HG2 PRO 24 2HG PRO 24 5.850 5.906 3.356
168 HG3 PRO 24 1HG PRO 24 7.361 6.665 2.830
169 HD2 PRO 24 2HD PRO 24 4.818 7.163 1.786
170 HD3 PRO 24 1HD PRO 24 6.360 7.618 1.035
171 H VAL 25 HN VAL 25 3.258 4.640 0.643
172 HA VAL 25 HA VAL 25 2.815 2.563 2.692
173 HB VAL 25 HB VAL 25 1.170 5.110 2.423
174 HG11 VAL 25 1HG1 VAL 25 -0.174 3.250 3.221
175 HG12 VAL 25 2HG1 VAL 25 0.088 4.425 4.512
176 HG13 VAL 25 3HG1 VAL 25 1.009 2.921 4.489
177 HG21 VAL 25 1HG2 VAL 25 3.360 5.611 3.356
178 HG22 VAL 25 2HG2 VAL 25 3.154 4.345 4.563
179 HG23 VAL 25 3HG2 VAL 25 2.112 5.769 4.593
180 H CYS 26 HN CYS 26 1.003 1.153 2.339
181 HA CYS 26 HA CYS 26 -0.054 1.275 -0.345
182 HB2 CYS 26 2HB CYS 26 -0.349 -0.775 1.855
183 HB3 CYS 26 1HB CYS 26 -1.029 -0.934 0.237
184 H TYR 27 HN TYR 27 -2.148 1.686 -0.803
185 HA TYR 27 HA TYR 27 -3.904 2.393 1.433
186 HB2 TYR 27 2HB TYR 27 -3.442 3.988 -1.093
187 HB3 TYR 27 1HB TYR 27 -4.779 4.257 0.009
188 HD1 TYR 27 1HD TYR 27 -1.156 4.535 -0.430
189 HD2 TYR 27 2HD TYR 27 -4.444 5.451 2.067
190 HE1 TYR 27 1HE TYR 27 0.236 6.148 0.791
191 HE2 TYR 27 2HE TYR 27 -3.075 7.054 3.313
192 HH TYR 27 HH TYR 27 -0.198 8.229 2.195
193 H LYS 28 HN LYS 28 -5.749 1.326 1.286
194 HA LYS 28 HA LYS 28 -6.505 0.206 -1.260
195 HB2 LYS 28 2HB LYS 28 -6.712 -1.232 0.672
196 HB3 LYS 28 1HB LYS 28 -7.738 -0.057 1.510
197 HG2 LYS 28 2HG LYS 28 -9.460 -0.406 -0.168
198 HG3 LYS 28 1HG LYS 28 -8.399 -1.516 -1.036
199 HD2 LYS 28 2HD LYS 28 -8.370 -2.989 0.932
200 HD3 LYS 28 1HD LYS 28 -9.490 -1.895 1.750
201 HE2 LYS 28 2HE LYS 28 -10.669 -3.792 0.752
202 HE3 LYS 28 1HE LYS 28 -11.138 -2.266 0.005
203 HZ1 LYS 28 1HZ LYS 28 -9.652 -2.758 -1.847
204 HZ2 LYS 28 2HZ LYS 28 -10.788 -3.959 -1.665
205 HZ3 LYS 28 3HZ LYS 28 -9.209 -4.224 -1.145
206 H ASN 29 HN ASN 29 -7.582 1.416 -2.572
207 HA ASN 29 HA ASN 29 -8.866 2.982 -3.534
208 HB2 ASN 29 2HB ASN 29 -10.128 3.427 -0.801
209 HB3 ASN 29 1HB ASN 29 -10.703 4.136 -2.301
210 HD21 ASN 29 1HD2 ASN 29 -11.671 2.774 -3.814
211 HD22 ASN 29 2HD2 ASN 29 -12.371 1.267 -3.375
Start of MODEL 10
1 H1 GLY 1 HN GLY 1 -7.636 3.886 -1.612
2 HA2 GLY 1 2HA GLY 1 -6.880 6.112 -1.685
3 HA3 GLY 1 1HA GLY 1 -8.499 6.649 -1.279
4 H LEU 2 HN LEU 2 -8.150 4.369 0.921
5 HA LEU 2 HA LEU 2 -6.940 6.246 2.839
6 HB2 LEU 2 2HB LEU 2 -9.129 4.218 3.300
7 HB3 LEU 2 1HB LEU 2 -8.454 5.276 4.518
8 HG LEU 2 HG LEU 2 -10.086 6.108 2.124
9 HD11 LEU 2 1HD1 LEU 2 -10.697 6.171 5.071
10 HD12 LEU 2 2HD1 LEU 2 -11.395 5.073 3.880
11 HD13 LEU 2 3HD1 LEU 2 -11.729 6.802 3.788
12 HD21 LEU 2 1HD2 LEU 2 -9.986 8.377 3.071
13 HD22 LEU 2 2HD2 LEU 2 -8.397 7.796 2.589
14 HD23 LEU 2 3HD2 LEU 2 -8.849 7.809 4.295
15 HA PRO 3 HA PRO 3 -4.140 2.978 3.832
16 HB2 PRO 3 2HB PRO 3 -3.462 3.576 6.399
17 HB3 PRO 3 1HB PRO 3 -2.885 4.516 5.019
18 HG2 PRO 3 2HG PRO 3 -5.080 5.130 6.941
19 HG3 PRO 3 1HG PRO 3 -3.913 6.227 6.184
20 HD2 PRO 3 2HD PRO 3 -6.521 5.920 5.361
21 HD3 PRO 3 1HD PRO 3 -5.201 6.491 4.324
22 H ILE 4 HN ILE 4 -5.771 1.411 3.691
23 HA ILE 4 HA ILE 4 -6.987 0.550 6.227
24 HB ILE 4 HB ILE 4 -7.592 -0.340 3.404
25 HG12 ILE 4 2HG1 ILE 4 -8.217 2.001 3.714
26 HG13 ILE 4 1HG1 ILE 4 -9.656 1.002 3.580
27 HG21 ILE 4 1HG2 ILE 4 -9.620 -1.347 4.306
28 HG22 ILE 4 2HG2 ILE 4 -9.110 -0.902 5.936
29 HG23 ILE 4 3HG2 ILE 4 -8.163 -2.063 5.001
30 HD11 ILE 4 1HD1 ILE 4 -8.496 2.132 6.126
31 HD12 ILE 4 2HD1 ILE 4 -9.923 1.101 6.023
32 HD13 ILE 4 3HD1 ILE 4 -9.938 2.702 5.283
33 H CYS 5 HN CYS 5 -4.814 -0.476 3.685
34 HA CYS 5 HA CYS 5 -4.808 -3.223 4.226
35 HB2 CYS 5 2HB CYS 5 -2.641 -1.588 2.937
36 HB3 CYS 5 1HB CYS 5 -2.901 -3.323 2.764
37 H GLY 6 HN GLY 6 -2.836 -0.608 5.584
38 HA2 GLY 6 2HA GLY 6 -1.642 -0.676 7.572
39 HA3 GLY 6 1HA GLY 6 -2.001 -2.392 7.692
40 H GLU 7 HN GLU 7 -0.957 -3.045 5.129
41 HA GLU 7 HA GLU 7 1.782 -3.348 5.742
42 HB2 GLU 7 2HB GLU 7 0.276 -3.929 3.205
43 HB3 GLU 7 1HB GLU 7 1.954 -4.368 3.492
44 HG2 GLU 7 2HG GLU 7 -0.437 -5.331 5.020
45 HG3 GLU 7 1HG GLU 7 0.543 -6.226 3.838
46 H THR 8 HN THR 8 3.374 -2.947 3.910
47 HA THR 8 HA THR 8 3.041 -0.219 2.964
48 HB THR 8 HB THR 8 5.468 0.227 3.707
49 HG1 THR 8 1HG THR 8 4.835 -2.093 5.181
50 HG21 THR 8 1HG2 THR 8 4.763 0.974 5.929
51 HG22 THR 8 2HG2 THR 8 3.298 -0.005 5.792
52 HG23 THR 8 3HG2 THR 8 3.556 1.365 4.703
53 H CYS 9 HN CYS 9 4.556 0.424 1.346
54 HA CYS 9 HA CYS 9 5.168 -1.789 -0.455
55 HB2 CYS 9 2HB CYS 9 5.257 1.194 -0.890
56 HB3 CYS 9 1HB CYS 9 5.615 -0.005 -2.112
57 H LEU 10 HN LEU 10 6.953 -2.262 1.250
58 HA LEU 10 HA LEU 10 9.205 -0.550 1.304
59 HB2 LEU 10 2HB LEU 10 9.294 -3.552 1.751
60 HB3 LEU 10 1HB LEU 10 10.539 -2.423 2.202
61 HG LEU 10 HG LEU 10 9.579 -2.955 4.187
62 HD11 LEU 10 1HD1 LEU 10 8.111 -0.482 3.390
63 HD12 LEU 10 2HD1 LEU 10 9.733 -0.601 4.073
64 HD13 LEU 10 3HD1 LEU 10 8.334 -1.061 5.041
65 HD21 LEU 10 1HD2 LEU 10 6.818 -2.814 2.977
66 HD22 LEU 10 2HD2 LEU 10 7.191 -3.182 4.657
67 HD23 LEU 10 3HD2 LEU 10 7.717 -4.277 3.383
68 H LEU 11 HN LEU 11 8.132 -2.957 -0.861
69 HA LEU 11 HA LEU 11 10.638 -3.279 -2.282
70 HB2 LEU 11 2HB LEU 11 7.865 -4.260 -2.953
71 HB3 LEU 11 1HB LEU 11 9.352 -4.775 -3.721
72 HG LEU 11 HG LEU 11 8.652 -5.266 -0.823
73 HD11 LEU 11 1HD1 LEU 11 7.187 -6.515 -2.318
74 HD12 LEU 11 2HD1 LEU 11 8.318 -7.582 -1.485
75 HD13 LEU 11 3HD1 LEU 11 8.595 -7.154 -3.169
76 HD21 LEU 11 1HD2 LEU 11 11.055 -5.149 -1.207
77 HD22 LEU 11 2HD2 LEU 11 10.911 -6.302 -2.533
78 HD23 LEU 11 3HD2 LEU 11 10.558 -6.810 -0.881
79 H GLY 12 HN GLY 12 8.406 -0.888 -2.165
80 HA2 GLY 12 2HA GLY 12 8.178 0.961 -3.586
81 HA3 GLY 12 1HA GLY 12 8.944 0.039 -4.879
82 H LYS 13 HN LYS 13 7.040 -2.116 -3.875
83 HA LYS 13 HA LYS 13 4.586 -1.316 -5.246
84 HB2 LYS 13 2HB LYS 13 5.979 -2.614 -6.794
85 HB3 LYS 13 1HB LYS 13 6.246 -3.835 -5.571
86 HG2 LYS 13 2HG LYS 13 4.684 -4.651 -7.213
87 HG3 LYS 13 1HG LYS 13 3.855 -4.426 -5.676
88 HD2 LYS 13 2HD LYS 13 2.879 -2.356 -6.476
89 HD3 LYS 13 1HD LYS 13 3.791 -2.484 -7.983
90 HE2 LYS 13 2HE LYS 13 1.519 -3.230 -8.358
91 HE3 LYS 13 1HE LYS 13 2.621 -4.589 -8.491
92 HZ1 LYS 13 1HZ LYS 13 0.912 -3.996 -6.112
93 HZ2 LYS 13 2HZ LYS 13 1.986 -5.273 -6.225
94 HZ3 LYS 13 3HZ LYS 13 0.664 -5.210 -7.236
95 H CYS 14 HN CYS 14 2.768 -2.279 -4.265
96 HA CYS 14 HA CYS 14 3.241 -3.428 -1.642
97 HB2 CYS 14 2HB CYS 14 1.524 -1.596 -2.059
98 HB3 CYS 14 1HB CYS 14 0.603 -2.782 -2.980
99 H TYR 15 HN TYR 15 2.675 -5.558 -1.179
100 HA TYR 15 HA TYR 15 2.377 -7.187 -3.566
101 HB2 TYR 15 2HB TYR 15 3.126 -9.059 -2.223
102 HB3 TYR 15 1HB TYR 15 4.227 -7.709 -2.020
103 HD1 TYR 15 1HD TYR 15 1.867 -9.928 -0.407
104 HD2 TYR 15 2HD TYR 15 4.264 -6.461 0.161
105 HE1 TYR 15 1HE TYR 15 1.635 -10.180 1.993
106 HE2 TYR 15 2HE TYR 15 4.030 -6.702 2.597
107 HH TYR 15 HH TYR 15 2.534 -7.767 4.231
108 H THR 16 HN THR 16 0.428 -5.917 -1.177
109 HA THR 16 HA THR 16 -1.355 -8.131 -0.977
110 HB THR 16 HB THR 16 -1.777 -5.260 -0.107
111 HG1 THR 16 1HG THR 16 -0.633 -7.472 1.292
112 HG21 THR 16 1HG2 THR 16 -2.935 -7.887 0.877
113 HG22 THR 16 2HG2 THR 16 -3.789 -6.694 -0.098
114 HG23 THR 16 3HG2 THR 16 -3.284 -6.292 1.543
115 HA PRO 17 HA PRO 17 -3.441 -7.022 -4.846
116 HB2 PRO 17 2HB PRO 17 -5.457 -8.915 -3.798
117 HB3 PRO 17 1HB PRO 17 -4.597 -8.947 -5.338
118 HG2 PRO 17 2HG PRO 17 -4.011 -10.678 -3.403
119 HG3 PRO 17 1HG PRO 17 -2.739 -9.985 -4.429
120 HD2 PRO 17 2HD PRO 17 -3.514 -9.282 -1.628
121 HD3 PRO 17 1HD PRO 17 -1.902 -9.417 -2.375
122 H GLY 18 HN GLY 18 -4.887 -5.435 -5.177
123 HA2 GLY 18 2HA GLY 18 -6.943 -4.328 -4.879
124 HA3 GLY 18 1HA GLY 18 -7.084 -5.075 -3.293
125 H CYS 19 HN CYS 19 -4.112 -4.254 -3.024
126 HA CYS 19 HA CYS 19 -4.797 -1.691 -1.890
127 HB2 CYS 19 2HB CYS 19 -2.372 -3.434 -1.501
128 HB3 CYS 19 1HB CYS 19 -2.633 -1.877 -0.718
129 H SER 20 HN SER 20 -4.248 0.096 -2.694
130 HA SER 20 HA SER 20 -2.741 0.268 -5.126
131 HB2 SER 20 2HB SER 20 -3.980 2.406 -3.388
132 HB3 SER 20 1HB SER 20 -3.441 2.585 -5.060
133 HG SER 20 HG SER 20 -4.999 0.578 -5.175
134 H CYS 21 HN CYS 21 -0.661 0.801 -5.186
135 HA CYS 21 HA CYS 21 0.657 1.079 -2.651
136 HB2 CYS 21 2HB CYS 21 1.483 -0.592 -4.183
137 HB3 CYS 21 1HB CYS 21 1.765 0.641 -5.408
138 H ARG 22 HN ARG 22 0.659 3.073 -1.926
139 HA ARG 22 HA ARG 22 1.810 5.100 -3.689
140 HB2 ARG 22 2HB ARG 22 0.105 5.492 -1.195
141 HB3 ARG 22 1HB ARG 22 0.847 6.780 -2.121
142 HG2 ARG 22 2HG ARG 22 -1.277 4.909 -3.171
143 HG3 ARG 22 1HG ARG 22 -1.560 6.544 -2.567
144 HD2 ARG 22 2HD ARG 22 -0.084 7.430 -4.292
145 HD3 ARG 22 1HD ARG 22 0.187 5.800 -4.910
146 HE ARG 22 HE ARG 22 -2.510 6.108 -4.986
147 HH11 ARG 22 1HH1 ARG 22 0.221 7.936 -6.320
148 HH12 ARG 22 2HH1 ARG 22 -0.639 8.511 -7.663
149 HH21 ARG 22 1HH2 ARG 22 -3.699 6.907 -6.843
150 HH22 ARG 22 2HH2 ARG 22 -2.923 7.942 -7.954
151 H ARG 23 HN ARG 23 3.746 4.060 -3.277
152 HA ARG 23 HA ARG 23 4.694 3.226 -0.858
153 HB2 ARG 23 2HB ARG 23 6.979 3.298 -1.784
154 HB3 ARG 23 1HB ARG 23 5.824 2.553 -2.869
155 HG2 ARG 23 2HG ARG 23 5.792 4.533 -4.246
156 HG3 ARG 23 1HG ARG 23 6.848 5.374 -3.106
157 HD2 ARG 23 2HD ARG 23 8.597 3.723 -3.495
158 HD3 ARG 23 1HD ARG 23 7.548 2.860 -4.618
159 HE ARG 23 HE ARG 23 7.690 5.413 -5.573
160 HH11 ARG 23 1HH1 ARG 23 10.095 2.923 -4.852
161 HH12 ARG 23 2HH1 ARG 23 11.136 3.360 -6.119
162 HH21 ARG 23 1HH2 ARG 23 9.102 6.042 -7.266
163 HH22 ARG 23 2HH2 ARG 23 10.561 5.197 -7.531
164 HA PRO 24 HA PRO 24 6.432 2.863 0.344
165 HB2 PRO 24 2HB PRO 24 6.716 3.461 3.113
166 HB3 PRO 24 1HB PRO 24 7.984 3.206 1.916
167 HG2 PRO 24 2HG PRO 24 7.523 5.611 3.173
168 HG3 PRO 24 1HG PRO 24 8.306 5.450 1.596
169 HD2 PRO 24 2HD PRO 24 5.444 6.100 2.224
170 HD3 PRO 24 1HD PRO 24 6.532 6.845 1.028
171 H VAL 25 HN VAL 25 3.425 4.155 0.830
172 HA VAL 25 HA VAL 25 2.746 2.143 2.884
173 HB VAL 25 HB VAL 25 1.313 4.774 2.398
174 HG11 VAL 25 1HG1 VAL 25 0.104 4.291 4.485
175 HG12 VAL 25 2HG1 VAL 25 0.884 2.710 4.555
176 HG13 VAL 25 3HG1 VAL 25 -0.216 3.090 3.233
177 HG21 VAL 25 1HG2 VAL 25 3.145 3.979 4.663
178 HG22 VAL 25 2HG2 VAL 25 2.227 5.482 4.566
179 HG23 VAL 25 3HG2 VAL 25 3.503 5.151 3.393
180 H CYS 26 HN CYS 26 0.935 0.802 2.609
181 HA CYS 26 HA CYS 26 -0.177 0.694 -0.077
182 HB2 CYS 26 2HB CYS 26 -0.465 -1.165 2.289
183 HB3 CYS 26 1HB CYS 26 -1.177 -1.445 0.708
184 H TYR 27 HN TYR 27 -2.054 1.635 -0.523
185 HA TYR 27 HA TYR 27 -3.910 2.232 1.673
186 HB2 TYR 27 2HB TYR 27 -3.453 3.629 -0.967
187 HB3 TYR 27 1HB TYR 27 -4.819 3.969 0.084
188 HD1 TYR 27 1HD TYR 27 -4.571 5.355 1.993
189 HD2 TYR 27 2HD TYR 27 -1.139 4.181 -0.206
190 HE1 TYR 27 1HE TYR 27 -3.245 6.994 3.214
191 HE2 TYR 27 2HE TYR 27 0.207 5.832 1.016
192 HH TYR 27 HH TYR 27 -0.810 7.277 3.822
193 H LYS 28 HN LYS 28 -6.195 2.117 1.104
194 HA LYS 28 HA LYS 28 -6.823 0.522 -1.227
195 HB2 LYS 28 2HB LYS 28 -6.559 -1.041 0.719
196 HB3 LYS 28 1HB LYS 28 -7.778 -0.085 1.560
197 HG2 LYS 28 2HG LYS 28 -9.418 -0.661 -0.131
198 HG3 LYS 28 1HG LYS 28 -8.207 -1.630 -0.971
199 HD2 LYS 28 2HD LYS 28 -8.008 -3.091 0.960
200 HD3 LYS 28 1HD LYS 28 -9.171 -2.099 1.846
201 HE2 LYS 28 2HE LYS 28 -9.723 -3.596 -0.711
202 HE3 LYS 28 1HE LYS 28 -10.219 -4.099 0.903
203 HZ1 LYS 28 1HZ LYS 28 -11.606 -2.152 1.075
204 HZ2 LYS 28 2HZ LYS 28 -11.994 -2.965 -0.350
205 HZ3 LYS 28 3HZ LYS 28 -11.082 -1.571 -0.411
206 H ASN 29 HN ASN 29 -8.415 1.515 -2.207
207 HA ASN 29 HA ASN 29 -10.124 2.889 -2.719
208 HB2 ASN 29 2HB ASN 29 -10.960 2.350 0.152
209 HB3 ASN 29 1HB ASN 29 -11.956 3.223 -1.007
210 HD21 ASN 29 1HD2 ASN 29 -12.903 2.080 -2.714
211 HD22 ASN 29 2HD2 ASN 29 -13.006 0.362 -2.712
Start of MODEL 11
1 H1 GLY 1 HN GLY 1 -8.313 4.099 0.300
2 HA2 GLY 1 2HA GLY 1 -6.920 6.506 -0.475
3 HA3 GLY 1 1HA GLY 1 -8.435 6.800 0.372
4 H LEU 2 HN LEU 2 -8.198 4.462 2.063
5 HA LEU 2 HA LEU 2 -6.230 5.552 3.909
6 HB2 LEU 2 2HB LEU 2 -8.501 3.607 4.325
7 HB3 LEU 2 1HB LEU 2 -7.438 4.181 5.590
8 HG LEU 2 HG LEU 2 -9.344 5.903 3.999
9 HD11 LEU 2 1HD1 LEU 2 -10.514 4.383 5.477
10 HD12 LEU 2 2HD1 LEU 2 -10.607 6.037 6.081
11 HD13 LEU 2 3HD1 LEU 2 -9.494 4.887 6.824
12 HD21 LEU 2 1HD2 LEU 2 -7.594 6.556 6.373
13 HD22 LEU 2 2HD2 LEU 2 -8.811 7.621 5.676
14 HD23 LEU 2 3HD2 LEU 2 -7.395 7.169 4.729
15 HA PRO 3 HA PRO 3 -3.556 2.048 3.297
16 HB2 PRO 3 2HB PRO 3 -2.239 1.967 5.636
17 HB3 PRO 3 1HB PRO 3 -2.028 3.309 4.508
18 HG2 PRO 3 2HG PRO 3 -3.732 3.162 6.960
19 HG3 PRO 3 1HG PRO 3 -2.645 4.459 6.428
20 HD2 PRO 3 2HD PRO 3 -5.330 4.540 6.053
21 HD3 PRO 3 1HD PRO 3 -4.173 5.303 4.944
22 H ILE 4 HN ILE 4 -6.046 1.185 3.722
23 HA ILE 4 HA ILE 4 -6.677 -0.397 5.948
24 HB ILE 4 HB ILE 4 -7.541 -0.768 3.070
25 HG12 ILE 4 2HG1 ILE 4 -8.025 1.502 3.836
26 HG13 ILE 4 1HG1 ILE 4 -9.513 0.589 3.628
27 HG21 ILE 4 1HG2 ILE 4 -8.889 -1.738 5.571
28 HG22 ILE 4 2HG2 ILE 4 -8.074 -2.717 4.343
29 HG23 ILE 4 3HG2 ILE 4 -9.542 -1.830 3.929
30 HD11 ILE 4 1HD1 ILE 4 -9.617 1.955 5.621
31 HD12 ILE 4 2HD1 ILE 4 -8.145 1.214 6.239
32 HD13 ILE 4 3HD1 ILE 4 -9.611 0.247 6.065
33 H CYS 5 HN CYS 5 -4.627 -1.003 3.239
34 HA CYS 5 HA CYS 5 -4.539 -3.806 3.281
35 HB2 CYS 5 2HB CYS 5 -2.298 -1.946 2.498
36 HB3 CYS 5 1HB CYS 5 -2.639 -3.557 1.863
37 H GLY 6 HN GLY 6 -2.875 -1.316 5.162
38 HA2 GLY 6 2HA GLY 6 -1.736 -1.460 7.134
39 HA3 GLY 6 1HA GLY 6 -2.270 -3.129 7.249
40 H GLU 7 HN GLU 7 -0.456 -1.866 4.588
41 HA GLU 7 HA GLU 7 1.997 -2.964 5.589
