Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
642741 | 6mm4 RC | 30525 | cing | 1-original | 6 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 H1 GLY 1 H1 GLY 1 1.870 -0.268 0.652
2 H2 GLY 1 H2 GLY 1 2.617 1.033 1.226
3 H3 GLY 1 H3 GLY 1 2.201 0.978 -0.366
4 HA2 GLY 1 HA2 GLY 1 4.074 -0.857 0.864
5 HA3 GLY 1 HA3 GLY 1 3.676 -0.674 -0.843
6 H CYS 2 H CYS 2 6.195 -0.415 -0.826
7 HA CYS 2 HA CYS 2 7.256 2.083 0.072
8 HB2 CYS 2 HB2 CYS 2 8.162 0.075 -2.023
9 HB3 CYS 2 HB3 CYS 2 9.187 1.392 -1.406
10 HA PRO 3 HA PRO 3 6.120 4.663 -3.135
11 HB2 PRO 3 HB2 PRO 3 8.117 6.394 -3.670
12 HB3 PRO 3 HB3 PRO 3 7.199 6.371 -2.134
13 HG2 PRO 3 HG2 PRO 3 9.911 5.157 -2.686
14 HG3 PRO 3 HG3 PRO 3 9.354 6.256 -1.360
15 HD2 PRO 3 HD2 PRO 3 9.511 3.507 -1.099
16 HD3 PRO 3 HD3 PRO 3 8.307 4.522 -0.249
17 H ARG 4 H ARG 4 5.660 3.922 -5.003
18 HA ARG 4 HA ARG 4 5.835 2.588 -6.856
19 HB2 ARG 4 HB2 ARG 4 7.408 5.092 -7.695
20 HB3 ARG 4 HB3 ARG 4 6.569 3.966 -8.747
21 HG2 ARG 4 HG2 ARG 4 4.435 4.635 -7.821
22 HG3 ARG 4 HG3 ARG 4 5.299 5.693 -6.657
23 HD2 ARG 4 HD2 ARG 4 6.234 7.022 -8.545
24 HD3 ARG 4 HD3 ARG 4 5.424 5.948 -9.704
25 HE ARG 4 HE ARG 4 4.203 8.048 -7.919
26 HH11 ARG 4 HH11 ARG 4 3.652 5.609 -10.368
27 HH12 ARG 4 HH12 ARG 4 2.043 6.182 -10.739
28 HH21 ARG 4 HH21 ARG 4 2.140 8.652 -8.356
29 HH22 ARG 4 HH22 ARG 4 1.174 7.887 -9.580
30 HA PRO 5 HA PRO 5 10.130 0.944 -6.686
31 HB2 PRO 5 HB2 PRO 5 9.596 -1.682 -6.165
32 HB3 PRO 5 HB3 PRO 5 9.501 -0.453 -4.871
33 HG2 PRO 5 HG2 PRO 5 7.241 -1.574 -6.528
34 HG3 PRO 5 HG3 PRO 5 7.396 -1.473 -4.730
35 HD2 PRO 5 HD2 PRO 5 6.060 0.378 -6.132
36 HD3 PRO 5 HD3 PRO 5 6.998 0.796 -4.687
37 H ARG 6 H ARG 6 11.085 -0.834 -8.229
38 HA ARG 6 HA ARG 6 9.297 -1.599 -10.479
39 HB2 ARG 6 HB2 ARG 6 11.696 0.187 -10.792
40 HB3 ARG 6 HB3 ARG 6 11.174 -0.901 -12.085
41 HG2 ARG 6 HG2 ARG 6 9.458 1.253 -10.889
42 HG3 ARG 6 HG3 ARG 6 10.334 1.382 -12.437
43 HD2 ARG 6 HD2 ARG 6 9.130 -0.762 -13.175
44 HD3 ARG 6 HD3 ARG 6 8.042 -0.511 -11.766
45 HE ARG 6 HE ARG 6 8.271 1.903 -13.347
46 HH11 ARG 6 HH11 ARG 6 6.710 -1.283 -13.321
47 HH12 ARG 6 HH12 ARG 6 5.344 -0.764 -14.309
48 HH21 ARG 6 HH21 ARG 6 6.615 2.470 -14.644
49 HH22 ARG 6 HH22 ARG 6 5.344 1.330 -15.066
50 H GLY 7 H GLY 7 10.236 -3.344 -11.697
51 HA2 GLY 7 HA2 GLY 7 12.059 -4.920 -10.037
52 HA3 GLY 7 HA3 GLY 7 11.214 -5.425 -11.509
53 H ASP 8 H ASP 8 12.710 -2.430 -11.885
54 HA ASP 8 HA ASP 8 14.898 -3.511 -13.524
55 HB2 ASP 8 HB2 ASP 8 13.851 -0.707 -12.946
56 HB3 ASP 8 HB3 ASP 8 15.372 -0.997 -13.820
57 H ASN 9 H ASN 9 14.228 -2.930 -10.331
58 HA ASN 9 HA ASN 9 17.089 -2.244 -9.671
59 HB2 ASN 9 HB2 ASN 9 14.512 -1.426 -8.232
60 HB3 ASN 9 HB3 ASN 9 16.158 -1.167 -7.608
61 HD21 ASN 9 HD21 ASN 9 13.706 0.532 -8.775
62 HD22 ASN 9 HD22 ASN 9 14.540 1.720 -9.785
63 HA PRO 10 HA PRO 10 16.788 -6.041 -7.331
64 HB2 PRO 10 HB2 PRO 10 18.850 -5.772 -5.603
65 HB3 PRO 10 HB3 PRO 10 19.117 -5.995 -7.344
66 HG2 PRO 10 HG2 PRO 10 19.224 -3.411 -5.794
67 HG3 PRO 10 HG3 PRO 10 20.299 -4.061 -7.051
68 HD2 PRO 10 HD2 PRO 10 18.361 -2.250 -7.609
69 HD3 PRO 10 HD3 PRO 10 18.888 -3.525 -8.765
70 HA PRO 11 HA PRO 11 14.673 -4.829 -3.604
71 HB2 PRO 11 HB2 PRO 11 14.711 -7.080 -2.071
72 HB3 PRO 11 HB3 PRO 11 13.730 -6.986 -3.565
73 HG2 PRO 11 HG2 PRO 11 16.456 -8.151 -3.149
74 HG3 PRO 11 HG3 PRO 11 15.035 -8.933 -3.962
75 HD2 PRO 11 HD2 PRO 11 16.984 -7.709 -5.373
76 HD3 PRO 11 HD3 PRO 11 15.295 -7.685 -5.936
77 H LEU 12 H LEU 12 15.201 -4.051 -1.534
78 HA LEU 12 HA LEU 12 18.105 -4.128 -0.866
79 HB2 LEU 12 HB2 LEU 12 17.655 -2.271 0.594
80 HB3 LEU 12 HB3 LEU 12 16.974 -1.921 -0.985
81 HG LEU 12 HG LEU 12 14.976 -3.003 0.812
82 HD11 LEU 12 HD11 LEU 12 16.152 -2.025 2.577
83 HD12 LEU 12 HD12 LEU 12 14.827 -0.911 2.184
84 HD13 LEU 12 HD13 LEU 12 16.508 -0.529 1.658
85 HD21 LEU 12 HD21 LEU 12 13.699 -1.107 -0.024
86 HD22 LEU 12 HD22 LEU 12 14.525 -1.950 -1.341
87 HD23 LEU 12 HD23 LEU 12 15.163 -0.379 -0.722
88 H THR 13 H THR 13 18.872 -4.714 1.195
89 HA THR 13 HA THR 13 17.294 -6.795 2.439
90 HB THR 13 HB THR 13 19.188 -6.765 4.082
91 HG1 THR 13 HG1 THR 13 20.129 -4.839 3.973
92 HG21 THR 13 HG21 THR 13 20.089 -6.924 1.210
93 HG22 THR 13 HG22 THR 13 19.015 -8.106 1.961
94 HG23 THR 13 HG23 THR 13 20.628 -7.861 2.600
95 H CYS 14 H CYS 14 16.854 -6.970 4.709
96 HA CYS 14 HA CYS 14 17.053 -4.506 6.341
97 HB2 CYS 14 HB2 CYS 14 14.634 -4.539 6.939
98 HB3 CYS 14 HB3 CYS 14 14.797 -4.286 5.175
99 H SER 15 H SER 15 16.282 -5.108 8.682
100 HA SER 15 HA SER 15 16.207 -8.032 9.136
101 HB2 SER 15 HB2 SER 15 18.263 -7.987 9.998
102 HB3 SER 15 HB3 SER 15 18.356 -6.231 9.926
103 HG SER 15 HG SER 15 18.407 -6.869 12.079
104 H GLN 16 H GLN 16 15.381 -4.753 9.882
105 HA GLN 16 HA GLN 16 13.229 -5.785 11.673
106 HB2 GLN 16 HB2 GLN 16 13.415 -3.651 12.961
107 HB3 GLN 16 HB3 GLN 16 14.766 -4.765 13.155
108 HG2 GLN 16 HG2 GLN 16 16.108 -3.410 11.583
109 HG3 GLN 16 HG3 GLN 16 14.785 -2.260 11.361
110 HE21 GLN 16 HE21 GLN 16 16.944 -1.060 12.132
111 HE22 GLN 16 HE22 GLN 16 16.938 -0.637 13.881
112 H ASP 17 H ASP 17 11.368 -4.188 11.647
113 HA ASP 17 HA ASP 17 10.638 -3.273 9.067
114 HB2 ASP 17 HB2 ASP 17 9.203 -4.053 10.962
115 HB3 ASP 17 HB3 ASP 17 9.638 -2.560 11.825
116 H SER 18 H SER 18 12.301 -1.682 11.760
117 HA SER 18 HA SER 18 11.833 1.024 10.794
118 HB2 SER 18 HB2 SER 18 14.291 0.694 12.304
119 HB3 SER 18 HB3 SER 18 12.770 1.486 12.771
120 HG SER 18 HG SER 18 13.591 -0.527 13.956
121 H ASP 19 H ASP 19 13.885 -1.428 9.469
122 HA ASP 19 HA ASP 19 16.096 0.308 8.774
123 HB2 ASP 19 HB2 ASP 19 15.197 -2.398 7.763
124 HB3 ASP 19 HB3 ASP 19 16.686 -1.572 7.147
125 H CYS 20 H CYS 20 12.962 -0.129 7.594
126 HA CYS 20 HA CYS 20 13.719 0.822 4.822
127 HB2 CYS 20 HB2 CYS 20 11.126 -0.382 5.811
128 HB3 CYS 20 HB3 CYS 20 11.553 0.054 4.172
129 H LEU 21 H LEU 21 11.777 1.999 3.744
130 HA LEU 21 HA LEU 21 11.406 4.514 5.162
131 HB2 LEU 21 HB2 LEU 21 10.457 3.515 2.507
132 HB3 LEU 21 HB3 LEU 21 10.196 5.166 3.090
133 HG LEU 21 HG LEU 21 12.926 3.975 2.402
134 HD11 LEU 21 HD11 LEU 21 11.189 6.015 0.892
135 HD12 LEU 21 HD12 LEU 21 11.450 4.344 0.380
136 HD13 LEU 21 HD13 LEU 21 12.823 5.436 0.411
137 HD21 LEU 21 HD21 LEU 21 13.723 6.272 2.585
138 HD22 LEU 21 HD22 LEU 21 13.025 5.710 4.132
139 HD23 LEU 21 HD23 LEU 21 12.104 6.831 3.060
140 H ALA 22 H ALA 22 9.231 5.445 5.429
141 HA ALA 22 HA ALA 22 7.383 3.695 6.754
142 HB1 ALA 22 HB1 ALA 22 6.834 6.511 5.480
143 HB2 ALA 22 HB2 ALA 22 5.796 5.695 6.673
144 HB3 ALA 22 HB3 ALA 22 7.415 6.249 7.111
145 H GLY 23 H GLY 23 5.488 2.624 5.980
146 HA2 GLY 23 HA2 GLY 23 3.886 2.024 4.250
147 HA3 GLY 23 HA3 GLY 23 4.961 2.703 3.046
148 H CYS 24 H CYS 24 7.301 1.256 4.444
149 HA CYS 24 HA CYS 24 7.019 -1.201 2.796
150 HB2 CYS 24 HB2 CYS 24 9.403 0.180 4.068
151 HB3 CYS 24 HB3 CYS 24 9.492 -1.227 2.985
152 H VAL 25 H VAL 25 7.894 -3.193 3.788
153 HA VAL 25 HA VAL 25 7.869 -3.195 6.834
154 HB VAL 25 HB VAL 25 6.760 -5.449 6.708
155 HG11 VAL 25 HG11 VAL 25 4.439 -4.634 6.320
156 HG12 VAL 25 HG12 VAL 25 5.392 -3.540 7.334
157 HG13 VAL 25 HG13 VAL 25 5.084 -3.136 5.667
158 HG21 VAL 25 HG21 VAL 25 7.182 -5.984 4.256
159 HG22 VAL 25 HG22 VAL 25 5.480 -5.991 4.562
160 HG23 VAL 25 HG23 VAL 25 6.189 -4.595 3.747
161 H CYS 26 H CYS 26 8.904 -5.330 7.545
162 HA CYS 26 HA CYS 26 11.031 -5.989 5.619
163 HB2 CYS 26 HB2 CYS 26 11.855 -4.884 7.675
164 HB3 CYS 26 HB3 CYS 26 11.163 -6.186 8.656
165 H GLY 27 H GLY 27 11.129 -8.036 4.768
166 HA2 GLY 27 HA2 GLY 27 9.078 -9.884 5.869
167 HA3 GLY 27 HA3 GLY 27 9.889 -9.939 4.296
168 HA PRO 28 HA PRO 28 11.532 -13.145 7.356
169 HB2 PRO 28 HB2 PRO 28 10.746 -15.451 6.200
170 HB3 PRO 28 HB3 PRO 28 9.649 -14.382 7.156
171 HG2 PRO 28 HG2 PRO 28 10.086 -14.405 4.141
172 HG3 PRO 28 HG3 PRO 28 8.549 -14.683 5.062
173 HD2 PRO 28 HD2 PRO 28 9.222 -12.257 4.057
174 HD3 PRO 28 HD3 PRO 28 8.394 -12.451 5.678
175 H ASN 29 H ASN 29 11.951 -12.701 3.844
176 HA ASN 29 HA ASN 29 14.260 -14.518 3.739
177 HB2 ASN 29 HB2 ASN 29 13.150 -12.565 1.716
178 HB3 ASN 29 HB3 ASN 29 14.476 -13.633 1.404
179 HD21 ASN 29 HD21 ASN 29 14.098 -15.924 1.368
180 HD22 ASN 29 HD22 ASN 29 12.449 -16.480 1.037
181 H GLY 30 H GLY 30 13.817 -11.522 5.160
182 HA2 GLY 30 HA2 GLY 30 15.450 -10.045 5.939
183 HA3 GLY 30 HA3 GLY 30 16.707 -10.976 5.086
184 H PHE 31 H PHE 31 13.932 -9.990 3.339
185 HA PHE 31 HA PHE 31 15.361 -7.564 2.179
186 HB2 PHE 31 HB2 PHE 31 13.579 -9.651 0.763
187 HB3 PHE 31 HB3 PHE 31 13.987 -8.063 0.096
188 HD1 PHE 31 HD1 PHE 31 14.953 -11.482 0.189
189 HD2 PHE 31 HD2 PHE 31 16.636 -7.524 -0.076
190 HE1 PHE 31 HE1 PHE 31 16.990 -12.459 -0.758
191 HE2 PHE 31 HE2 PHE 31 18.714 -8.466 -0.992
192 HZ PHE 31 HZ PHE 31 18.855 -11.006 -1.400
193 H CYS 32 H CYS 32 14.136 -5.841 1.738
194 HA CYS 32 HA CYS 32 11.777 -5.480 3.405
195 HB2 CYS 32 HB2 CYS 32 13.742 -3.746 2.864
196 HB3 CYS 32 HB3 CYS 32 12.856 -3.556 1.345
197 H GLY 33 H GLY 33 9.746 -4.847 2.711
198 HA2 GLY 33 HA2 GLY 33 9.060 -5.328 -0.162
199 HA3 GLY 33 HA3 GLY 33 8.295 -6.346 1.064
Start of MODEL 2
1 H1 GLY 1 H1 GLY 1 4.140 4.586 -0.104
2 H2 GLY 1 H2 GLY 1 5.434 5.442 0.288
3 H3 GLY 1 H3 GLY 1 5.174 5.096 -1.290
4 HA2 GLY 1 HA2 GLY 1 5.777 3.249 0.824
5 HA3 GLY 1 HA3 GLY 1 5.405 2.786 -0.837
6 H CYS 2 H CYS 2 7.598 1.778 -0.854
7 HA CYS 2 HA CYS 2 9.896 3.556 -0.780
8 HB2 CYS 2 HB2 CYS 2 9.482 0.647 -1.472
9 HB3 CYS 2 HB3 CYS 2 11.085 1.432 -1.589
10 HA PRO 3 HA PRO 3 9.774 4.676 -4.885
11 HB2 PRO 3 HB2 PRO 3 12.242 5.573 -5.493
12 HB3 PRO 3 HB3 PRO 3 11.225 6.305 -4.228
13 HG2 PRO 3 HG2 PRO 3 13.407 4.272 -3.841
14 HG3 PRO 3 HG3 PRO 3 13.211 5.903 -3.120
15 HD2 PRO 3 HD2 PRO 3 12.354 3.603 -1.863
16 HD3 PRO 3 HD3 PRO 3 11.509 5.173 -1.708
17 H ARG 4 H ARG 4 10.220 4.206 -7.116
18 HA ARG 4 HA ARG 4 11.814 1.727 -7.597
19 HB2 ARG 4 HB2 ARG 4 9.150 2.509 -8.762
20 HB3 ARG 4 HB3 ARG 4 10.134 1.183 -9.374
21 HG2 ARG 4 HG2 ARG 4 8.516 0.097 -8.190