42 HB2 GLU 7 2HB GLU 7 2.378 -4.109 3.358
43 HB3 GLU 7 1HB GLU 7 1.181 -4.867 4.391
44 HG2 GLU 7 2HG GLU 7 -0.578 -3.665 3.062
45 HG3 GLU 7 1HG GLU 7 0.703 -3.182 1.950
46 H THR 8 HN THR 8 3.830 -2.138 4.335
47 HA THR 8 HA THR 8 3.082 0.395 3.099
48 HB THR 8 HB THR 8 5.466 1.081 3.812
49 HG1 THR 8 1HG THR 8 4.980 -1.047 5.636
50 HG21 THR 8 1HG2 THR 8 4.660 1.802 6.016
51 HG22 THR 8 2HG2 THR 8 3.289 0.698 5.858
52 HG23 THR 8 3HG2 THR 8 3.457 2.064 4.753
53 H CYS 9 HN CYS 9 4.505 1.212 1.505
54 HA CYS 9 HA CYS 9 5.447 -0.911 -0.210
55 HB2 CYS 9 2HB CYS 9 4.889 1.999 -0.688
56 HB3 CYS 9 1HB CYS 9 5.688 0.993 -1.887
57 H LEU 10 HN LEU 10 7.112 -1.217 1.326
58 HA LEU 10 HA LEU 10 9.154 0.764 1.680
59 HB2 LEU 10 2HB LEU 10 8.439 -1.081 3.294
60 HB3 LEU 10 1HB LEU 10 9.311 -2.183 2.252
61 HG LEU 10 HG LEU 10 11.378 -0.886 2.687
62 HD11 LEU 10 1HD1 LEU 10 11.349 0.676 4.607
63 HD12 LEU 10 2HD1 LEU 10 9.583 0.553 4.637
64 HD13 LEU 10 3HD1 LEU 10 10.391 1.249 3.243
65 HD21 LEU 10 1HD2 LEU 10 10.828 -2.909 3.939
66 HD22 LEU 10 2HD2 LEU 10 9.941 -1.936 5.111
67 HD23 LEU 10 3HD2 LEU 10 11.687 -1.743 4.944
68 H LEU 11 HN LEU 11 8.687 -2.212 -0.108
69 HA LEU 11 HA LEU 11 11.151 -1.856 -1.588
70 HB2 LEU 11 2HB LEU 11 8.936 -3.885 -1.919
71 HB3 LEU 11 1HB LEU 11 10.481 -3.912 -2.737
72 HG LEU 11 HG LEU 11 10.046 -4.264 0.221
73 HD11 LEU 11 1HD1 LEU 11 9.318 -6.179 -1.074
74 HD12 LEU 11 2HD1 LEU 11 10.794 -6.547 -0.181
75 HD13 LEU 11 3HD1 LEU 11 10.870 -6.218 -1.912
76 HD21 LEU 11 1HD2 LEU 11 12.580 -4.352 -1.414
77 HD22 LEU 11 2HD2 LEU 11 12.438 -4.822 0.279
78 HD23 LEU 11 3HD2 LEU 11 12.159 -3.147 -0.193
79 H GLY 12 HN GLY 12 7.771 -1.391 -1.841
80 HA2 GLY 12 2HA GLY 12 7.009 0.466 -3.284
81 HA3 GLY 12 1HA GLY 12 8.195 -0.082 -4.456
82 H LYS 13 HN LYS 13 6.318 -2.397 -2.700
83 HA LYS 13 HA LYS 13 4.511 -2.783 -4.944
84 HB2 LYS 13 2HB LYS 13 6.478 -4.187 -5.334
85 HB3 LYS 13 1HB LYS 13 6.328 -4.865 -3.726
86 HG2 LYS 13 2HG LYS 13 4.233 -5.919 -4.350
87 HG3 LYS 13 1HG LYS 13 4.337 -5.190 -5.957
88 HD2 LYS 13 2HD LYS 13 6.440 -6.360 -6.347
89 HD3 LYS 13 1HD LYS 13 6.327 -7.098 -4.752
90 HE2 LYS 13 2HE LYS 13 4.335 -8.267 -5.380
91 HE3 LYS 13 1HE LYS 13 4.281 -7.432 -6.930
92 HZ1 LYS 13 1HZ LYS 13 5.208 -9.628 -7.187
93 HZ2 LYS 13 2HZ LYS 13 6.379 -9.308 -6.019
94 HZ3 LYS 13 3HZ LYS 13 6.419 -8.483 -7.475
95 H CYS 14 HN CYS 14 2.556 -3.777 -4.292
96 HA CYS 14 HA CYS 14 2.192 -4.101 -1.405
97 HB2 CYS 14 2HB CYS 14 0.179 -3.597 -3.610
98 HB3 CYS 14 1HB CYS 14 -0.262 -3.979 -1.951
99 H TYR 15 HN TYR 15 1.236 -5.954 -0.642
100 HA TYR 15 HA TYR 15 1.483 -8.229 -2.461
101 HB2 TYR 15 2HB TYR 15 1.487 -8.110 0.563
102 HB3 TYR 15 1HB TYR 15 1.654 -9.581 -0.394
103 HD1 TYR 15 1HD TYR 15 3.325 -6.531 0.754
104 HD2 TYR 15 2HD TYR 15 3.701 -10.024 -1.646
105 HE1 TYR 15 1HE TYR 15 5.739 -6.159 0.604
106 HE2 TYR 15 2HE TYR 15 6.113 -9.666 -1.796
107 HH TYR 15 HH TYR 15 7.784 -7.513 0.173
108 H THR 16 HN THR 16 -0.642 -6.550 -0.290
109 HA THR 16 HA THR 16 -2.745 -8.451 -0.479
110 HB THR 16 HB THR 16 -2.802 -5.539 0.392
111 HG1 THR 16 1HG THR 16 -1.604 -6.704 1.870
112 HG21 THR 16 1HG2 THR 16 -4.893 -7.703 0.801
113 HG22 THR 16 2HG2 THR 16 -5.059 -6.311 -0.266
114 HG23 THR 16 3HG2 THR 16 -4.952 -6.076 1.479
115 HA PRO 17 HA PRO 17 -4.171 -7.339 -4.586
116 HB2 PRO 17 2HB PRO 17 -6.566 -8.640 -4.464
117 HB3 PRO 17 1HB PRO 17 -5.031 -9.470 -4.736
118 HG2 PRO 17 2HG PRO 17 -6.571 -9.140 -2.191
119 HG3 PRO 17 1HG PRO 17 -5.793 -10.595 -2.840
120 HD2 PRO 17 2HD PRO 17 -4.651 -9.128 -0.925
121 HD3 PRO 17 1HD PRO 17 -3.680 -9.899 -2.198
122 H GLY 18 HN GLY 18 -5.410 -5.718 -5.401
123 HA2 GLY 18 2HA GLY 18 -7.178 -4.224 -5.550
124 HA3 GLY 18 1HA GLY 18 -7.728 -4.755 -3.967
125 H CYS 19 HN CYS 19 -4.513 -4.114 -3.782
126 HA CYS 19 HA CYS 19 -5.063 -1.545 -2.551
127 HB2 CYS 19 2HB CYS 19 -2.753 -3.451 -2.307
128 HB3 CYS 19 1HB CYS 19 -2.791 -1.859 -1.555
129 H SER 20 HN SER 20 -3.800 0.263 -2.949
130 HA SER 20 HA SER 20 -2.454 0.231 -5.524
131 HB2 SER 20 2HB SER 20 -4.588 1.596 -5.295
132 HB3 SER 20 1HB SER 20 -3.749 2.573 -4.092
133 HG SER 20 HG SER 20 -3.017 2.179 -6.788
134 H CYS 21 HN CYS 21 -0.354 0.487 -5.368
135 HA CYS 21 HA CYS 21 0.843 1.045 -2.821
136 HB2 CYS 21 2HB CYS 21 1.727 -0.753 -4.227
137 HB3 CYS 21 1HB CYS 21 2.082 0.408 -5.500
138 H ARG 22 HN ARG 22 1.211 3.032 -2.190
139 HA ARG 22 HA ARG 22 2.038 5.031 -4.171
140 HB2 ARG 22 2HB ARG 22 0.454 5.602 -1.658
141 HB3 ARG 22 1HB ARG 22 0.841 6.715 -2.952
142 HG2 ARG 22 2HG ARG 22 -1.000 4.352 -3.229
143 HG3 ARG 22 1HG ARG 22 -1.522 6.009 -2.936
144 HD2 ARG 22 2HD ARG 22 -0.540 6.699 -5.056
145 HD3 ARG 22 1HD ARG 22 0.047 5.057 -5.325
146 HE ARG 22 HE ARG 22 -2.144 4.312 -5.634
147 HH11 ARG 22 1HH1 ARG 22 -2.046 7.816 -5.147
148 HH12 ARG 22 2HH1 ARG 22 -3.530 8.114 -5.915
149 HH21 ARG 22 1HH2 ARG 22 -4.172 4.676 -6.600
150 HH22 ARG 22 2HH2 ARG 22 -4.807 6.249 -6.786
151 H ARG 23 HN ARG 23 4.146 4.332 -3.585
152 HA ARG 23 HA ARG 23 4.987 3.904 -0.986
153 HB2 ARG 23 2HB ARG 23 7.366 4.274 -1.829
154 HB3 ARG 23 1HB ARG 23 6.431 3.000 -2.583
155 HG2 ARG 23 2HG ARG 23 6.003 4.438 -4.483
156 HG3 ARG 23 1HG ARG 23 6.929 5.738 -3.727
157 HD2 ARG 23 2HD ARG 23 8.935 4.395 -3.795
158 HD3 ARG 23 1HD ARG 23 8.025 2.998 -4.362
159 HE ARG 23 HE ARG 23 7.833 5.297 -6.061
160 HH11 ARG 23 1HH1 ARG 23 9.813 2.448 -5.337
161 HH12 ARG 23 2HH1 ARG 23 10.401 2.292 -6.920
162 HH21 ARG 23 1HH2 ARG 23 8.685 5.084 -8.221
163 HH22 ARG 23 2HH2 ARG 23 9.763 3.818 -8.600
164 HA PRO 24 HA PRO 24 6.634 3.925 0.359
165 HB2 PRO 24 2HB PRO 24 6.883 4.422 2.936
166 HB3 PRO 24 1HB PRO 24 7.974 5.147 1.748
167 HG2 PRO 24 2HG PRO 24 5.644 6.368 3.166
168 HG3 PRO 24 1HG PRO 24 7.222 7.077 2.787
169 HD2 PRO 24 2HD PRO 24 4.883 7.448 1.311
170 HD3 PRO 24 1HD PRO 24 6.529 7.760 0.728
171 H VAL 25 HN VAL 25 3.403 4.819 0.588
172 HA VAL 25 HA VAL 25 2.916 2.727 2.615
173 HB VAL 25 HB VAL 25 1.130 5.139 2.121
174 HG11 VAL 25 1HG1 VAL 25 -0.105 3.238 2.972
175 HG12 VAL 25 2HG1 VAL 25 0.015 4.489 4.211
176 HG13 VAL 25 3HG1 VAL 25 1.044 3.057 4.296
177 HG21 VAL 25 1HG2 VAL 25 1.920 6.001 4.282
178 HG22 VAL 25 2HG2 VAL 25 3.238 5.862 3.115
179 HG23 VAL 25 3HG2 VAL 25 3.061 4.661 4.393
180 H CYS 26 HN CYS 26 0.973 1.346 2.298
181 HA CYS 26 HA CYS 26 0.198 1.277 -0.508
182 HB2 CYS 26 2HB CYS 26 1.369 -0.726 0.393
183 HB3 CYS 26 1HB CYS 26 0.111 -0.888 1.609
184 H TYR 27 HN TYR 27 -1.782 2.053 -0.881
185 HA TYR 27 HA TYR 27 -3.640 2.248 1.386
186 HB2 TYR 27 2HB TYR 27 -3.467 3.994 -1.077
187 HB3 TYR 27 1HB TYR 27 -4.667 4.136 0.189
188 HD1 TYR 27 1HD TYR 27 -1.313 4.969 -0.843
189 HD2 TYR 27 2HD TYR 27 -3.960 4.900 2.467
190 HE1 TYR 27 1HE TYR 27 0.140 6.561 0.340
191 HE2 TYR 27 2HE TYR 27 -2.525 6.479 3.663
192 HH TYR 27 HH TYR 27 -0.193 7.183 3.656
193 H LYS 28 HN LYS 28 -5.776 1.749 1.078
194 HA LYS 28 HA LYS 28 -6.458 0.481 -1.464
195 HB2 LYS 28 2HB LYS 28 -6.328 -1.101 0.466
196 HB3 LYS 28 1HB LYS 28 -7.489 -0.079 1.310
197 HG2 LYS 28 2HG LYS 28 -9.185 -0.619 -0.333
198 HG3 LYS 28 1HG LYS 28 -8.019 -1.593 -1.233
199 HD2 LYS 28 2HD LYS 28 -7.754 -3.084 0.668
200 HD3 LYS 28 1HD LYS 28 -8.860 -2.096 1.620
201 HE2 LYS 28 2HE LYS 28 -10.671 -2.621 0.070
202 HE3 LYS 28 1HE LYS 28 -9.552 -3.559 -0.913
203 HZ1 LYS 28 1HZ LYS 28 -9.243 -5.081 0.918
204 HZ2 LYS 28 2HZ LYS 28 -10.876 -4.952 0.557
205 HZ3 LYS 28 3HZ LYS 28 -10.253 -4.163 1.905
206 H ASN 29 HN ASN 29 -7.643 1.909 -2.477
207 HA ASN 29 HA ASN 29 -9.159 3.463 -3.033
208 HB2 ASN 29 2HB ASN 29 -10.306 2.908 -0.300
209 HB3 ASN 29 1HB ASN 29 -10.923 4.222 -1.293
210 HD21 ASN 29 1HD2 ASN 29 -10.807 0.813 -0.795
211 HD22 ASN 29 2HD2 ASN 29 -11.939 0.415 -2.030
Start of MODEL 12
1 H1 GLY 1 HN GLY 1 -7.006 4.465 -1.937
2 HA2 GLY 1 2HA GLY 1 -6.802 6.649 -1.160
3 HA3 GLY 1 1HA GLY 1 -8.488 6.605 -0.688
4 H LEU 2 HN LEU 2 -8.245 4.267 0.996
5 HA LEU 2 HA LEU 2 -6.971 5.612 3.268
6 HB2 LEU 2 2HB LEU 2 -9.063 3.438 3.201
7 HB3 LEU 2 1HB LEU 2 -8.284 3.965 4.671
8 HG LEU 2 HG LEU 2 -9.264 6.268 4.205
9 HD11 LEU 2 1HD1 LEU 2 -10.938 4.724 2.241
10 HD12 LEU 2 2HD1 LEU 2 -9.785 6.000 1.852
11 HD13 LEU 2 3HD1 LEU 2 -11.236 6.375 2.786
12 HD21 LEU 2 1HD2 LEU 2 -10.136 4.795 5.904
13 HD22 LEU 2 2HD2 LEU 2 -11.123 3.957 4.704
14 HD23 LEU 2 3HD2 LEU 2 -11.454 5.644 5.096
15 HA PRO 3 HA PRO 3 -3.757 2.528 3.421
16 HB2 PRO 3 2HB PRO 3 -2.855 2.926 5.920
17 HB3 PRO 3 1HB PRO 3 -2.647 4.150 4.663
18 HG2 PRO 3 2HG PRO 3 -4.706 3.999 6.831
19 HG3 PRO 3 1HG PRO 3 -3.738 5.389 6.306
20 HD2 PRO 3 2HD PRO 3 -6.307 4.998 5.513
21 HD3 PRO 3 1HD PRO 3 -5.096 5.817 4.505
22 H ILE 4 HN ILE 4 -6.171 1.340 3.639
23 HA ILE 4 HA ILE 4 -6.942 0.049 5.996
24 HB ILE 4 HB ILE 4 -7.287 -0.891 3.148
25 HG12 ILE 4 2HG1 ILE 4 -8.165 1.354 3.420
26 HG13 ILE 4 1HG1 ILE 4 -9.483 0.204 3.240
27 HG21 ILE 4 1HG2 ILE 4 -8.875 -1.655 5.587
28 HG22 ILE 4 2HG2 ILE 4 -7.763 -2.687 4.694
29 HG23 ILE 4 3HG2 ILE 4 -9.248 -2.125 3.928
30 HD11 ILE 4 1HD1 ILE 4 -8.558 1.459 5.822
31 HD12 ILE 4 2HD1 ILE 4 -9.860 0.282 5.663
32 HD13 ILE 4 3HD1 ILE 4 -10.014 1.870 4.914
33 H CYS 5 HN CYS 5 -4.821 -1.105 3.387
34 HA CYS 5 HA CYS 5 -4.413 -3.659 4.470
35 HB2 CYS 5 2HB CYS 5 -2.592 -2.084 2.637
36 HB3 CYS 5 1HB CYS 5 -2.579 -3.831 2.876
37 H GLY 6 HN GLY 6 -2.623 -0.627 4.829
38 HA2 GLY 6 2HA GLY 6 -1.297 0.100 6.550
39 HA3 GLY 6 1HA GLY 6 -1.773 -1.334 7.442
40 H GLU 7 HN GLU 7 -0.428 -1.954 4.400
41 HA GLU 7 HA GLU 7 1.980 -2.880 5.718
42 HB2 GLU 7 2HB GLU 7 2.345 -4.263 3.707
43 HB3 GLU 7 1HB GLU 7 0.782 -4.588 4.431
44 HG2 GLU 7 2HG GLU 7 -0.285 -3.205 2.703
45 HG3 GLU 7 1HG GLU 7 1.301 -2.914 1.985
46 H THR 8 HN THR 8 4.006 -2.299 4.929
47 HA THR 8 HA THR 8 3.927 0.235 3.583
48 HB THR 8 HB THR 8 6.417 0.171 4.268
49 HG1 THR 8 1HG THR 8 7.006 -1.367 5.623
50 HG21 THR 8 1HG2 THR 8 4.789 1.662 5.243
51 HG22 THR 8 2HG2 THR 8 5.829 1.013 6.520
52 HG23 THR 8 3HG2 THR 8 4.191 0.375 6.290
53 H CYS 9 HN CYS 9 4.725 0.552 1.653
54 HA CYS 9 HA CYS 9 5.776 -1.811 0.321
55 HB2 CYS 9 2HB CYS 9 4.827 -0.926 -1.791
56 HB3 CYS 9 1HB CYS 9 3.605 -1.262 -0.574
57 H LEU 10 HN LEU 10 7.828 -1.164 1.117
58 HA LEU 10 HA LEU 10 9.052 1.252 0.164
59 HB2 LEU 10 2HB LEU 10 10.342 -1.223 1.342
60 HB3 LEU 10 1HB LEU 10 11.193 0.256 0.975
61 HG LEU 10 HG LEU 10 10.889 0.232 3.289
62 HD11 LEU 10 1HD1 LEU 10 9.507 2.153 3.780
63 HD12 LEU 10 2HD1 LEU 10 8.766 2.029 2.188
64 HD13 LEU 10 3HD1 LEU 10 10.487 2.388 2.333
65 HD21 LEU 10 1HD2 LEU 10 8.711 -0.041 4.401
66 HD22 LEU 10 2HD2 LEU 10 9.211 -1.485 3.519
67 HD23 LEU 10 3HD2 LEU 10 7.982 -0.415 2.840
68 H LEU 11 HN LEU 11 8.799 -2.019 -0.886
69 HA LEU 11 HA LEU 11 10.739 -1.671 -3.002
70 HB2 LEU 11 2HB LEU 11 8.942 -3.990 -2.303
71 HB3 LEU 11 1HB LEU 11 10.036 -3.997 -3.664
72 HG LEU 11 HG LEU 11 11.922 -3.674 -1.993
73 HD11 LEU 11 1HD1 LEU 11 10.628 -2.906 -0.084
74 HD12 LEU 11 2HD1 LEU 11 11.547 -4.363 0.297
75 HD13 LEU 11 3HD1 LEU 11 9.814 -4.471 -0.001
76 HD21 LEU 11 1HD2 LEU 11 10.287 -6.189 -1.852
77 HD22 LEU 11 2HD2 LEU 11 11.991 -6.028 -1.411
78 HD23 LEU 11 3HD2 LEU 11 11.483 -5.771 -3.080
79 H GLY 12 HN GLY 12 7.866 -0.410 -2.707
80 HA2 GLY 12 2HA GLY 12 6.311 0.439 -4.170
81 HA3 GLY 12 1HA GLY 12 7.410 -0.017 -5.465
82 H LYS 13 HN LYS 13 6.081 -2.280 -3.173
83 HA LYS 13 HA LYS 13 4.257 -3.330 -5.179
84 HB2 LYS 13 2HB LYS 13 6.377 -4.527 -5.455
85 HB3 LYS 13 1HB LYS 13 6.395 -4.914 -3.743
86 HG2 LYS 13 2HG LYS 13 4.341 -6.239 -4.055
87 HG3 LYS 13 1HG LYS 13 4.408 -5.883 -5.781
88 HD2 LYS 13 2HD LYS 13 6.579 -6.974 -5.931
89 HD3 LYS 13 1HD LYS 13 6.535 -7.319 -4.201
90 HE2 LYS 13 2HE LYS 13 4.520 -8.671 -4.530
91 HE3 LYS 13 1HE LYS 13 4.578 -8.310 -6.255
92 HZ1 LYS 13 1HZ LYS 13 5.508 -10.472 -5.749
93 HZ2 LYS 13 2HZ LYS 13 6.642 -9.777 -4.733
94 HZ3 LYS 13 3HZ LYS 13 6.698 -9.457 -6.386
95 H CYS 14 HN CYS 14 2.458 -4.175 -4.256
96 HA CYS 14 HA CYS 14 2.328 -4.245 -1.330
97 HB2 CYS 14 2HB CYS 14 0.167 -3.868 -3.403
98 HB3 CYS 14 1HB CYS 14 -0.129 -4.058 -1.679
99 H TYR 15 HN TYR 15 1.360 -6.047 -0.365
100 HA TYR 15 HA TYR 15 1.403 -8.399 -2.063
101 HB2 TYR 15 2HB TYR 15 1.412 -8.091 0.935
102 HB3 TYR 15 1HB TYR 15 1.379 -9.642 0.107
103 HD1 TYR 15 1HD TYR 15 3.361 -10.644 -0.641
104 HD2 TYR 15 2HD TYR 15 3.441 -6.551 0.506
105 HE1 TYR 15 1HE TYR 15 5.798 -10.641 -0.814
106 HE2 TYR 15 2HE TYR 15 5.888 -6.543 0.334
107 HH TYR 15 HH TYR 15 7.584 -8.994 -1.212
108 H THR 16 HN THR 16 -0.816 -6.306 -0.566
109 HA THR 16 HA THR 16 -2.961 -8.253 -0.795
110 HB THR 16 HB THR 16 -3.157 -5.302 -0.076
111 HG1 THR 16 1HG THR 16 -1.969 -6.158 1.500
112 HG21 THR 16 1HG2 THR 16 -5.056 -7.613 0.405
113 HG22 THR 16 2HG2 THR 16 -5.268 -6.346 -0.801
114 HG23 THR 16 3HG2 THR 16 -5.312 -5.944 0.915
115 HA PRO 17 HA PRO 17 -3.540 -6.677 -5.007
116 HB2 PRO 17 2HB PRO 17 -5.649 -8.310 -5.632
117 HB3 PRO 17 1HB PRO 17 -3.965 -8.830 -5.735
118 HG2 PRO 17 2HG PRO 17 -5.993 -9.367 -3.619
119 HG3 PRO 17 1HG PRO 17 -4.732 -10.433 -4.259
120 HD2 PRO 17 2HD PRO 17 -4.539 -9.109 -1.880
121 HD3 PRO 17 1HD PRO 17 -3.131 -9.577 -2.852
122 H GLY 18 HN GLY 18 -4.897 -5.108 -5.777
123 HA2 GLY 18 2HA GLY 18 -6.809 -3.777 -5.907
124 HA3 GLY 18 1HA GLY 18 -7.530 -4.730 -4.610
125 H CYS 19 HN CYS 19 -4.387 -3.759 -4.040
126 HA CYS 19 HA CYS 19 -5.164 -1.406 -2.496
127 HB2 CYS 19 2HB CYS 19 -4.797 -3.659 -1.207
128 HB3 CYS 19 1HB CYS 19 -3.112 -3.468 -1.651
129 H SER 20 HN SER 20 -3.655 0.249 -2.936
130 HA SER 20 HA SER 20 -1.637 -0.539 -4.899
131 HB2 SER 20 2HB SER 20 -3.570 0.685 -5.834
132 HB3 SER 20 1HB SER 20 -3.174 2.059 -4.804
133 HG SER 20 HG SER 20 -1.366 0.906 -6.650
134 H CYS 21 HN CYS 21 0.290 0.533 -4.902
135 HA CYS 21 HA CYS 21 1.161 1.279 -2.289
136 HB2 CYS 21 2HB CYS 21 2.498 -0.278 -3.556
137 HB3 CYS 21 1HB CYS 21 2.670 0.886 -4.864
138 H ARG 22 HN ARG 22 1.107 3.243 -1.619
139 HA ARG 22 HA ARG 22 2.004 5.375 -3.392
140 HB2 ARG 22 2HB ARG 22 -0.418 5.650 -2.782
141 HB3 ARG 22 1HB ARG 22 0.018 5.546 -1.089
142 HG2 ARG 22 2HG ARG 22 -0.407 7.831 -1.669
143 HG3 ARG 22 1HG ARG 22 1.307 7.629 -1.325
144 HD2 ARG 22 2HD ARG 22 1.788 7.573 -3.713
145 HD3 ARG 22 1HD ARG 22 0.067 7.698 -4.068
146 HE ARG 22 HE ARG 22 0.382 9.828 -2.590
147 HH11 ARG 22 1HH1 ARG 22 2.434 8.695 -5.246
148 HH12 ARG 22 2HH1 ARG 22 2.894 10.254 -5.739
149 HH21 ARG 22 1HH2 ARG 22 1.018 11.946 -3.266
150 HH22 ARG 22 2HH2 ARG 22 2.097 12.152 -4.579
151 H ARG 23 HN ARG 23 4.007 4.712 -2.786
152 HA ARG 23 HA ARG 23 4.829 3.803 -0.387
153 HB2 ARG 23 2HB ARG 23 7.161 4.269 -1.073
154 HB3 ARG 23 1HB ARG 23 6.200 3.461 -2.298
155 HG2 ARG 23 2HG ARG 23 5.920 5.575 -3.463
156 HG3 ARG 23 1HG ARG 23 6.905 6.380 -2.233
157 HD2 ARG 23 2HD ARG 23 8.768 4.899 -2.795
158 HD3 ARG 23 1HD ARG 23 7.769 4.132 -4.032
159 HE ARG 23 HE ARG 23 8.045 6.973 -4.258
160 HH11 ARG 23 1HH1 ARG 23 9.358 3.824 -5.210
161 HH12 ARG 23 2HH1 ARG 23 10.156 4.422 -6.592
162 HH21 ARG 23 1HH2 ARG 23 9.189 7.788 -6.164
163 HH22 ARG 23 2HH2 ARG 23 10.058 6.691 -7.141
164 HA PRO 24 HA PRO 24 6.379 3.523 0.856
165 HB2 PRO 24 2HB PRO 24 6.870 3.422 3.440
166 HB3 PRO 24 1HB PRO 24 7.888 4.386 2.362
167 HG2 PRO 24 2HG PRO 24 5.780 5.278 4.270
168 HG3 PRO 24 1HG PRO 24 7.305 6.061 3.826
169 HD2 PRO 24 2HD PRO 24 4.740 6.643 2.781
170 HD3 PRO 24 1HD PRO 24 6.291 7.235 2.160
171 H VAL 25 HN VAL 25 3.303 4.507 1.383
172 HA VAL 25 HA VAL 25 2.691 2.202 3.109
173 HB VAL 25 HB VAL 25 1.067 4.760 2.878
174 HG11 VAL 25 1HG1 VAL 25 -0.320 2.834 3.398
175 HG12 VAL 25 2HG1 VAL 25 -0.201 3.907 4.792
176 HG13 VAL 25 3HG1 VAL 25 0.738 2.415 4.746
177 HG21 VAL 25 1HG2 VAL 25 3.161 5.196 4.045
178 HG22 VAL 25 2HG2 VAL 25 2.858 3.837 5.128
179 HG23 VAL 25 3HG2 VAL 25 1.804 5.251 5.174
180 H CYS 26 HN CYS 26 1.104 0.790 2.430
181 HA CYS 26 HA CYS 26 0.160 1.241 -0.275
182 HB2 CYS 26 2HB CYS 26 1.257 -0.927 0.385
183 HB3 CYS 26 1HB CYS 26 -0.119 -1.225 1.438
184 H TYR 27 HN TYR 27 -1.888 1.711 -0.734
185 HA TYR 27 HA TYR 27 -3.775 1.989 1.508
186 HB2 TYR 27 2HB TYR 27 -3.461 3.740 -0.942
187 HB3 TYR 27 1HB TYR 27 -4.737 3.898 0.249
188 HD1 TYR 27 1HD TYR 27 -1.068 4.104 -0.186
189 HD2 TYR 27 2HD TYR 27 -4.406 5.259 2.147
190 HE1 TYR 27 1HE TYR 27 0.345 5.687 1.026
191 HE2 TYR 27 2HE TYR 27 -2.999 6.844 3.388
192 HH TYR 27 HH TYR 27 0.013 7.762 2.290
193 H LYS 28 HN LYS 28 -5.869 1.442 1.117
194 HA LYS 28 HA LYS 28 -6.386 0.102 -1.431
195 HB2 LYS 28 2HB LYS 28 -6.388 -1.467 0.515
196 HB3 LYS 28 1HB LYS 28 -7.616 -0.458 1.272
197 HG2 LYS 28 2HG LYS 28 -9.193 -0.980 -0.471
198 HG3 LYS 28 1HG LYS 28 -7.970 -1.911 -1.335
199 HD2 LYS 28 2HD LYS 28 -7.844 -3.487 0.532
200 HD3 LYS 28 1HD LYS 28 -9.050 -2.543 1.413
201 HE2 LYS 28 2HE LYS 28 -10.698 -2.981 -0.295
202 HE3 LYS 28 1HE LYS 28 -9.501 -3.811 -1.278
203 HZ1 LYS 28 1HZ LYS 28 -9.323 -5.488 0.456
204 HZ2 LYS 28 2HZ LYS 28 -10.905 -5.377 -0.104
205 HZ3 LYS 28 3HZ LYS 28 -10.492 -4.703 1.377
206 H ASN 29 HN ASN 29 -7.239 1.708 -2.490
207 HA ASN 29 HA ASN 29 -8.657 3.252 -3.220
208 HB2 ASN 29 2HB ASN 29 -10.588 1.901 -1.327
209 HB3 ASN 29 1HB ASN 29 -11.058 3.136 -2.488
210 HD21 ASN 29 1HD2 ASN 29 -11.915 0.416 -2.252
211 HD22 ASN 29 2HD2 ASN 29 -11.567 -0.363 -3.750
Start of MODEL 13
1 H1 GLY 1 HN GLY 1 -8.224 4.295 -0.031
2 HA2 GLY 1 2HA GLY 1 -6.197 5.992 -1.113
3 HA3 GLY 1 1HA GLY 1 -7.690 6.885 -0.823
4 H LEU 2 HN LEU 2 -7.071 4.190 1.266
5 HA LEU 2 HA LEU 2 -6.131 5.935 3.398
6 HB2 LEU 2 2HB LEU 2 -8.428 3.954 3.510
7 HB3 LEU 2 1HB LEU 2 -7.642 4.586 4.930
8 HG LEU 2 HG LEU 2 -9.698 5.687 4.710
9 HD11 LEU 2 1HD1 LEU 2 -9.111 8.025 4.481
10 HD12 LEU 2 2HD1 LEU 2 -7.567 7.558 3.769
11 HD13 LEU 2 3HD1 LEU 2 -7.940 7.113 5.434
12 HD21 LEU 2 1HD2 LEU 2 -10.408 6.941 2.708
13 HD22 LEU 2 2HD2 LEU 2 -10.218 5.220 2.381
14 HD23 LEU 2 3HD2 LEU 2 -8.979 6.359 1.855
15 HA PRO 3 HA PRO 3 -3.370 2.449 3.801
16 HB2 PRO 3 2HB PRO 3 -2.421 2.873 6.291
17 HB3 PRO 3 1HB PRO 3 -2.013 3.946 4.946
18 HG2 PRO 3 2HG PRO 3 -4.074 4.299 7.086
19 HG3 PRO 3 1HG PRO 3 -2.896 5.473 6.471
20 HD2 PRO 3 2HD PRO 3 -5.485 5.444 5.666
21 HD3 PRO 3 1HD PRO 3 -4.155 5.947 4.604
22 H ILE 4 HN ILE 4 -5.974 1.686 4.107
23 HA ILE 4 HA ILE 4 -6.869 0.551 6.519
24 HB ILE 4 HB ILE 4 -7.364 -0.531 3.734
25 HG12 ILE 4 2HG1 ILE 4 -7.944 1.859 3.835
26 HG13 ILE 4 1HG1 ILE 4 -9.378 0.861 3.644
27 HG21 ILE 4 1HG2 ILE 4 -8.999 -0.835 6.242
28 HG22 ILE 4 2HG2 ILE 4 -8.058 -2.089 5.439
29 HG23 ILE 4 3HG2 ILE 4 -9.472 -1.402 4.640
30 HD11 ILE 4 1HD1 ILE 4 -9.854 1.125 6.031
31 HD12 ILE 4 2HD1 ILE 4 -9.771 2.676 5.194
32 HD13 ILE 4 3HD1 ILE 4 -8.419 2.138 6.190
33 H CYS 5 HN CYS 5 -4.934 -0.750 3.901
34 HA CYS 5 HA CYS 5 -4.820 -3.415 4.706
35 HB2 CYS 5 2HB CYS 5 -2.784 -1.869 3.097
36 HB3 CYS 5 1HB CYS 5 -3.039 -3.613 3.073
37 H GLY 6 HN GLY 6 -2.881 -0.619 5.656
38 HA2 GLY 6 2HA GLY 6 -1.506 -0.391 7.501
39 HA3 GLY 6 1HA GLY 6 -1.768 -2.085 7.875
40 H GLU 7 HN GLU 7 -0.960 -2.704 5.064
41 HA GLU 7 HA GLU 7 1.786 -3.221 5.501
42 HB2 GLU 7 2HB GLU 7 0.173 -3.383 2.969
43 HB3 GLU 7 1HB GLU 7 1.756 -4.091 3.235
44 HG2 GLU 7 2HG GLU 7 0.823 -5.533 4.949
45 HG3 GLU 7 1HG GLU 7 -0.771 -4.826 4.672
46 H THR 8 HN THR 8 3.426 -2.578 3.873
47 HA THR 8 HA THR 8 2.963 0.123 2.946
48 HB THR 8 HB THR 8 5.456 0.485 3.614
49 HG1 THR 8 1HG THR 8 4.655 -1.688 5.247
50 HG21 THR 8 1HG2 THR 8 3.292 0.366 5.730
51 HG22 THR 8 2HG2 THR 8 3.572 1.704 4.619
52 HG23 THR 8 3HG2 THR 8 4.785 1.302 5.834
53 H CYS 9 HN CYS 9 4.712 0.791 1.428
54 HA CYS 9 HA CYS 9 5.540 -1.477 -0.231
55 HB2 CYS 9 2HB CYS 9 5.069 1.397 -1.065
56 HB3 CYS 9 1HB CYS 9 5.625 0.096 -2.106
57 H LEU 10 HN LEU 10 7.305 -1.580 1.265
58 HA LEU 10 HA LEU 10 9.073 0.694 1.386
59 HB2 LEU 10 2HB LEU 10 8.603 -0.853 3.321
60 HB3 LEU 10 1HB LEU 10 9.478 -2.102 2.475
61 HG LEU 10 HG LEU 10 10.728 -1.014 4.349
62 HD11 LEU 10 1HD1 LEU 10 12.859 -0.735 3.198
63 HD12 LEU 10 2HD1 LEU 10 12.013 -0.687 1.649
64 HD13 LEU 10 3HD1 LEU 10 11.987 -2.158 2.622
65 HD21 LEU 10 1HD2 LEU 10 11.647 1.219 4.031
66 HD22 LEU 10 2HD2 LEU 10 9.880 1.246 4.058
67 HD23 LEU 10 3HD2 LEU 10 10.744 1.375 2.529
68 H LEU 11 HN LEU 11 8.978 -2.578 0.007
69 HA LEU 11 HA LEU 11 11.443 -2.288 -1.366
70 HB2 LEU 11 2HB LEU 11 9.160 -4.246 -1.581
71 HB3 LEU 11 1HB LEU 11 10.631 -4.363 -2.514
72 HG LEU 11 HG LEU 11 10.673 -5.906 -0.755
73 HD11 LEU 11 1HD1 LEU 11 12.572 -3.657 -0.140
74 HD12 LEU 11 2HD1 LEU 11 12.794 -4.932 -1.336
75 HD13 LEU 11 3HD1 LEU 11 12.769 -5.332 0.378
76 HD21 LEU 11 1HD2 LEU 11 10.706 -5.304 1.646
77 HD22 LEU 11 2HD2 LEU 11 9.165 -4.957 0.865
78 HD23 LEU 11 3HD2 LEU 11 10.298 -3.646 1.199
79 H GLY 12 HN GLY 12 8.363 -1.158 -1.766
80 HA2 GLY 12 2HA GLY 12 8.006 0.565 -3.442
81 HA3 GLY 12 1HA GLY 12 8.937 -0.420 -4.561
82 H LYS 13 HN LYS 13 7.434 -2.765 -3.380
83 HA LYS 13 HA LYS 13 5.089 -2.469 -5.126
84 HB2 LYS 13 2HB LYS 13 6.779 -4.090 -5.917
85 HB3 LYS 13 1HB LYS 13 6.684 -4.934 -4.385
86 HG2 LYS 13 2HG LYS 13 5.469 -6.162 -6.056
87 HG3 LYS 13 1HG LYS 13 4.337 -5.505 -4.875
88 HD2 LYS 13 2HD LYS 13 3.913 -3.615 -6.440
89 HD3 LYS 13 1HD LYS 13 4.928 -4.434 -7.624
90 HE2 LYS 13 2HE LYS 13 3.444 -6.359 -7.602
91 HE3 LYS 13 1HE LYS 13 2.443 -5.588 -6.375
92 HZ1 LYS 13 1HZ LYS 13 1.949 -3.821 -7.972
93 HZ2 LYS 13 2HZ LYS 13 1.460 -5.331 -8.537
94 HZ3 LYS 13 3HZ LYS 13 2.865 -4.624 -9.149
95 H CYS 14 HN CYS 14 3.092 -3.105 -4.325
96 HA CYS 14 HA CYS 14 3.017 -3.980 -1.530
97 HB2 CYS 14 2HB CYS 14 1.739 -1.878 -2.138
98 HB3 CYS 14 1HB CYS 14 0.750 -2.863 -3.216
99 H TYR 15 HN TYR 15 2.215 -5.995 -1.147
100 HA TYR 15 HA TYR 15 2.019 -7.592 -3.556
101 HB2 TYR 15 2HB TYR 15 2.510 -8.461 -0.710
102 HB3 TYR 15 1HB TYR 15 2.633 -9.480 -2.144
103 HD1 TYR 15 1HD TYR 15 4.345 -8.809 -3.937
104 HD2 TYR 15 2HD TYR 15 4.371 -7.188 -0.002
105 HE1 TYR 15 1HE TYR 15 6.655 -8.056 -4.262
106 HE2 TYR 15 2HE TYR 15 6.673 -6.435 -0.314
107 HH TYR 15 HH TYR 15 8.163 -6.262 -3.306
108 H THR 16 HN THR 16 -0.218 -6.171 -1.743
109 HA THR 16 HA THR 16 -2.031 -8.450 -1.924
110 HB THR 16 HB THR 16 -2.301 -5.893 -0.317
111 HG1 THR 16 1HG THR 16 -1.511 -7.034 1.288
112 HG21 THR 16 1HG2 THR 16 -4.284 -6.961 0.699
113 HG22 THR 16 2HG2 THR 16 -4.106 -8.337 -0.389
114 HG23 THR 16 3HG2 THR 16 -4.512 -6.749 -1.037
115 HA PRO 17 HA PRO 17 -3.773 -6.268 -5.454
116 HB2 PRO 17 2HB PRO 17 -5.604 -8.167 -6.109
117 HB3 PRO 17 1HB PRO 17 -3.891 -8.319 -6.515
118 HG2 PRO 17 2HG PRO 17 -5.429 -9.575 -4.284
119 HG3 PRO 17 1HG PRO 17 -4.161 -10.276 -5.303
120 HD2 PRO 17 2HD PRO 17 -3.736 -9.358 -2.767
121 HD3 PRO 17 1HD PRO 17 -2.476 -9.392 -4.018
122 H GLY 18 HN GLY 18 -5.353 -4.799 -5.471
123 HA2 GLY 18 2HA GLY 18 -7.637 -4.146 -5.155
124 HA3 GLY 18 1HA GLY 18 -7.706 -5.208 -3.750
125 H CYS 19 HN CYS 19 -4.828 -4.038 -3.449
126 HA CYS 19 HA CYS 19 -5.622 -1.646 -1.965
127 HB2 CYS 19 2HB CYS 19 -4.870 -3.688 -0.634
128 HB3 CYS 19 1HB CYS 19 -3.308 -3.530 -1.420
129 H SER 20 HN SER 20 -4.734 0.141 -2.910
130 HA SER 20 HA SER 20 -2.851 -0.294 -5.036
131 HB2 SER 20 2HB SER 20 -3.166 2.139 -5.521
132 HB3 SER 20 1HB SER 20 -4.665 1.220 -5.538
133 HG SER 20 HG SER 20 -4.500 2.035 -3.097
134 H CYS 21 HN CYS 21 -0.796 0.219 -5.073
135 HA CYS 21 HA CYS 21 0.450 0.809 -2.561
136 HB2 CYS 21 2HB CYS 21 1.379 -0.930 -3.987
137 HB3 CYS 21 1HB CYS 21 1.557 0.226 -5.296
138 H ARG 22 HN ARG 22 0.392 2.894 -2.001
139 HA ARG 22 HA ARG 22 1.308 4.845 -3.990
140 HB2 ARG 22 2HB ARG 22 -0.999 5.272 -3.041
141 HB3 ARG 22 1HB ARG 22 -0.271 5.344 -1.446
142 HG2 ARG 22 2HG ARG 22 1.120 7.257 -2.249
143 HG3 ARG 22 1HG ARG 22 0.165 7.242 -3.734
144 HD2 ARG 22 2HD ARG 22 -0.867 7.666 -0.931
145 HD3 ARG 22 1HD ARG 22 -0.722 8.894 -2.187
146 HE ARG 22 HE ARG 22 -2.346 6.693 -2.989
147 HH11 ARG 22 1HH1 ARG 22 -2.416 9.678 -1.099
148 HH12 ARG 22 2HH1 ARG 22 -4.081 9.931 -1.245
149 HH21 ARG 22 1HH2 ARG 22 -4.636 6.987 -3.205
150 HH22 ARG 22 2HH2 ARG 22 -5.401 8.329 -2.500
151 H ARG 23 HN ARG 23 3.397 4.626 -3.653
152 HA ARG 23 HA ARG 23 4.604 3.653 -1.404
153 HB2 ARG 23 2HB ARG 23 5.867 5.455 -3.464
154 HB3 ARG 23 1HB ARG 23 6.738 4.474 -2.312
155 HG2 ARG 23 2HG ARG 23 5.852 2.435 -3.274
156 HG3 ARG 23 1HG ARG 23 4.883 3.368 -4.410
157 HD2 ARG 23 2HD ARG 23 6.907 4.240 -5.444
158 HD3 ARG 23 1HD ARG 23 7.901 3.366 -4.276
159 HE ARG 23 HE ARG 23 6.165 1.582 -5.596
160 HH11 ARG 23 1HH1 ARG 23 9.119 3.425 -6.283
161 HH12 ARG 23 2HH1 ARG 23 9.692 2.308 -7.431
162 HH21 ARG 23 1HH2 ARG 23 6.959 0.106 -7.159
163 HH22 ARG 23 2HH2 ARG 23 8.441 0.384 -7.960
164 HA PRO 24 HA PRO 24 6.073 3.558 -0.196
165 HB2 PRO 24 2HB PRO 24 6.768 3.772 2.471
166 HB3 PRO 24 1HB PRO 24 7.773 4.261 1.110
167 HG2 PRO 24 2HG PRO 24 6.596 5.962 3.076
168 HG3 PRO 24 1HG PRO 24 7.494 6.443 1.630
169 HD2 PRO 24 2HD PRO 24 4.555 6.268 2.062
170 HD3 PRO 24 1HD PRO 24 5.475 7.364 1.012
171 H VAL 25 HN VAL 25 2.991 4.122 0.518
172 HA VAL 25 HA VAL 25 2.811 1.966 2.514
173 HB VAL 25 HB VAL 25 0.957 4.376 2.505
174 HG11 VAL 25 1HG1 VAL 25 1.196 2.146 4.506
175 HG12 VAL 25 2HG1 VAL 25 -0.139 2.421 3.387
176 HG13 VAL 25 3HG1 VAL 25 0.183 3.579 4.679
177 HG21 VAL 25 1HG2 VAL 25 3.161 5.077 3.212
178 HG22 VAL 25 2HG2 VAL 25 3.220 3.769 4.392
179 HG23 VAL 25 3HG2 VAL 25 2.046 5.071 4.578
180 H CYS 26 HN CYS 26 0.892 0.615 2.393
181 HA CYS 26 HA CYS 26 -0.290 0.517 -0.239
182 HB2 CYS 26 2HB CYS 26 -0.608 -1.256 2.190
183 HB3 CYS 26 1HB CYS 26 -1.388 -1.545 0.642
184 H TYR 27 HN TYR 27 -2.001 1.722 -0.653
185 HA TYR 27 HA TYR 27 -3.844 2.402 1.514
186 HB2 TYR 27 2HB TYR 27 -3.280 3.856 -1.080
187 HB3 TYR 27 1HB TYR 27 -4.612 4.214 -0.019
188 HD1 TYR 27 1HD TYR 27 -0.892 4.085 -0.043
189 HD2 TYR 27 2HD TYR 27 -4.389 5.729 1.697
190 HE1 TYR 27 1HE TYR 27 0.482 5.698 1.188
191 HE2 TYR 27 2HE TYR 27 -3.051 7.313 2.950
192 HH TYR 27 HH TYR 27 -0.808 7.618 3.739
193 H LYS 28 HN LYS 28 -5.591 1.289 1.453
194 HA LYS 28 HA LYS 28 -6.593 0.190 -1.028
195 HB2 LYS 28 2HB LYS 28 -6.750 -1.201 0.922
196 HB3 LYS 28 1HB LYS 28 -7.597 0.069 1.821
197 HG2 LYS 28 2HG LYS 28 -9.492 -0.177 0.228
198 HG3 LYS 28 1HG LYS 28 -8.616 -1.486 -0.552
199 HD2 LYS 28 2HD LYS 28 -8.522 -2.703 1.593
200 HD3 LYS 28 1HD LYS 28 -9.478 -1.425 2.334
201 HE2 LYS 28 2HE LYS 28 -11.320 -1.902 0.815
202 HE3 LYS 28 1HE LYS 28 -10.344 -3.145 0.031
203 HZ1 LYS 28 1HZ LYS 28 -11.213 -3.177 2.858
204 HZ2 LYS 28 2HZ LYS 28 -10.264 -4.346 2.111
205 HZ3 LYS 28 3HZ LYS 28 -11.864 -4.109 1.607
206 H ASN 29 HN ASN 29 -7.782 1.405 -2.231
207 HA ASN 29 HA ASN 29 -9.234 2.917 -3.032
208 HB2 ASN 29 2HB ASN 29 -10.756 2.293 -1.115
209 HB3 ASN 29 1HB ASN 29 -9.986 3.542 -0.151