22 HG3 ARG 4 HG3 ARG 4 9.862 0.214 -6.987
23 HD2 ARG 4 HD2 ARG 4 7.743 0.813 -5.884
24 HD3 ARG 4 HD3 ARG 4 8.786 2.243 -6.073
25 HE ARG 4 HE ARG 4 6.981 2.082 -8.242
26 HH11 ARG 4 HH11 ARG 4 6.986 2.707 -4.816
27 HH12 ARG 4 HH12 ARG 4 5.499 3.602 -4.860
28 HH21 ARG 4 HH21 ARG 4 5.037 3.260 -8.270
29 HH22 ARG 4 HH22 ARG 4 4.383 3.962 -6.789
30 HA PRO 5 HA PRO 5 13.167 5.418 -10.093
31 HB2 PRO 5 HB2 PRO 5 15.775 5.111 -9.872
32 HB3 PRO 5 HB3 PRO 5 14.792 5.903 -8.601
33 HG2 PRO 5 HG2 PRO 5 15.731 3.025 -8.671
34 HG3 PRO 5 HG3 PRO 5 15.909 4.255 -7.381
35 HD2 PRO 5 HD2 PRO 5 13.914 2.532 -7.337
36 HD3 PRO 5 HD3 PRO 5 13.698 4.219 -6.922
37 H ARG 6 H ARG 6 14.065 2.030 -10.273
38 HA ARG 6 HA ARG 6 14.652 2.332 -13.091
39 HB2 ARG 6 HB2 ARG 6 15.894 0.363 -11.396
40 HB3 ARG 6 HB3 ARG 6 16.232 0.598 -12.976
41 HG2 ARG 6 HG2 ARG 6 16.796 2.526 -10.925
42 HG3 ARG 6 HG3 ARG 6 17.909 1.504 -11.543
43 HD2 ARG 6 HD2 ARG 6 16.545 3.565 -13.029
44 HD3 ARG 6 HD3 ARG 6 18.123 3.594 -12.609
45 HE ARG 6 HE ARG 6 16.963 2.137 -14.760
46 HH11 ARG 6 HH11 ARG 6 18.389 1.166 -16.223
47 HH12 ARG 6 HH12 ARG 6 20.076 1.057 -15.845
48 HH21 ARG 6 HH21 ARG 6 19.775 2.642 -12.739
49 HH22 ARG 6 HH22 ARG 6 20.866 1.898 -13.860
50 H GLY 7 H GLY 7 13.703 0.041 -10.605
51 HA2 GLY 7 HA2 GLY 7 11.752 -1.328 -10.582
52 HA3 GLY 7 HA3 GLY 7 11.506 -0.954 -12.319
53 H ASP 8 H ASP 8 14.670 -1.473 -12.243
54 HA ASP 8 HA ASP 8 14.486 -4.393 -12.731
55 HB2 ASP 8 HB2 ASP 8 16.366 -2.229 -13.691
56 HB3 ASP 8 HB3 ASP 8 16.640 -3.963 -14.008
57 H ASN 9 H ASN 9 15.172 -2.461 -10.267
58 HA ASN 9 HA ASN 9 17.897 -3.455 -9.616
59 HB2 ASN 9 HB2 ASN 9 15.954 -1.540 -8.259
60 HB3 ASN 9 HB3 ASN 9 17.444 -2.122 -7.470
61 HD21 ASN 9 HD21 ASN 9 16.955 0.577 -7.883
62 HD22 ASN 9 HD22 ASN 9 18.068 1.208 -9.113
63 HA PRO 10 HA PRO 10 16.269 -6.822 -7.145
64 HB2 PRO 10 HB2 PRO 10 18.293 -7.212 -5.378
65 HB3 PRO 10 HB3 PRO 10 18.434 -7.631 -7.108
66 HG2 PRO 10 HG2 PRO 10 19.514 -5.229 -5.707
67 HG3 PRO 10 HG3 PRO 10 20.249 -6.275 -6.892
68 HD2 PRO 10 HD2 PRO 10 19.136 -3.886 -7.568
69 HD3 PRO 10 HD3 PRO 10 19.140 -5.307 -8.659
70 HA PRO 11 HA PRO 11 14.565 -4.833 -3.588
71 HB2 PRO 11 HB2 PRO 11 14.217 -6.829 -1.788
72 HB3 PRO 11 HB3 PRO 11 13.213 -6.701 -3.249
73 HG2 PRO 11 HG2 PRO 11 15.700 -8.393 -2.785
74 HG3 PRO 11 HG3 PRO 11 14.082 -8.928 -3.463
75 HD2 PRO 11 HD2 PRO 11 16.138 -8.322 -5.081
76 HD3 PRO 11 HD3 PRO 11 14.445 -7.892 -5.525
77 H LEU 12 H LEU 12 15.129 -3.914 -1.631
78 HA LEU 12 HA LEU 12 17.992 -4.122 -1.000
79 HB2 LEU 12 HB2 LEU 12 17.646 -2.256 0.492
80 HB3 LEU 12 HB3 LEU 12 16.932 -1.906 -1.079
81 HG LEU 12 HG LEU 12 15.009 -2.982 0.875
82 HD11 LEU 12 HD11 LEU 12 14.837 -0.946 2.154
83 HD12 LEU 12 HD12 LEU 12 16.276 -0.293 1.331
84 HD13 LEU 12 HD13 LEU 12 16.425 -1.728 2.372
85 HD21 LEU 12 HD21 LEU 12 13.570 -1.237 -0.069
86 HD22 LEU 12 HD22 LEU 12 14.426 -2.101 -1.385
87 HD23 LEU 12 HD23 LEU 12 14.964 -0.493 -0.876
88 H THR 13 H THR 13 18.840 -4.514 1.087
89 HA THR 13 HA THR 13 17.534 -6.729 2.416
90 HB THR 13 HB THR 13 19.490 -6.290 4.026
91 HG1 THR 13 HG1 THR 13 21.158 -4.985 3.126
92 HG21 THR 13 HG21 THR 13 19.983 -6.895 1.086
93 HG22 THR 13 HG22 THR 13 19.314 -8.002 2.268
94 HG23 THR 13 HG23 THR 13 20.965 -7.421 2.440
95 H CYS 14 H CYS 14 17.038 -6.975 4.625
96 HA CYS 14 HA CYS 14 17.044 -4.525 6.282
97 HB2 CYS 14 HB2 CYS 14 14.696 -4.709 6.894
98 HB3 CYS 14 HB3 CYS 14 14.827 -4.441 5.147
99 H SER 15 H SER 15 16.383 -5.126 8.602
100 HA SER 15 HA SER 15 16.625 -8.060 9.114
101 HB2 SER 15 HB2 SER 15 18.833 -7.620 9.688
102 HB3 SER 15 HB3 SER 15 18.552 -5.900 9.896
103 HG SER 15 HG SER 15 18.956 -7.026 11.866
104 H GLN 16 H GLN 16 15.539 -4.824 9.884
105 HA GLN 16 HA GLN 16 13.452 -6.056 11.624
106 HB2 GLN 16 HB2 GLN 16 13.548 -4.119 13.131
107 HB3 GLN 16 HB3 GLN 16 15.011 -5.081 13.145
108 HG2 GLN 16 HG2 GLN 16 16.124 -3.423 11.685
109 HG3 GLN 16 HG3 GLN 16 14.680 -2.373 11.770
110 HE21 GLN 16 HE21 GLN 16 17.663 -2.894 13.018
111 HE22 GLN 16 HE22 GLN 16 17.501 -2.167 14.617
112 H ASP 17 H ASP 17 11.466 -4.640 11.558
113 HA ASP 17 HA ASP 17 10.883 -3.653 8.962
114 HB2 ASP 17 HB2 ASP 17 9.576 -3.269 11.663
115 HB3 ASP 17 HB3 ASP 17 8.891 -2.662 10.104
116 H SER 18 H SER 18 12.232 -2.025 11.797
117 HA SER 18 HA SER 18 11.604 0.641 10.848
118 HB2 SER 18 HB2 SER 18 12.323 -0.046 13.258
119 HB3 SER 18 HB3 SER 18 13.980 -0.001 12.595
120 HG SER 18 HG SER 18 13.641 2.024 13.346
121 H ASP 19 H ASP 19 13.840 -1.612 9.567
122 HA ASP 19 HA ASP 19 15.890 0.253 8.702
123 HB2 ASP 19 HB2 ASP 19 15.064 -2.515 7.785
124 HB3 ASP 19 HB3 ASP 19 16.420 -1.581 7.020
125 H CYS 20 H CYS 20 12.745 -0.646 7.704
126 HA CYS 20 HA CYS 20 13.169 0.453 4.924
127 HB2 CYS 20 HB2 CYS 20 10.753 -0.958 6.189
128 HB3 CYS 20 HB3 CYS 20 10.875 -0.381 4.533
129 H LEU 21 H LEU 21 11.196 1.663 4.004
130 HA LEU 21 HA LEU 21 11.015 4.100 5.615
131 HB2 LEU 21 HB2 LEU 21 10.096 3.455 2.823
132 HB3 LEU 21 HB3 LEU 21 10.092 5.050 3.503
133 HG LEU 21 HG LEU 21 12.614 3.484 2.838
134 HD11 LEU 21 HD11 LEU 21 12.909 4.995 0.971
135 HD12 LEU 21 HD12 LEU 21 11.447 5.898 1.431
136 HD13 LEU 21 HD13 LEU 21 11.326 4.233 0.857
137 HD21 LEU 21 HD21 LEU 21 12.994 5.017 4.703
138 HD22 LEU 21 HD22 LEU 21 12.242 6.360 3.774
139 HD23 LEU 21 HD23 LEU 21 13.792 5.641 3.204
140 H ALA 22 H ALA 22 8.817 5.220 5.669
141 HA ALA 22 HA ALA 22 6.798 3.520 6.721
142 HB1 ALA 22 HB1 ALA 22 6.409 6.362 5.532
143 HB2 ALA 22 HB2 ALA 22 5.296 5.590 6.673
144 HB3 ALA 22 HB3 ALA 22 6.926 6.073 7.188
145 H GLY 23 H GLY 23 5.110 2.380 5.772
146 HA2 GLY 23 HA2 GLY 23 3.638 1.780 3.911
147 HA3 GLY 23 HA3 GLY 23 4.664 2.664 2.833
148 H CYS 24 H CYS 24 6.879 1.037 4.611
149 HA CYS 24 HA CYS 24 6.847 -1.331 2.762
150 HB2 CYS 24 HB2 CYS 24 9.187 0.404 3.652
151 HB3 CYS 24 HB3 CYS 24 9.318 -1.024 2.646
152 H VAL 25 H VAL 25 7.946 -3.146 3.710
153 HA VAL 25 HA VAL 25 8.123 -3.095 6.760
154 HB VAL 25 HB VAL 25 6.976 -5.376 6.749
155 HG11 VAL 25 HG11 VAL 25 4.666 -4.550 6.559
156 HG12 VAL 25 HG12 VAL 25 5.686 -3.387 7.422
157 HG13 VAL 25 HG13 VAL 25 5.227 -3.097 5.760
158 HG21 VAL 25 HG21 VAL 25 5.511 -5.891 4.664
159 HG22 VAL 25 HG22 VAL 25 6.296 -4.534 3.836
160 HG23 VAL 25 HG23 VAL 25 7.262 -5.942 4.294
161 H CYS 26 H CYS 26 9.144 -5.197 7.503
162 HA CYS 26 HA CYS 26 11.197 -5.986 5.528
163 HB2 CYS 26 HB2 CYS 26 12.062 -5.056 7.721
164 HB3 CYS 26 HB3 CYS 26 11.204 -6.373 8.541
165 H GLY 27 H GLY 27 11.161 -8.038 4.678
166 HA2 GLY 27 HA2 GLY 27 8.987 -9.737 5.778
167 HA3 GLY 27 HA3 GLY 27 9.770 -9.848 4.181
168 HA PRO 28 HA PRO 28 11.341 -12.978 7.585
169 HB2 PRO 28 HB2 PRO 28 10.357 -14.830 5.482
170 HB3 PRO 28 HB3 PRO 28 10.279 -15.013 7.239
171 HG2 PRO 28 HG2 PRO 28 8.116 -14.430 5.880
172 HG3 PRO 28 HG3 PRO 28 8.494 -13.520 7.389
173 HD2 PRO 28 HD2 PRO 28 8.891 -12.670 4.519
174 HD3 PRO 28 HD3 PRO 28 8.186 -11.772 5.938
175 H ASN 29 H ASN 29 11.705 -12.689 4.020
176 HA ASN 29 HA ASN 29 13.955 -14.485 3.933
177 HB2 ASN 29 HB2 ASN 29 13.082 -12.372 1.858
178 HB3 ASN 29 HB3 ASN 29 14.234 -13.635 1.587
179 HD21 ASN 29 HD21 ASN 29 12.471 -13.728 -0.204
180 HD22 ASN 29 HD22 ASN 29 11.224 -14.935 0.123
181 H GLY 30 H GLY 30 13.713 -11.333 5.233
182 HA2 GLY 30 HA2 GLY 30 15.483 -9.999 5.994
183 HA3 GLY 30 HA3 GLY 30 16.660 -11.024 5.112
184 H PHE 31 H PHE 31 13.886 -9.869 3.499
185 HA PHE 31 HA PHE 31 15.319 -7.509 2.281
186 HB2 PHE 31 HB2 PHE 31 13.645 -9.623 0.805
187 HB3 PHE 31 HB3 PHE 31 14.115 -8.026 0.169
188 HD1 PHE 31 HD1 PHE 31 15.161 -11.466 0.666
189 HD2 PHE 31 HD2 PHE 31 16.630 -7.488 -0.187
190 HE1 PHE 31 HE1 PHE 31 17.235 -12.448 -0.174
191 HE2 PHE 31 HE2 PHE 31 18.768 -8.448 -0.988
192 HZ PHE 31 HZ PHE 31 19.020 -10.970 -1.064
193 H CYS 32 H CYS 32 14.112 -5.799 1.788
194 HA CYS 32 HA CYS 32 11.747 -5.428 3.372
195 HB2 CYS 32 HB2 CYS 32 13.650 -3.675 2.611
196 HB3 CYS 32 HB3 CYS 32 12.669 -3.623 1.127
197 H GLY 33 H GLY 33 9.701 -4.797 2.627
198 HA2 GLY 33 HA2 GLY 33 8.987 -5.461 -0.188
199 HA3 GLY 33 HA3 GLY 33 8.211 -6.423 1.075
Start of MODEL 3
1 H1 GLY 1 H1 GLY 1 3.626 1.899 -0.416
2 H2 GLY 1 H2 GLY 1 3.455 1.366 -1.970
3 H3 GLY 1 H3 GLY 1 2.829 0.482 -0.726
4 HA2 GLY 1 HA2 GLY 1 5.005 0.042 0.130
5 HA3 GLY 1 HA3 GLY 1 4.878 -0.532 -1.523
6 H CYS 2 H CYS 2 7.328 -0.324 -1.017
7 HA CYS 2 HA CYS 2 8.366 2.344 -0.963
8 HB2 CYS 2 HB2 CYS 2 9.440 -0.443 -1.145
9 HB3 CYS 2 HB3 CYS 2 10.487 0.885 -1.647
10 HA PRO 3 HA PRO 3 8.639 3.279 -5.241
11 HB2 PRO 3 HB2 PRO 3 10.975 4.663 -5.538
12 HB3 PRO 3 HB3 PRO 3 9.603 5.335 -4.586
13 HG2 PRO 3 HG2 PRO 3 12.004 3.795 -3.621
14 HG3 PRO 3 HG3 PRO 3 11.426 5.392 -3.046
15 HD2 PRO 3 HD2 PRO 3 10.824 3.122 -1.765
16 HD3 PRO 3 HD3 PRO 3 9.582 4.417 -1.914
17 H ARG 4 H ARG 4 9.898 2.971 -7.276
18 HA ARG 4 HA ARG 4 11.057 0.357 -7.299
19 HB2 ARG 4 HB2 ARG 4 10.855 2.536 -9.364
20 HB3 ARG 4 HB3 ARG 4 11.549 0.976 -9.741
21 HG2 ARG 4 HG2 ARG 4 8.675 1.486 -8.829
22 HG3 ARG 4 HG3 ARG 4 9.213 1.146 -10.492
23 HD2 ARG 4 HD2 ARG 4 9.498 -0.771 -8.119
24 HD3 ARG 4 HD3 ARG 4 8.310 -0.942 -9.453
25 HE ARG 4 HE ARG 4 10.691 -0.819 -10.776
26 HH11 ARG 4 HH11 ARG 4 9.669 -2.893 -8.097
27 HH12 ARG 4 HH12 ARG 4 10.661 -4.209 -8.647
28 HH21 ARG 4 HH21 ARG 4 11.927 -2.533 -11.385
29 HH22 ARG 4 HH22 ARG 4 11.933 -3.996 -10.470
30 HA PRO 5 HA PRO 5 15.225 1.589 -6.720
31 HB2 PRO 5 HB2 PRO 5 16.608 -0.588 -7.585
32 HB3 PRO 5 HB3 PRO 5 15.507 -0.719 -6.183
33 HG2 PRO 5 HG2 PRO 5 14.989 -1.410 -9.056
34 HG3 PRO 5 HG3 PRO 5 14.689 -2.406 -7.611
35 HD2 PRO 5 HD2 PRO 5 12.772 -0.887 -8.864
36 HD3 PRO 5 HD3 PRO 5 12.735 -1.208 -7.092
37 H ARG 6 H ARG 6 17.425 1.299 -8.149
38 HA ARG 6 HA ARG 6 17.202 3.093 -10.193
39 HB2 ARG 6 HB2 ARG 6 19.253 2.426 -8.945
40 HB3 ARG 6 HB3 ARG 6 19.375 1.167 -9.978
41 HG2 ARG 6 HG2 ARG 6 19.607 2.760 -11.773
42 HG3 ARG 6 HG3 ARG 6 19.680 3.940 -10.646
43 HD2 ARG 6 HD2 ARG 6 21.561 1.758 -10.782
44 HD3 ARG 6 HD3 ARG 6 21.867 3.251 -11.369