210 HD21 ASN 29 1HD2 ASN 29 -12.135 2.811 -2.622
211 HD22 ASN 29 2HD2 ASN 29 -12.828 4.387 -2.847
Start of MODEL 14
1 H1 GLY 1 HN GLY 1 -6.986 4.489 -1.213
2 HA2 GLY 1 2HA GLY 1 -5.903 6.477 -0.654
3 HA3 GLY 1 1HA GLY 1 -7.466 7.219 -0.349
4 H LEU 2 HN LEU 2 -7.775 4.501 1.248
5 HA LEU 2 HA LEU 2 -6.919 5.768 3.724
6 HB2 LEU 2 2HB LEU 2 -8.969 3.628 3.183
7 HB3 LEU 2 1HB LEU 2 -8.590 4.256 4.778
8 HG LEU 2 HG LEU 2 -9.768 5.856 2.502
9 HD11 LEU 2 1HD1 LEU 2 -11.316 4.168 3.328
10 HD12 LEU 2 2HD1 LEU 2 -11.823 5.789 3.789
11 HD13 LEU 2 3HD1 LEU 2 -11.059 4.736 4.980
12 HD21 LEU 2 1HD2 LEU 2 -8.458 7.233 4.036
13 HD22 LEU 2 2HD2 LEU 2 -9.322 6.543 5.408
14 HD23 LEU 2 3HD2 LEU 2 -10.183 7.544 4.239
15 HA PRO 3 HA PRO 3 -3.927 2.503 4.386
16 HB2 PRO 3 2HB PRO 3 -4.323 2.761 7.281
17 HB3 PRO 3 1HB PRO 3 -2.923 3.225 6.313
18 HG2 PRO 3 2HG PRO 3 -4.531 5.047 7.473
19 HG3 PRO 3 1HG PRO 3 -3.747 5.343 5.912
20 HD2 PRO 3 2HD PRO 3 -6.557 4.477 6.481
21 HD3 PRO 3 1HD PRO 3 -5.955 5.725 5.364
22 H ILE 4 HN ILE 4 -6.461 1.504 3.909
23 HA ILE 4 HA ILE 4 -7.602 -0.194 5.868
24 HB ILE 4 HB ILE 4 -7.692 -0.444 2.866
25 HG12 ILE 4 2HG1 ILE 4 -8.507 1.726 3.599
26 HG13 ILE 4 1HG1 ILE 4 -9.835 0.760 2.969
27 HG21 ILE 4 1HG2 ILE 4 -8.386 -2.513 3.883
28 HG22 ILE 4 2HG2 ILE 4 -9.771 -1.695 3.156
29 HG23 ILE 4 3HG2 ILE 4 -9.545 -1.655 4.907
30 HD11 ILE 4 1HD1 ILE 4 -10.528 1.985 4.935
31 HD12 ILE 4 2HD1 ILE 4 -9.201 1.302 5.864
32 HD13 ILE 4 3HD1 ILE 4 -10.507 0.257 5.296
33 H CYS 5 HN CYS 5 -5.202 -0.772 3.342
34 HA CYS 5 HA CYS 5 -5.132 -3.567 3.697
35 HB2 CYS 5 2HB CYS 5 -2.988 -1.833 2.407
36 HB3 CYS 5 1HB CYS 5 -3.217 -3.565 2.223
37 H GLY 6 HN GLY 6 -3.316 -0.938 5.200
38 HA2 GLY 6 2HA GLY 6 -2.148 -0.980 7.175
39 HA3 GLY 6 1HA GLY 6 -2.556 -2.685 7.332
40 H GLU 7 HN GLU 7 -1.245 -1.882 4.397
41 HA GLU 7 HA GLU 7 1.243 -3.198 5.161
42 HB2 GLU 7 2HB GLU 7 -0.147 -3.091 2.503
43 HB3 GLU 7 1HB GLU 7 1.464 -3.748 2.745
44 HG2 GLU 7 2HG GLU 7 -1.105 -4.739 3.914
45 HG3 GLU 7 1HG GLU 7 -0.104 -5.503 2.663
46 H THR 8 HN THR 8 2.995 -2.695 3.659
47 HA THR 8 HA THR 8 3.095 0.186 3.187
48 HB THR 8 HB THR 8 5.574 -0.022 3.696
49 HG1 THR 8 1HG THR 8 4.720 -2.513 4.790
50 HG21 THR 8 1HG2 THR 8 3.665 -0.677 5.938
51 HG22 THR 8 2HG2 THR 8 4.003 0.937 5.306
52 HG23 THR 8 3HG2 THR 8 5.275 0.025 6.125
53 H CYS 9 HN CYS 9 4.905 0.699 1.639
54 HA CYS 9 HA CYS 9 5.179 -1.384 -0.391
55 HB2 CYS 9 2HB CYS 9 4.878 1.595 -0.738
56 HB3 CYS 9 1HB CYS 9 5.480 0.550 -2.010
57 H LEU 10 HN LEU 10 7.022 -1.976 0.841
58 HA LEU 10 HA LEU 10 9.191 -0.060 0.938
59 HB2 LEU 10 2HB LEU 10 9.121 -2.987 1.655
60 HB3 LEU 10 1HB LEU 10 10.445 -1.889 1.982
61 HG LEU 10 HG LEU 10 7.687 -1.757 3.192
62 HD11 LEU 10 1HD1 LEU 10 10.341 -2.543 4.356
63 HD12 LEU 10 2HD1 LEU 10 8.965 -3.604 4.049
64 HD13 LEU 10 3HD1 LEU 10 8.845 -2.329 5.261
65 HD21 LEU 10 1HD2 LEU 10 8.620 0.483 2.943
66 HD22 LEU 10 2HD2 LEU 10 10.124 -0.044 3.692
67 HD23 LEU 10 3HD2 LEU 10 8.639 -0.002 4.638
68 H LEU 11 HN LEU 11 8.191 -2.847 -0.885
69 HA LEU 11 HA LEU 11 10.575 -2.895 -2.514
70 HB2 LEU 11 2HB LEU 11 8.037 -4.528 -2.511
71 HB3 LEU 11 1HB LEU 11 9.315 -4.755 -3.674
72 HG LEU 11 HG LEU 11 10.841 -5.367 -1.794
73 HD11 LEU 11 1HD1 LEU 11 8.347 -5.340 -0.130
74 HD12 LEU 11 2HD1 LEU 11 9.754 -4.292 0.051
75 HD13 LEU 11 3HD1 LEU 11 9.901 -6.024 0.353
76 HD21 LEU 11 1HD2 LEU 11 9.930 -7.601 -1.477
77 HD22 LEU 11 2HD2 LEU 11 9.744 -7.057 -3.150
78 HD23 LEU 11 3HD2 LEU 11 8.362 -7.042 -2.057
79 H GLY 12 HN GLY 12 8.286 -0.747 -2.462
80 HA2 GLY 12 2HA GLY 12 7.502 0.766 -4.033
81 HA3 GLY 12 1HA GLY 12 8.313 -0.174 -5.279
82 H LYS 13 HN LYS 13 6.500 -2.236 -3.523
83 HA LYS 13 HA LYS 13 4.082 -1.966 -5.127
84 HB2 LYS 13 2HB LYS 13 5.707 -3.437 -6.300
85 HB3 LYS 13 1HB LYS 13 5.802 -4.449 -4.876
86 HG2 LYS 13 2HG LYS 13 3.367 -4.943 -5.152
87 HG3 LYS 13 1HG LYS 13 3.418 -4.051 -6.673
88 HD2 LYS 13 2HD LYS 13 5.122 -6.448 -6.005
89 HD3 LYS 13 1HD LYS 13 3.655 -6.506 -6.970
90 HE2 LYS 13 2HE LYS 13 6.133 -4.918 -7.673
91 HE3 LYS 13 1HE LYS 13 5.747 -6.501 -8.319
92 HZ1 LYS 13 1HZ LYS 13 4.142 -4.020 -8.729
93 HZ2 LYS 13 2HZ LYS 13 3.730 -5.569 -9.280
94 HZ3 LYS 13 3HZ LYS 13 5.109 -4.815 -9.857
95 H CYS 14 HN CYS 14 2.323 -3.076 -4.075
96 HA CYS 14 HA CYS 14 2.575 -3.291 -1.232
97 HB2 CYS 14 2HB CYS 14 0.267 -3.854 -3.091
98 HB3 CYS 14 1HB CYS 14 0.179 -3.964 -1.344
99 H TYR 15 HN TYR 15 2.180 -5.139 -0.020
100 HA TYR 15 HA TYR 15 3.000 -7.625 -1.192
101 HB2 TYR 15 2HB TYR 15 1.935 -7.094 1.590
102 HB3 TYR 15 1HB TYR 15 2.887 -8.481 1.070
103 HD1 TYR 15 1HD TYR 15 5.293 -8.064 0.337
104 HD2 TYR 15 2HD TYR 15 2.970 -5.158 2.363
105 HE1 TYR 15 1HE TYR 15 7.339 -6.861 0.952
106 HE2 TYR 15 2HE TYR 15 5.001 -3.941 2.968
107 HH TYR 15 HH TYR 15 7.365 -4.480 3.308
108 H THR 16 HN THR 16 0.063 -6.005 -0.389
109 HA THR 16 HA THR 16 -1.504 -8.436 -0.718
110 HB THR 16 HB THR 16 -2.453 -5.690 0.111
111 HG1 THR 16 1HG THR 16 -1.395 -7.869 1.596
112 HG21 THR 16 1HG2 THR 16 -3.587 -8.467 0.552
113 HG22 THR 16 2HG2 THR 16 -4.186 -7.300 -0.627
114 HG23 THR 16 3HG2 THR 16 -4.309 -6.951 1.098
115 HA PRO 17 HA PRO 17 -2.504 -6.813 -4.872
116 HB2 PRO 17 2HB PRO 17 -4.116 -9.265 -5.026
117 HB3 PRO 17 1HB PRO 17 -2.774 -8.754 -6.050
118 HG2 PRO 17 2HG PRO 17 -2.509 -10.796 -4.334
119 HG3 PRO 17 1HG PRO 17 -1.179 -9.668 -4.648
120 HD2 PRO 17 2HD PRO 17 -3.092 -9.733 -2.346
121 HD3 PRO 17 1HD PRO 17 -1.324 -9.524 -2.351
122 H GLY 18 HN GLY 18 -4.214 -5.578 -5.401
123 HA2 GLY 18 2HA GLY 18 -6.598 -5.222 -5.531
124 HA3 GLY 18 1HA GLY 18 -6.754 -6.007 -3.960
125 H CYS 19 HN CYS 19 -4.075 -4.249 -3.757
126 HA CYS 19 HA CYS 19 -5.463 -1.971 -2.559
127 HB2 CYS 19 2HB CYS 19 -2.698 -3.081 -2.093
128 HB3 CYS 19 1HB CYS 19 -3.364 -1.667 -1.293
129 H SER 20 HN SER 20 -4.086 0.087 -2.648
130 HA SER 20 HA SER 20 -2.905 0.373 -5.291
131 HB2 SER 20 2HB SER 20 -4.412 2.355 -3.574
132 HB3 SER 20 1HB SER 20 -3.707 2.718 -5.149
133 HG SER 20 HG SER 20 -5.062 0.777 -5.801
134 H CYS 21 HN CYS 21 -0.786 0.738 -5.181
135 HA CYS 21 HA CYS 21 0.445 1.213 -2.630
136 HB2 CYS 21 2HB CYS 21 1.361 -0.467 -4.156
137 HB3 CYS 21 1HB CYS 21 1.628 0.777 -5.370
138 H ARG 22 HN ARG 22 1.332 3.041 -1.932
139 HA ARG 22 HA ARG 22 2.008 5.165 -3.778
140 HB2 ARG 22 2HB ARG 22 -0.295 5.709 -2.916
141 HB3 ARG 22 1HB ARG 22 0.327 5.583 -1.277
142 HG2 ARG 22 2HG ARG 22 0.123 7.905 -1.862
143 HG3 ARG 22 1HG ARG 22 1.833 7.494 -1.745
144 HD2 ARG 22 2HD ARG 22 1.917 7.288 -4.204
145 HD3 ARG 22 1HD ARG 22 0.218 7.752 -4.280
146 HE ARG 22 HE ARG 22 1.737 9.681 -2.868
147 HH11 ARG 22 1HH1 ARG 22 0.891 8.631 -6.146
148 HH12 ARG 22 2HH1 ARG 22 1.402 10.077 -6.889
149 HH21 ARG 22 1HH2 ARG 22 2.462 11.695 -3.941
150 HH22 ARG 22 2HH2 ARG 22 2.316 11.809 -5.641
151 H ARG 23 HN ARG 23 4.045 4.411 -3.358
152 HA ARG 23 HA ARG 23 5.172 3.607 -1.050
153 HB2 ARG 23 2HB ARG 23 7.414 4.231 -1.970
154 HB3 ARG 23 1HB ARG 23 6.403 3.301 -3.058
155 HG2 ARG 23 2HG ARG 23 5.857 5.365 -4.289
156 HG3 ARG 23 1HG ARG 23 6.889 6.268 -3.181
157 HD2 ARG 23 2HD ARG 23 8.837 5.063 -3.898
158 HD3 ARG 23 1HD ARG 23 7.854 3.965 -4.865
159 HE ARG 23 HE ARG 23 7.247 6.285 -5.980
160 HH11 ARG 23 1HH1 ARG 23 10.442 5.075 -5.082
161 HH12 ARG 23 2HH1 ARG 23 11.261 5.819 -6.367
162 HH21 ARG 23 1HH2 ARG 23 8.302 7.240 -7.768
163 HH22 ARG 23 2HH2 ARG 23 9.978 7.081 -8.004
164 HA PRO 24 HA PRO 24 6.677 3.355 0.174
165 HB2 PRO 24 2HB PRO 24 7.477 3.407 2.690
166 HB3 PRO 24 1HB PRO 24 8.370 4.281 1.443
167 HG2 PRO 24 2HG PRO 24 6.532 5.335 3.537
168 HG3 PRO 24 1HG PRO 24 7.983 6.074 2.844
169 HD2 PRO 24 2HD PRO 24 5.286 6.586 2.106
170 HD3 PRO 24 1HD PRO 24 6.746 7.160 1.280
171 H VAL 25 HN VAL 25 3.699 4.308 0.794
172 HA VAL 25 HA VAL 25 3.146 2.225 2.794
173 HB VAL 25 HB VAL 25 1.520 4.769 2.407
174 HG11 VAL 25 1HG1 VAL 25 1.428 2.716 4.609
175 HG12 VAL 25 2HG1 VAL 25 0.224 2.930 3.339
176 HG13 VAL 25 3HG1 VAL 25 0.472 4.196 4.543
177 HG21 VAL 25 1HG2 VAL 25 2.478 5.574 4.525
178 HG22 VAL 25 2HG2 VAL 25 3.709 5.372 3.278
179 HG23 VAL 25 3HG2 VAL 25 3.550 4.172 4.562
180 H CYS 26 HN CYS 26 0.965 1.151 2.501
181 HA CYS 26 HA CYS 26 0.189 1.171 -0.326
182 HB2 CYS 26 2HB CYS 26 1.192 -0.961 0.548
183 HB3 CYS 26 1HB CYS 26 -0.082 -1.002 1.746
184 H TYR 27 HN TYR 27 -1.929 1.743 -0.711
185 HA TYR 27 HA TYR 27 -3.656 2.022 1.644
186 HB2 TYR 27 2HB TYR 27 -3.402 3.884 -0.729
187 HB3 TYR 27 1HB TYR 27 -4.657 3.996 0.495
188 HD1 TYR 27 1HD TYR 27 -1.122 4.544 -0.246
189 HD2 TYR 27 2HD TYR 27 -4.148 4.831 2.716
190 HE1 TYR 27 1HE TYR 27 0.336 5.995 1.081
191 HE2 TYR 27 2HE TYR 27 -2.723 6.273 4.067
192 HH TYR 27 HH TYR 27 -0.369 6.805 4.349
193 H LYS 28 HN LYS 28 -5.965 2.159 0.984
194 HA LYS 28 HA LYS 28 -6.619 1.052 -1.602
195 HB2 LYS 28 2HB LYS 28 -6.467 -0.899 -0.057
196 HB3 LYS 28 1HB LYS 28 -7.619 -0.096 1.013
197 HG2 LYS 28 2HG LYS 28 -9.313 -0.247 -0.752
198 HG3 LYS 28 1HG LYS 28 -8.138 -1.073 -1.778
199 HD2 LYS 28 2HD LYS 28 -7.937 -2.855 -0.108
200 HD3 LYS 28 1HD LYS 28 -9.132 -2.040 0.897
201 HE2 LYS 28 2HE LYS 28 -10.200 -3.827 -0.336
202 HE3 LYS 28 1HE LYS 28 -10.773 -2.263 -0.909
203 HZ1 LYS 28 1HZ LYS 28 -8.684 -3.893 -2.253
204 HZ2 LYS 28 2HZ LYS 28 -9.335 -2.471 -2.853
205 HZ3 LYS 28 3HZ LYS 28 -10.281 -3.842 -2.718
206 H ASN 29 HN ASN 29 -7.896 2.563 -2.348
207 HA ASN 29 HA ASN 29 -9.534 4.094 -2.584
208 HB2 ASN 29 2HB ASN 29 -10.530 3.086 0.107
209 HB3 ASN 29 1HB ASN 29 -11.380 4.273 -0.872
210 HD21 ASN 29 1HD2 ASN 29 -12.312 3.594 -2.818
211 HD22 ASN 29 2HD2 ASN 29 -12.662 1.926 -3.118
Start of MODEL 15
1 H1 GLY 1 HN GLY 1 -7.143 4.448 -1.305
2 HA2 GLY 1 2HA GLY 1 -6.402 6.615 -0.723
3 HA3 GLY 1 1HA GLY 1 -8.066 7.047 -0.349
4 H LEU 2 HN LEU 2 -8.044 4.279 1.083
5 HA LEU 2 HA LEU 2 -7.193 5.459 3.609
6 HB2 LEU 2 2HB LEU 2 -9.037 3.157 3.022
7 HB3 LEU 2 1HB LEU 2 -8.506 3.568 4.635
8 HG LEU 2 HG LEU 2 -9.632 5.836 4.206
9 HD11 LEU 2 1HD1 LEU 2 -9.906 5.639 1.795
10 HD12 LEU 2 2HD1 LEU 2 -11.465 5.819 2.600
11 HD13 LEU 2 3HD1 LEU 2 -10.950 4.236 2.021
12 HD21 LEU 2 1HD2 LEU 2 -10.445 4.115 5.718
13 HD22 LEU 2 2HD2 LEU 2 -11.302 3.341 4.380
14 HD23 LEU 2 3HD2 LEU 2 -11.764 4.956 4.917
15 HA PRO 3 HA PRO 3 -3.886 2.484 3.867
16 HB2 PRO 3 2HB PRO 3 -3.327 2.683 6.485
17 HB3 PRO 3 1HB PRO 3 -3.014 4.034 5.387
18 HG2 PRO 3 2HG PRO 3 -5.346 3.600 7.218
19 HG3 PRO 3 1HG PRO 3 -4.368 5.059 6.989
20 HD2 PRO 3 2HD PRO 3 -6.768 4.695 5.789
21 HD3 PRO 3 1HD PRO 3 -5.454 5.633 5.045
22 H ILE 4 HN ILE 4 -6.296 1.299 3.648
23 HA ILE 4 HA ILE 4 -7.325 -0.294 5.706
24 HB ILE 4 HB ILE 4 -7.230 -0.824 2.730
25 HG12 ILE 4 2HG1 ILE 4 -8.353 1.264 3.279
26 HG13 ILE 4 1HG1 ILE 4 -9.501 0.086 2.658
27 HG21 ILE 4 1HG2 ILE 4 -9.004 -2.131 4.779
28 HG22 ILE 4 2HG2 ILE 4 -7.697 -2.893 3.870
29 HG23 ILE 4 3HG2 ILE 4 -9.133 -2.305 3.030
30 HD11 ILE 4 1HD1 ILE 4 -10.462 1.316 4.503
31 HD12 ILE 4 2HD1 ILE 4 -9.114 0.866 5.544
32 HD13 ILE 4 3HD1 ILE 4 -10.233 -0.370 4.967
33 H CYS 5 HN CYS 5 -4.903 -0.988 3.265
34 HA CYS 5 HA CYS 5 -4.377 -3.635 4.166
35 HB2 CYS 5 2HB CYS 5 -2.622 -1.863 2.476
36 HB3 CYS 5 1HB CYS 5 -2.693 -3.628 2.471
37 H GLY 6 HN GLY 6 -2.914 -0.454 4.581
38 HA2 GLY 6 2HA GLY 6 -1.509 0.411 6.168
39 HA3 GLY 6 1HA GLY 6 -2.042 -0.910 7.195
40 H GLU 7 HN GLU 7 -0.377 -1.329 4.179
41 HA GLU 7 HA GLU 7 1.781 -2.602 5.678
42 HB2 GLU 7 2HB GLU 7 1.049 -2.902 2.775
43 HB3 GLU 7 1HB GLU 7 2.332 -3.755 3.612
44 HG2 GLU 7 2HG GLU 7 0.654 -4.740 5.076
45 HG3 GLU 7 1HG GLU 7 -0.606 -3.990 4.091
46 H THR 8 HN THR 8 3.895 -2.249 4.904
47 HA THR 8 HA THR 8 4.144 0.311 3.597
48 HB THR 8 HB THR 8 6.571 -0.030 4.260
49 HG1 THR 8 1HG THR 8 7.029 -1.639 5.606
50 HG21 THR 8 1HG2 THR 8 4.449 0.262 6.380
51 HG22 THR 8 2HG2 THR 8 5.117 1.555 5.384
52 HG23 THR 8 3HG2 THR 8 6.136 0.744 6.580
53 H CYS 9 HN CYS 9 4.871 0.393 1.622
54 HA CYS 9 HA CYS 9 5.585 -2.171 0.402
55 HB2 CYS 9 2HB CYS 9 4.757 -1.205 -1.745
56 HB3 CYS 9 1HB CYS 9 3.515 -1.388 -0.517
57 H LEU 10 HN LEU 10 7.689 -1.744 1.266
58 HA LEU 10 HA LEU 10 9.187 0.479 0.357
59 HB2 LEU 10 2HB LEU 10 10.155 -2.116 1.531
60 HB3 LEU 10 1HB LEU 10 11.137 -0.692 1.284
61 HG LEU 10 HG LEU 10 8.807 -0.941 3.186
62 HD11 LEU 10 1HD1 LEU 10 10.506 -0.678 4.909
63 HD12 LEU 10 2HD1 LEU 10 11.762 -0.660 3.671
64 HD13 LEU 10 3HD1 LEU 10 10.796 -2.114 3.926
65 HD21 LEU 10 1HD2 LEU 10 9.446 1.306 3.947
66 HD22 LEU 10 2HD2 LEU 10 8.909 1.314 2.272
67 HD23 LEU 10 3HD2 LEU 10 10.632 1.404 2.645
68 H LEU 11 HN LEU 11 8.749 -2.772 -0.838
69 HA LEU 11 HA LEU 11 10.946 -2.715 -2.622
70 HB2 LEU 11 2HB LEU 11 8.431 -4.363 -2.801
71 HB3 LEU 11 1HB LEU 11 9.888 -4.631 -3.732
72 HG LEU 11 HG LEU 11 9.541 -4.976 -0.760
73 HD11 LEU 11 1HD1 LEU 11 8.628 -6.773 -2.103
74 HD12 LEU 11 2HD1 LEU 11 10.061 -7.302 -1.223
75 HD13 LEU 11 3HD1 LEU 11 10.168 -6.941 -2.945
76 HD21 LEU 11 1HD2 LEU 11 12.043 -5.231 -2.428
77 HD22 LEU 11 2HD2 LEU 11 11.879 -5.756 -0.755
78 HD23 LEU 11 3HD2 LEU 11 11.747 -4.045 -1.153
79 H GLY 12 HN GLY 12 7.705 -1.492 -2.847
80 HA2 GLY 12 2HA GLY 12 7.511 0.414 -4.391
81 HA3 GLY 12 1HA GLY 12 8.312 -0.606 -5.588
82 H LYS 13 HN LYS 13 6.754 -2.760 -4.070
83 HA LYS 13 HA LYS 13 4.274 -2.496 -5.599
84 HB2 LYS 13 2HB LYS 13 5.827 -4.947 -4.828
85 HB3 LYS 13 1HB LYS 13 4.226 -4.952 -5.532
86 HG2 LYS 13 2HG LYS 13 6.750 -3.949 -6.805
87 HG3 LYS 13 1HG LYS 13 5.924 -5.465 -7.174
88 HD2 LYS 13 2HD LYS 13 3.944 -4.112 -7.882
89 HD3 LYS 13 1HD LYS 13 4.935 -2.666 -7.682
90 HE2 LYS 13 2HE LYS 13 5.476 -4.964 -9.561
91 HE3 LYS 13 1HE LYS 13 4.910 -3.360 -10.014
92 HZ1 LYS 13 1HZ LYS 13 7.259 -3.549 -10.410
93 HZ2 LYS 13 2HZ LYS 13 7.541 -4.044 -8.831
94 HZ3 LYS 13 3HZ LYS 13 7.032 -2.479 -9.125
95 H CYS 14 HN CYS 14 2.481 -3.290 -4.604
96 HA CYS 14 HA CYS 14 2.572 -3.268 -1.707
97 HB2 CYS 14 2HB CYS 14 0.847 -1.940 -2.987
98 HB3 CYS 14 1HB CYS 14 0.171 -3.479 -3.526
99 H TYR 15 HN TYR 15 1.591 -5.026 -0.530
100 HA TYR 15 HA TYR 15 2.142 -7.534 -1.894
101 HB2 TYR 15 2HB TYR 15 1.766 -7.032 1.065
102 HB3 TYR 15 1HB TYR 15 2.465 -8.466 0.305
103 HD1 TYR 15 1HD TYR 15 3.155 -5.273 1.688
104 HD2 TYR 15 2HD TYR 15 4.579 -8.115 -1.128
105 HE1 TYR 15 1HE TYR 15 5.323 -4.169 1.696
106 HE2 TYR 15 2HE TYR 15 6.773 -7.030 -1.129
107 HH TYR 15 HH TYR 15 7.638 -4.651 1.191
108 H THR 16 HN THR 16 -0.393 -5.723 -0.450
109 HA THR 16 HA THR 16 -2.225 -7.932 -0.434
110 HB THR 16 HB THR 16 -2.698 -4.964 -0.004
111 HG1 THR 16 1HG THR 16 -1.390 -5.801 1.601
112 HG21 THR 16 1HG2 THR 16 -4.816 -5.641 1.024
113 HG22 THR 16 2HG2 THR 16 -4.471 -7.330 0.651
114 HG23 THR 16 3HG2 THR 16 -4.755 -6.180 -0.656
115 HA PRO 17 HA PRO 17 -3.436 -7.207 -4.717
116 HB2 PRO 17 2HB PRO 17 -5.421 -9.057 -4.808
117 HB3 PRO 17 1HB PRO 17 -3.711 -9.497 -4.886
118 HG2 PRO 17 2HG PRO 17 -5.596 -9.624 -2.575
119 HG3 PRO 17 1HG PRO 17 -4.336 -10.773 -3.057
120 HD2 PRO 17 2HD PRO 17 -4.045 -8.937 -1.055
121 HD3 PRO 17 1HD PRO 17 -2.689 -9.593 -1.991
122 H GLY 18 HN GLY 18 -4.941 -5.823 -5.558
123 HA2 GLY 18 2HA GLY 18 -6.918 -4.622 -5.702
124 HA3 GLY 18 1HA GLY 18 -7.492 -5.454 -4.257
125 H CYS 19 HN CYS 19 -4.390 -4.047 -4.262
126 HA CYS 19 HA CYS 19 -5.262 -1.705 -2.755
127 HB2 CYS 19 2HB CYS 19 -4.712 -3.711 -1.264
128 HB3 CYS 19 1HB CYS 19 -3.074 -3.605 -1.883
129 H SER 20 HN SER 20 -3.426 -0.081 -2.770
130 HA SER 20 HA SER 20 -1.574 -0.658 -4.953
131 HB2 SER 20 2HB SER 20 -3.163 1.882 -4.565
132 HB3 SER 20 1HB SER 20 -1.932 1.622 -5.807
133 HG SER 20 HG SER 20 -3.206 -0.198 -6.472
134 H CYS 21 HN CYS 21 0.372 0.563 -4.961
135 HA CYS 21 HA CYS 21 1.249 1.067 -2.259
136 HB2 CYS 21 2HB CYS 21 2.592 -0.479 -3.540
137 HB3 CYS 21 1HB CYS 21 2.763 0.692 -4.840
138 H ARG 22 HN ARG 22 0.661 3.074 -1.721
139 HA ARG 22 HA ARG 22 1.678 5.230 -3.411
140 HB2 ARG 22 2HB ARG 22 -0.774 5.350 -2.716
141 HB3 ARG 22 1HB ARG 22 -0.230 5.379 -1.050
142 HG2 ARG 22 2HG ARG 22 -0.830 7.592 -1.772
143 HG3 ARG 22 1HG ARG 22 0.902 7.506 -1.447
144 HD2 ARG 22 2HD ARG 22 1.381 7.360 -3.805
145 HD3 ARG 22 1HD ARG 22 -0.339 7.272 -4.186
146 HE ARG 22 HE ARG 22 -0.091 9.577 -2.808
147 HH11 ARG 22 1HH1 ARG 22 1.499 8.301 -5.695
148 HH12 ARG 22 2HH1 ARG 22 1.738 9.824 -6.424
149 HH21 ARG 22 1HH2 ARG 22 0.206 11.676 -3.803
150 HH22 ARG 22 2HH2 ARG 22 0.966 11.809 -5.322
151 H ARG 23 HN ARG 23 3.722 4.879 -2.864
152 HA ARG 23 HA ARG 23 4.766 3.883 -0.618
153 HB2 ARG 23 2HB ARG 23 6.151 5.959 -2.297
154 HB3 ARG 23 1HB ARG 23 6.925 4.874 -1.166
155 HG2 ARG 23 2HG ARG 23 6.066 2.963 -2.526
156 HG3 ARG 23 1HG ARG 23 5.557 4.147 -3.731
157 HD2 ARG 23 2HD ARG 23 8.353 3.744 -2.708
158 HD3 ARG 23 1HD ARG 23 7.749 3.212 -4.276
159 HE ARG 23 HE ARG 23 7.271 5.863 -4.289
160 HH11 ARG 23 1HH1 ARG 23 10.177 3.992 -3.577
161 HH12 ARG 23 2HH1 ARG 23 11.265 5.145 -4.210
162 HH21 ARG 23 1HH2 ARG 23 8.776 7.451 -5.182
163 HH22 ARG 23 2HH2 ARG 23 10.446 7.147 -5.128
164 HA PRO 24 HA PRO 24 6.156 3.677 0.659
165 HB2 PRO 24 2HB PRO 24 6.746 3.426 3.230
166 HB3 PRO 24 1HB PRO 24 7.631 4.550 2.194
167 HG2 PRO 24 2HG PRO 24 5.578 5.114 4.269
168 HG3 PRO 24 1HG PRO 24 6.947 6.103 3.746
169 HD2 PRO 24 2HD PRO 24 4.222 6.345 2.925
170 HD3 PRO 24 1HD PRO 24 5.617 7.243 2.302
171 H VAL 25 HN VAL 25 3.025 4.223 1.263
172 HA VAL 25 HA VAL 25 2.677 1.801 2.889
173 HB VAL 25 HB VAL 25 0.976 4.309 3.102
174 HG11 VAL 25 1HG1 VAL 25 -0.360 2.334 3.540
175 HG12 VAL 25 2HG1 VAL 25 -0.096 3.245 5.026
176 HG13 VAL 25 3HG1 VAL 25 0.824 1.772 4.718
177 HG21 VAL 25 1HG2 VAL 25 2.974 3.174 5.050
178 HG22 VAL 25 2HG2 VAL 25 1.924 4.559 5.349
179 HG23 VAL 25 3HG2 VAL 25 3.165 4.646 4.099
180 H CYS 26 HN CYS 26 1.043 0.461 2.402
181 HA CYS 26 HA CYS 26 -0.163 0.583 -0.205
182 HB2 CYS 26 2HB CYS 26 -0.317 -1.368 2.065
183 HB3 CYS 26 1HB CYS 26 -1.388 -1.493 0.681
184 H TYR 27 HN TYR 27 -1.876 1.701 -0.612
185 HA TYR 27 HA TYR 27 -3.903 2.072 1.470
186 HB2 TYR 27 2HB TYR 27 -3.099 3.912 -0.779
187 HB3 TYR 27 1HB TYR 27 -4.572 4.110 0.151
188 HD1 TYR 27 1HD TYR 27 -4.514 5.095 2.336
189 HD2 TYR 27 2HD TYR 27 -0.905 4.259 0.280
190 HE1 TYR 27 1HE TYR 27 -3.293 6.494 3.930
191 HE2 TYR 27 2HE TYR 27 0.328 5.663 1.847
192 HH TYR 27 HH TYR 27 -0.861 6.646 4.776
193 H LYS 28 HN LYS 28 -5.984 1.875 0.872
194 HA LYS 28 HA LYS 28 -6.552 0.919 -1.816
195 HB2 LYS 28 2HB LYS 28 -6.481 -0.982 -0.186
196 HB3 LYS 28 1HB LYS 28 -7.746 -0.173 0.738
197 HG2 LYS 28 2HG LYS 28 -9.198 -0.281 -1.263
198 HG3 LYS 28 1HG LYS 28 -7.944 -1.214 -2.073
199 HD2 LYS 28 2HD LYS 28 -8.090 -2.895 -0.248
200 HD3 LYS 28 1HD LYS 28 -9.450 -1.989 0.419
201 HE2 LYS 28 2HE LYS 28 -9.299 -3.318 -2.283
202 HE3 LYS 28 1HE LYS 28 -10.295 -3.799 -0.910
203 HZ1 LYS 28 1HZ LYS 28 -11.587 -2.607 -2.535
204 HZ2 LYS 28 2HZ LYS 28 -10.570 -1.285 -2.467
205 HZ3 LYS 28 3HZ LYS 28 -11.503 -1.696 -1.128
206 H ASN 29 HN ASN 29 -7.812 2.420 -2.633
207 HA ASN 29 HA ASN 29 -9.541 3.858 -2.976
208 HB2 ASN 29 2HB ASN 29 -10.843 1.962 -1.852
209 HB3 ASN 29 1HB ASN 29 -10.691 2.849 -0.349
210 HD21 ASN 29 1HD2 ASN 29 -12.109 2.785 -3.494
211 HD22 ASN 29 2HD2 ASN 29 -13.383 3.913 -3.188
Start of MODEL 16
1 H1 GLY 1 HN GLY 1 -6.711 3.636 -1.348
2 HA2 GLY 1 2HA GLY 1 -5.778 5.799 -1.089
3 HA3 GLY 1 1HA GLY 1 -7.407 6.461 -1.030
4 H LEU 2 HN LEU 2 -7.555 3.884 0.941
5 HA LEU 2 HA LEU 2 -6.844 5.492 3.307
6 HB2 LEU 2 2HB LEU 2 -8.789 3.194 3.064
7 HB3 LEU 2 1HB LEU 2 -8.475 4.115 4.519
8 HG LEU 2 HG LEU 2 -9.806 5.123 2.012
9 HD11 LEU 2 1HD1 LEU 2 -10.886 4.589 4.770
10 HD12 LEU 2 2HD1 LEU 2 -11.182 3.611 3.335
11 HD13 LEU 2 3HD1 LEU 2 -11.791 5.265 3.415
12 HD21 LEU 2 1HD2 LEU 2 -10.246 7.153 3.294
13 HD22 LEU 2 2HD2 LEU 2 -8.519 6.893 3.061
14 HD23 LEU 2 3HD2 LEU 2 -9.266 6.532 4.622
15 HA PRO 3 HA PRO 3 -3.695 2.439 4.010
16 HB2 PRO 3 2HB PRO 3 -3.106 2.983 6.583
17 HB3 PRO 3 1HB PRO 3 -2.703 4.105 5.277
18 HG2 PRO 3 2HG PRO 3 -5.027 4.159 7.168
19 HG3 PRO 3 1HG PRO 3 -3.961 5.490 6.676
20 HD2 PRO 3 2HD PRO 3 -6.411 5.096 5.590
21 HD3 PRO 3 1HD PRO 3 -5.055 5.787 4.675
22 H ILE 4 HN ILE 4 -6.287 1.362 4.136
23 HA ILE 4 HA ILE 4 -6.842 -0.028 6.553
24 HB ILE 4 HB ILE 4 -7.736 -0.685 3.727
25 HG12 ILE 4 2HG1 ILE 4 -8.435 1.558 4.379
26 HG13 ILE 4 1HG1 ILE 4 -9.827 0.484 4.316
27 HG21 ILE 4 1HG2 ILE 4 -8.886 -1.622 6.355
28 HG22 ILE 4 2HG2 ILE 4 -8.015 -2.610 5.183
29 HG23 ILE 4 3HG2 ILE 4 -9.585 -1.924 4.762
30 HD11 ILE 4 1HD1 ILE 4 -9.971 1.978 6.214
31 HD12 ILE 4 2HD1 ILE 4 -8.406 1.427 6.803
32 HD13 ILE 4 3HD1 ILE 4 -9.776 0.314 6.769
33 H CYS 5 HN CYS 5 -5.156 -0.948 3.558
34 HA CYS 5 HA CYS 5 -4.604 -3.602 4.238
35 HB2 CYS 5 2HB CYS 5 -2.927 -1.704 2.572
36 HB3 CYS 5 1HB CYS 5 -2.768 -3.457 2.590
37 H GLY 6 HN GLY 6 -2.753 -0.626 4.815
38 HA2 GLY 6 2HA GLY 6 -1.489 -0.081 6.640
39 HA3 GLY 6 1HA GLY 6 -1.873 -1.646 7.329
40 H GLU 7 HN GLU 7 -0.690 -2.145 4.311
41 HA GLU 7 HA GLU 7 1.843 -3.011 5.380
42 HB2 GLU 7 2HB GLU 7 0.760 -3.184 2.574
43 HB3 GLU 7 1HB GLU 7 2.295 -3.849 3.100
44 HG2 GLU 7 2HG GLU 7 -0.442 -4.674 3.987
45 HG3 GLU 7 1HG GLU 7 0.706 -5.550 2.950
46 H THR 8 HN THR 8 3.738 -2.596 3.954
47 HA THR 8 HA THR 8 3.746 0.246 3.289
48 HB THR 8 HB THR 8 6.197 0.198 3.995
49 HG1 THR 8 1HG THR 8 5.499 -1.812 5.773
50 HG21 THR 8 1HG2 THR 8 5.635 0.635 6.338
51 HG22 THR 8 2HG2 THR 8 4.058 -0.127 6.108
52 HG23 THR 8 3HG2 THR 8 4.451 1.368 5.257
53 H CYS 9 HN CYS 9 4.498 0.801 1.442
54 HA CYS 9 HA CYS 9 5.449 -1.233 -0.364
55 HB2 CYS 9 2HB CYS 9 4.865 1.694 -0.765
56 HB3 CYS 9 1HB CYS 9 5.534 0.673 -2.026
57 H LEU 10 HN LEU 10 7.345 -1.588 0.972
58 HA LEU 10 HA LEU 10 9.421 0.395 0.850
59 HB2 LEU 10 2HB LEU 10 9.579 -2.550 1.516
60 HB3 LEU 10 1HB LEU 10 10.907 -1.423 1.686
61 HG LEU 10 HG LEU 10 8.341 -1.448 3.265
62 HD11 LEU 10 1HD1 LEU 10 11.203 -1.945 4.048
63 HD12 LEU 10 2HD1 LEU 10 9.928 -3.156 3.923
64 HD13 LEU 10 3HD1 LEU 10 9.832 -1.893 5.150
65 HD21 LEU 10 1HD2 LEU 10 10.657 0.489 3.394
66 HD22 LEU 10 2HD2 LEU 10 9.323 0.405 4.543
67 HD23 LEU 10 3HD2 LEU 10 9.012 0.863 2.871
68 H LEU 11 HN LEU 11 8.817 -2.701 -0.728
69 HA LEU 11 HA LEU 11 10.883 -2.211 -2.689
70 HB2 LEU 11 2HB LEU 11 8.911 -4.482 -2.373
71 HB3 LEU 11 1HB LEU 11 10.082 -4.396 -3.665
72 HG LEU 11 HG LEU 11 11.884 -4.424 -1.882
73 HD11 LEU 11 1HD1 LEU 11 10.559 -3.778 0.037
74 HD12 LEU 11 2HD1 LEU 11 11.323 -5.345 0.294
75 HD13 LEU 11 3HD1 LEU 11 9.605 -5.255 -0.100
76 HD21 LEU 11 1HD2 LEU 11 11.743 -6.842 -1.579
77 HD22 LEU 11 2HD2 LEU 11 11.362 -6.355 -3.230
78 HD23 LEU 11 3HD2 LEU 11 10.066 -6.804 -2.123
79 H GLY 12 HN GLY 12 8.173 -0.806 -2.338
80 HA2 GLY 12 2HA GLY 12 6.875 0.498 -3.742
81 HA3 GLY 12 1HA GLY 12 7.879 -0.063 -5.065
82 H LYS 13 HN LYS 13 6.252 -2.440 -3.119
83 HA LYS 13 HA LYS 13 4.150 -2.700 -5.112
84 HB2 LYS 13 2HB LYS 13 6.071 -4.128 -5.797
85 HB3 LYS 13 1HB LYS 13 6.016 -4.921 -4.236
86 HG2 LYS 13 2HG LYS 13 4.994 -6.332 -5.874
87 HG3 LYS 13 1HG LYS 13 3.739 -5.735 -4.784
88 HD2 LYS 13 2HD LYS 13 3.134 -4.035 -6.457
89 HD3 LYS 13 1HD LYS 13 4.385 -4.662 -7.527
90 HE2 LYS 13 2HE LYS 13 2.205 -5.526 -8.176
91 HE3 LYS 13 1HE LYS 13 3.241 -6.828 -7.603
92 HZ1 LYS 13 1HZ LYS 13 0.956 -6.964 -6.756
93 HZ2 LYS 13 2HZ LYS 13 1.128 -5.499 -5.982
94 HZ3 LYS 13 3HZ LYS 13 2.071 -6.828 -5.501
95 H CYS 14 HN CYS 14 2.257 -3.500 -4.199
96 HA CYS 14 HA CYS 14 2.237 -3.817 -1.328
97 HB2 CYS 14 2HB CYS 14 0.080 -3.460 -3.381
98 HB3 CYS 14 1HB CYS 14 -0.291 -4.053 -1.773
99 H TYR 15 HN TYR 15 1.892 -5.625 -0.279
100 HA TYR 15 HA TYR 15 1.993 -8.171 -1.499
101 HB2 TYR 15 2HB TYR 15 1.068 -7.371 1.270
102 HB3 TYR 15 1HB TYR 15 1.403 -9.013 0.753
103 HD1 TYR 15 1HD TYR 15 3.720 -9.684 0.265
104 HD2 TYR 15 2HD TYR 15 2.822 -5.886 1.940
105 HE1 TYR 15 1HE TYR 15 6.021 -9.484 0.994
106 HE2 TYR 15 2HE TYR 15 5.140 -5.653 2.669
107 HH TYR 15 HH TYR 15 6.977 -7.278 3.273
108 H THR 16 HN THR 16 -0.571 -6.101 -0.308
109 HA THR 16 HA THR 16 -2.639 -8.034 -0.637
110 HB THR 16 HB THR 16 -2.866 -5.056 -0.140
111 HG1 THR 16 1HG THR 16 -2.028 -7.198 1.429
112 HG21 THR 16 1HG2 THR 16 -4.943 -5.711 1.010
113 HG22 THR 16 2HG2 THR 16 -4.631 -7.403 0.623
114 HG23 THR 16 3HG2 THR 16 -4.971 -6.252 -0.669
115 HA PRO 17 HA PRO 17 -3.103 -6.976 -5.048
116 HB2 PRO 17 2HB PRO 17 -5.493 -8.666 -4.785
117 HB3 PRO 17 1HB PRO 17 -4.115 -8.849 -5.871
118 HG2 PRO 17 2HG PRO 17 -4.468 -10.509 -3.813
119 HG3 PRO 17 1HG PRO 17 -2.847 -9.959 -4.272
120 HD2 PRO 17 2HD PRO 17 -4.601 -9.007 -2.038
121 HD3 PRO 17 1HD PRO 17 -2.854 -9.353 -2.057
122 H GLY 18 HN GLY 18 -4.170 -5.308 -5.916
123 HA2 GLY 18 2HA GLY 18 -6.007 -4.025 -6.505
124 HA3 GLY 18 1HA GLY 18 -6.953 -4.874 -5.291
125 H CYS 19 HN CYS 19 -4.241 -3.991 -3.773
126 HA CYS 19 HA CYS 19 -5.506 -1.657 -2.611
127 HB2 CYS 19 2HB CYS 19 -4.500 -3.620 -1.285
128 HB3 CYS 19 1HB CYS 19 -2.929 -3.027 -1.797
129 H SER 20 HN SER 20 -4.501 0.422 -2.769
130 HA SER 20 HA SER 20 -2.850 0.658 -5.094
131 HB2 SER 20 2HB SER 20 -4.080 2.775 -3.325
132 HB3 SER 20 1HB SER 20 -3.260 3.072 -4.860
133 HG SER 20 HG SER 20 -5.372 1.234 -4.719
134 H CYS 21 HN CYS 21 -0.785 0.832 -5.087
135 HA CYS 21 HA CYS 21 0.595 1.087 -2.561
136 HB2 CYS 21 2HB CYS 21 1.256 -0.735 -4.044
137 HB3 CYS 21 1HB CYS 21 1.605 0.415 -5.328
138 H ARG 22 HN ARG 22 0.847 3.103 -1.938
139 HA ARG 22 HA ARG 22 2.098 4.937 -3.824
140 HB2 ARG 22 2HB ARG 22 -0.245 5.658 -3.372
141 HB3 ARG 22 1HB ARG 22 0.101 5.660 -1.650
142 HG2 ARG 22 2HG ARG 22 0.115 7.917 -2.537
143 HG3 ARG 22 1HG ARG 22 1.722 7.461 -1.973
144 HD2 ARG 22 2HD ARG 22 1.834 8.659 -4.104
145 HD3 ARG 22 1HD ARG 22 2.410 7.005 -4.279
146 HE ARG 22 HE ARG 22 -0.333 7.138 -4.883
147 HH11 ARG 22 1HH1 ARG 22 2.793 8.110 -6.304
148 HH12 ARG 22 2HH1 ARG 22 2.207 8.019 -7.904
149 HH21 ARG 22 1HH2 ARG 22 -1.060 7.024 -7.090
150 HH22 ARG 22 2HH2 ARG 22 0.024 7.399 -8.363
151 H ARG 23 HN ARG 23 4.063 4.469 -3.166
152 HA ARG 23 HA ARG 23 4.792 3.655 -0.674
153 HB2 ARG 23 2HB ARG 23 7.145 4.124 -1.293
154 HB3 ARG 23 1HB ARG 23 6.253 3.195 -2.480
155 HG2 ARG 23 2HG ARG 23 5.990 5.264 -3.823
156 HG3 ARG 23 1HG ARG 23 6.975 6.108 -2.632
157 HD2 ARG 23 2HD ARG 23 8.831 4.633 -3.039
158 HD3 ARG 23 1HD ARG 23 7.862 3.668 -4.148
159 HE ARG 23 HE ARG 23 7.772 6.154 -5.198
160 HH11 ARG 23 1HH1 ARG 23 10.411 3.980 -4.270
161 HH12 ARG 23 2HH1 ARG 23 11.488 4.566 -5.451
162 HH21 ARG 23 1HH2 ARG 23 9.227 6.939 -6.792
163 HH22 ARG 23 2HH2 ARG 23 10.819 6.323 -6.904
164 HA PRO 24 HA PRO 24 6.222 3.427 0.633
165 HB2 PRO 24 2HB PRO 24 6.787 3.530 3.209
166 HB3 PRO 24 1HB PRO 24 7.811 4.331 2.010
167 HG2 PRO 24 2HG PRO 24 5.880 5.512 3.934
168 HG3 PRO 24 1HG PRO 24 7.373 6.196 3.270
169 HD2 PRO 24 2HD PRO 24 4.700 6.674 2.383