45 HE ARG 6 HE ARG 6 21.880 2.466 -8.634
46 HH11 ARG 6 HH11 ARG 6 22.702 3.960 -7.147
47 HH12 ARG 6 HH12 ARG 6 22.994 5.596 -7.635
48 HH21 ARG 6 HH21 ARG 6 21.920 5.106 -10.930
49 HH22 ARG 6 HH22 ARG 6 22.549 6.249 -9.791
50 H GLY 7 H GLY 7 17.124 -0.331 -10.472
51 HA2 GLY 7 HA2 GLY 7 16.420 -0.062 -13.335
52 HA3 GLY 7 HA3 GLY 7 17.828 -1.083 -12.922
53 H ASP 8 H ASP 8 17.110 -3.118 -13.284
54 HA ASP 8 HA ASP 8 14.538 -3.968 -12.092
55 HB2 ASP 8 HB2 ASP 8 14.908 -6.085 -13.204
56 HB3 ASP 8 HB3 ASP 8 15.168 -4.773 -14.368
57 H ASN 9 H ASN 9 17.110 -3.121 -10.683
58 HA ASN 9 HA ASN 9 18.439 -5.270 -9.488
59 HB2 ASN 9 HB2 ASN 9 17.732 -2.515 -8.453
60 HB3 ASN 9 HB3 ASN 9 18.714 -3.630 -7.518
61 HD21 ASN 9 HD21 ASN 9 19.804 -1.280 -8.140
62 HD22 ASN 9 HD22 ASN 9 21.003 -1.439 -9.378
63 HA PRO 10 HA PRO 10 15.629 -7.149 -6.661
64 HB2 PRO 10 HB2 PRO 10 17.347 -8.013 -4.708
65 HB3 PRO 10 HB3 PRO 10 17.354 -8.727 -6.360
66 HG2 PRO 10 HG2 PRO 10 19.030 -6.507 -5.212
67 HG3 PRO 10 HG3 PRO 10 19.605 -8.006 -6.003
68 HD2 PRO 10 HD2 PRO 10 19.421 -5.730 -7.416
69 HD3 PRO 10 HD3 PRO 10 18.819 -7.256 -8.147
70 HA PRO 11 HA PRO 11 14.603 -4.314 -3.444
71 HB2 PRO 11 HB2 PRO 11 13.745 -5.869 -1.354
72 HB3 PRO 11 HB3 PRO 11 12.798 -5.686 -2.857
73 HG2 PRO 11 HG2 PRO 11 14.760 -7.902 -2.130
74 HG3 PRO 11 HG3 PRO 11 13.038 -8.011 -2.701
75 HD2 PRO 11 HD2 PRO 11 15.050 -8.291 -4.396
76 HD3 PRO 11 HD3 PRO 11 13.575 -7.358 -4.851
77 H LEU 12 H LEU 12 15.328 -3.427 -1.422
78 HA LEU 12 HA LEU 12 18.090 -3.981 -0.778
79 HB2 LEU 12 HB2 LEU 12 17.843 -2.148 0.753
80 HB3 LEU 12 HB3 LEU 12 17.060 -1.728 -0.755
81 HG LEU 12 HG LEU 12 15.182 -2.930 1.140
82 HD11 LEU 12 HD11 LEU 12 15.159 -1.105 2.756
83 HD12 LEU 12 HD12 LEU 12 16.582 -0.358 1.971
84 HD13 LEU 12 HD13 LEU 12 16.741 -1.942 2.799
85 HD21 LEU 12 HD21 LEU 12 14.525 -1.618 -0.927
86 HD22 LEU 12 HD22 LEU 12 15.241 -0.164 -0.199
87 HD23 LEU 12 HD23 LEU 12 13.852 -0.920 0.590
88 H THR 13 H THR 13 18.930 -4.595 1.262
89 HA THR 13 HA THR 13 17.407 -6.744 2.475
90 HB THR 13 HB THR 13 19.673 -6.565 3.974
91 HG1 THR 13 HG1 THR 13 21.336 -5.722 2.724
92 HG21 THR 13 HG21 THR 13 19.515 -7.704 1.149
93 HG22 THR 13 HG22 THR 13 18.920 -8.485 2.599
94 HG23 THR 13 HG23 THR 13 20.656 -8.200 2.397
95 H CYS 14 H CYS 14 16.951 -6.901 4.753
96 HA CYS 14 HA CYS 14 17.280 -4.489 6.432
97 HB2 CYS 14 HB2 CYS 14 14.836 -4.505 7.020
98 HB3 CYS 14 HB3 CYS 14 15.102 -4.074 5.329
99 H SER 15 H SER 15 16.785 -5.017 8.654
100 HA SER 15 HA SER 15 16.638 -7.933 9.274
101 HB2 SER 15 HB2 SER 15 18.847 -7.714 9.808
102 HB3 SER 15 HB3 SER 15 18.732 -5.962 9.917
103 HG SER 15 HG SER 15 17.399 -7.411 11.890
104 H GLN 16 H GLN 16 15.333 -4.855 9.623
105 HA GLN 16 HA GLN 16 13.463 -5.820 11.704
106 HB2 GLN 16 HB2 GLN 16 13.791 -3.697 12.991
107 HB3 GLN 16 HB3 GLN 16 15.163 -4.788 13.081
108 HG2 GLN 16 HG2 GLN 16 16.373 -3.475 11.405
109 HG3 GLN 16 HG3 GLN 16 15.000 -2.372 11.210
110 HE21 GLN 16 HE21 GLN 16 17.225 -1.160 11.705
111 HE22 GLN 16 HE22 GLN 16 17.360 -0.621 13.349
112 H ASP 17 H ASP 17 11.592 -4.133 11.685
113 HA ASP 17 HA ASP 17 10.985 -3.630 8.917
114 HB2 ASP 17 HB2 ASP 17 8.894 -2.647 9.789
115 HB3 ASP 17 HB3 ASP 17 9.221 -4.221 10.526
116 H SER 18 H SER 18 12.264 -1.797 11.570
117 HA SER 18 HA SER 18 11.822 0.831 10.605
118 HB2 SER 18 HB2 SER 18 14.214 0.855 12.097
119 HB3 SER 18 HB3 SER 18 12.573 1.111 12.696
120 HG SER 18 HG SER 18 13.772 -0.640 13.751
121 H ASP 19 H ASP 19 13.957 -1.510 9.339
122 HA ASP 19 HA ASP 19 15.989 0.401 8.425
123 HB2 ASP 19 HB2 ASP 19 15.349 -2.483 7.623
124 HB3 ASP 19 HB3 ASP 19 16.706 -1.524 6.921
125 H CYS 20 H CYS 20 12.825 -0.357 7.564
126 HA CYS 20 HA CYS 20 13.230 0.320 4.679
127 HB2 CYS 20 HB2 CYS 20 10.963 -0.935 6.263
128 HB3 CYS 20 HB3 CYS 20 10.757 -0.428 4.621
129 H LEU 21 H LEU 21 11.496 1.693 3.729
130 HA LEU 21 HA LEU 21 11.240 4.165 5.269
131 HB2 LEU 21 HB2 LEU 21 9.988 3.313 2.615
132 HB3 LEU 21 HB3 LEU 21 9.962 4.954 3.262
133 HG LEU 21 HG LEU 21 12.524 3.514 2.514
134 HD11 LEU 21 HD11 LEU 21 10.865 5.522 0.948
135 HD12 LEU 21 HD12 LEU 21 11.120 3.819 0.528
136 HD13 LEU 21 HD13 LEU 21 12.490 4.910 0.497
137 HD21 LEU 21 HD21 LEU 21 13.414 5.840 2.632
138 HD22 LEU 21 HD22 LEU 21 12.818 5.248 4.186
139 HD23 LEU 21 HD23 LEU 21 11.852 6.399 3.210
140 H ALA 22 H ALA 22 9.182 5.071 5.799
141 HA ALA 22 HA ALA 22 7.423 3.324 7.113
142 HB1 ALA 22 HB1 ALA 22 7.579 5.753 7.693
143 HB2 ALA 22 HB2 ALA 22 6.862 6.157 6.118
144 HB3 ALA 22 HB3 ALA 22 5.908 5.279 7.334
145 H GLY 23 H GLY 23 5.744 2.064 6.356
146 HA2 GLY 23 HA2 GLY 23 3.840 1.717 4.956
147 HA3 GLY 23 HA3 GLY 23 4.573 2.745 3.701
148 H CYS 24 H CYS 24 7.110 0.937 4.842
149 HA CYS 24 HA CYS 24 6.587 -1.362 3.019
150 HB2 CYS 24 HB2 CYS 24 9.241 -0.068 3.666
151 HB3 CYS 24 HB3 CYS 24 8.955 -1.344 2.443
152 H VAL 25 H VAL 25 7.627 -3.390 3.803
153 HA VAL 25 HA VAL 25 8.147 -3.319 6.748
154 HB VAL 25 HB VAL 25 7.023 -5.494 6.972
155 HG11 VAL 25 HG11 VAL 25 5.733 -3.428 7.461
156 HG12 VAL 25 HG12 VAL 25 5.216 -3.378 5.745
157 HG13 VAL 25 HG13 VAL 25 4.695 -4.714 6.815
158 HG21 VAL 25 HG21 VAL 25 5.652 -6.448 5.234
159 HG22 VAL 25 HG22 VAL 25 6.034 -5.108 4.112
160 HG23 VAL 25 HG23 VAL 25 7.295 -6.274 4.608
161 H CYS 26 H CYS 26 9.249 -5.355 7.506
162 HA CYS 26 HA CYS 26 11.325 -6.115 5.485
163 HB2 CYS 26 HB2 CYS 26 12.056 -5.039 7.647
164 HB3 CYS 26 HB3 CYS 26 11.400 -6.429 8.560
165 H GLY 27 H GLY 27 11.096 -8.011 4.526
166 HA2 GLY 27 HA2 GLY 27 8.985 -9.810 5.516
167 HA3 GLY 27 HA3 GLY 27 9.912 -9.919 4.036
168 HA PRO 28 HA PRO 28 11.213 -13.045 7.290
169 HB2 PRO 28 HB2 PRO 28 10.474 -15.375 6.071
170 HB3 PRO 28 HB3 PRO 28 9.316 -14.359 7.008
171 HG2 PRO 28 HG2 PRO 28 9.772 -14.402 4.044
172 HG3 PRO 28 HG3 PRO 28 8.236 -14.561 4.937
173 HD2 PRO 28 HD2 PRO 28 9.050 -12.213 3.914
174 HD3 PRO 28 HD3 PRO 28 8.215 -12.261 5.508
175 H ASN 29 H ASN 29 11.905 -12.534 3.967
176 HA ASN 29 HA ASN 29 14.184 -14.431 3.913
177 HB2 ASN 29 HB2 ASN 29 13.126 -12.463 1.804
178 HB3 ASN 29 HB3 ASN 29 14.454 -13.605 1.608
179 HD21 ASN 29 HD21 ASN 29 12.233 -13.620 -0.052
180 HD22 ASN 29 HD22 ASN 29 11.376 -15.109 0.227
181 H GLY 30 H GLY 30 13.680 -11.423 5.278
182 HA2 GLY 30 HA2 GLY 30 15.241 -9.889 6.007
183 HA3 GLY 30 HA3 GLY 30 16.527 -10.821 5.200
184 H PHE 31 H PHE 31 13.781 -9.927 3.357
185 HA PHE 31 HA PHE 31 15.291 -7.641 2.107
186 HB2 PHE 31 HB2 PHE 31 13.441 -9.701 0.859
187 HB3 PHE 31 HB3 PHE 31 13.790 -8.140 0.097
188 HD1 PHE 31 HD1 PHE 31 14.521 -11.420 -0.103
189 HD2 PHE 31 HD2 PHE 31 16.610 -7.712 0.290
190 HE1 PHE 31 HE1 PHE 31 16.520 -12.470 -1.143
191 HE2 PHE 31 HE2 PHE 31 18.645 -8.748 -0.772
192 HZ PHE 31 HZ PHE 31 18.590 -11.124 -1.464
193 H CYS 32 H CYS 32 14.141 -5.797 1.624
194 HA CYS 32 HA CYS 32 11.832 -5.332 3.348
195 HB2 CYS 32 HB2 CYS 32 13.671 -3.656 2.561
196 HB3 CYS 32 HB3 CYS 32 12.770 -3.583 1.048
197 H GLY 33 H GLY 33 9.658 -4.902 2.664
198 HA2 GLY 33 HA2 GLY 33 8.926 -5.142 -0.139
199 HA3 GLY 33 HA3 GLY 33 8.459 -6.554 0.811
Start of MODEL 4
1 H1 GLY 1 H1 GLY 1 5.169 3.260 -2.731
2 H2 GLY 1 H2 GLY 1 4.185 2.452 -1.705
3 H3 GLY 1 H3 GLY 1 5.187 3.657 -1.124
4 HA2 GLY 1 HA2 GLY 1 5.911 1.428 -0.652
5 HA3 GLY 1 HA3 GLY 1 6.113 1.194 -2.382
6 H CYS 2 H CYS 2 8.388 0.783 -1.361
7 HA CYS 2 HA CYS 2 9.959 3.148 -0.700
8 HB2 CYS 2 HB2 CYS 2 10.397 0.208 -1.024
9 HB3 CYS 2 HB3 CYS 2 11.811 1.271 -0.941
10 HA PRO 3 HA PRO 3 10.925 4.263 -4.627
11 HB2 PRO 3 HB2 PRO 3 13.467 5.181 -4.791
12 HB3 PRO 3 HB3 PRO 3 12.212 5.952 -3.793
13 HG2 PRO 3 HG2 PRO 3 14.333 3.995 -2.856
14 HG3 PRO 3 HG3 PRO 3 13.932 5.637 -2.286
15 HD2 PRO 3 HD2 PRO 3 12.873 3.418 -1.092
16 HD3 PRO 3 HD3 PRO 3 11.926 4.929 -1.299
17 H ARG 4 H ARG 4 11.744 3.817 -6.672
18 HA ARG 4 HA ARG 4 13.282 1.427 -6.940
19 HB2 ARG 4 HB2 ARG 4 11.594 0.869 -8.773
20 HB3 ARG 4 HB3 ARG 4 11.274 0.446 -7.229
21 HG2 ARG 4 HG2 ARG 4 9.818 2.219 -6.972
22 HG3 ARG 4 HG3 ARG 4 10.266 2.858 -8.407
23 HD2 ARG 4 HD2 ARG 4 8.237 1.829 -8.801
24 HD3 ARG 4 HD3 ARG 4 9.357 0.834 -9.452
25 HE ARG 4 HE ARG 4 8.950 -0.028 -6.885
26 HH11 ARG 4 HH11 ARG 4 7.594 -1.780 -6.426
27 HH12 ARG 4 HH12 ARG 4 6.386 -2.264 -7.568
28 HH21 ARG 4 HH21 ARG 4 7.196 0.213 -9.904
29 HH22 ARG 4 HH22 ARG 4 6.159 -1.128 -9.551
30 HA PRO 5 HA PRO 5 14.746 4.861 -9.653
31 HB2 PRO 5 HB2 PRO 5 17.233 3.230 -9.358
32 HB3 PRO 5 HB3 PRO 5 17.033 5.009 -9.380
33 HG2 PRO 5 HG2 PRO 5 17.372 3.721 -7.073
34 HG3 PRO 5 HG3 PRO 5 16.257 5.110 -7.202
35 HD2 PRO 5 HD2 PRO 5 15.765 2.178 -7.085
36 HD3 PRO 5 HD3 PRO 5 14.872 3.543 -6.367
37 H ARG 6 H ARG 6 15.200 1.365 -10.040
38 HA ARG 6 HA ARG 6 15.115 1.816 -12.978
39 HB2 ARG 6 HB2 ARG 6 17.372 0.906 -11.982
40 HB3 ARG 6 HB3 ARG 6 16.502 -0.635 -11.888
41 HG2 ARG 6 HG2 ARG 6 17.026 -0.916 -14.088
42 HG3 ARG 6 HG3 ARG 6 15.949 0.440 -14.477
43 HD2 ARG 6 HD2 ARG 6 17.993 1.044 -15.396
44 HD3 ARG 6 HD3 ARG 6 17.744 2.041 -13.943
45 HE ARG 6 HE ARG 6 19.294 -0.358 -13.403
46 HH11 ARG 6 HH11 ARG 6 19.549 2.793 -14.868
47 HH12 ARG 6 HH12 ARG 6 21.260 2.959 -14.610
48 HH21 ARG 6 HH21 ARG 6 21.582 -0.149 -13.056
49 HH22 ARG 6 HH22 ARG 6 22.384 1.261 -13.662
50 H GLY 7 H GLY 7 14.456 -0.423 -10.262
51 HA2 GLY 7 HA2 GLY 7 12.439 -1.626 -9.901
52 HA3 GLY 7 HA3 GLY 7 11.904 -1.161 -11.524
53 H ASP 8 H ASP 8 15.067 -2.210 -11.701
54 HA ASP 8 HA ASP 8 14.263 -4.873 -12.728
55 HB2 ASP 8 HB2 ASP 8 16.704 -3.151 -13.223
56 HB3 ASP 8 HB3 ASP 8 16.514 -4.804 -13.837
57 H ASN 9 H ASN 9 15.827 -3.361 -10.091
58 HA ASN 9 HA ASN 9 17.862 -5.514 -9.750
59 HB2 ASN 9 HB2 ASN 9 17.270 -2.877 -8.277
60 HB3 ASN 9 HB3 ASN 9 18.530 -4.007 -7.763
61 HD21 ASN 9 HD21 ASN 9 18.407 -1.136 -9.020
62 HD22 ASN 9 HD22 ASN 9 19.679 -1.205 -10.255
63 HA PRO 10 HA PRO 10 15.442 -7.632 -6.615
64 HB2 PRO 10 HB2 PRO 10 17.352 -8.432 -4.818
65 HB3 PRO 10 HB3 PRO 10 17.074 -9.203 -6.387
66 HG2 PRO 10 HG2 PRO 10 19.203 -7.189 -5.668
67 HG3 PRO 10 HG3 PRO 10 19.295 -8.642 -6.621