170 HD3 PRO 24 1HD PRO 24 6.203 7.253 1.640
171 H VAL 25 HN VAL 25 3.177 4.485 1.128
172 HA VAL 25 HA VAL 25 2.597 2.330 3.035
173 HB VAL 25 HB VAL 25 1.032 4.919 2.728
174 HG11 VAL 25 1HG1 VAL 25 -0.284 4.172 4.645
175 HG12 VAL 25 2HG1 VAL 25 0.605 2.649 4.675
176 HG13 VAL 25 3HG1 VAL 25 -0.432 3.037 3.303
177 HG21 VAL 25 1HG2 VAL 25 1.800 5.426 4.996
178 HG22 VAL 25 2HG2 VAL 25 3.158 5.246 3.881
179 HG23 VAL 25 3HG2 VAL 25 2.759 3.946 5.002
180 H CYS 26 HN CYS 26 0.957 0.954 2.626
181 HA CYS 26 HA CYS 26 -0.011 0.899 -0.115
182 HB2 CYS 26 2HB CYS 26 1.109 -1.048 1.041
183 HB3 CYS 26 1HB CYS 26 -0.282 -1.130 2.105
184 H TYR 27 HN TYR 27 -1.917 1.884 -0.489
185 HA TYR 27 HA TYR 27 -3.861 2.261 1.704
186 HB2 TYR 27 2HB TYR 27 -3.369 3.900 -0.783
187 HB3 TYR 27 1HB TYR 27 -4.669 4.175 0.355
188 HD1 TYR 27 1HD TYR 27 -4.206 5.168 2.527
189 HD2 TYR 27 2HD TYR 27 -1.106 4.547 -0.300
190 HE1 TYR 27 1HE TYR 27 -2.807 6.726 3.759
191 HE2 TYR 27 2HE TYR 27 0.334 6.103 0.917
192 HH TYR 27 HH TYR 27 -0.377 7.221 4.055
193 H LYS 28 HN LYS 28 -5.673 1.067 1.433
194 HA LYS 28 HA LYS 28 -6.363 0.179 -1.246
195 HB2 LYS 28 2HB LYS 28 -6.486 -1.465 0.609
196 HB3 LYS 28 1HB LYS 28 -7.748 -0.487 1.374
197 HG2 LYS 28 2HG LYS 28 -9.125 -0.806 -0.656
198 HG3 LYS 28 1HG LYS 28 -7.873 -1.864 -1.299
199 HD2 LYS 28 2HD LYS 28 -8.173 -3.349 0.646
200 HD3 LYS 28 1HD LYS 28 -9.474 -2.299 1.217
201 HE2 LYS 28 2HE LYS 28 -9.422 -3.803 -1.401
202 HE3 LYS 28 1HE LYS 28 -10.372 -4.221 0.023
203 HZ1 LYS 28 1HZ LYS 28 -11.604 -2.160 -0.233
204 HZ2 LYS 28 2HZ LYS 28 -11.675 -3.057 -1.651
205 HZ3 LYS 28 3HZ LYS 28 -10.669 -1.716 -1.564
206 H ASN 29 HN ASN 29 -7.464 1.492 -2.379
207 HA ASN 29 HA ASN 29 -8.965 2.985 -3.146
208 HB2 ASN 29 2HB ASN 29 -10.439 2.495 -0.530
209 HB3 ASN 29 1HB ASN 29 -11.094 3.369 -1.907
210 HD21 ASN 29 1HD2 ASN 29 -11.697 2.200 -3.745
211 HD22 ASN 29 2HD2 ASN 29 -11.943 0.488 -3.695
Start of MODEL 17
1 H1 GLY 1 HN GLY 1 -6.202 3.892 -1.447
2 HA2 GLY 1 2HA GLY 1 -5.197 5.900 -0.732
3 HA3 GLY 1 1HA GLY 1 -6.722 6.725 -1.039
4 H LEU 2 HN LEU 2 -7.431 3.939 0.596
5 HA LEU 2 HA LEU 2 -7.565 5.379 3.138
6 HB2 LEU 2 2HB LEU 2 -9.150 3.020 2.121
7 HB3 LEU 2 1HB LEU 2 -9.336 3.745 3.702
8 HG LEU 2 HG LEU 2 -9.948 5.080 1.067
9 HD11 LEU 2 1HD1 LEU 2 -11.759 4.022 3.232
10 HD12 LEU 2 2HD1 LEU 2 -11.529 3.313 1.634
11 HD13 LEU 2 3HD1 LEU 2 -12.275 4.902 1.794
12 HD21 LEU 2 1HD2 LEU 2 -9.195 6.690 2.719
13 HD22 LEU 2 2HD2 LEU 2 -10.305 6.018 3.908
14 HD23 LEU 2 3HD2 LEU 2 -10.936 6.839 2.481
15 HA PRO 3 HA PRO 3 -4.787 2.369 4.747
16 HB2 PRO 3 2HB PRO 3 -5.609 2.771 7.452
17 HB3 PRO 3 1HB PRO 3 -4.193 3.437 6.640
18 HG2 PRO 3 2HG PRO 3 -6.430 4.872 7.495
19 HG3 PRO 3 1HG PRO 3 -5.181 5.459 6.400
20 HD2 PRO 3 2HD PRO 3 -7.911 4.495 5.811
21 HD3 PRO 3 1HD PRO 3 -6.872 5.619 4.908
22 H ILE 4 HN ILE 4 -6.174 0.748 3.788
23 HA ILE 4 HA ILE 4 -7.964 -0.668 5.640
24 HB ILE 4 HB ILE 4 -7.465 -1.206 2.701
25 HG12 ILE 4 2HG1 ILE 4 -8.527 0.985 3.000
26 HG13 ILE 4 1HG1 ILE 4 -9.655 -0.150 2.276
27 HG21 ILE 4 1HG2 ILE 4 -9.517 -2.575 2.806
28 HG22 ILE 4 2HG2 ILE 4 -9.589 -2.288 4.543
29 HG23 ILE 4 3HG2 ILE 4 -8.237 -3.187 3.856
30 HD11 ILE 4 1HD1 ILE 4 -9.604 0.746 5.151
31 HD12 ILE 4 2HD1 ILE 4 -10.717 -0.445 4.478
32 HD13 ILE 4 3HD1 ILE 4 -10.765 1.226 3.912
33 H CYS 5 HN CYS 5 -5.070 -1.061 3.725
34 HA CYS 5 HA CYS 5 -4.705 -3.790 4.497
35 HB2 CYS 5 2HB CYS 5 -2.793 -1.967 2.954
36 HB3 CYS 5 1HB CYS 5 -2.758 -3.715 3.069
37 H GLY 6 HN GLY 6 -3.328 -0.638 5.285
38 HA2 GLY 6 2HA GLY 6 -2.055 0.059 7.082
39 HA3 GLY 6 1HA GLY 6 -2.483 -1.457 7.866
40 H GLU 7 HN GLU 7 -0.934 -1.251 4.793
41 HA GLU 7 HA GLU 7 1.427 -2.549 5.940
42 HB2 GLU 7 2HB GLU 7 -0.030 -3.130 3.386
43 HB3 GLU 7 1HB GLU 7 1.630 -3.637 3.655
44 HG2 GLU 7 2HG GLU 7 -0.719 -4.388 5.357
45 HG3 GLU 7 1HG GLU 7 0.038 -5.399 4.110
46 H THR 8 HN THR 8 3.243 -2.484 4.419
47 HA THR 8 HA THR 8 3.429 0.159 3.198
48 HB THR 8 HB THR 8 5.955 -0.128 3.670
49 HG1 THR 8 1HG THR 8 5.139 -2.409 4.685
50 HG21 THR 8 1HG2 THR 8 5.730 0.838 5.912
51 HG22 THR 8 2HG2 THR 8 4.028 0.354 5.943
52 HG23 THR 8 3HG2 THR 8 4.592 1.548 4.768
53 H CYS 9 HN CYS 9 4.927 0.319 1.408
54 HA CYS 9 HA CYS 9 5.310 -2.189 -0.014
55 HB2 CYS 9 2HB CYS 9 4.537 -1.020 -2.106
56 HB3 CYS 9 1HB CYS 9 3.267 -1.328 -0.927
57 H LEU 10 HN LEU 10 7.428 -1.843 0.804
58 HA LEU 10 HA LEU 10 8.994 0.425 0.239
59 HB2 LEU 10 2HB LEU 10 9.754 -2.385 0.996
60 HB3 LEU 10 1HB LEU 10 10.940 -1.137 0.731
61 HG LEU 10 HG LEU 10 10.019 0.145 2.640
62 HD11 LEU 10 1HD1 LEU 10 8.423 -0.840 4.159
63 HD12 LEU 10 2HD1 LEU 10 8.243 -2.235 3.099
64 HD13 LEU 10 3HD1 LEU 10 7.706 -0.643 2.558
65 HD21 LEU 10 1HD2 LEU 10 11.846 -1.370 2.985
66 HD22 LEU 10 2HD2 LEU 10 10.723 -2.705 3.223
67 HD23 LEU 10 3HD2 LEU 10 10.775 -1.382 4.389
68 H LEU 11 HN LEU 11 8.252 -2.362 -1.630
69 HA LEU 11 HA LEU 11 10.401 -1.752 -3.531
70 HB2 LEU 11 2HB LEU 11 8.531 -4.114 -3.412
71 HB3 LEU 11 1HB LEU 11 9.852 -3.919 -4.550
72 HG LEU 11 HG LEU 11 10.128 -4.202 -1.557
73 HD11 LEU 11 1HD1 LEU 11 10.814 -6.093 -3.787
74 HD12 LEU 11 2HD1 LEU 11 9.497 -6.274 -2.623
75 HD13 LEU 11 3HD1 LEU 11 11.172 -6.333 -2.079
76 HD21 LEU 11 1HD2 LEU 11 12.240 -3.959 -3.697
77 HD22 LEU 11 2HD2 LEU 11 12.530 -4.337 -2.001
78 HD23 LEU 11 3HD2 LEU 11 11.876 -2.765 -2.447
79 H GLY 12 HN GLY 12 7.637 -0.444 -3.075
80 HA2 GLY 12 2HA GLY 12 6.453 0.948 -4.508
81 HA3 GLY 12 1HA GLY 12 7.250 0.170 -5.867
82 H LYS 13 HN LYS 13 6.188 -2.308 -4.163
83 HA LYS 13 HA LYS 13 3.525 -2.264 -5.346
84 HB2 LYS 13 2HB LYS 13 5.071 -3.551 -6.785
85 HB3 LYS 13 1HB LYS 13 5.493 -4.548 -5.402
86 HG2 LYS 13 2HG LYS 13 3.175 -5.308 -5.251
87 HG3 LYS 13 1HG LYS 13 2.784 -4.343 -6.674
88 HD2 LYS 13 2HD LYS 13 4.311 -5.628 -8.008
89 HD3 LYS 13 1HD LYS 13 4.827 -6.550 -6.598
90 HE2 LYS 13 2HE LYS 13 2.043 -6.490 -7.754
91 HE3 LYS 13 1HE LYS 13 3.208 -7.798 -7.935
92 HZ1 LYS 13 1HZ LYS 13 3.140 -8.123 -5.522
93 HZ2 LYS 13 2HZ LYS 13 1.624 -8.300 -6.217
94 HZ3 LYS 13 3HZ LYS 13 1.980 -6.906 -5.359
95 H CYS 14 HN CYS 14 2.003 -3.258 -4.123
96 HA CYS 14 HA CYS 14 2.728 -3.908 -1.411
97 HB2 CYS 14 2HB CYS 14 0.037 -3.714 -2.762
98 HB3 CYS 14 1HB CYS 14 0.318 -3.898 -1.036
99 H TYR 15 HN TYR 15 1.964 -5.864 -0.464
100 HA TYR 15 HA TYR 15 2.009 -8.066 -2.355
101 HB2 TYR 15 2HB TYR 15 2.378 -7.989 0.641
102 HB3 TYR 15 1HB TYR 15 2.355 -9.484 -0.296
103 HD1 TYR 15 1HD TYR 15 4.159 -6.255 0.094
104 HD2 TYR 15 2HD TYR 15 4.303 -10.233 -1.392
105 HE1 TYR 15 1HE TYR 15 6.525 -5.964 -0.410
106 HE2 TYR 15 2HE TYR 15 6.686 -9.959 -1.898
107 HH TYR 15 HH TYR 15 8.499 -7.326 -0.731
108 H THR 16 HN THR 16 -0.119 -6.351 -0.313
109 HA THR 16 HA THR 16 -2.156 -8.344 -0.285
110 HB THR 16 HB THR 16 -2.295 -5.354 0.231
111 HG1 THR 16 1HG THR 16 -2.370 -6.413 2.506
112 HG21 THR 16 1HG2 THR 16 -4.151 -7.603 1.061
113 HG22 THR 16 2HG2 THR 16 -4.499 -6.390 -0.168
114 HG23 THR 16 3HG2 THR 16 -4.327 -5.909 1.520
115 HA PRO 17 HA PRO 17 -3.138 -7.303 -4.584
116 HB2 PRO 17 2HB PRO 17 -5.421 -9.103 -4.285
117 HB3 PRO 17 1HB PRO 17 -4.010 -9.270 -5.329
118 HG2 PRO 17 2HG PRO 17 -4.440 -10.841 -3.172
119 HG3 PRO 17 1HG PRO 17 -2.819 -10.427 -3.753
120 HD2 PRO 17 2HD PRO 17 -4.341 -9.317 -1.431
121 HD3 PRO 17 1HD PRO 17 -2.609 -9.678 -1.612
122 H GLY 18 HN GLY 18 -4.242 -5.589 -5.195
123 HA2 GLY 18 2HA GLY 18 -6.200 -4.366 -5.608
124 HA3 GLY 18 1HA GLY 18 -6.998 -5.247 -4.309
125 H CYS 19 HN CYS 19 -3.860 -3.798 -3.947
126 HA CYS 19 HA CYS 19 -5.022 -1.598 -2.425
127 HB2 CYS 19 2HB CYS 19 -4.241 -3.735 -1.076
128 HB3 CYS 19 1HB CYS 19 -2.629 -3.151 -1.436
129 H SER 20 HN SER 20 -3.875 0.336 -2.899
130 HA SER 20 HA SER 20 -1.866 0.017 -4.962
131 HB2 SER 20 2HB SER 20 -3.484 2.411 -4.106
132 HB3 SER 20 1HB SER 20 -2.278 2.417 -5.395
133 HG SER 20 HG SER 20 -3.544 0.644 -6.300
134 H CYS 21 HN CYS 21 0.103 0.929 -4.877
135 HA CYS 21 HA CYS 21 1.140 1.329 -2.247
136 HB2 CYS 21 2HB CYS 21 2.371 -0.038 -3.852
137 HB3 CYS 21 1HB CYS 21 2.497 1.340 -4.941
138 H ARG 22 HN ARG 22 1.379 3.195 -1.343
139 HA ARG 22 HA ARG 22 1.660 5.617 -2.957
140 HB2 ARG 22 2HB ARG 22 0.526 5.308 -0.175
141 HB3 ARG 22 1HB ARG 22 0.624 6.802 -1.081
142 HG2 ARG 22 2HG ARG 22 -1.123 4.443 -1.788
143 HG3 ARG 22 1HG ARG 22 -1.665 5.943 -1.032
144 HD2 ARG 22 2HD ARG 22 -0.453 5.642 -3.772
145 HD3 ARG 22 1HD ARG 22 -2.141 5.991 -3.389
146 HE ARG 22 HE ARG 22 -0.460 7.894 -2.191
147 HH11 ARG 22 1HH1 ARG 22 -1.825 7.044 -5.354
148 HH12 ARG 22 2HH1 ARG 22 -1.657 8.615 -5.977
149 HH21 ARG 22 1HH2 ARG 22 -0.205 9.962 -3.019
150 HH22 ARG 22 2HH2 ARG 22 -0.702 10.352 -4.599
151 H ARG 23 HN ARG 23 3.842 4.668 -2.854
152 HA ARG 23 HA ARG 23 5.130 3.719 -0.714
153 HB2 ARG 23 2HB ARG 23 7.291 4.259 -1.788
154 HB3 ARG 23 1HB ARG 23 6.127 3.463 -2.831
155 HG2 ARG 23 2HG ARG 23 5.639 5.599 -3.897
156 HG3 ARG 23 1HG ARG 23 6.818 6.384 -2.834
157 HD2 ARG 23 2HD ARG 23 8.591 4.984 -3.732
158 HD3 ARG 23 1HD ARG 23 7.429 4.137 -4.748
159 HE ARG 23 HE ARG 23 7.190 6.790 -5.379
160 HH11 ARG 23 1HH1 ARG 23 9.830 4.425 -5.448
161 HH12 ARG 23 2HH1 ARG 23 10.578 5.089 -6.824
162 HH21 ARG 23 1HH2 ARG 23 8.224 7.683 -7.295
163 HH22 ARG 23 2HH2 ARG 23 9.637 6.968 -7.905
164 HA PRO 24 HA PRO 24 6.722 3.304 0.381
165 HB2 PRO 24 2HB PRO 24 7.397 3.068 2.911
166 HB3 PRO 24 1HB PRO 24 8.381 4.039 1.808
167 HG2 PRO 24 2HG PRO 24 6.365 4.941 3.829
168 HG3 PRO 24 1HG PRO 24 7.960 5.621 3.470
169 HD2 PRO 24 2HD PRO 24 5.544 6.584 2.467
170 HD3 PRO 24 1HD PRO 24 7.135 6.903 1.754
171 H VAL 25 HN VAL 25 3.820 4.578 1.439
172 HA VAL 25 HA VAL 25 3.178 2.259 3.150
173 HB VAL 25 HB VAL 25 1.598 4.831 2.946
174 HG11 VAL 25 1HG1 VAL 25 0.349 2.953 3.853
175 HG12 VAL 25 2HG1 VAL 25 0.655 4.151 5.108
176 HG13 VAL 25 3HG1 VAL 25 1.611 2.670 5.053
177 HG21 VAL 25 1HG2 VAL 25 3.846 5.370 3.710
178 HG22 VAL 25 2HG2 VAL 25 3.726 4.144 4.972
179 HG23 VAL 25 3HG2 VAL 25 2.681 5.565 5.017
180 H CYS 26 HN CYS 26 1.179 1.071 2.726
181 HA CYS 26 HA CYS 26 0.399 1.344 -0.063
182 HB2 CYS 26 2HB CYS 26 1.250 -0.866 0.936
183 HB3 CYS 26 1HB CYS 26 -0.223 -0.867 1.876
184 H TYR 27 HN TYR 27 -1.717 1.840 -0.562
185 HA TYR 27 HA TYR 27 -3.642 2.026 1.610
186 HB2 TYR 27 2HB TYR 27 -2.907 4.268 -0.258
187 HB3 TYR 27 1HB TYR 27 -4.476 4.189 0.524
188 HD1 TYR 27 1HD TYR 27 -4.586 4.245 3.011
189 HD2 TYR 27 2HD TYR 27 -1.013 5.082 0.911
190 HE1 TYR 27 1HE TYR 27 -3.718 5.347 4.982
191 HE2 TYR 27 2HE TYR 27 -0.095 6.198 2.894
192 HH TYR 27 HH TYR 27 -1.100 7.358 4.966
193 H LYS 28 HN LYS 28 -5.537 1.286 1.106
194 HA LYS 28 HA LYS 28 -6.000 0.397 -1.629
195 HB2 LYS 28 2HB LYS 28 -6.335 -1.198 0.234
196 HB3 LYS 28 1HB LYS 28 -7.534 -0.109 0.925
197 HG2 LYS 28 2HG LYS 28 -8.927 -0.415 -1.070
198 HG3 LYS 28 1HG LYS 28 -7.727 -1.536 -1.712
199 HD2 LYS 28 2HD LYS 28 -8.038 -2.972 0.257
200 HD3 LYS 28 1HD LYS 28 -9.273 -1.858 0.849
201 HE2 LYS 28 2HE LYS 28 -10.293 -3.760 -0.247
202 HE3 LYS 28 1HE LYS 28 -10.606 -2.281 -1.153
203 HZ1 LYS 28 1HZ LYS 28 -8.870 -2.886 -2.700
204 HZ2 LYS 28 2HZ LYS 28 -9.971 -4.163 -2.572
205 HZ3 LYS 28 3HZ LYS 28 -8.488 -4.243 -1.791
206 H ASN 29 HN ASN 29 -6.900 1.890 -2.851
207 HA ASN 29 HA ASN 29 -8.240 3.543 -3.636
208 HB2 ASN 29 2HB ASN 29 -9.936 2.757 -1.257
209 HB3 ASN 29 1HB ASN 29 -10.419 4.013 -2.390
210 HD21 ASN 29 1HD2 ASN 29 -11.119 3.448 -4.378
211 HD22 ASN 29 2HD2 ASN 29 -11.440 1.816 -4.833
Start of MODEL 18
1 H1 GLY 1 HN GLY 1 -8.291 4.047 -0.464
2 HA2 GLY 1 2HA GLY 1 -6.877 6.269 -1.506
3 HA3 GLY 1 1HA GLY 1 -8.455 6.784 -0.918
4 H LEU 2 HN LEU 2 -8.626 4.852 1.161
5 HA LEU 2 HA LEU 2 -6.984 6.204 3.131
6 HB2 LEU 2 2HB LEU 2 -9.208 4.196 3.370
7 HB3 LEU 2 1HB LEU 2 -8.364 4.893 4.734
8 HG LEU 2 HG LEU 2 -10.017 6.435 2.742
9 HD11 LEU 2 1HD1 LEU 2 -11.589 6.662 4.595
10 HD12 LEU 2 2HD1 LEU 2 -10.562 5.625 5.587
11 HD13 LEU 2 3HD1 LEU 2 -11.355 4.970 4.154
12 HD21 LEU 2 1HD2 LEU 2 -8.206 7.757 3.679
13 HD22 LEU 2 2HD2 LEU 2 -8.677 7.267 5.305
14 HD23 LEU 2 3HD2 LEU 2 -9.758 8.267 4.337
15 HA PRO 3 HA PRO 3 -4.303 2.712 3.667
16 HB2 PRO 3 2HB PRO 3 -3.537 3.137 6.281
17 HB3 PRO 3 1HB PRO 3 -2.823 3.981 4.909
18 HG2 PRO 3 2HG PRO 3 -4.772 4.950 6.909
19 HG3 PRO 3 1HG PRO 3 -3.581 5.853 5.969
20 HD2 PRO 3 2HD PRO 3 -6.324 5.743 5.457
21 HD3 PRO 3 1HD PRO 3 -5.079 6.295 4.325
22 H ILE 4 HN ILE 4 -5.846 1.179 3.534
23 HA ILE 4 HA ILE 4 -7.217 0.357 6.001
24 HB ILE 4 HB ILE 4 -7.705 -0.459 3.122
25 HG12 ILE 4 2HG1 ILE 4 -8.370 1.854 3.499
26 HG13 ILE 4 1HG1 ILE 4 -9.796 0.848 3.294
27 HG21 ILE 4 1HG2 ILE 4 -9.765 -1.519 3.908
28 HG22 ILE 4 2HG2 ILE 4 -9.301 -1.166 5.575
29 HG23 ILE 4 3HG2 ILE 4 -8.323 -2.265 4.600
30 HD11 ILE 4 1HD1 ILE 4 -10.131 2.482 5.051
31 HD12 ILE 4 2HD1 ILE 4 -8.712 1.893 5.907
32 HD13 ILE 4 3HD1 ILE 4 -10.128 0.854 5.730
33 H CYS 5 HN CYS 5 -4.954 -0.622 3.568
34 HA CYS 5 HA CYS 5 -4.875 -3.369 4.230
35 HB2 CYS 5 2HB CYS 5 -2.743 -1.754 2.842
36 HB3 CYS 5 1HB CYS 5 -3.084 -3.478 2.663
37 H GLY 6 HN GLY 6 -2.818 -0.559 5.049
38 HA2 GLY 6 2HA GLY 6 -1.621 -0.209 6.996
39 HA3 GLY 6 1HA GLY 6 -1.999 -1.850 7.506
40 H GLU 7 HN GLU 7 -1.075 -2.707 4.810
41 HA GLU 7 HA GLU 7 1.525 -3.415 5.516
42 HB2 GLU 7 2HB GLU 7 0.037 -3.661 2.933
43 HB3 GLU 7 1HB GLU 7 1.647 -4.319 3.194