68 HD2 PRO 10 HD2 PRO 10 19.113 -6.256 -7.809
69 HD3 PRO 10 HD3 PRO 10 18.347 -7.687 -8.485
70 HA PRO 11 HA PRO 11 14.644 -4.637 -3.510
71 HB2 PRO 11 HB2 PRO 11 13.784 -6.086 -1.394
72 HB3 PRO 11 HB3 PRO 11 12.761 -5.902 -2.850
73 HG2 PRO 11 HG2 PRO 11 14.654 -8.187 -2.133
74 HG3 PRO 11 HG3 PRO 11 12.897 -8.260 -2.690
75 HD2 PRO 11 HD2 PRO 11 14.890 -8.641 -4.421
76 HD3 PRO 11 HD3 PRO 11 13.448 -7.664 -4.900
77 H LEU 12 H LEU 12 15.444 -3.621 -1.653
78 HA LEU 12 HA LEU 12 18.196 -4.237 -0.945
79 HB2 LEU 12 HB2 LEU 12 18.031 -2.372 0.528
80 HB3 LEU 12 HB3 LEU 12 17.273 -1.913 -0.969
81 HG LEU 12 HG LEU 12 15.623 -2.748 1.416
82 HD11 LEU 12 HD11 LEU 12 17.093 -1.129 2.345
83 HD12 LEU 12 HD12 LEU 12 15.545 -0.311 1.984
84 HD13 LEU 12 HD13 LEU 12 16.945 -0.075 0.884
85 HD21 LEU 12 HD21 LEU 12 14.367 -2.563 -0.646
86 HD22 LEU 12 HD22 LEU 12 15.058 -0.967 -1.006
87 HD23 LEU 12 HD23 LEU 12 13.984 -1.163 0.409
88 H THR 13 H THR 13 18.981 -4.692 1.236
89 HA THR 13 HA THR 13 17.409 -6.776 2.493
90 HB THR 13 HB THR 13 19.300 -6.650 4.190
91 HG1 THR 13 HG1 THR 13 21.038 -5.420 3.715
92 HG21 THR 13 HG21 THR 13 19.271 -8.292 2.462
93 HG22 THR 13 HG22 THR 13 20.893 -7.620 2.495
94 HG23 THR 13 HG23 THR 13 19.771 -7.106 1.232
95 H CYS 14 H CYS 14 16.848 -6.978 4.644
96 HA CYS 14 HA CYS 14 16.879 -4.514 6.310
97 HB2 CYS 14 HB2 CYS 14 14.490 -4.700 6.816
98 HB3 CYS 14 HB3 CYS 14 14.644 -4.740 5.057
99 H SER 15 H SER 15 16.238 -5.063 8.619
100 HA SER 15 HA SER 15 16.445 -7.950 9.251
101 HB2 SER 15 HB2 SER 15 18.585 -7.562 9.911
102 HB3 SER 15 HB3 SER 15 18.382 -5.802 9.884
103 HG SER 15 HG SER 15 18.662 -6.553 12.010
104 H GLN 16 H GLN 16 15.458 -4.666 9.834
105 HA GLN 16 HA GLN 16 13.241 -5.717 11.529
106 HB2 GLN 16 HB2 GLN 16 13.331 -3.581 12.828
107 HB3 GLN 16 HB3 GLN 16 14.689 -4.650 13.092
108 HG2 GLN 16 HG2 GLN 16 16.048 -3.226 11.547
109 HG3 GLN 16 HG3 GLN 16 14.680 -2.111 11.428
110 HE21 GLN 16 HE21 GLN 16 17.551 -2.500 12.857
111 HE22 GLN 16 HE22 GLN 16 17.298 -1.705 14.412
112 H ASP 17 H ASP 17 11.362 -4.030 11.324
113 HA ASP 17 HA ASP 17 11.055 -3.365 8.553
114 HB2 ASP 17 HB2 ASP 17 8.860 -2.785 9.058
115 HB3 ASP 17 HB3 ASP 17 9.240 -4.086 10.199
116 H SER 18 H SER 18 12.156 -1.610 11.425
117 HA SER 18 HA SER 18 11.802 1.056 10.402
118 HB2 SER 18 HB2 SER 18 14.267 0.443 11.955
119 HB3 SER 18 HB3 SER 18 12.934 1.587 12.313
120 HG SER 18 HG SER 18 13.301 -0.560 13.583
121 H ASP 19 H ASP 19 13.926 -1.451 9.207
122 HA ASP 19 HA ASP 19 16.003 0.329 8.258
123 HB2 ASP 19 HB2 ASP 19 15.177 -2.476 7.423
124 HB3 ASP 19 HB3 ASP 19 16.615 -1.587 6.745
125 H CYS 20 H CYS 20 12.883 -0.702 7.191
126 HA CYS 20 HA CYS 20 13.344 0.375 4.390
127 HB2 CYS 20 HB2 CYS 20 10.725 -0.747 5.544
128 HB3 CYS 20 HB3 CYS 20 11.319 -0.750 3.878
129 H LEU 21 H LEU 21 11.336 1.708 3.611
130 HA LEU 21 HA LEU 21 11.255 4.032 5.370
131 HB2 LEU 21 HB2 LEU 21 9.920 3.522 2.740
132 HB3 LEU 21 HB3 LEU 21 9.982 5.089 3.558
133 HG LEU 21 HG LEU 21 12.363 3.695 2.287
134 HD11 LEU 21 HD11 LEU 21 12.296 5.663 0.737
135 HD12 LEU 21 HD12 LEU 21 10.874 6.274 1.608
136 HD13 LEU 21 HD13 LEU 21 10.751 4.752 0.691
137 HD21 LEU 21 HD21 LEU 21 12.101 6.318 3.786
138 HD22 LEU 21 HD22 LEU 21 13.530 5.904 2.789
139 HD23 LEU 21 HD23 LEU 21 13.147 4.932 4.246
140 H ALA 22 H ALA 22 9.187 5.096 5.934
141 HA ALA 22 HA ALA 22 7.322 3.284 7.216
142 HB1 ALA 22 HB1 ALA 22 7.518 5.709 7.979
143 HB2 ALA 22 HB2 ALA 22 6.982 6.279 6.403
144 HB3 ALA 22 HB3 ALA 22 5.861 5.403 7.475
145 H GLY 23 H GLY 23 5.631 2.129 6.425
146 HA2 GLY 23 HA2 GLY 23 3.792 1.788 4.781
147 HA3 GLY 23 HA3 GLY 23 4.700 2.704 3.612
148 H CYS 24 H CYS 24 7.146 1.016 4.795
149 HA CYS 24 HA CYS 24 6.750 -1.235 2.864
150 HB2 CYS 24 HB2 CYS 24 9.243 0.191 3.800
151 HB3 CYS 24 HB3 CYS 24 9.226 -1.242 2.710
152 H VAL 25 H VAL 25 7.841 -3.262 3.698
153 HA VAL 25 HA VAL 25 7.812 -3.326 6.736
154 HB VAL 25 HB VAL 25 6.842 -5.644 6.531
155 HG11 VAL 25 HG11 VAL 25 5.436 -3.510 6.960
156 HG12 VAL 25 HG12 VAL 25 4.938 -3.675 5.255
157 HG13 VAL 25 HG13 VAL 25 4.596 -4.978 6.426
158 HG21 VAL 25 HG21 VAL 25 7.437 -6.032 4.050
159 HG22 VAL 25 HG22 VAL 25 5.734 -6.263 4.372
160 HG23 VAL 25 HG23 VAL 25 6.263 -4.768 3.605
161 H CYS 26 H CYS 26 8.829 -5.562 7.435
162 HA CYS 26 HA CYS 26 11.039 -6.235 5.612
163 HB2 CYS 26 HB2 CYS 26 11.894 -4.958 7.595
164 HB3 CYS 26 HB3 CYS 26 11.096 -6.151 8.611
165 H GLY 27 H GLY 27 11.032 -8.374 4.919
166 HA2 GLY 27 HA2 GLY 27 9.187 -10.129 6.504
167 HA3 GLY 27 HA3 GLY 27 9.537 -10.196 4.747
168 HA PRO 28 HA PRO 28 11.900 -13.454 7.375
169 HB2 PRO 28 HB2 PRO 28 10.591 -15.201 5.382
170 HB3 PRO 28 HB3 PRO 28 10.819 -15.460 7.134
171 HG2 PRO 28 HG2 PRO 28 8.418 -14.855 6.209
172 HG3 PRO 28 HG3 PRO 28 9.053 -14.017 7.672
173 HD2 PRO 28 HD2 PRO 28 9.011 -13.068 4.814
174 HD3 PRO 28 HD3 PRO 28 8.448 -12.233 6.349
175 H ASN 29 H ASN 29 11.740 -12.654 3.921
176 HA ASN 29 HA ASN 29 13.992 -14.389 3.245
177 HB2 ASN 29 HB2 ASN 29 12.789 -12.044 1.655
178 HB3 ASN 29 HB3 ASN 29 13.986 -13.190 1.100
179 HD21 ASN 29 HD21 ASN 29 11.469 -12.659 -0.096
180 HD22 ASN 29 HD22 ASN 29 10.607 -14.164 -0.032
181 H GLY 30 H GLY 30 13.697 -11.518 5.098
182 HA2 GLY 30 HA2 GLY 30 15.416 -10.211 5.960
183 HA3 GLY 30 HA3 GLY 30 16.610 -11.082 4.994
184 H PHE 31 H PHE 31 13.849 -9.819 3.456
185 HA PHE 31 HA PHE 31 15.383 -7.470 2.336
186 HB2 PHE 31 HB2 PHE 31 13.468 -9.356 0.835
187 HB3 PHE 31 HB3 PHE 31 14.161 -7.836 0.202
188 HD1 PHE 31 HD1 PHE 31 14.538 -11.311 0.079
189 HD2 PHE 31 HD2 PHE 31 16.923 -7.760 0.498
190 HE1 PHE 31 HE1 PHE 31 16.508 -12.557 -0.710
191 HE2 PHE 31 HE2 PHE 31 18.892 -8.981 -0.270
192 HZ PHE 31 HZ PHE 31 18.666 -11.434 -0.953
193 H CYS 32 H CYS 32 14.317 -5.641 2.021
194 HA CYS 32 HA CYS 32 11.877 -5.090 3.539
195 HB2 CYS 32 HB2 CYS 32 13.512 -3.534 1.494
196 HB3 CYS 32 HB3 CYS 32 11.948 -2.936 2.149
197 H GLY 33 H GLY 33 9.884 -4.762 2.758
198 HA2 GLY 33 HA2 GLY 33 9.302 -5.513 -0.095
199 HA3 GLY 33 HA3 GLY 33 8.563 -6.477 1.199
Start of MODEL 5
1 H1 GLY 1 H1 GLY 1 5.931 4.964 1.367
2 H2 GLY 1 H2 GLY 1 5.600 5.418 -0.164
3 H3 GLY 1 H3 GLY 1 4.414 4.719 0.770
4 HA2 GLY 1 HA2 GLY 1 5.893 2.770 0.867
5 HA3 GLY 1 HA3 GLY 1 5.153 3.089 -0.721
6 H CYS 2 H CYS 2 7.413 1.557 -0.710
7 HA CYS 2 HA CYS 2 9.819 3.146 -0.834
8 HB2 CYS 2 HB2 CYS 2 9.092 0.265 -1.329
9 HB3 CYS 2 HB3 CYS 2 10.712 0.869 -1.741
10 HA PRO 3 HA PRO 3 9.205 4.123 -5.015
11 HB2 PRO 3 HB2 PRO 3 11.363 5.596 -5.626
12 HB3 PRO 3 HB3 PRO 3 10.171 6.120 -4.404
13 HG2 PRO 3 HG2 PRO 3 12.825 4.794 -3.919
14 HG3 PRO 3 HG3 PRO 3 12.120 6.282 -3.227
15 HD2 PRO 3 HD2 PRO 3 11.999 3.776 -2.025
16 HD3 PRO 3 HD3 PRO 3 10.810 5.103 -1.776
17 H ARG 4 H ARG 4 9.833 3.591 -7.156
18 HA ARG 4 HA ARG 4 12.091 1.671 -7.351
19 HB2 ARG 4 HB2 ARG 4 9.448 1.483 -8.811
20 HB3 ARG 4 HB3 ARG 4 10.777 0.340 -8.938
21 HG2 ARG 4 HG2 ARG 4 10.315 -0.076 -6.423
22 HG3 ARG 4 HG3 ARG 4 8.752 0.727 -6.760
23 HD2 ARG 4 HD2 ARG 4 9.855 -1.738 -8.251
24 HD3 ARG 4 HD3 ARG 4 8.603 -1.753 -6.995
25 HE ARG 4 HE ARG 4 7.736 0.062 -8.962
26 HH11 ARG 4 HH11 ARG 4 8.291 -3.416 -8.725
27 HH12 ARG 4 HH12 ARG 4 7.007 -3.777 -9.832
28 HH21 ARG 4 HH21 ARG 4 6.137 -0.476 -10.331
29 HH22 ARG 4 HH22 ARG 4 5.760 -2.131 -10.722
30 HA PRO 5 HA PRO 5 12.665 5.326 -10.216
31 HB2 PRO 5 HB2 PRO 5 15.433 4.356 -9.730
32 HB3 PRO 5 HB3 PRO 5 14.819 6.025 -9.899
33 HG2 PRO 5 HG2 PRO 5 15.362 5.018 -7.517
34 HG3 PRO 5 HG3 PRO 5 13.952 6.075 -7.758
35 HD2 PRO 5 HD2 PRO 5 14.203 3.115 -7.471
36 HD3 PRO 5 HD3 PRO 5 12.972 4.260 -6.842
37 H ARG 6 H ARG 6 14.354 2.160 -10.245
38 HA ARG 6 HA ARG 6 14.817 2.302 -13.133
39 HB2 ARG 6 HB2 ARG 6 16.295 1.066 -11.483
40 HB3 ARG 6 HB3 ARG 6 14.976 -0.103 -11.258
41 HG2 ARG 6 HG2 ARG 6 15.141 -0.724 -13.651
42 HG3 ARG 6 HG3 ARG 6 16.420 0.494 -13.875
43 HD2 ARG 6 HD2 ARG 6 16.605 -1.796 -11.845
44 HD3 ARG 6 HD3 ARG 6 17.228 -1.849 -13.478
45 HE ARG 6 HE ARG 6 18.381 -0.353 -11.255
46 HH11 ARG 6 HH11 ARG 6 18.309 -0.790 -14.755
47 HH12 ARG 6 HH12 ARG 6 19.823 0.055 -15.007
48 HH21 ARG 6 HH21 ARG 6 20.338 0.742 -11.640
49 HH22 ARG 6 HH22 ARG 6 20.924 0.893 -13.268
50 H GLY 7 H GLY 7 12.651 0.792 -10.745
51 HA2 GLY 7 HA2 GLY 7 10.357 0.313 -11.156
52 HA3 GLY 7 HA3 GLY 7 10.699 0.173 -12.902
53 H ASP 8 H ASP 8 13.013 -1.404 -12.786
54 HA ASP 8 HA ASP 8 11.921 -4.066 -12.060
55 HB2 ASP 8 HB2 ASP 8 14.355 -3.190 -13.640
56 HB3 ASP 8 HB3 ASP 8 13.950 -4.880 -13.323
57 H ASN 9 H ASN 9 13.373 -1.789 -10.314
58 HA ASN 9 HA ASN 9 15.860 -3.092 -9.642
59 HB2 ASN 9 HB2 ASN 9 15.834 -1.374 -7.730
60 HB3 ASN 9 HB3 ASN 9 15.750 -0.750 -9.378
61 HD21 ASN 9 HD21 ASN 9 14.127 -1.270 -6.333
62 HD22 ASN 9 HD22 ASN 9 12.723 -0.252 -6.655
63 HA PRO 10 HA PRO 10 14.418 -6.143 -6.715
64 HB2 PRO 10 HB2 PRO 10 16.751 -6.661 -5.431
65 HB3 PRO 10 HB3 PRO 10 16.465 -7.167 -7.103
66 HG2 PRO 10 HG2 PRO 10 18.001 -4.821 -6.129
67 HG3 PRO 10 HG3 PRO 10 18.381 -6.031 -7.361
68 HD2 PRO 10 HD2 PRO 10 17.365 -3.617 -8.046
69 HD3 PRO 10 HD3 PRO 10 16.938 -5.113 -8.919
70 HA PRO 11 HA PRO 11 13.923 -4.027 -2.853
71 HB2 PRO 11 HB2 PRO 11 13.772 -5.991 -1.032
72 HB3 PRO 11 HB3 PRO 11 12.480 -5.779 -2.217
73 HG2 PRO 11 HG2 PRO 11 14.849 -7.682 -2.295
74 HG3 PRO 11 HG3 PRO 11 13.087 -8.088 -2.570
75 HD2 PRO 11 HD2 PRO 11 14.772 -7.644 -4.635
76 HD3 PRO 11 HD3 PRO 11 13.062 -7.116 -4.711
77 H LEU 12 H LEU 12 14.963 -3.364 -0.964
78 HA LEU 12 HA LEU 12 17.892 -3.833 -0.828
79 HB2 LEU 12 HB2 LEU 12 17.800 -2.195 0.962
80 HB3 LEU 12 HB3 LEU 12 16.999 -1.542 -0.456
81 HG LEU 12 HG LEU 12 15.276 -2.760 1.640
82 HD11 LEU 12 HD11 LEU 12 16.681 -1.578 3.094
83 HD12 LEU 12 HD12 LEU 12 15.235 -0.585 2.845
84 HD13 LEU 12 HD13 LEU 12 16.752 -0.157 1.994
85 HD21 LEU 12 HD21 LEU 12 14.261 -1.883 -0.403
86 HD22 LEU 12 HD22 LEU 12 14.992 -0.285 -0.109
87 HD23 LEU 12 HD23 LEU 12 13.781 -0.919 1.016
88 H THR 13 H THR 13 18.884 -4.474 1.257
89 HA THR 13 HA THR 13 17.474 -6.708 2.480
90 HB THR 13 HB THR 13 19.421 -6.489 4.145
91 HG1 THR 13 HG1 THR 13 21.127 -5.230 3.468
92 HG21 THR 13 HG21 THR 13 19.378 -8.167 2.431
93 HG22 THR 13 HG22 THR 13 20.984 -7.443 2.401
94 HG23 THR 13 HG23 THR 13 19.776 -6.980 1.176
95 H CYS 14 H CYS 14 16.896 -6.937 4.675
96 HA CYS 14 HA CYS 14 16.974 -4.514 6.365
97 HB2 CYS 14 HB2 CYS 14 14.533 -4.543 6.836
98 HB3 CYS 14 HB3 CYS 14 14.786 -4.267 5.102
99 H SER 15 H SER 15 16.409 -5.104 8.691
100 HA SER 15 HA SER 15 16.297 -8.070 9.094
101 HB2 SER 15 HB2 SER 15 18.454 -7.838 9.778
102 HB3 SER 15 HB3 SER 15 18.298 -6.110 10.088
103 HG SER 15 HG SER 15 18.526 -7.524 11.993
104 H GLN 16 H GLN 16 15.363 -4.840 9.840
105 HA GLN 16 HA GLN 16 13.064 -5.958 11.374
106 HB2 GLN 16 HB2 GLN 16 13.163 -3.899 12.863
107 HB3 GLN 16 HB3 GLN 16 14.408 -5.100 13.146
108 HG2 GLN 16 HG2 GLN 16 16.012 -3.702 11.820
109 HG3 GLN 16 HG3 GLN 16 14.765 -2.436 11.655
110 HE21 GLN 16 HE21 GLN 16 17.434 -3.150 13.269
111 HE22 GLN 16 HE22 GLN 16 17.139 -2.447 14.848
112 H ASP 17 H ASP 17 11.226 -4.193 11.236
113 HA ASP 17 HA ASP 17 11.066 -3.328 8.499
114 HB2 ASP 17 HB2 ASP 17 8.880 -2.613 9.068
115 HB3 ASP 17 HB3 ASP 17 9.142 -4.070 10.016
116 H SER 18 H SER 18 12.073 -1.881 11.520
117 HA SER 18 HA SER 18 11.965 0.882 10.772
118 HB2 SER 18 HB2 SER 18 14.359 0.029 12.223
119 HB3 SER 18 HB3 SER 18 13.071 1.191 12.680
120 HG SER 18 HG SER 18 13.307 -1.052 13.803
121 H ASP 19 H ASP 19 14.052 -1.625 9.447
122 HA ASP 19 HA ASP 19 16.169 0.203 8.586
123 HB2 ASP 19 HB2 ASP 19 15.376 -2.606 7.749
124 HB3 ASP 19 HB3 ASP 19 16.827 -1.726 7.101
125 H CYS 20 H CYS 20 13.019 -0.623 7.533
126 HA CYS 20 HA CYS 20 13.556 0.147 4.671
127 HB2 CYS 20 HB2 CYS 20 11.023 -0.786 6.114
128 HB3 CYS 20 HB3 CYS 20 11.126 -0.342 4.425
129 H LEU 21 H LEU 21 11.685 1.475 3.724
130 HA LEU 21 HA LEU 21 11.735 4.066 5.104
131 HB2 LEU 21 HB2 LEU 21 10.644 3.235 2.426
132 HB3 LEU 21 HB3 LEU 21 10.684 4.887 2.985
133 HG LEU 21 HG LEU 21 13.164 3.251 2.298
134 HD11 LEU 21 HD11 LEU 21 11.844 5.584 0.858
135 HD12 LEU 21 HD12 LEU 21 11.777 3.909 0.317
136 HD13 LEU 21 HD13 LEU 21 13.339 4.736 0.351
137 HD21 LEU 21 HD21 LEU 21 12.805 6.133 3.182
138 HD22 LEU 21 HD22 LEU 21 14.309 5.499 2.481
139 HD23 LEU 21 HD23 LEU 21 13.698 4.853 4.033
140 H ALA 22 H ALA 22 9.659 5.309 5.234
141 HA ALA 22 HA ALA 22 7.693 3.839 6.701
142 HB1 ALA 22 HB1 ALA 22 7.943 6.336 7.043
143 HB2 ALA 22 HB2 ALA 22 7.518 6.653 5.365
144 HB3 ALA 22 HB3 ALA 22 6.285 6.009 6.485
145 H GLY 23 H GLY 23 5.758 2.878 6.170
146 HA2 GLY 23 HA2 GLY 23 3.961 2.223 4.690
147 HA3 GLY 23 HA3 GLY 23 4.809 2.995 3.347
148 H CYS 24 H CYS 24 7.242 1.250 4.652
149 HA CYS 24 HA CYS 24 6.650 -1.113 2.903
150 HB2 CYS 24 HB2 CYS 24 9.312 0.051 3.702
151 HB3 CYS 24 HB3 CYS 24 9.004 -1.175 2.464
152 H VAL 25 H VAL 25 7.693 -3.115 3.734
153 HA VAL 25 HA VAL 25 7.951 -3.067 6.763
154 HB VAL 25 HB VAL 25 6.789 -5.306 6.765
155 HG11 VAL 25 HG11 VAL 25 5.192 -2.884 5.813
156 HG12 VAL 25 HG12 VAL 25 4.427 -4.378 6.392
157 HG13 VAL 25 HG13 VAL 25 5.466 -3.446 7.507
158 HG21 VAL 25 HG21 VAL 25 7.092 -5.821 4.307
159 HG22 VAL 25 HG22 VAL 25 5.426 -5.899 4.760
160 HG23 VAL 25 HG23 VAL 25 5.966 -4.486 3.874
161 H CYS 26 H CYS 26 8.899 -5.259 7.445
162 HA CYS 26 HA CYS 26 10.946 -6.079 5.463
163 HB2 CYS 26 HB2 CYS 26 11.831 -5.010 7.585
164 HB3 CYS 26 HB3 CYS 26 11.099 -6.380 8.482
165 H GLY 27 H GLY 27 11.374 -8.379 5.220
166 HA2 GLY 27 HA2 GLY 27 9.210 -10.018 6.511
167 HA3 GLY 27 HA3 GLY 27 9.614 -10.126 4.777
168 HA PRO 28 HA PRO 28 12.060 -13.163 7.661
169 HB2 PRO 28 HB2 PRO 28 10.653 -15.102 5.877
170 HB3 PRO 28 HB3 PRO 28 11.025 -15.229 7.603
171 HG2 PRO 28 HG2 PRO 28 8.556 -14.720 6.854
172 HG3 PRO 28 HG3 PRO 28 9.280 -13.767 8.184
173 HD2 PRO 28 HD2 PRO 28 8.981 -13.041 5.263
174 HD3 PRO 28 HD3 PRO 28 8.571 -12.085 6.788
175 H ASN 29 H ASN 29 11.723 -12.727 4.158
176 HA ASN 29 HA ASN 29 13.937 -14.425 3.419
177 HB2 ASN 29 HB2 ASN 29 12.112 -13.412 1.891
178 HB3 ASN 29 HB3 ASN 29 13.053 -11.892 1.931
179 HD21 ASN 29 HD21 ASN 29 13.795 -11.818 -0.171
180 HD22 ASN 29 HD22 ASN 29 14.800 -13.054 -0.930
181 H GLY 30 H GLY 30 13.711 -11.335 5.077
182 HA2 GLY 30 HA2 GLY 30 15.495 -10.123 5.971
183 HA3 GLY 30 HA3 GLY 30 16.680 -11.098 5.072
184 H PHE 31 H PHE 31 14.001 -9.844 3.410
185 HA PHE 31 HA PHE 31 15.435 -7.383 2.376
186 HB2 PHE 31 HB2 PHE 31 14.133 -9.601 0.692
187 HB3 PHE 31 HB3 PHE 31 14.475 -7.956 0.123
188 HD1 PHE 31 HD1 PHE 31 16.029 -11.174 1.188
189 HD2 PHE 31 HD2 PHE 31 16.764 -7.251 -0.480
190 HE1 PHE 31 HE1 PHE 31 18.292 -11.902 0.589
191 HE2 PHE 31 HE2 PHE 31 19.065 -7.946 -1.064
192 HZ PHE 31 HZ PHE 31 19.811 -10.339 -0.585
193 H CYS 32 H CYS 32 14.097 -5.774 1.753
194 HA CYS 32 HA CYS 32 11.715 -5.500 3.326
195 HB2 CYS 32 HB2 CYS 32 13.569 -3.716 2.495
196 HB3 CYS 32 HB3 CYS 32 12.548 -3.673 1.061
197 H GLY 33 H GLY 33 9.661 -4.966 2.694
198 HA2 GLY 33 HA2 GLY 33 8.847 -5.624 -0.121
199 HA3 GLY 33 HA3 GLY 33 8.151 -6.603 1.162
Start of MODEL 6
1 H1 GLY 1 H1 GLY 1 3.418 2.204 -1.867
2 H2 GLY 1 H2 GLY 1 2.739 1.953 -0.407
3 H3 GLY 1 H3 GLY 1 3.927 3.108 -0.570
4 HA2 GLY 1 HA2 GLY 1 4.608 1.059 0.491
5 HA3 GLY 1 HA3 GLY 1 4.365 0.261 -1.086
6 H CYS 2 H CYS 2 6.739 -0.208 -0.958
7 HA CYS 2 HA CYS 2 8.588 1.987 -0.986
8 HB2 CYS 2 HB2 CYS 2 9.102 -0.801 -2.027
9 HB3 CYS 2 HB3 CYS 2 10.274 0.284 -1.251
10 HA PRO 3 HA PRO 3 8.464 2.820 -5.232
11 HB2 PRO 3 HB2 PRO 3 10.981 3.580 -5.975
12 HB3 PRO 3 HB3 PRO 3 9.910 4.552 -4.925
13 HG2 PRO 3 HG2 PRO 3 12.158 2.730 -4.080
14 HG3 PRO 3 HG3 PRO 3 11.807 4.438 -3.652
15 HD2 PRO 3 HD2 PRO 3 11.079 2.314 -2.077
16 HD3 PRO 3 HD3 PRO 3 10.123 3.840 -2.195
17 H ARG 4 H ARG 4 8.522 1.624 -7.179
18 HA ARG 4 HA ARG 4 9.303 -1.112 -6.756
19 HB2 ARG 4 HB2 ARG 4 8.433 -1.583 -9.054
20 HB3 ARG 4 HB3 ARG 4 7.297 -0.678 -8.006
21 HG2 ARG 4 HG2 ARG 4 7.658 1.385 -9.219
22 HG3 ARG 4 HG3 ARG 4 8.967 0.631 -10.156
23 HD2 ARG 4 HD2 ARG 4 7.025 0.558 -11.581
24 HD3 ARG 4 HD3 ARG 4 7.333 -1.067 -11.009
25 HE ARG 4 HE ARG 4 5.452 0.464 -9.337
26 HH11 ARG 4 HH11 ARG 4 5.639 -1.728 -12.038
27 HH12 ARG 4 HH12 ARG 4 4.002 -2.287 -11.892
28 HH21 ARG 4 HH21 ARG 4 3.388 -0.189 -9.226
29 HH22 ARG 4 HH22 ARG 4 2.745 -1.395 -10.282
30 HA PRO 5 HA PRO 5 13.270 -0.806 -8.698
31 HB2 PRO 5 HB2 PRO 5 13.900 -3.399 -9.117
32 HB3 PRO 5 HB3 PRO 5 13.607 -2.825 -7.446
33 HG2 PRO 5 HG2 PRO 5 11.692 -4.281 -9.299
34 HG3 PRO 5 HG3 PRO 5 12.101 -4.601 -7.576
35 HD2 PRO 5 HD2 PRO 5 9.962 -3.188 -8.353
36 HD3 PRO 5 HD3 PRO 5 10.781 -2.992 -6.796
37 H ARG 6 H ARG 6 14.440 -1.373 -10.842
38 HA ARG 6 HA ARG 6 12.486 -1.307 -13.023
39 HB2 ARG 6 HB2 ARG 6 14.521 0.068 -13.034
40 HB3 ARG 6 HB3 ARG 6 15.497 -1.438 -13.233
41 HG2 ARG 6 HG2 ARG 6 14.345 -1.947 -15.397
42 HG3 ARG 6 HG3 ARG 6 13.334 -0.493 -15.255
43 HD2 ARG 6 HD2 ARG 6 16.367 -0.376 -15.222
44 HD3 ARG 6 HD3 ARG 6 15.354 -0.208 -16.652
45 HE ARG 6 HE ARG 6 14.394 1.662 -14.801
46 HH11 ARG 6 HH11 ARG 6 17.229 1.087 -16.831
47 HH12 ARG 6 HH12 ARG 6 17.626 2.803 -17.006
48 HH21 ARG 6 HH21 ARG 6 14.969 3.830 -15.058
49 HH22 ARG 6 HH22 ARG 6 16.314 4.311 -16.017
50 H GLY 7 H GLY 7 14.288 -3.556 -11.255
51 HA2 GLY 7 HA2 GLY 7 13.797 -5.868 -11.253
52 HA3 GLY 7 HA3 GLY 7 13.306 -5.735 -12.941
53 H ASP 8 H ASP 8 16.243 -4.180 -12.076
54 HA ASP 8 HA ASP 8 17.820 -6.277 -13.394
55 HB2 ASP 8 HB2 ASP 8 18.228 -3.320 -13.087
56 HB3 ASP 8 HB3 ASP 8 19.522 -4.427 -13.530
57 H ASN 9 H ASN 9 17.073 -5.047 -10.332
58 HA ASN 9 HA ASN 9 19.598 -6.128 -9.131
59 HB2 ASN 9 HB2 ASN 9 18.429 -3.316 -8.655
60 HB3 ASN 9 HB3 ASN 9 19.593 -4.085 -7.535
61 HD21 ASN 9 HD21 ASN 9 19.256 -2.235 -10.467
62 HD22 ASN 9 HD22 ASN 9 20.974 -2.272 -10.869
63 HA PRO 10 HA PRO 10 16.488 -7.802 -6.384
64 HB2 PRO 10 HB2 PRO 10 17.958 -8.269 -4.093
65 HB3 PRO 10 HB3 PRO 10 18.145 -9.242 -5.576
66 HG2 PRO 10 HG2 PRO 10 19.828 -6.973 -4.616
67 HG3 PRO 10 HG3 PRO 10 20.292 -8.536 -5.289
68 HD2 PRO 10 HD2 PRO 10 20.291 -6.319 -6.831
69 HD3 PRO 10 HD3 PRO 10 19.857 -7.918 -7.463
70 HA PRO 11 HA PRO 11 15.117 -4.423 -3.819
71 HB2 PRO 11 HB2 PRO 11 13.761 -5.603 -1.846
72 HB3 PRO 11 HB3 PRO 11 13.124 -5.610 -3.513
73 HG2 PRO 11 HG2 PRO 11 14.707 -7.765 -2.081
74 HG3 PRO 11 HG3 PRO 11 13.148 -7.935 -3.028
75 HD2 PRO 11 HD2 PRO 11 15.496 -8.480 -4.114
76 HD3 PRO 11 HD3 PRO 11 14.228 -7.750 -5.085
77 H LEU 12 H LEU 12 15.502 -3.372 -1.662
78 HA LEU 12 HA LEU 12 18.200 -3.914 -0.753
79 HB2 LEU 12 HB2 LEU 12 17.832 -2.194 0.888
80 HB3 LEU 12 HB3 LEU 12 17.200 -1.702 -0.651
81 HG LEU 12 HG LEU 12 14.944 -2.691 0.762
82 HD11 LEU 12 HD11 LEU 12 16.564 -0.801 2.494
83 HD12 LEU 12 HD12 LEU 12 16.246 -2.484 2.844
84 HD13 LEU 12 HD13 LEU 12 14.905 -1.386 2.747
85 HD21 LEU 12 HD21 LEU 12 15.106 -0.896 -0.947
86 HD22 LEU 12 HD22 LEU 12 15.963 0.151 0.187
87 HD23 LEU 12 HD23 LEU 12 14.293 -0.340 0.549
88 H THR 13 H THR 13 18.989 -4.611 1.241
89 HA THR 13 HA THR 13 17.349 -6.712 2.481
90 HB THR 13 HB THR 13 19.431 -6.861 3.911
91 HG1 THR 13 HG1 THR 13 21.260 -5.847 3.076
92 HG21 THR 13 HG21 THR 13 20.502 -8.189 2.190
93 HG22 THR 13 HG22 THR 13 19.650 -7.250 0.901
94 HG23 THR 13 HG23 THR 13 18.739 -8.318 2.007
95 H CYS 14 H CYS 14 16.953 -6.939 4.687
96 HA CYS 14 HA CYS 14 17.304 -4.536 6.383
97 HB2 CYS 14 HB2 CYS 14 14.815 -4.485 6.926
98 HB3 CYS 14 HB3 CYS 14 15.141 -4.092 5.216
99 H SER 15 H SER 15 16.654 -5.012 8.706
100 HA SER 15 HA SER 15 16.412 -7.953 9.184
101 HB2 SER 15 HB2 SER 15 18.524 -7.842 9.887
102 HB3 SER 15 HB3 SER 15 18.514 -6.094 10.038
103 HG SER 15 HG SER 15 17.001 -7.555 11.864
104 H GLN 16 H GLN 16 15.150 -4.915 9.543
105 HA GLN 16 HA GLN 16 13.096 -5.949 11.367
106 HB2 GLN 16 HB2 GLN 16 13.199 -3.923 12.833
107 HB3 GLN 16 HB3 GLN 16 14.594 -4.986 12.960
108 HG2 GLN 16 HG2 GLN 16 15.846 -3.433 11.457
109 HG3 GLN 16 HG3 GLN 16 14.519 -2.253 11.531
110 HE21 GLN 16 HE21 GLN 16 16.999 -1.515 12.373