44 HG2 GLU 7 2HG GLU 7 -0.737 -4.975 4.864
45 HG3 GLU 7 1HG GLU 7 -0.180 -5.925 3.470
46 H THR 8 HN THR 8 3.284 -3.181 4.006
47 HA THR 8 HA THR 8 3.448 -0.412 3.112
48 HB THR 8 HB THR 8 5.914 -0.512 3.737
49 HG1 THR 8 1HG THR 8 4.980 -2.790 5.168
50 HG21 THR 8 1HG2 THR 8 4.288 0.752 5.065
51 HG22 THR 8 2HG2 THR 8 5.487 0.002 6.116
52 HG23 THR 8 3HG2 THR 8 3.877 -0.705 5.967
53 H CYS 9 HN CYS 9 4.655 0.010 1.298
54 HA CYS 9 HA CYS 9 5.263 -2.367 -0.303
55 HB2 CYS 9 2HB CYS 9 4.450 -1.134 -2.262
56 HB3 CYS 9 1HB CYS 9 3.192 -1.311 -1.051
57 H LEU 10 HN LEU 10 7.198 -1.527 1.150
58 HA LEU 10 HA LEU 10 8.682 0.729 0.543
59 HB2 LEU 10 2HB LEU 10 8.978 -0.694 2.523
60 HB3 LEU 10 1HB LEU 10 9.686 -1.938 1.522
61 HG LEU 10 HG LEU 10 11.555 -0.383 0.986
62 HD11 LEU 10 1HD1 LEU 10 11.860 1.605 2.377
63 HD12 LEU 10 2HD1 LEU 10 10.250 1.370 3.058
64 HD13 LEU 10 3HD1 LEU 10 10.440 1.733 1.343
65 HD21 LEU 10 1HD2 LEU 10 11.086 -0.917 3.916
66 HD22 LEU 10 2HD2 LEU 10 12.646 -0.567 3.169
67 HD23 LEU 10 3HD2 LEU 10 11.779 -2.045 2.752
68 H LEU 11 HN LEU 11 8.513 -2.241 -1.252
69 HA LEU 11 HA LEU 11 10.903 -1.561 -2.768
70 HB2 LEU 11 2HB LEU 11 9.123 -3.988 -2.901
71 HB3 LEU 11 1HB LEU 11 10.489 -3.723 -3.957
72 HG LEU 11 HG LEU 11 11.904 -3.649 -1.832
73 HD11 LEU 11 1HD1 LEU 11 10.168 -3.379 -0.191
74 HD12 LEU 11 2HD1 LEU 11 11.055 -4.879 0.092
75 HD13 LEU 11 3HD1 LEU 11 9.456 -4.926 -0.650
76 HD21 LEU 11 1HD2 LEU 11 10.558 -6.209 -2.653
77 HD22 LEU 11 2HD2 LEU 11 12.072 -6.084 -1.757
78 HD23 LEU 11 3HD2 LEU 11 11.974 -5.477 -3.409
79 H GLY 12 HN GLY 12 8.015 -0.310 -2.899
80 HA2 GLY 12 2HA GLY 12 7.128 1.002 -4.583
81 HA3 GLY 12 1HA GLY 12 8.195 0.216 -5.739
82 H LYS 13 HN LYS 13 6.793 -2.119 -3.993
83 HA LYS 13 HA LYS 13 4.478 -2.473 -5.761
84 HB2 LYS 13 2HB LYS 13 6.358 -3.851 -6.595
85 HB3 LYS 13 1HB LYS 13 6.574 -4.526 -4.991
86 HG2 LYS 13 2HG LYS 13 5.470 -6.146 -6.387
87 HG3 LYS 13 1HG LYS 13 4.333 -5.572 -5.170
88 HD2 LYS 13 2HD LYS 13 3.326 -4.065 -6.817
89 HD3 LYS 13 1HD LYS 13 4.481 -4.619 -8.026
90 HE2 LYS 13 2HE LYS 13 2.349 -5.735 -8.341
91 HE3 LYS 13 1HE LYS 13 3.574 -6.895 -7.846
92 HZ1 LYS 13 1HZ LYS 13 1.568 -5.668 -6.044
93 HZ2 LYS 13 2HZ LYS 13 2.676 -6.849 -5.603
94 HZ3 LYS 13 3HZ LYS 13 1.453 -7.206 -6.702
95 H CYS 14 HN CYS 14 2.704 -3.271 -4.625
96 HA CYS 14 HA CYS 14 3.089 -3.534 -1.753
97 HB2 CYS 14 2HB CYS 14 1.316 -1.984 -2.615
98 HB3 CYS 14 1HB CYS 14 0.506 -3.365 -3.339
99 H TYR 15 HN TYR 15 2.021 -5.368 -0.659
100 HA TYR 15 HA TYR 15 2.117 -7.714 -2.413
101 HB2 TYR 15 2HB TYR 15 2.831 -7.546 0.517
102 HB3 TYR 15 1HB TYR 15 2.934 -8.992 -0.491
103 HD1 TYR 15 1HD TYR 15 4.325 -8.670 -2.702
104 HD2 TYR 15 2HD TYR 15 4.751 -6.288 0.779
105 HE1 TYR 15 1HE TYR 15 6.569 -8.006 -3.445
106 HE2 TYR 15 2HE TYR 15 7.000 -5.612 0.053
107 HH TYR 15 HH TYR 15 8.766 -6.609 -1.435
108 H THR 16 HN THR 16 -0.102 -5.892 -1.275
109 HA THR 16 HA THR 16 -1.799 -8.147 -0.515
110 HB THR 16 HB THR 16 -2.303 -5.254 0.230
111 HG1 THR 16 1HG THR 16 -1.127 -7.336 1.794
112 HG21 THR 16 1HG2 THR 16 -4.250 -6.769 0.270
113 HG22 THR 16 2HG2 THR 16 -3.801 -6.261 1.897
114 HG23 THR 16 3HG2 THR 16 -3.367 -7.872 1.327
115 HA PRO 17 HA PRO 17 -3.725 -7.288 -4.523
116 HB2 PRO 17 2HB PRO 17 -5.785 -9.008 -3.219
117 HB3 PRO 17 1HB PRO 17 -5.060 -9.165 -4.820
118 HG2 PRO 17 2HG PRO 17 -4.336 -10.800 -2.875
119 HG3 PRO 17 1HG PRO 17 -3.122 -10.140 -3.987
120 HD2 PRO 17 2HD PRO 17 -3.730 -9.353 -1.170
121 HD3 PRO 17 1HD PRO 17 -2.170 -9.483 -2.011
122 H GLY 18 HN GLY 18 -5.062 -5.642 -5.015
123 HA2 GLY 18 2HA GLY 18 -7.043 -4.401 -4.886
124 HA3 GLY 18 1HA GLY 18 -7.312 -5.037 -3.268
125 H CYS 19 HN CYS 19 -4.223 -4.239 -3.139
126 HA CYS 19 HA CYS 19 -4.872 -1.608 -2.071
127 HB2 CYS 19 2HB CYS 19 -2.489 -3.379 -1.530
128 HB3 CYS 19 1HB CYS 19 -2.842 -1.836 -0.752
129 H SER 20 HN SER 20 -3.569 0.144 -2.490
130 HA SER 20 HA SER 20 -2.078 0.007 -4.997
131 HB2 SER 20 2HB SER 20 -4.113 1.445 -4.934
132 HB3 SER 20 1HB SER 20 -3.399 2.356 -3.609
133 HG SER 20 HG SER 20 -3.106 3.336 -5.666
134 H CYS 21 HN CYS 21 0.009 0.802 -4.981
135 HA CYS 21 HA CYS 21 1.172 1.189 -2.374
136 HB2 CYS 21 2HB CYS 21 2.368 -0.274 -3.907
137 HB3 CYS 21 1HB CYS 21 2.460 1.017 -5.101
138 H ARG 22 HN ARG 22 1.275 3.086 -1.530
139 HA ARG 22 HA ARG 22 2.098 5.330 -3.196
140 HB2 ARG 22 2HB ARG 22 -0.283 5.636 -2.430
141 HB3 ARG 22 1HB ARG 22 0.259 5.416 -0.782
142 HG2 ARG 22 2HG ARG 22 -0.131 7.760 -1.221
143 HG3 ARG 22 1HG ARG 22 1.582 7.476 -0.936
144 HD2 ARG 22 2HD ARG 22 0.428 7.599 -3.716
145 HD3 ARG 22 1HD ARG 22 0.909 9.046 -2.849
146 HE ARG 22 HE ARG 22 3.166 7.988 -2.714
147 HH11 ARG 22 1HH1 ARG 22 1.004 7.016 -5.355
148 HH12 ARG 22 2HH1 ARG 22 2.242 6.892 -6.507
149 HH21 ARG 22 1HH2 ARG 22 4.884 7.809 -4.358
150 HH22 ARG 22 2HH2 ARG 22 4.468 7.303 -5.916
151 H ARG 23 HN ARG 23 4.107 4.766 -2.769
152 HA ARG 23 HA ARG 23 5.151 3.577 -0.679
153 HB2 ARG 23 2HB ARG 23 7.381 4.443 -1.292
154 HB3 ARG 23 1HB ARG 23 6.443 3.849 -2.649
155 HG2 ARG 23 2HG ARG 23 5.886 6.185 -3.231
156 HG3 ARG 23 1HG ARG 23 6.916 6.714 -1.894
157 HD2 ARG 23 2HD ARG 23 8.836 5.606 -2.919
158 HD3 ARG 23 1HD ARG 23 7.800 5.043 -4.230
159 HE ARG 23 HE ARG 23 7.748 7.873 -3.990
160 HH11 ARG 23 1HH1 ARG 23 9.668 5.172 -5.309
161 HH12 ARG 23 2HH1 ARG 23 10.445 6.144 -6.474
162 HH21 ARG 23 1HH2 ARG 23 8.805 9.147 -5.627
163 HH22 ARG 23 2HH2 ARG 23 9.968 8.429 -6.646
164 HA PRO 24 HA PRO 24 6.368 3.019 0.570
165 HB2 PRO 24 2HB PRO 24 7.021 2.485 3.074
166 HB3 PRO 24 1HB PRO 24 8.031 3.533 2.075
167 HG2 PRO 24 2HG PRO 24 6.185 4.244 4.293
168 HG3 PRO 24 1HG PRO 24 7.673 5.048 3.773
169 HD2 PRO 24 2HD PRO 24 4.985 5.774 3.119
170 HD3 PRO 24 1HD PRO 24 6.479 6.496 2.498
171 H VAL 25 HN VAL 25 3.394 4.004 1.387
172 HA VAL 25 HA VAL 25 2.736 1.665 3.055
173 HB VAL 25 HB VAL 25 1.295 4.339 3.003
174 HG11 VAL 25 1HG1 VAL 25 0.842 1.955 4.794
175 HG12 VAL 25 2HG1 VAL 25 -0.241 2.524 3.527
176 HG13 VAL 25 3HG1 VAL 25 0.051 3.524 4.951
177 HG21 VAL 25 1HG2 VAL 25 3.104 3.161 5.110
178 HG22 VAL 25 2HG2 VAL 25 2.183 4.655 5.273
179 HG23 VAL 25 3HG2 VAL 25 3.469 4.537 4.070
180 H CYS 26 HN CYS 26 0.959 0.420 2.579
181 HA CYS 26 HA CYS 26 -0.135 0.641 -0.090
182 HB2 CYS 26 2HB CYS 26 -0.412 -1.444 2.066
183 HB3 CYS 26 1HB CYS 26 -1.242 -1.529 0.521
184 H TYR 27 HN TYR 27 -1.852 1.791 -0.416
185 HA TYR 27 HA TYR 27 -3.855 2.178 1.709
186 HB2 TYR 27 2HB TYR 27 -3.281 3.736 -0.827
187 HB3 TYR 27 1HB TYR 27 -4.658 4.038 0.218
188 HD1 TYR 27 1HD TYR 27 -0.922 3.980 0.227
189 HD2 TYR 27 2HD TYR 27 -4.461 5.524 1.993
190 HE1 TYR 27 1HE TYR 27 0.420 5.534 1.539
191 HE2 TYR 27 2HE TYR 27 -3.123 7.080 3.324
192 HH TYR 27 HH TYR 27 0.122 7.686 2.697
193 H LYS 28 HN LYS 28 -6.120 2.030 1.022
194 HA LYS 28 HA LYS 28 -6.429 0.479 -1.417
195 HB2 LYS 28 2HB LYS 28 -6.542 -0.976 0.656
196 HB3 LYS 28 1HB LYS 28 -7.971 -0.052 1.125
197 HG2 LYS 28 2HG LYS 28 -9.140 -0.797 -0.839
198 HG3 LYS 28 1HG LYS 28 -7.694 -1.618 -1.426
199 HD2 LYS 28 2HD LYS 28 -7.748 -3.014 0.639
200 HD3 LYS 28 1HD LYS 28 -9.305 -2.285 1.028
201 HE2 LYS 28 2HE LYS 28 -10.215 -3.102 -1.095
202 HE3 LYS 28 1HE LYS 28 -8.660 -3.836 -1.473
203 HZ1 LYS 28 1HZ LYS 28 -8.913 -5.232 0.513
204 HZ2 LYS 28 2HZ LYS 28 -10.138 -5.479 -0.591
205 HZ3 LYS 28 3HZ LYS 28 -10.437 -4.571 0.787
206 H ASN 29 HN ASN 29 -7.656 1.518 -2.691
207 HA ASN 29 HA ASN 29 -9.178 2.861 -3.627
208 HB2 ASN 29 2HB ASN 29 -10.496 2.992 -0.891
209 HB3 ASN 29 1HB ASN 29 -11.188 3.656 -2.364
210 HD21 ASN 29 1HD2 ASN 29 -12.002 2.211 -3.932
211 HD22 ASN 29 2HD2 ASN 29 -12.355 0.574 -3.526
Start of MODEL 19
1 H1 GLY 1 HN GLY 1 -7.031 4.275 -1.904
2 HA2 GLY 1 2HA GLY 1 -6.105 6.404 -1.729
3 HA3 GLY 1 1HA GLY 1 -7.708 7.054 -1.432
4 H LEU 2 HN LEU 2 -7.201 4.365 0.524
5 HA LEU 2 HA LEU 2 -6.170 6.030 2.713
6 HB2 LEU 2 2HB LEU 2 -8.495 4.117 2.808
7 HB3 LEU 2 1HB LEU 2 -7.749 4.826 4.222
8 HG LEU 2 HG LEU 2 -9.217 6.327 2.054
9 HD11 LEU 2 1HD1 LEU 2 -9.954 5.677 4.901
10 HD12 LEU 2 2HD1 LEU 2 -10.687 4.989 3.452
11 HD13 LEU 2 3HD1 LEU 2 -10.882 6.704 3.811
12 HD21 LEU 2 1HD2 LEU 2 -8.998 8.252 3.582
13 HD22 LEU 2 2HD2 LEU 2 -7.440 7.685 2.998
14 HD23 LEU 2 3HD2 LEU 2 -7.964 7.282 4.632
15 HA PRO 3 HA PRO 3 -3.489 2.544 3.420
16 HB2 PRO 3 2HB PRO 3 -2.701 3.124 5.952
17 HB3 PRO 3 1HB PRO 3 -2.131 4.052 4.557
18 HG2 PRO 3 2HG PRO 3 -4.277 4.690 6.533
19 HG3 PRO 3 1HG PRO 3 -3.049 5.760 5.836
20 HD2 PRO 3 2HD PRO 3 -5.630 5.675 4.969
21 HD3 PRO 3 1HD PRO 3 -4.261 6.105 3.925
22 H ILE 4 HN ILE 4 -5.700 1.464 3.398
23 HA ILE 4 HA ILE 4 -6.925 0.652 5.865
24 HB ILE 4 HB ILE 4 -7.325 -0.325 3.036
25 HG12 ILE 4 2HG1 ILE 4 -7.877 2.040 3.272
26 HG13 ILE 4 1HG1 ILE 4 -9.333 1.090 3.014
27 HG21 ILE 4 1HG2 ILE 4 -9.051 -0.799 5.445
28 HG22 ILE 4 2HG2 ILE 4 -8.085 -2.001 4.583
29 HG23 ILE 4 3HG2 ILE 4 -9.458 -1.232 3.782
30 HD11 ILE 4 1HD1 ILE 4 -9.722 2.808 4.666
31 HD12 ILE 4 2HD1 ILE 4 -8.368 2.232 5.628
32 HD13 ILE 4 3HD1 ILE 4 -9.802 1.221 5.434
33 H CYS 5 HN CYS 5 -4.683 -0.804 3.591
34 HA CYS 5 HA CYS 5 -5.129 -3.477 4.378
35 HB2 CYS 5 2HB CYS 5 -2.820 -2.299 2.840
36 HB3 CYS 5 1HB CYS 5 -3.268 -4.005 2.902
37 H GLY 6 HN GLY 6 -2.957 -1.056 5.609
38 HA2 GLY 6 2HA GLY 6 -1.691 -1.088 7.536
39 HA3 GLY 6 1HA GLY 6 -2.243 -2.733 7.826
40 H GLU 7 HN GLU 7 -0.882 -2.062 4.790
41 HA GLU 7 HA GLU 7 1.508 -3.571 5.572
42 HB2 GLU 7 2HB GLU 7 0.003 -3.556 2.971
43 HB3 GLU 7 1HB GLU 7 1.634 -4.184 3.113
44 HG2 GLU 7 2HG GLU 7 -0.764 -5.181 4.616
45 HG3 GLU 7 1HG GLU 7 -0.031 -5.926 3.182
46 H THR 8 HN THR 8 3.295 -3.244 3.962
47 HA THR 8 HA THR 8 3.557 -0.382 3.402
48 HB THR 8 HB THR 8 6.011 -0.632 3.934
49 HG1 THR 8 1HG THR 8 5.078 -3.126 4.875
50 HG21 THR 8 1HG2 THR 8 4.502 0.521 5.452
51 HG22 THR 8 2HG2 THR 8 5.735 -0.375 6.341
52 HG23 THR 8 3HG2 THR 8 4.088 -1.014 6.229
53 H CYS 9 HN CYS 9 4.988 0.133 1.713
54 HA CYS 9 HA CYS 9 5.857 -2.088 0.105
55 HB2 CYS 9 2HB CYS 9 4.983 -0.950 -1.963
56 HB3 CYS 9 1HB CYS 9 3.747 -1.607 -0.899
57 H LEU 10 HN LEU 10 7.865 -1.537 0.906
58 HA LEU 10 HA LEU 10 9.012 1.038 0.604
59 HB2 LEU 10 2HB LEU 10 10.351 -1.625 1.032
60 HB3 LEU 10 1HB LEU 10 11.144 -0.071 1.175
61 HG LEU 10 HG LEU 10 8.888 -1.051 2.932
62 HD11 LEU 10 1HD1 LEU 10 10.964 -2.248 3.333
63 HD12 LEU 10 2HD1 LEU 10 10.580 -1.170 4.675
64 HD13 LEU 10 3HD1 LEU 10 11.819 -0.716 3.506
65 HD21 LEU 10 1HD2 LEU 10 8.838 1.373 2.688
66 HD22 LEU 10 2HD2 LEU 10 10.554 1.461 3.081
67 HD23 LEU 10 3HD2 LEU 10 9.398 0.926 4.299
68 H LEU 11 HN LEU 11 8.754 -1.634 -1.557
69 HA LEU 11 HA LEU 11 10.666 -0.368 -3.386
70 HB2 LEU 11 2HB LEU 11 9.488 -3.145 -3.407
71 HB3 LEU 11 1HB LEU 11 10.532 -2.508 -4.656
72 HG LEU 11 HG LEU 11 11.339 -2.897 -1.772
73 HD11 LEU 11 1HD1 LEU 11 10.974 -5.019 -2.903
74 HD12 LEU 11 2HD1 LEU 11 12.692 -4.740 -2.624
75 HD13 LEU 11 3HD1 LEU 11 12.009 -4.500 -4.232
76 HD21 LEU 11 1HD2 LEU 11 12.564 -1.084 -2.827
77 HD22 LEU 11 2HD2 LEU 11 12.926 -2.108 -4.213
78 HD23 LEU 11 3HD2 LEU 11 13.611 -2.491 -2.634
79 H GLY 12 HN GLY 12 7.582 -0.020 -2.760
80 HA2 GLY 12 2HA GLY 12 5.958 1.054 -4.040
81 HA3 GLY 12 1HA GLY 12 6.993 0.854 -5.445
82 H LYS 13 HN LYS 13 6.301 -1.950 -3.606
83 HA LYS 13 HA LYS 13 4.214 -2.781 -5.516
84 HB2 LYS 13 2HB LYS 13 6.414 -3.800 -6.063
85 HB3 LYS 13 1HB LYS 13 6.498 -4.458 -4.436
86 HG2 LYS 13 2HG LYS 13 4.413 -5.742 -4.930
87 HG3 LYS 13 1HG LYS 13 4.532 -5.185 -6.599
88 HD2 LYS 13 2HD LYS 13 6.604 -6.817 -5.121
89 HD3 LYS 13 1HD LYS 13 5.476 -7.436 -6.321
90 HE2 LYS 13 2HE LYS 13 6.520 -5.929 -8.006
91 HE3 LYS 13 1HE LYS 13 7.667 -5.410 -6.774
92 HZ1 LYS 13 1HZ LYS 13 8.572 -7.155 -8.224
93 HZ2 LYS 13 2HZ LYS 13 7.362 -8.203 -7.715
94 HZ3 LYS 13 3HZ LYS 13 8.499 -7.648 -6.616
95 H CYS 14 HN CYS 14 2.390 -3.251 -4.352
96 HA CYS 14 HA CYS 14 2.723 -3.699 -1.511
97 HB2 CYS 14 2HB CYS 14 0.994 -2.088 -2.336
98 HB3 CYS 14 1HB CYS 14 0.134 -3.449 -3.058
99 H TYR 15 HN TYR 15 1.975 -5.488 -0.418
100 HA TYR 15 HA TYR 15 2.142 -7.943 -1.928
101 HB2 TYR 15 2HB TYR 15 1.787 -7.525 1.041
102 HB3 TYR 15 1HB TYR 15 2.217 -9.031 0.240
103 HD1 TYR 15 1HD TYR 15 4.409 -8.995 -1.147
104 HD2 TYR 15 2HD TYR 15 3.464 -6.127 1.840
105 HE1 TYR 15 1HE TYR 15 6.786 -8.445 -0.934
106 HE2 TYR 15 2HE TYR 15 5.830 -5.557 2.058
107 HH TYR 15 HH TYR 15 8.131 -6.463 -0.179
108 H THR 16 HN THR 16 -0.311 -5.997 -0.461
109 HA THR 16 HA THR 16 -2.218 -8.150 -0.341
110 HB THR 16 HB THR 16 -2.606 -5.187 0.150
111 HG1 THR 16 1HG THR 16 -1.547 -7.280 1.689
112 HG21 THR 16 1HG2 THR 16 -4.534 -5.922 1.498
113 HG22 THR 16 2HG2 THR 16 -4.191 -7.599 1.080
114 HG23 THR 16 3HG2 THR 16 -4.697 -6.466 -0.172
115 HA PRO 17 HA PRO 17 -3.572 -7.227 -4.550
116 HB2 PRO 17 2HB PRO 17 -5.672 -8.959 -4.587
117 HB3 PRO 17 1HB PRO 17 -4.000 -9.491 -4.794
118 HG2 PRO 17 2HG PRO 17 -5.726 -9.576 -2.357
119 HG3 PRO 17 1HG PRO 17 -4.586 -10.789 -2.965
120 HD2 PRO 17 2HD PRO 17 -4.006 -9.094 -0.933
121 HD3 PRO 17 1HD PRO 17 -2.776 -9.730 -2.043
122 H GLY 18 HN GLY 18 -5.226 -5.995 -5.425
123 HA2 GLY 18 2HA GLY 18 -6.979 -4.504 -5.438
124 HA3 GLY 18 1HA GLY 18 -7.645 -5.376 -4.059
125 H CYS 19 HN CYS 19 -4.458 -4.061 -4.062
126 HA CYS 19 HA CYS 19 -5.205 -1.757 -2.473
127 HB2 CYS 19 2HB CYS 19 -4.816 -3.834 -0.995