111 HE22 GLN 16 HE22 GLN 16 17.056 -1.356 14.138
112 H ASP 17 H ASP 17 11.146 -4.475 11.219
113 HA ASP 17 HA ASP 17 10.632 -3.491 8.624
114 HB2 ASP 17 HB2 ASP 17 9.385 -2.926 11.327
115 HB3 ASP 17 HB3 ASP 17 8.765 -2.213 9.814
116 H SER 18 H SER 18 11.977 -1.875 11.501
117 HA SER 18 HA SER 18 11.593 0.815 10.661
118 HB2 SER 18 HB2 SER 18 14.004 0.494 12.158
119 HB3 SER 18 HB3 SER 18 12.420 1.135 12.674
120 HG SER 18 HG SER 18 13.350 -0.926 13.704
121 H ASP 19 H ASP 19 13.843 -1.558 9.429
122 HA ASP 19 HA ASP 19 15.940 0.343 8.699
123 HB2 ASP 19 HB2 ASP 19 15.294 -2.445 7.730
124 HB3 ASP 19 HB3 ASP 19 16.741 -1.529 7.159
125 H CYS 20 H CYS 20 12.923 -0.493 7.503
126 HA CYS 20 HA CYS 20 13.581 0.478 4.702
127 HB2 CYS 20 HB2 CYS 20 11.048 -0.741 5.909
128 HB3 CYS 20 HB3 CYS 20 11.241 -0.205 4.245
129 H LEU 21 H LEU 21 11.618 1.629 3.678
130 HA LEU 21 HA LEU 21 11.448 4.236 4.920
131 HB2 LEU 21 HB2 LEU 21 10.249 3.104 2.418
132 HB3 LEU 21 HB3 LEU 21 10.159 4.794 2.855
133 HG LEU 21 HG LEU 21 12.775 3.310 2.152
134 HD11 LEU 21 HD11 LEU 21 12.622 4.549 0.014
135 HD12 LEU 21 HD12 LEU 21 11.120 5.338 0.563
136 HD13 LEU 21 HD13 LEU 21 11.174 3.571 0.242
137 HD21 LEU 21 HD21 LEU 21 13.712 5.630 2.049
138 HD22 LEU 21 HD22 LEU 21 13.095 5.248 3.680
139 HD23 LEU 21 HD23 LEU 21 12.155 6.291 2.572
140 H ALA 22 H ALA 22 9.373 5.329 5.229
141 HA ALA 22 HA ALA 22 7.429 3.842 6.736
142 HB1 ALA 22 HB1 ALA 22 5.965 5.900 6.530
143 HB2 ALA 22 HB2 ALA 22 7.631 6.357 6.984
144 HB3 ALA 22 HB3 ALA 22 7.086 6.546 5.314
145 H GLY 23 H GLY 23 5.510 2.760 6.089
146 HA2 GLY 23 HA2 GLY 23 3.864 1.988 4.470
147 HA3 GLY 23 HA3 GLY 23 4.843 2.780 3.163
148 H CYS 24 H CYS 24 7.098 1.102 4.871
149 HA CYS 24 HA CYS 24 6.796 -1.323 3.114
150 HB2 CYS 24 HB2 CYS 24 9.241 0.242 4.025
151 HB3 CYS 24 HB3 CYS 24 9.297 -1.282 3.094
152 H VAL 25 H VAL 25 7.718 -3.224 4.012
153 HA VAL 25 HA VAL 25 8.137 -3.157 7.024
154 HB VAL 25 HB VAL 25 7.021 -5.456 7.088
155 HG11 VAL 25 HG11 VAL 25 4.694 -4.659 7.044
156 HG12 VAL 25 HG12 VAL 25 5.762 -3.487 7.853
157 HG13 VAL 25 HG13 VAL 25 5.201 -3.177 6.238
158 HG21 VAL 25 HG21 VAL 25 5.909 -4.618 4.314
159 HG22 VAL 25 HG22 VAL 25 7.243 -5.787 4.543
160 HG23 VAL 25 HG23 VAL 25 5.612 -6.153 5.177
161 H CYS 26 H CYS 26 9.178 -5.370 7.608
162 HA CYS 26 HA CYS 26 11.097 -6.051 5.452
163 HB2 CYS 26 HB2 CYS 26 12.122 -5.006 7.529
164 HB3 CYS 26 HB3 CYS 26 11.454 -6.386 8.427
165 H GLY 27 H GLY 27 11.199 -8.222 4.779
166 HA2 GLY 27 HA2 GLY 27 9.106 -9.877 6.117
167 HA3 GLY 27 HA3 GLY 27 9.733 -10.007 4.437
168 HA PRO 28 HA PRO 28 11.540 -13.253 7.485
169 HB2 PRO 28 HB2 PRO 28 10.417 -15.009 5.358
170 HB3 PRO 28 HB3 PRO 28 10.466 -15.276 7.130
171 HG2 PRO 28 HG2 PRO 28 8.201 -14.590 6.003
172 HG3 PRO 28 HG3 PRO 28 8.715 -13.767 7.471
173 HD2 PRO 28 HD2 PRO 28 8.948 -12.845 4.607
174 HD3 PRO 28 HD3 PRO 28 8.285 -11.961 6.086
175 H ASN 29 H ASN 29 11.774 -12.658 3.970
176 HA ASN 29 HA ASN 29 14.087 -14.438 3.670
177 HB2 ASN 29 HB2 ASN 29 12.923 -12.361 1.740
178 HB3 ASN 29 HB3 ASN 29 14.180 -13.543 1.427
179 HD21 ASN 29 HD21 ASN 29 11.219 -12.991 0.648
180 HD22 ASN 29 HD22 ASN 29 10.557 -14.601 0.663
181 H GLY 30 H GLY 30 13.680 -11.395 5.180
182 HA2 GLY 30 HA2 GLY 30 15.393 -10.002 5.942
183 HA3 GLY 30 HA3 GLY 30 16.609 -10.960 5.088
184 H PHE 31 H PHE 31 13.880 -9.868 3.360
185 HA PHE 31 HA PHE 31 15.324 -7.478 2.160
186 HB2 PHE 31 HB2 PHE 31 13.501 -9.523 0.774
187 HB3 PHE 31 HB3 PHE 31 14.098 -8.007 0.064
188 HD1 PHE 31 HD1 PHE 31 14.697 -11.501 0.352
189 HD2 PHE 31 HD2 PHE 31 16.796 -7.737 -0.021
190 HE1 PHE 31 HE1 PHE 31 16.641 -12.719 -0.453
191 HE2 PHE 31 HE2 PHE 31 18.815 -8.970 -0.826
192 HZ PHE 31 HZ PHE 31 18.665 -11.525 -1.095
193 H CYS 32 H CYS 32 14.069 -5.813 1.646
194 HA CYS 32 HA CYS 32 11.779 -5.375 3.307
195 HB2 CYS 32 HB2 CYS 32 13.656 -3.670 2.362
196 HB3 CYS 32 HB3 CYS 32 12.570 -3.636 0.944
197 H GLY 33 H GLY 33 9.661 -4.907 2.706
198 HA2 GLY 33 HA2 GLY 33 8.879 -5.638 -0.084
199 HA3 GLY 33 HA3 GLY 33 8.139 -6.570 1.218
Start of MODEL 7
1 H1 GLY 1 H1 GLY 1 6.189 4.507 -0.839
2 H2 GLY 1 H2 GLY 1 5.158 4.008 0.322
3 H3 GLY 1 H3 GLY 1 6.660 4.578 0.749
4 HA2 GLY 1 HA2 GLY 1 6.405 2.193 0.852
5 HA3 GLY 1 HA3 GLY 1 6.251 2.217 -0.915
6 H CYS 2 H CYS 2 8.224 0.885 -0.871
7 HA CYS 2 HA CYS 2 10.729 1.880 0.047
8 HB2 CYS 2 HB2 CYS 2 9.914 -0.227 -1.959
9 HB3 CYS 2 HB3 CYS 2 11.614 0.134 -1.697
10 HA PRO 3 HA PRO 3 11.747 4.649 -3.027
11 HB2 PRO 3 HB2 PRO 3 14.457 4.618 -3.362
12 HB3 PRO 3 HB3 PRO 3 13.647 5.199 -1.871
13 HG2 PRO 3 HG2 PRO 3 14.824 2.455 -2.415
14 HG3 PRO 3 HG3 PRO 3 15.137 3.585 -1.068
15 HD2 PRO 3 HD2 PRO 3 13.346 1.530 -0.910
16 HD3 PRO 3 HD3 PRO 3 13.087 3.106 -0.092
17 H ARG 4 H ARG 4 12.071 4.953 -5.238
18 HA ARG 4 HA ARG 4 12.792 2.592 -6.859
19 HB2 ARG 4 HB2 ARG 4 10.886 3.286 -8.403
20 HB3 ARG 4 HB3 ARG 4 10.587 2.354 -6.932
21 HG2 ARG 4 HG2 ARG 4 9.722 4.236 -5.784
22 HG3 ARG 4 HG3 ARG 4 10.163 5.305 -7.110
23 HD2 ARG 4 HD2 ARG 4 8.053 3.030 -7.300
24 HD3 ARG 4 HD3 ARG 4 7.715 4.777 -7.129
25 HE ARG 4 HE ARG 4 9.309 4.387 -9.424
26 HH11 ARG 4 HH11 ARG 4 6.095 3.478 -8.318
27 HH12 ARG 4 HH12 ARG 4 5.457 3.357 -9.975
28 HH21 ARG 4 HH21 ARG 4 8.470 4.214 -11.525
29 HH22 ARG 4 HH22 ARG 4 6.786 3.792 -11.786
30 HA PRO 5 HA PRO 5 14.921 6.417 -8.484
31 HB2 PRO 5 HB2 PRO 5 17.408 5.477 -8.635
32 HB3 PRO 5 HB3 PRO 5 16.705 6.042 -7.080
33 HG2 PRO 5 HG2 PRO 5 16.859 3.199 -8.088
34 HG3 PRO 5 HG3 PRO 5 17.418 3.892 -6.540
35 HD2 PRO 5 HD2 PRO 5 15.073 2.753 -6.731
36 HD3 PRO 5 HD3 PRO 5 15.350 4.212 -5.762
37 H ARG 6 H ARG 6 14.746 3.075 -9.523
38 HA ARG 6 HA ARG 6 15.247 4.016 -12.333
39 HB2 ARG 6 HB2 ARG 6 16.868 2.204 -11.284
40 HB3 ARG 6 HB3 ARG 6 15.517 1.093 -11.605
41 HG2 ARG 6 HG2 ARG 6 16.864 0.939 -13.516
42 HG3 ARG 6 HG3 ARG 6 15.607 2.064 -14.039
43 HD2 ARG 6 HD2 ARG 6 17.721 3.017 -14.753
44 HD3 ARG 6 HD3 ARG 6 17.026 4.039 -13.457
45 HE ARG 6 HE ARG 6 18.828 3.436 -12.042
46 HH11 ARG 6 HH11 ARG 6 18.916 1.357 -14.950
47 HH12 ARG 6 HH12 ARG 6 20.532 0.861 -14.634
48 HH21 ARG 6 HH21 ARG 6 20.946 2.745 -11.753
49 HH22 ARG 6 HH22 ARG 6 21.684 1.575 -12.866
50 H GLY 7 H GLY 7 13.493 1.747 -10.174
51 HA2 GLY 7 HA2 GLY 7 11.050 1.770 -10.224
52 HA3 GLY 7 HA3 GLY 7 11.125 1.903 -11.980
53 H ASP 8 H ASP 8 13.472 -0.035 -12.101
54 HA ASP 8 HA ASP 8 11.960 -2.533 -11.497
55 HB2 ASP 8 HB2 ASP 8 13.177 -3.602 -13.279
56 HB3 ASP 8 HB3 ASP 8 12.566 -2.085 -13.941
57 H ASN 9 H ASN 9 13.923 -0.684 -10.003
58 HA ASN 9 HA ASN 9 16.291 -2.335 -9.693
59 HB2 ASN 9 HB2 ASN 9 16.759 -0.651 -7.826
60 HB3 ASN 9 HB3 ASN 9 16.416 0.058 -9.430
61 HD21 ASN 9 HD21 ASN 9 15.260 -0.587 -6.187
62 HD22 ASN 9 HD22 ASN 9 13.925 0.565 -6.171
63 HA PRO 10 HA PRO 10 14.581 -5.309 -6.953
64 HB2 PRO 10 HB2 PRO 10 16.814 -6.265 -5.733
65 HB3 PRO 10 HB3 PRO 10 16.456 -6.534 -7.435
66 HG2 PRO 10 HG2 PRO 10 18.277 -4.510 -6.252
67 HG3 PRO 10 HG3 PRO 10 18.541 -5.653 -7.603
68 HD2 PRO 10 HD2 PRO 10 17.828 -3.072 -8.085
69 HD3 PRO 10 HD3 PRO 10 17.204 -4.421 -9.066
70 HA PRO 11 HA PRO 11 14.167 -3.623 -2.889
71 HB2 PRO 11 HB2 PRO 11 13.763 -5.734 -1.299
72 HB3 PRO 11 HB3 PRO 11 12.553 -5.247 -2.494
73 HG2 PRO 11 HG2 PRO 11 14.695 -7.344 -2.718
74 HG3 PRO 11 HG3 PRO 11 12.911 -7.522 -3.064
75 HD2 PRO 11 HD2 PRO 11 14.686 -7.059 -5.050
76 HD3 PRO 11 HD3 PRO 11 13.058 -6.306 -5.097
77 H LEU 12 H LEU 12 15.165 -3.162 -1.019
78 HA LEU 12 HA LEU 12 18.048 -3.890 -0.781
79 HB2 LEU 12 HB2 LEU 12 18.053 -2.253 1.035
80 HB3 LEU 12 HB3 LEU 12 17.293 -1.520 -0.370
81 HG LEU 12 HG LEU 12 15.610 -2.680 1.828
82 HD11 LEU 12 HD11 LEU 12 15.636 -0.598 3.020
83 HD12 LEU 12 HD12 LEU 12 16.892 0.058 1.892
84 HD13 LEU 12 HD13 LEU 12 17.261 -1.342 2.954
85 HD21 LEU 12 HD21 LEU 12 13.990 -0.870 1.160
86 HD22 LEU 12 HD22 LEU 12 14.387 -1.899 -0.198
87 HD23 LEU 12 HD23 LEU 12 15.135 -0.300 -0.056
88 H THR 13 H THR 13 18.922 -4.690 1.237
89 HA THR 13 HA THR 13 17.319 -6.824 2.418
90 HB THR 13 HB THR 13 19.268 -6.717 4.100
91 HG1 THR 13 HG1 THR 13 21.053 -5.651 3.399
92 HG21 THR 13 HG21 THR 13 20.524 -8.169 2.583
93 HG22 THR 13 HG22 THR 13 19.733 -7.381 1.161
94 HG23 THR 13 HG23 THR 13 18.767 -8.397 2.292
95 H CYS 14 H CYS 14 16.816 -7.053 4.652
96 HA CYS 14 HA CYS 14 17.016 -4.602 6.329
97 HB2 CYS 14 HB2 CYS 14 14.643 -4.729 6.975
98 HB3 CYS 14 HB3 CYS 14 14.734 -4.647 5.220
99 H SER 15 H SER 15 16.609 -5.036 8.613
100 HA SER 15 HA SER 15 16.642 -7.900 9.401
101 HB2 SER 15 HB2 SER 15 18.932 -7.560 9.652
102 HB3 SER 15 HB3 SER 15 18.738 -5.809 9.848
103 HG SER 15 HG SER 15 17.871 -7.750 11.761
104 H GLN 16 H GLN 16 15.602 -4.696 9.670
105 HA GLN 16 HA GLN 16 13.691 -5.595 11.765
106 HB2 GLN 16 HB2 GLN 16 13.812 -3.343 12.793
107 HB3 GLN 16 HB3 GLN 16 15.267 -4.273 12.999
108 HG2 GLN 16 HG2 GLN 16 16.361 -2.922 11.240
109 HG3 GLN 16 HG3 GLN 16 14.897 -1.962 11.025
110 HE21 GLN 16 HE21 GLN 16 17.454 -0.889 11.730
111 HE22 GLN 16 HE22 GLN 16 17.335 -0.220 13.388
112 H ASP 17 H ASP 17 11.714 -4.210 11.620
113 HA ASP 17 HA ASP 17 10.874 -3.588 8.990
114 HB2 ASP 17 HB2 ASP 17 9.294 -4.226 10.613
115 HB3 ASP 17 HB3 ASP 17 9.901 -3.046 11.788
116 H SER 18 H SER 18 12.345 -1.633 11.536
117 HA SER 18 HA SER 18 11.657 0.910 10.310
118 HB2 SER 18 HB2 SER 18 12.461 0.451 12.737
119 HB3 SER 18 HB3 SER 18 14.107 0.489 12.044
120 HG SER 18 HG SER 18 13.693 2.556 12.640
121 H ASP 19 H ASP 19 13.872 -1.449 9.180
122 HA ASP 19 HA ASP 19 15.911 0.348 8.179
123 HB2 ASP 19 HB2 ASP 19 15.074 -2.447 7.401
124 HB3 ASP 19 HB3 ASP 19 16.444 -1.559 6.591
125 H CYS 20 H CYS 20 12.738 -0.538 7.151
126 HA CYS 20 HA CYS 20 13.246 0.405 4.337
127 HB2 CYS 20 HB2 CYS 20 10.558 -0.485 5.417
128 HB3 CYS 20 HB3 CYS 20 11.243 -0.574 3.793
129 H LEU 21 H LEU 21 11.578 1.796 3.338
130 HA LEU 21 HA LEU 21 11.149 4.153 4.997
131 HB2 LEU 21 HB2 LEU 21 10.569 3.487 2.132
132 HB3 LEU 21 HB3 LEU 21 10.074 5.010 2.849
133 HG LEU 21 HG LEU 21 12.938 4.115 2.372
134 HD11 LEU 21 HD11 LEU 21 12.989 5.885 0.632
135 HD12 LEU 21 HD12 LEU 21 11.335 6.410 1.091
136 HD13 LEU 21 HD13 LEU 21 11.598 4.818 0.325
137 HD21 LEU 21 HD21 LEU 21 13.549 6.431 3.097
138 HD22 LEU 21 HD22 LEU 21 12.782 5.457 4.419
139 HD23 LEU 21 HD23 LEU 21 11.842 6.713 3.534
140 H ALA 22 H ALA 22 9.021 5.163 5.132
141 HA ALA 22 HA ALA 22 7.037 3.506 6.198
142 HB1 ALA 22 HB1 ALA 22 6.629 6.269 4.826
143 HB2 ALA 22 HB2 ALA 22 5.459 5.536 5.915
144 HB3 ALA 22 HB3 ALA 22 7.062 6.015 6.530
145 H GLY 23 H GLY 23 5.382 2.263 5.382
146 HA2 GLY 23 HA2 GLY 23 3.857 1.587 3.553
147 HA3 GLY 23 HA3 GLY 23 4.988 2.277 2.410
148 H CYS 24 H CYS 24 7.204 0.793 4.180
149 HA CYS 24 HA CYS 24 6.825 -1.824 2.753
150 HB2 CYS 24 HB2 CYS 24 9.093 0.111 2.956
151 HB3 CYS 24 HB3 CYS 24 9.501 -1.614 3.008
152 H VAL 25 H VAL 25 7.550 -3.621 3.897
153 HA VAL 25 HA VAL 25 8.145 -3.123 6.823
154 HB VAL 25 HB VAL 25 6.957 -5.288 7.311
155 HG11 VAL 25 HG11 VAL 25 5.780 -2.961 7.441
156 HG12 VAL 25 HG12 VAL 25 5.025 -3.412 5.897
157 HG13 VAL 25 HG13 VAL 25 4.755 -4.403 7.359
158 HG21 VAL 25 HG21 VAL 25 7.084 -6.293 4.963
159 HG22 VAL 25 HG22 VAL 25 5.417 -6.179 5.492
160 HG23 VAL 25 HG23 VAL 25 6.037 -4.986 4.368
161 H CYS 26 H CYS 26 9.199 -5.152 7.760
162 HA CYS 26 HA CYS 26 11.237 -6.023 5.830
163 HB2 CYS 26 HB2 CYS 26 12.030 -5.060 7.970
164 HB3 CYS 26 HB3 CYS 26 11.231 -6.388 8.832
165 H GLY 27 H GLY 27 11.109 -7.973 4.821
166 HA2 GLY 27 HA2 GLY 27 9.006 -9.795 5.811
167 HA3 GLY 27 HA3 GLY 27 9.832 -9.770 4.229
168 HA PRO 28 HA PRO 28 11.395 -13.170 7.095
169 HB2 PRO 28 HB2 PRO 28 10.489 -15.404 5.895
170 HB3 PRO 28 HB3 PRO 28 9.448 -14.367 6.897
171 HG2 PRO 28 HG2 PRO 28 9.829 -14.299 3.892
172 HG3 PRO 28 HG3 PRO 28 8.300 -14.551 4.825
173 HD2 PRO 28 HD2 PRO 28 9.020 -12.090 3.894
174 HD3 PRO 28 HD3 PRO 28 8.229 -12.337 5.528
175 H ASN 29 H ASN 29 11.731 -12.524 3.624
176 HA ASN 29 HA ASN 29 13.926 -14.433 3.241
177 HB2 ASN 29 HB2 ASN 29 13.031 -12.040 1.509
178 HB3 ASN 29 HB3 ASN 29 14.269 -13.201 1.088
179 HD21 ASN 29 HD21 ASN 29 13.560 -14.620 -0.376
180 HD22 ASN 29 HD22 ASN 29 11.897 -15.272 -0.377
181 H GLY 30 H GLY 30 13.663 -11.517 4.979
182 HA2 GLY 30 HA2 GLY 30 15.362 -10.300 5.992
183 HA3 GLY 30 HA3 GLY 30 16.608 -11.152 5.013
184 H PHE 31 H PHE 31 13.860 -9.811 3.486
185 HA PHE 31 HA PHE 31 15.385 -7.361 2.522
186 HB2 PHE 31 HB2 PHE 31 13.788 -9.396 0.839
187 HB3 PHE 31 HB3 PHE 31 14.156 -7.747 0.322
188 HD1 PHE 31 HD1 PHE 31 15.749 -11.020 1.198
189 HD2 PHE 31 HD2 PHE 31 16.319 -7.125 -0.567
190 HE1 PHE 31 HE1 PHE 31 17.930 -11.761 0.377
191 HE2 PHE 31 HE2 PHE 31 18.549 -7.832 -1.391
192 HZ PHE 31 HZ PHE 31 19.309 -10.228 -0.937
193 H CYS 32 H CYS 32 14.229 -5.565 2.089
194 HA CYS 32 HA CYS 32 11.748 -5.173 3.584
195 HB2 CYS 32 HB2 CYS 32 13.471 -3.529 1.669
196 HB3 CYS 32 HB3 CYS 32 11.863 -2.984 2.215
197 H GLY 33 H GLY 33 9.702 -4.907 2.744
198 HA2 GLY 33 HA2 GLY 33 9.094 -4.901 -0.067
199 HA3 GLY 33 HA3 GLY 33 9.037 -6.571 0.531
Start of MODEL 8
1 H1 GLY 1 H1 GLY 1 1.369 -0.836 1.438
2 H2 GLY 1 H2 GLY 1 2.055 0.438 2.147
3 H3 GLY 1 H3 GLY 1 1.511 0.569 0.599
4 HA2 GLY 1 HA2 GLY 1 3.620 -1.219 1.428
5 HA3 GLY 1 HA3 GLY 1 3.063 -0.855 -0.220
6 H CYS 2 H CYS 2 5.576 -0.367 -0.280
7 HA CYS 2 HA CYS 2 6.536 1.948 0.984
8 HB2 CYS 2 HB2 CYS 2 7.308 0.572 -1.623
9 HB3 CYS 2 HB3 CYS 2 8.251 1.878 -0.889
10 HA PRO 3 HA PRO 3 4.756 5.161 -1.273
11 HB2 PRO 3 HB2 PRO 3 7.180 6.797 -0.975
12 HB3 PRO 3 HB3 PRO 3 5.506 7.131 -0.432
13 HG2 PRO 3 HG2 PRO 3 7.496 6.534 1.326
14 HG3 PRO 3 HG3 PRO 3 5.819 5.873 1.532
15 HD2 PRO 3 HD2 PRO 3 8.248 4.542 0.332
16 HD3 PRO 3 HD3 PRO 3 7.070 3.906 1.552
17 H ARG 4 H ARG 4 4.593 5.814 -3.316
18 HA ARG 4 HA ARG 4 4.915 5.236 -5.459
19 HB2 ARG 4 HB2 ARG 4 6.957 7.253 -4.967
20 HB3 ARG 4 HB3 ARG 4 6.347 6.974 -6.456
21 HG2 ARG 4 HG2 ARG 4 4.533 7.722 -4.408
22 HG3 ARG 4 HG3 ARG 4 5.467 8.890 -5.064
23 HD2 ARG 4 HD2 ARG 4 4.580 8.469 -7.191
24 HD3 ARG 4 HD3 ARG 4 3.744 7.185 -6.625
25 HE ARG 4 HE ARG 4 2.153 8.553 -5.681
26 HH11 ARG 4 HH11 ARG 4 1.055 10.531 -5.662
27 HH12 ARG 4 HH12 ARG 4 1.814 11.950 -6.303
28 HH21 ARG 4 HH21 ARG 4 4.777 10.311 -7.189
29 HH22 ARG 4 HH22 ARG 4 3.935 11.824 -7.173
30 HA PRO 5 HA PRO 5 8.644 2.662 -5.421
31 HB2 PRO 5 HB2 PRO 5 7.621 0.225 -6.232
32 HB3 PRO 5 HB3 PRO 5 7.398 0.822 -4.559
33 HG2 PRO 5 HG2 PRO 5 5.478 1.051 -6.901
34 HG3 PRO 5 HG3 PRO 5 5.172 0.376 -5.258
35 HD2 PRO 5 HD2 PRO 5 4.528 2.920 -5.846
36 HD3 PRO 5 HD3 PRO 5 5.196 2.501 -4.253
37 H ARG 6 H ARG 6 10.022 2.163 -7.258
38 HA ARG 6 HA ARG 6 9.058 3.363 -9.726
39 HB2 ARG 6 HB2 ARG 6 11.423 3.504 -8.908
40 HB3 ARG 6 HB3 ARG 6 11.630 1.839 -9.416
41 HG2 ARG 6 HG2 ARG 6 12.452 2.955 -11.200
42 HG3 ARG 6 HG3 ARG 6 10.809 2.599 -11.730
43 HD2 ARG 6 HD2 ARG 6 10.015 4.813 -11.093
44 HD3 ARG 6 HD3 ARG 6 11.685 5.315 -10.647
45 HE ARG 6 HE ARG 6 11.311 4.260 -13.347
46 HH11 ARG 6 HH11 ARG 6 11.449 7.146 -11.398
47 HH12 ARG 6 HH12 ARG 6 11.700 8.205 -12.765
48 HH21 ARG 6 HH21 ARG 6 11.687 5.621 -15.061
49 HH22 ARG 6 HH22 ARG 6 11.877 7.289 -14.792
50 H GLY 7 H GLY 7 9.865 0.133 -8.579
51 HA2 GLY 7 HA2 GLY 7 8.735 -1.861 -9.132
52 HA3 GLY 7 HA3 GLY 7 8.132 -1.103 -10.618
53 H ASP 8 H ASP 8 11.164 -0.115 -10.646
54 HA ASP 8 HA ASP 8 12.193 -2.370 -12.249
55 HB2 ASP 8 HB2 ASP 8 12.138 -0.016 -13.221
56 HB3 ASP 8 HB3 ASP 8 13.183 0.479 -11.873
57 H ASN 9 H ASN 9 12.460 -0.660 -9.292
58 HA ASN 9 HA ASN 9 15.254 -1.048 -8.802
59 HB2 ASN 9 HB2 ASN 9 14.555 -0.289 -6.485
60 HB3 ASN 9 HB3 ASN 9 13.985 0.753 -7.823
61 HD21 ASN 9 HD21 ASN 9 13.148 -1.346 -5.213
62 HD22 ASN 9 HD22 ASN 9 11.408 -1.217 -5.349
63 HA PRO 10 HA PRO 10 15.097 -5.286 -7.299
64 HB2 PRO 10 HB2 PRO 10 17.567 -5.434 -6.219
65 HB3 PRO 10 HB3 PRO 10 17.336 -5.429 -7.956
66 HG2 PRO 10 HG2 PRO 10 18.162 -3.139 -6.219
67 HG3 PRO 10 HG3 PRO 10 18.778 -3.693 -7.796
68 HD2 PRO 10 HD2 PRO 10 16.994 -1.638 -7.571
69 HD3 PRO 10 HD3 PRO 10 17.005 -2.773 -8.957
70 HA PRO 11 HA PRO 11 14.175 -4.602 -3.034
71 HB2 PRO 11 HB2 PRO 11 14.521 -6.984 -1.846
72 HB3 PRO 11 HB3 PRO 11 13.205 -6.729 -3.040
73 HG2 PRO 11 HG2 PRO 11 15.974 -7.943 -3.441
74 HG3 PRO 11 HG3 PRO 11 14.374 -8.620 -3.978
75 HD2 PRO 11 HD2 PRO 11 15.947 -7.210 -5.670
76 HD3 PRO 11 HD3 PRO 11 14.160 -7.140 -5.763
77 H LEU 12 H LEU 12 15.031 -4.151 -1.040
78 HA LEU 12 HA LEU 12 18.050 -4.310 -0.902
79 HB2 LEU 12 HB2 LEU 12 17.927 -2.408 0.599
80 HB3 LEU 12 HB3 LEU 12 17.165 -2.011 -0.939
81 HG LEU 12 HG LEU 12 15.063 -2.858 0.677
82 HD11 LEU 12 HD11 LEU 12 16.842 -1.050 2.316
83 HD12 LEU 12 HD12 LEU 12 16.439 -2.723 2.678
84 HD13 LEU 12 HD13 LEU 12 15.170 -1.504 2.685
85 HD21 LEU 12 HD21 LEU 12 16.031 -0.066 0.002
86 HD22 LEU 12 HD22 LEU 12 14.378 -0.497 0.499
87 HD23 LEU 12 HD23 LEU 12 15.011 -1.125 -1.031
88 H THR 13 H THR 13 19.014 -4.855 1.144
89 HA THR 13 HA THR 13 17.495 -6.818 2.554
90 HB THR 13 HB THR 13 19.609 -6.655 4.060
91 HG1 THR 13 HG1 THR 13 21.385 -5.817 2.909
92 HG21 THR 13 HG21 THR 13 20.649 -8.245 2.643
93 HG22 THR 13 HG22 THR 13 19.800 -7.609 1.185
94 HG23 THR 13 HG23 THR 13 18.880 -8.448 2.452
95 H CYS 14 H CYS 14 16.937 -6.939 4.692
96 HA CYS 14 HA CYS 14 17.259 -4.561 6.413
97 HB2 CYS 14 HB2 CYS 14 14.823 -4.499 6.956
98 HB3 CYS 14 HB3 CYS 14 15.074 -4.185 5.234
99 H SER 15 H SER 15 16.447 -5.111 8.676
100 HA SER 15 HA SER 15 16.269 -8.032 9.171
101 HB2 SER 15 HB2 SER 15 18.345 -8.001 9.960
102 HB3 SER 15 HB3 SER 15 18.387 -6.231 10.021
103 HG SER 15 HG SER 15 17.942 -8.004 12.014
104 H GLN 16 H GLN 16 15.415 -4.738 9.782
105 HA GLN 16 HA GLN 16 13.120 -5.713 11.403
106 HB2 GLN 16 HB2 GLN 16 13.196 -3.601 12.702
107 HB3 GLN 16 HB3 GLN 16 14.566 -4.649 13.007
108 HG2 GLN 16 HG2 GLN 16 15.962 -3.251 11.472
109 HG3 GLN 16 HG3 GLN 16 14.610 -2.124 11.246
110 HE21 GLN 16 HE21 GLN 16 16.727 -0.867 12.148
111 HE22 GLN 16 HE22 GLN 16 16.661 -0.564 13.912
112 H ASP 17 H ASP 17 11.311 -3.916 11.122
113 HA ASP 17 HA ASP 17 11.117 -3.261 8.330
114 HB2 ASP 17 HB2 ASP 17 8.927 -2.630 8.782
115 HB3 ASP 17 HB3 ASP 17 9.221 -3.935 9.932
116 H SER 18 H SER 18 12.088 -1.550 11.241
117 HA SER 18 HA SER 18 11.829 1.133 10.270
118 HB2 SER 18 HB2 SER 18 14.111 0.820 11.927
119 HB3 SER 18 HB3 SER 18 12.525 1.485 12.357
120 HG SER 18 HG SER 18 13.152 -0.450 13.561
121 H ASP 19 H ASP 19 13.975 -1.356 9.153
122 HA ASP 19 HA ASP 19 16.209 0.350 8.433
123 HB2 ASP 19 HB2 ASP 19 15.354 -2.399 7.474
124 HB3 ASP 19 HB3 ASP 19 16.878 -1.601 6.956
125 H CYS 20 H CYS 20 13.082 -0.057 7.242
126 HA CYS 20 HA CYS 20 13.919 0.851 4.482
127 HB2 CYS 20 HB2 CYS 20 12.694 -1.430 5.062
128 HB3 CYS 20 HB3 CYS 20 11.255 -0.425 5.047
129 H LEU 21 H LEU 21 11.442 1.657 3.522
130 HA LEU 21 HA LEU 21 11.290 4.287 4.796
131 HB2 LEU 21 HB2 LEU 21 9.883 3.186 2.405
132 HB3 LEU 21 HB3 LEU 21 9.826 4.869 2.886
133 HG LEU 21 HG LEU 21 12.307 3.457 1.904
134 HD11 LEU 21 HD11 LEU 21 12.032 4.819 -0.187
135 HD12 LEU 21 HD12 LEU 21 10.562 5.551 0.514
136 HD13 LEU 21 HD13 LEU 21 10.582 3.822 0.090
137 HD21 LEU 21 HD21 LEU 21 11.793 6.353 2.679
138 HD22 LEU 21 HD22 LEU 21 13.225 5.838 1.762
139 HD23 LEU 21 HD23 LEU 21 12.958 5.227 3.417
140 H ALA 22 H ALA 22 9.168 5.272 5.329
141 HA ALA 22 HA ALA 22 7.622 3.541 7.102
142 HB1 ALA 22 HB1 ALA 22 6.143 5.588 7.401
143 HB2 ALA 22 HB2 ALA 22 7.868 6.080 7.499
144 HB3 ALA 22 HB3 ALA 22 6.912 6.390 6.029
145 H GLY 23 H GLY 23 5.790 2.356 6.652
146 HA2 GLY 23 HA2 GLY 23 3.799 1.779 5.317
147 HA3 GLY 23 HA3 GLY 23 4.473 2.632 3.961
148 H CYS 24 H CYS 24 7.126 1.095 4.823
149 HA CYS 24 HA CYS 24 6.630 -1.223 3.010
150 HB2 CYS 24 HB2 CYS 24 9.177 -0.099 4.234
151 HB3 CYS 24 HB3 CYS 24 9.076 -1.405 3.039
152 H VAL 25 H VAL 25 7.756 -3.289 3.777
153 HA VAL 25 HA VAL 25 7.731 -3.500 6.802
154 HB VAL 25 HB VAL 25 6.861 -5.876 6.504
155 HG11 VAL 25 HG11 VAL 25 5.403 -3.861 7.153
156 HG12 VAL 25 HG12 VAL 25 4.821 -3.902 5.463
157 HG13 VAL 25 HG13 VAL 25 4.574 -5.321 6.551