128 HB3 CYS 19 1HB CYS 19 -3.154 -3.786 -1.551
129 H SER 20 HN SER 20 -3.827 -0.122 -3.032
130 HA SER 20 HA SER 20 -1.813 -0.775 -5.032
131 HB2 SER 20 2HB SER 20 -3.708 0.797 -5.611
132 HB3 SER 20 1HB SER 20 -3.104 1.886 -4.372
133 HG SER 20 HG SER 20 -1.783 1.045 -6.729
134 H CYS 21 HN CYS 21 0.015 0.921 -4.956
135 HA CYS 21 HA CYS 21 0.923 1.092 -2.190
136 HB2 CYS 21 2HB CYS 21 2.360 -0.325 -3.509
137 HB3 CYS 21 1HB CYS 21 2.494 0.908 -4.757
138 H ARG 22 HN ARG 22 1.290 2.990 -1.359
139 HA ARG 22 HA ARG 22 1.945 5.212 -3.076
140 HB2 ARG 22 2HB ARG 22 -0.446 5.464 -2.444
141 HB3 ARG 22 1HB ARG 22 -0.013 5.277 -0.757
142 HG2 ARG 22 2HG ARG 22 -0.461 7.592 -1.313
143 HG3 ARG 22 1HG ARG 22 1.217 7.370 -0.823
144 HD2 ARG 22 2HD ARG 22 1.954 7.460 -3.104
145 HD3 ARG 22 1HD ARG 22 0.292 7.469 -3.693
146 HE ARG 22 HE ARG 22 0.381 9.607 -2.083
147 HH11 ARG 22 1HH1 ARG 22 2.511 8.628 -4.736
148 HH12 ARG 22 2HH1 ARG 22 2.808 10.213 -5.262
149 HH21 ARG 22 1HH2 ARG 22 0.797 11.782 -2.810
150 HH22 ARG 22 2HH2 ARG 22 1.804 12.054 -4.151
151 H ARG 23 HN ARG 23 3.949 4.807 -2.595
152 HA ARG 23 HA ARG 23 5.094 3.676 -0.514
153 HB2 ARG 23 2HB ARG 23 7.222 4.683 -1.157
154 HB3 ARG 23 1HB ARG 23 6.288 4.146 -2.543
155 HG2 ARG 23 2HG ARG 23 5.584 6.490 -2.924
156 HG3 ARG 23 1HG ARG 23 6.619 6.977 -1.583
157 HD2 ARG 23 2HD ARG 23 8.538 5.981 -2.737
158 HD3 ARG 23 1HD ARG 23 7.491 5.591 -4.097
159 HE ARG 23 HE ARG 23 7.278 8.309 -3.557
160 HH11 ARG 23 1HH1 ARG 23 9.577 5.954 -4.839
161 HH12 ARG 23 2HH1 ARG 23 10.505 7.062 -5.729
162 HH21 ARG 23 1HH2 ARG 23 8.539 9.892 -4.804
163 HH22 ARG 23 2HH2 ARG 23 9.898 9.386 -5.700
164 HA PRO 24 HA PRO 24 6.397 3.239 0.743
165 HB2 PRO 24 2HB PRO 24 6.938 2.977 3.457
166 HB3 PRO 24 1HB PRO 24 8.059 3.574 2.234
167 HG2 PRO 24 2HG PRO 24 6.956 5.051 4.384
168 HG3 PRO 24 1HG PRO 24 7.897 5.688 3.028
169 HD2 PRO 24 2HD PRO 24 4.940 5.614 3.417
170 HD3 PRO 24 1HD PRO 24 5.942 6.828 2.590
171 H VAL 25 HN VAL 25 3.398 3.985 1.510
172 HA VAL 25 HA VAL 25 2.885 1.556 3.084
173 HB VAL 25 HB VAL 25 1.532 4.268 3.340
174 HG11 VAL 25 1HG1 VAL 25 0.820 1.703 4.749
175 HG12 VAL 25 2HG1 VAL 25 -0.168 2.534 3.547
176 HG13 VAL 25 3HG1 VAL 25 0.150 3.295 5.107
177 HG21 VAL 25 1HG2 VAL 25 2.325 4.182 5.646
178 HG22 VAL 25 2HG2 VAL 25 3.659 4.090 4.491
179 HG23 VAL 25 3HG2 VAL 25 3.104 2.635 5.317
180 H CYS 26 HN CYS 26 0.940 0.401 2.612
181 HA CYS 26 HA CYS 26 0.086 0.616 -0.131
182 HB2 CYS 26 2HB CYS 26 -0.758 -1.216 2.112
183 HB3 CYS 26 1HB CYS 26 -1.401 -1.310 0.480
184 H TYR 27 HN TYR 27 -1.877 1.273 -0.872
185 HA TYR 27 HA TYR 27 -3.757 2.364 1.073
186 HB2 TYR 27 2HB TYR 27 -2.642 3.741 -1.361
187 HB3 TYR 27 1HB TYR 27 -4.220 4.169 -0.719
188 HD1 TYR 27 1HD TYR 27 -0.745 3.648 0.580
189 HD2 TYR 27 2HD TYR 27 -4.268 6.005 0.672
190 HE1 TYR 27 1HE TYR 27 0.332 5.176 2.122
191 HE2 TYR 27 2HE TYR 27 -3.199 7.543 2.237
192 HH TYR 27 HH TYR 27 0.154 7.453 2.836
193 H LYS 28 HN LYS 28 -5.790 2.009 0.671
194 HA LYS 28 HA LYS 28 -6.558 0.714 -1.835
195 HB2 LYS 28 2HB LYS 28 -6.355 -0.916 0.043
196 HB3 LYS 28 1HB LYS 28 -7.467 0.067 0.982
197 HG2 LYS 28 2HG LYS 28 -9.227 -0.384 -0.668
198 HG3 LYS 28 1HG LYS 28 -8.097 -1.398 -1.571
199 HD2 LYS 28 2HD LYS 28 -7.839 -2.846 0.394
200 HD3 LYS 28 1HD LYS 28 -8.990 -1.845 1.278
201 HE2 LYS 28 2HE LYS 28 -10.103 -3.831 0.439
202 HE3 LYS 28 1HE LYS 28 -10.714 -2.409 -0.399
203 HZ1 LYS 28 1HZ LYS 28 -10.316 -4.237 -1.894
204 HZ2 LYS 28 2HZ LYS 28 -8.677 -4.274 -1.453
205 HZ3 LYS 28 3HZ LYS 28 -9.299 -2.940 -2.263
206 H ASN 29 HN ASN 29 -7.989 2.037 -2.778
207 HA ASN 29 HA ASN 29 -9.602 3.561 -3.155
208 HB2 ASN 29 2HB ASN 29 -10.496 2.808 -0.357
209 HB3 ASN 29 1HB ASN 29 -11.402 3.894 -1.403
210 HD21 ASN 29 1HD2 ASN 29 -12.432 3.058 -3.197
211 HD22 ASN 29 2HD2 ASN 29 -12.702 1.373 -3.423
Start of MODEL 20
1 H1 GLY 1 HN GLY 1 -6.526 3.640 -1.618
2 HA2 GLY 1 2HA GLY 1 -5.438 5.719 -1.363
3 HA3 GLY 1 1HA GLY 1 -7.009 6.505 -1.323
4 H LEU 2 HN LEU 2 -7.555 4.100 0.656
5 HA LEU 2 HA LEU 2 -6.768 5.675 2.991
6 HB2 LEU 2 2HB LEU 2 -8.929 3.608 2.630
7 HB3 LEU 2 1HB LEU 2 -8.464 4.223 4.194
8 HG LEU 2 HG LEU 2 -9.156 6.514 3.390
9 HD11 LEU 2 1HD1 LEU 2 -9.089 6.159 1.002
10 HD12 LEU 2 2HD1 LEU 2 -10.709 6.643 1.511
11 HD13 LEU 2 3HD1 LEU 2 -10.371 4.957 1.120
12 HD21 LEU 2 1HD2 LEU 2 -10.517 5.207 4.865
13 HD22 LEU 2 2HD2 LEU 2 -11.235 4.345 3.504
14 HD23 LEU 2 3HD2 LEU 2 -11.536 6.072 3.717
15 HA PRO 3 HA PRO 3 -3.966 2.464 4.135
16 HB2 PRO 3 2HB PRO 3 -3.669 3.024 6.784
17 HB3 PRO 3 1HB PRO 3 -2.940 4.016 5.516
18 HG2 PRO 3 2HG PRO 3 -5.424 4.501 7.108
19 HG3 PRO 3 1HG PRO 3 -4.189 5.654 6.577
20 HD2 PRO 3 2HD PRO 3 -6.619 5.330 5.327
21 HD3 PRO 3 1HD PRO 3 -5.153 5.923 4.523
22 H ILE 4 HN ILE 4 -5.449 0.772 3.781
23 HA ILE 4 HA ILE 4 -6.852 -0.251 6.193
24 HB ILE 4 HB ILE 4 -7.669 -0.669 3.302
25 HG12 ILE 4 2HG1 ILE 4 -7.971 1.692 3.874
26 HG13 ILE 4 1HG1 ILE 4 -9.523 0.889 3.686
27 HG21 ILE 4 1HG2 ILE 4 -9.783 -1.461 4.195
28 HG22 ILE 4 2HG2 ILE 4 -9.164 -1.263 5.836
29 HG23 ILE 4 3HG2 ILE 4 -8.424 -2.444 4.746
30 HD11 ILE 4 1HD1 ILE 4 -9.738 0.767 6.120
31 HD12 ILE 4 2HD1 ILE 4 -9.548 2.428 5.554
32 HD13 ILE 4 3HD1 ILE 4 -8.184 1.587 6.291
33 H CYS 5 HN CYS 5 -4.434 -0.809 3.924
34 HA CYS 5 HA CYS 5 -4.784 -3.653 3.630
35 HB2 CYS 5 2HB CYS 5 -2.390 -2.011 2.843
36 HB3 CYS 5 1HB CYS 5 -2.945 -3.531 2.147
37 H GLY 6 HN GLY 6 -2.741 -1.414 5.422
38 HA2 GLY 6 2HA GLY 6 -1.595 -1.799 7.393
39 HA3 GLY 6 1HA GLY 6 -2.068 -3.495 7.304
40 H GLU 7 HN GLU 7 -0.631 -1.854 4.643
41 HA GLU 7 HA GLU 7 1.845 -3.317 5.091
42 HB2 GLU 7 2HB GLU 7 0.155 -3.291 2.637
43 HB3 GLU 7 1HB GLU 7 1.898 -3.479 2.504
44 HG2 GLU 7 2HG GLU 7 0.040 -5.234 4.066
45 HG3 GLU 7 1HG GLU 7 0.795 -5.612 2.506
46 H THR 8 HN THR 8 3.596 -2.566 3.913
47 HA THR 8 HA THR 8 3.527 0.332 3.557
48 HB THR 8 HB THR 8 6.001 0.171 3.996
49 HG1 THR 8 1HG THR 8 5.577 -2.361 5.145
50 HG21 THR 8 1HG2 THR 8 4.208 -0.875 6.203
51 HG22 THR 8 2HG2 THR 8 4.456 0.823 5.801
52 HG23 THR 8 3HG2 THR 8 5.791 -0.136 6.437
53 H CYS 9 HN CYS 9 5.345 0.990 2.025
54 HA CYS 9 HA CYS 9 5.713 -0.942 -0.131
55 HB2 CYS 9 2HB CYS 9 5.065 1.975 -0.312
56 HB3 CYS 9 1HB CYS 9 5.827 1.118 -1.642
57 H LEU 10 HN LEU 10 7.587 -1.269 1.331
58 HA LEU 10 HA LEU 10 9.662 0.733 1.140
59 HB2 LEU 10 2HB LEU 10 9.766 -2.101 2.199
60 HB3 LEU 10 1HB LEU 10 11.010 -0.883 2.395
61 HG LEU 10 HG LEU 10 8.246 -0.784 3.604
62 HD11 LEU 10 1HD1 LEU 10 9.651 -2.458 4.653
63 HD12 LEU 10 2HD1 LEU 10 9.398 -1.085 5.729
64 HD13 LEU 10 3HD1 LEU 10 10.931 -1.264 4.878
65 HD21 LEU 10 1HD2 LEU 10 10.586 1.103 3.906
66 HD22 LEU 10 2HD2 LEU 10 9.092 1.168 4.841
67 HD23 LEU 10 3HD2 LEU 10 9.055 1.459 3.103
68 H LEU 11 HN LEU 11 8.756 -2.373 -0.261
69 HA LEU 11 HA LEU 11 10.989 -2.463 -2.022
70 HB2 LEU 11 2HB LEU 11 8.326 -3.887 -2.073
71 HB3 LEU 11 1HB LEU 11 9.675 -4.257 -3.120
72 HG LEU 11 HG LEU 11 9.569 -5.899 -1.491
73 HD11 LEU 11 1HD1 LEU 11 11.821 -5.249 -2.013
74 HD12 LEU 11 2HD1 LEU 11 11.725 -5.753 -0.327
75 HD13 LEU 11 3HD1 LEU 11 11.804 -4.039 -0.728
76 HD21 LEU 11 1HD2 LEU 11 9.551 -3.791 0.660
77 HD22 LEU 11 2HD2 LEU 11 9.687 -5.524 0.946
78 HD23 LEU 11 3HD2 LEU 11 8.221 -4.864 0.218
79 H GLY 12 HN GLY 12 7.699 -1.268 -2.083
80 HA2 GLY 12 2HA GLY 12 7.390 0.827 -3.318
81 HA3 GLY 12 1HA GLY 12 8.343 0.103 -4.609
82 H LYS 13 HN LYS 13 6.330 -2.140 -3.112
83 HA LYS 13 HA LYS 13 4.184 -1.696 -4.986
84 HB2 LYS 13 2HB LYS 13 4.249 -4.079 -5.522
85 HB3 LYS 13 1HB LYS 13 5.584 -3.167 -6.231
86 HG2 LYS 13 2HG LYS 13 7.057 -4.041 -4.465
87 HG3 LYS 13 1HG LYS 13 5.698 -4.923 -3.769
88 HD2 LYS 13 2HD LYS 13 6.766 -5.338 -6.563
89 HD3 LYS 13 1HD LYS 13 7.188 -6.325 -5.163
90 HE2 LYS 13 2HE LYS 13 4.839 -6.966 -4.904
91 HE3 LYS 13 1HE LYS 13 4.401 -5.963 -6.282
92 HZ1 LYS 13 1HZ LYS 13 6.183 -8.351 -6.396
93 HZ2 LYS 13 2HZ LYS 13 5.708 -7.391 -7.712
94 HZ3 LYS 13 3HZ LYS 13 4.573 -8.271 -6.862
95 H CYS 14 HN CYS 14 2.342 -3.024 -4.496
96 HA CYS 14 HA CYS 14 2.095 -3.701 -1.670
97 HB2 CYS 14 2HB CYS 14 0.059 -3.159 -3.823
98 HB3 CYS 14 1HB CYS 14 -0.364 -3.799 -2.240
99 H TYR 15 HN TYR 15 1.577 -5.720 -1.020
100 HA TYR 15 HA TYR 15 1.430 -7.794 -3.086
101 HB2 TYR 15 2HB TYR 15 2.089 -7.950 -0.136
102 HB3 TYR 15 1HB TYR 15 1.917 -9.361 -1.173
103 HD1 TYR 15 1HD TYR 15 3.616 -9.919 -2.786
104 HD2 TYR 15 2HD TYR 15 4.017 -6.449 -0.361
105 HE1 TYR 15 1HE TYR 15 5.963 -9.746 -3.436
106 HE2 TYR 15 2HE TYR 15 6.365 -6.260 -1.001
107 HH TYR 15 HH TYR 15 8.151 -7.732 -1.835
108 H THR 16 HN THR 16 -0.468 -5.956 -1.124
109 HA THR 16 HA THR 16 -2.387 -7.939 -0.360
110 HB THR 16 HB THR 16 -2.645 -4.943 -0.163
111 HG1 THR 16 1HG THR 16 -1.179 -6.763 1.474
112 HG21 THR 16 1HG2 THR 16 -3.888 -5.521 1.879
113 HG22 THR 16 2HG2 THR 16 -3.549 -7.229 1.608
114 HG23 THR 16 3HG2 THR 16 -4.581 -6.345 0.481
115 HA PRO 17 HA PRO 17 -4.507 -7.298 -4.308
116 HB2 PRO 17 2HB PRO 17 -6.660 -8.876 -3.701
117 HB3 PRO 17 1HB PRO 17 -5.132 -9.489 -4.340
118 HG2 PRO 17 2HG PRO 17 -6.164 -9.506 -1.553
119 HG3 PRO 17 1HG PRO 17 -5.175 -10.710 -2.396
120 HD2 PRO 17 2HD PRO 17 -4.190 -8.924 -0.592
121 HD3 PRO 17 1HD PRO 17 -3.224 -9.625 -1.906
122 H GLY 18 HN GLY 18 -5.762 -5.664 -4.796
123 HA2 GLY 18 2HA GLY 18 -7.775 -4.430 -4.706
124 HA3 GLY 18 1HA GLY 18 -7.996 -4.969 -3.043
125 H CYS 19 HN CYS 19 -4.851 -4.132 -3.441
126 HA CYS 19 HA CYS 19 -5.328 -1.423 -2.437
127 HB2 CYS 19 2HB CYS 19 -3.130 -3.376 -1.770
128 HB3 CYS 19 1HB CYS 19 -3.181 -1.707 -1.225
129 H SER 20 HN SER 20 -3.842 0.170 -3.056
130 HA SER 20 HA SER 20 -2.153 -0.484 -5.342
131 HB2 SER 20 2HB SER 20 -4.325 0.743 -5.948
132 HB3 SER 20 1HB SER 20 -3.732 2.085 -4.976
133 HG SER 20 HG SER 20 -2.047 1.081 -6.970
134 H CYS 21 HN CYS 21 -0.169 0.604 -5.280
135 HA CYS 21 HA CYS 21 0.611 1.281 -2.600
136 HB2 CYS 21 2HB CYS 21 1.962 -0.281 -3.816
137 HB3 CYS 21 1HB CYS 21 2.189 0.868 -5.127
138 H ARG 22 HN ARG 22 1.190 3.207 -1.829
139 HA ARG 22 HA ARG 22 1.865 5.374 -3.681
140 HB2 ARG 22 2HB ARG 22 0.445 5.789 -1.028
141 HB3 ARG 22 1HB ARG 22 0.860 7.017 -2.200
142 HG2 ARG 22 2HG ARG 22 -1.209 4.872 -2.541
143 HG3 ARG 22 1HG ARG 22 -1.515 6.562 -2.150
144 HD2 ARG 22 2HD ARG 22 -0.538 7.221 -4.272
145 HD3 ARG 22 1HD ARG 22 -0.228 5.523 -4.658
146 HE ARG 22 HE ARG 22 -2.871 6.732 -4.307
147 HH11 ARG 22 1HH1 ARG 22 -0.801 4.243 -5.762
148 HH12 ARG 22 2HH1 ARG 22 -2.103 3.463 -6.533
149 HH21 ARG 22 1HH2 ARG 22 -4.590 5.683 -5.342
150 HH22 ARG 22 2HH2 ARG 22 -4.315 4.329 -6.337
151 H ARG 23 HN ARG 23 3.986 4.667 -3.302
152 HA ARG 23 HA ARG 23 4.990 3.853 -0.886
153 HB2 ARG 23 2HB ARG 23 7.255 4.211 -1.739
154 HB3 ARG 23 1HB ARG 23 6.224 3.453 -2.934
155 HG2 ARG 23 2HG ARG 23 6.022 5.582 -4.111
156 HG3 ARG 23 1HG ARG 23 7.037 6.355 -2.887
157 HD2 ARG 23 2HD ARG 23 8.827 4.728 -3.417
158 HD3 ARG 23 1HD ARG 23 7.830 4.097 -4.724
159 HE ARG 23 HE ARG 23 8.012 6.762 -5.195
160 HH11 ARG 23 1HH1 ARG 23 10.378 4.164 -4.762
161 HH12 ARG 23 2HH1 ARG 23 11.570 4.869 -5.755
162 HH21 ARG 23 1HH2 ARG 23 9.659 7.754 -6.588
163 HH22 ARG 23 2HH2 ARG 23 11.144 6.973 -6.797
164 HA PRO 24 HA PRO 24 6.672 3.706 0.361
165 HB2 PRO 24 2HB PRO 24 7.394 3.890 2.867
166 HB3 PRO 24 1HB PRO 24 8.231 4.851 1.639
167 HG2 PRO 24 2HG PRO 24 6.113 5.703 3.579
168 HG3 PRO 24 1HG PRO 24 7.601 6.546 3.119
169 HD2 PRO 24 2HD PRO 24 5.068 7.023 2.040
170 HD3 PRO 24 1HD PRO 24 6.607 7.504 1.298
171 H VAL 25 HN VAL 25 3.581 4.460 0.867
172 HA VAL 25 HA VAL 25 3.183 2.260 2.784
173 HB VAL 25 HB VAL 25 1.376 4.702 2.613
174 HG11 VAL 25 1HG1 VAL 25 0.220 2.727 3.406
175 HG12 VAL 25 2HG1 VAL 25 0.406 3.897 4.712
176 HG13 VAL 25 3HG1 VAL 25 1.451 2.477 4.644
177 HG21 VAL 25 1HG2 VAL 25 3.471 4.098 4.701
178 HG22 VAL 25 2HG2 VAL 25 2.297 5.412 4.775
179 HG23 VAL 25 3HG2 VAL 25 3.528 5.398 3.510
180 H CYS 26 HN CYS 26 1.188 0.985 2.434
181 HA CYS 26 HA CYS 26 0.382 1.037 -0.375
182 HB2 CYS 26 2HB CYS 26 1.343 -1.050 0.600
183 HB3 CYS 26 1HB CYS 26 0.041 -1.066 1.779
184 H TYR 27 HN TYR 27 -1.890 1.303 -0.865
185 HA TYR 27 HA TYR 27 -3.580 1.823 1.467
186 HB2 TYR 27 2HB TYR 27 -3.247 3.635 -0.923
187 HB3 TYR 27 1HB TYR 27 -4.542 3.787 0.252
188 HD1 TYR 27 1HD TYR 27 -4.075 4.610 2.501
189 HD2 TYR 27 2HD TYR 27 -0.980 4.284 -0.373
190 HE1 TYR 27 1HE TYR 27 -2.665 6.044 3.878
191 HE2 TYR 27 2HE TYR 27 0.451 5.727 0.995
192 HH TYR 27 HH TYR 27 -0.381 6.585 4.214
193 H LYS 28 HN LYS 28 -5.798 1.581 1.136
194 HA LYS 28 HA LYS 28 -6.548 0.072 -1.269
195 HB2 LYS 28 2HB LYS 28 -6.601 -1.200 0.892
196 HB3 LYS 28 1HB LYS 28 -7.752 -0.006 1.491
197 HG2 LYS 28 2HG LYS 28 -9.334 -0.684 -0.253
198 HG3 LYS 28 1HG LYS 28 -8.182 -1.905 -0.801
199 HD2 LYS 28 2HD LYS 28 -8.253 -2.949 1.420
200 HD3 LYS 28 1HD LYS 28 -9.433 -1.749 1.938
201 HE2 LYS 28 2HE LYS 28 -10.574 -3.793 1.353
202 HE3 LYS 28 1HE LYS 28 -10.976 -2.546 0.178
203 HZ1 LYS 28 1HZ LYS 28 -10.526 -4.646 -0.889
204 HZ2 LYS 28 2HZ LYS 28 -8.992 -4.718 -0.207
205 HZ3 LYS 28 3HZ LYS 28 -9.376 -3.505 -1.340
206 H ASN 29 HN ASN 29 -7.460 1.517 -2.516
207 HA ASN 29 HA ASN 29 -8.773 3.109 -3.369
208 HB2 ASN 29 2HB ASN 29 -10.429 2.792 -0.833
209 HB3 ASN 29 1HB ASN 29 -10.912 3.770 -2.212
210 HD21 ASN 29 1HD2 ASN 29 -10.720 0.613 -0.886
211 HD22 ASN 29 2HD2 ASN 29 -11.443 -0.214 -2.214