158 HG21 VAL 25 HG21 VAL 25 5.585 -6.331 4.331
159 HG22 VAL 25 HG22 VAL 25 6.197 -4.802 3.670
160 HG23 VAL 25 HG23 VAL 25 7.316 -6.150 4.028
161 H CYS 26 H CYS 26 8.899 -5.651 7.403
162 HA CYS 26 HA CYS 26 11.085 -6.127 5.466
163 HB2 CYS 26 HB2 CYS 26 11.896 -4.997 7.547
164 HB3 CYS 26 HB3 CYS 26 11.276 -6.320 8.480
165 H GLY 27 H GLY 27 11.045 -8.187 4.591
166 HA2 GLY 27 HA2 GLY 27 9.002 -9.963 5.865
167 HA3 GLY 27 HA3 GLY 27 9.674 -10.059 4.231
168 HA PRO 28 HA PRO 28 11.419 -13.391 7.180
169 HB2 PRO 28 HB2 PRO 28 10.361 -15.115 5.002
170 HB3 PRO 28 HB3 PRO 28 10.291 -15.372 6.758
171 HG2 PRO 28 HG2 PRO 28 8.122 -14.692 5.382
172 HG3 PRO 28 HG3 PRO 28 8.496 -13.889 6.971
173 HD2 PRO 28 HD2 PRO 28 8.921 -12.867 4.171
174 HD3 PRO 28 HD3 PRO 28 8.220 -12.059 5.663
175 H ASN 29 H ASN 29 11.769 -12.594 3.745
176 HA ASN 29 HA ASN 29 14.069 -14.380 3.352
177 HB2 ASN 29 HB2 ASN 29 12.425 -13.455 1.558
178 HB3 ASN 29 HB3 ASN 29 13.414 -11.964 1.568
179 HD21 ASN 29 HD21 ASN 29 14.044 -12.410 -0.672
180 HD22 ASN 29 HD22 ASN 29 15.186 -13.708 -1.043
181 H GLY 30 H GLY 30 13.634 -11.478 5.104
182 HA2 GLY 30 HA2 GLY 30 15.242 -10.088 6.050
183 HA3 GLY 30 HA3 GLY 30 16.560 -11.011 5.241
184 H PHE 31 H PHE 31 13.865 -9.790 3.480
185 HA PHE 31 HA PHE 31 15.391 -7.388 2.429
186 HB2 PHE 31 HB2 PHE 31 13.875 -9.557 0.879
187 HB3 PHE 31 HB3 PHE 31 14.170 -7.932 0.233
188 HD1 PHE 31 HD1 PHE 31 15.784 -11.155 1.104
189 HD2 PHE 31 HD2 PHE 31 16.413 -7.188 -0.511
190 HE1 PHE 31 HE1 PHE 31 17.965 -11.863 0.261
191 HE2 PHE 31 HE2 PHE 31 18.645 -7.873 -1.340
192 HZ PHE 31 HZ PHE 31 19.366 -10.302 -1.006
193 H CYS 32 H CYS 32 14.185 -5.683 1.945
194 HA CYS 32 HA CYS 32 11.766 -5.279 3.474
195 HB2 CYS 32 HB2 CYS 32 13.512 -3.427 2.990
196 HB3 CYS 32 HB3 CYS 32 13.063 -3.547 1.306
197 H GLY 33 H GLY 33 9.754 -5.072 2.818
198 HA2 GLY 33 HA2 GLY 33 9.131 -5.799 -0.047
199 HA3 GLY 33 HA3 GLY 33 8.104 -6.213 1.327
Start of MODEL 9
1 H1 GLY 1 H1 GLY 1 5.804 5.448 -1.451
2 H2 GLY 1 H2 GLY 1 5.241 5.552 0.071
3 H3 GLY 1 H3 GLY 1 6.824 5.945 -0.240
4 HA2 GLY 1 HA2 GLY 1 6.402 3.821 0.821
5 HA3 GLY 1 HA3 GLY 1 5.760 3.293 -0.747
6 H CYS 2 H CYS 2 7.669 1.721 -0.682
7 HA CYS 2 HA CYS 2 10.337 2.750 -0.796
8 HB2 CYS 2 HB2 CYS 2 9.049 0.073 -1.431
9 HB3 CYS 2 HB3 CYS 2 10.780 0.356 -1.692
10 HA PRO 3 HA PRO 3 10.372 3.915 -4.857
11 HB2 PRO 3 HB2 PRO 3 12.973 3.838 -5.663
12 HB3 PRO 3 HB3 PRO 3 12.381 4.942 -4.408
13 HG2 PRO 3 HG2 PRO 3 13.741 2.280 -4.067
14 HG3 PRO 3 HG3 PRO 3 14.160 3.883 -3.400
15 HD2 PRO 3 HD2 PRO 3 12.674 2.035 -2.015
16 HD3 PRO 3 HD3 PRO 3 12.410 3.798 -1.856
17 H ARG 4 H ARG 4 10.095 3.208 -6.921
18 HA ARG 4 HA ARG 4 11.164 0.573 -7.751
19 HB2 ARG 4 HB2 ARG 4 8.850 0.029 -8.716
20 HB3 ARG 4 HB3 ARG 4 9.126 -0.200 -6.964
21 HG2 ARG 4 HG2 ARG 4 7.953 1.789 -6.423
22 HG3 ARG 4 HG3 ARG 4 7.680 2.156 -8.166
23 HD2 ARG 4 HD2 ARG 4 6.413 -0.094 -8.288
24 HD3 ARG 4 HD3 ARG 4 6.618 -0.255 -6.558
25 HE ARG 4 HE ARG 4 5.421 2.309 -7.273
26 HH11 ARG 4 HH11 ARG 4 4.702 -1.111 -6.889
27 HH12 ARG 4 HH12 ARG 4 3.003 -0.875 -6.629
28 HH21 ARG 4 HH21 ARG 4 3.223 2.559 -6.930
29 HH22 ARG 4 HH22 ARG 4 2.165 1.199 -6.636
30 HA PRO 5 HA PRO 5 11.144 4.091 -10.850
31 HB2 PRO 5 HB2 PRO 5 13.729 4.212 -11.477
32 HB3 PRO 5 HB3 PRO 5 13.054 5.044 -10.032
33 HG2 PRO 5 HG2 PRO 5 14.389 2.355 -10.143
34 HG3 PRO 5 HG3 PRO 5 14.722 3.746 -9.095
35 HD2 PRO 5 HD2 PRO 5 13.198 1.768 -8.251
36 HD3 PRO 5 HD3 PRO 5 12.819 3.477 -7.911
37 H ARG 6 H ARG 6 12.219 0.814 -10.909
38 HA ARG 6 HA ARG 6 12.043 0.858 -13.920
39 HB2 ARG 6 HB2 ARG 6 13.744 -1.053 -12.252
40 HB3 ARG 6 HB3 ARG 6 13.635 -0.936 -14.041
41 HG2 ARG 6 HG2 ARG 6 14.467 1.434 -13.782
42 HG3 ARG 6 HG3 ARG 6 14.837 0.952 -12.089
43 HD2 ARG 6 HD2 ARG 6 16.068 0.148 -14.657
44 HD3 ARG 6 HD3 ARG 6 16.860 0.516 -13.121
45 HE ARG 6 HE ARG 6 15.276 -1.982 -13.350
46 HH11 ARG 6 HH11 ARG 6 18.476 -0.513 -13.289
47 HH12 ARG 6 HH12 ARG 6 19.272 -2.023 -13.066
48 HH21 ARG 6 HH21 ARG 6 16.337 -3.927 -13.147
49 HH22 ARG 6 HH22 ARG 6 18.083 -3.990 -13.020
50 H GLY 7 H GLY 7 11.275 -0.778 -10.856
51 HA2 GLY 7 HA2 GLY 7 9.165 -1.845 -10.521
52 HA3 GLY 7 HA3 GLY 7 9.019 -2.023 -12.295
53 H ASP 8 H ASP 8 11.932 -2.916 -12.303
54 HA ASP 8 HA ASP 8 11.557 -5.679 -11.265
55 HB2 ASP 8 HB2 ASP 8 12.987 -6.483 -12.981
56 HB3 ASP 8 HB3 ASP 8 11.923 -5.342 -13.777
57 H ASN 9 H ASN 9 12.857 -2.863 -10.379
58 HA ASN 9 HA ASN 9 15.614 -3.615 -9.955
59 HB2 ASN 9 HB2 ASN 9 15.548 -1.504 -8.488
60 HB3 ASN 9 HB3 ASN 9 15.016 -1.301 -10.143
61 HD21 ASN 9 HD21 ASN 9 14.126 -1.573 -6.791
62 HD22 ASN 9 HD22 ASN 9 12.497 -0.856 -6.942
63 HA PRO 10 HA PRO 10 14.721 -6.390 -6.643
64 HB2 PRO 10 HB2 PRO 10 17.182 -6.643 -5.458
65 HB3 PRO 10 HB3 PRO 10 16.820 -7.314 -7.053
66 HG2 PRO 10 HG2 PRO 10 18.253 -4.749 -6.443
67 HG3 PRO 10 HG3 PRO 10 18.628 -6.038 -7.591
68 HD2 PRO 10 HD2 PRO 10 17.356 -3.787 -8.388
69 HD3 PRO 10 HD3 PRO 10 16.986 -5.371 -9.108
70 HA PRO 11 HA PRO 11 14.039 -3.983 -2.974
71 HB2 PRO 11 HB2 PRO 11 13.704 -5.901 -1.107
72 HB3 PRO 11 HB3 PRO 11 12.509 -5.682 -2.396
73 HG2 PRO 11 HG2 PRO 11 14.794 -7.601 -2.229
74 HG3 PRO 11 HG3 PRO 11 13.049 -7.947 -2.628
75 HD2 PRO 11 HD2 PRO 11 14.904 -7.679 -4.549
76 HD3 PRO 11 HD3 PRO 11 13.243 -7.085 -4.787
77 H LEU 12 H LEU 12 14.960 -3.257 -1.045
78 HA LEU 12 HA LEU 12 17.861 -3.704 -0.765
79 HB2 LEU 12 HB2 LEU 12 17.679 -2.093 1.102
80 HB3 LEU 12 HB3 LEU 12 17.016 -1.455 -0.426
81 HG LEU 12 HG LEU 12 14.841 -2.566 1.104
82 HD11 LEU 12 HD11 LEU 12 14.819 -1.086 3.002
83 HD12 LEU 12 HD12 LEU 12 16.492 -0.507 2.609
84 HD13 LEU 12 HD13 LEU 12 16.209 -2.208 3.076
85 HD21 LEU 12 HD21 LEU 12 15.613 0.289 0.318
86 HD22 LEU 12 HD22 LEU 12 13.978 -0.314 0.749
87 HD23 LEU 12 HD23 LEU 12 14.749 -0.883 -0.725
88 H THR 13 H THR 13 18.875 -4.375 1.248
89 HA THR 13 HA THR 13 17.481 -6.651 2.432
90 HB THR 13 HB THR 13 19.534 -6.623 3.936
91 HG1 THR 13 HG1 THR 13 21.242 -5.290 3.300
92 HG21 THR 13 HG21 THR 13 20.926 -7.579 2.161
93 HG22 THR 13 HG22 THR 13 20.023 -6.662 0.909
94 HG23 THR 13 HG23 THR 13 19.207 -7.969 1.816
95 H CYS 14 H CYS 14 16.963 -6.994 4.623
96 HA CYS 14 HA CYS 14 17.091 -4.623 6.418
97 HB2 CYS 14 HB2 CYS 14 14.681 -4.596 6.866
98 HB3 CYS 14 HB3 CYS 14 14.939 -4.328 5.134
99 H SER 15 H SER 15 16.234 -5.278 8.663
100 HA SER 15 HA SER 15 16.020 -8.206 9.035
101 HB2 SER 15 HB2 SER 15 18.140 -8.201 9.831
102 HB3 SER 15 HB3 SER 15 18.167 -6.477 10.082
103 HG SER 15 HG SER 15 18.137 -7.313 12.099
104 H GLN 16 H GLN 16 15.307 -4.889 9.835
105 HA GLN 16 HA GLN 16 12.983 -5.906 11.435
106 HB2 GLN 16 HB2 GLN 16 13.158 -3.928 12.837
107 HB3 GLN 16 HB3 GLN 16 14.500 -5.021 13.055
108 HG2 GLN 16 HG2 GLN 16 15.902 -3.520 11.614
109 HG3 GLN 16 HG3 GLN 16 14.599 -2.364 11.539
110 HE21 GLN 16 HE21 GLN 16 16.778 -1.296 12.572
111 HE22 GLN 16 HE22 GLN 16 16.725 -1.195 14.361
112 H ASP 17 H ASP 17 11.150 -4.289 11.254
113 HA ASP 17 HA ASP 17 10.777 -3.267 8.683
114 HB2 ASP 17 HB2 ASP 17 9.495 -2.468 11.307
115 HB3 ASP 17 HB3 ASP 17 8.871 -2.059 9.736
116 H SER 18 H SER 18 12.198 -1.783 11.531
117 HA SER 18 HA SER 18 12.066 0.968 10.656
118 HB2 SER 18 HB2 SER 18 14.515 0.181 12.095
119 HB3 SER 18 HB3 SER 18 13.233 1.358 12.536
120 HG SER 18 HG SER 18 13.456 -0.666 13.850
121 H ASP 19 H ASP 19 13.978 -1.591 9.296
122 HA ASP 19 HA ASP 19 16.197 0.118 8.416
123 HB2 ASP 19 HB2 ASP 19 15.257 -2.643 7.587
124 HB3 ASP 19 HB3 ASP 19 16.756 -1.820 6.938
125 H CYS 20 H CYS 20 12.988 -0.550 7.398
126 HA CYS 20 HA CYS 20 13.543 0.184 4.530
127 HB2 CYS 20 HB2 CYS 20 11.036 -0.766 5.990
128 HB3 CYS 20 HB3 CYS 20 11.097 -0.346 4.292
129 H LEU 21 H LEU 21 11.622 1.458 3.542
130 HA LEU 21 HA LEU 21 11.714 4.110 4.752
131 HB2 LEU 21 HB2 LEU 21 10.359 3.016 2.280
132 HB3 LEU 21 HB3 LEU 21 10.290 4.695 2.737
133 HG LEU 21 HG LEU 21 11.711 4.539 0.892
134 HD11 LEU 21 HD11 LEU 21 13.406 4.990 3.393
135 HD12 LEU 21 HD12 LEU 21 12.544 6.232 2.443
136 HD13 LEU 21 HD13 LEU 21 13.971 5.398 1.734
137 HD21 LEU 21 HD21 LEU 21 12.317 2.184 1.051
138 HD22 LEU 21 HD22 LEU 21 13.533 2.602 2.290
139 HD23 LEU 21 HD23 LEU 21 13.640 3.263 0.622
140 H ALA 22 H ALA 22 9.600 5.287 5.111
141 HA ALA 22 HA ALA 22 7.730 3.771 6.638
142 HB1 ALA 22 HB1 ALA 22 7.246 6.548 5.295
143 HB2 ALA 22 HB2 ALA 22 6.323 5.884 6.646
144 HB3 ALA 22 HB3 ALA 22 8.052 6.346 6.855
145 H GLY 23 H GLY 23 5.684 2.853 6.088
146 HA2 GLY 23 HA2 GLY 23 3.966 2.200 4.541
147 HA3 GLY 23 HA3 GLY 23 4.892 2.928 3.222
148 H CYS 24 H CYS 24 7.150 1.110 4.783
149 HA CYS 24 HA CYS 24 6.586 -1.277 3.095
150 HB2 CYS 24 HB2 CYS 24 9.186 0.094 3.741
151 HB3 CYS 24 HB3 CYS 24 9.045 -1.363 2.795
152 H VAL 25 H VAL 25 7.668 -3.222 3.868
153 HA VAL 25 HA VAL 25 8.030 -3.133 6.881
154 HB VAL 25 HB VAL 25 6.890 -5.425 6.959
155 HG11 VAL 25 HG11 VAL 25 5.671 -3.201 7.499
156 HG12 VAL 25 HG12 VAL 25 4.904 -3.422 5.901
157 HG13 VAL 25 HG13 VAL 25 4.718 -4.659 7.163
158 HG21 VAL 25 HG21 VAL 25 5.347 -5.969 4.978
159 HG22 VAL 25 HG22 VAL 25 6.094 -4.625 4.080
160 HG23 VAL 25 HG23 VAL 25 7.077 -6.046 4.538
161 H CYS 26 H CYS 26 9.080 -5.276 7.605
162 HA CYS 26 HA CYS 26 11.102 -5.984 5.571
163 HB2 CYS 26 HB2 CYS 26 11.980 -5.065 7.724
164 HB3 CYS 26 HB3 CYS 26 11.265 -6.434 8.556
165 H GLY 27 H GLY 27 11.203 -8.026 4.670
166 HA2 GLY 27 HA2 GLY 27 9.055 -9.774 5.624
167 HA3 GLY 27 HA3 GLY 27 9.968 -9.877 4.120
168 HA PRO 28 HA PRO 28 11.384 -13.039 7.323
169 HB2 PRO 28 HB2 PRO 28 10.570 -15.352 6.212
170 HB3 PRO 28 HB3 PRO 28 9.510 -14.251 7.127
171 HG2 PRO 28 HG2 PRO 28 9.994 -14.413 4.156
172 HG3 PRO 28 HG3 PRO 28 8.445 -14.622 5.071
173 HD2 PRO 28 HD2 PRO 28 9.126 -12.236 3.940
174 HD3 PRO 28 HD3 PRO 28 8.281 -12.346 5.553
175 H ASN 29 H ASN 29 11.920 -12.633 3.879
176 HA ASN 29 HA ASN 29 14.245 -14.435 3.848
177 HB2 ASN 29 HB2 ASN 29 13.294 -12.502 1.687
178 HB3 ASN 29 HB3 ASN 29 14.487 -13.749 1.505
179 HD21 ASN 29 HD21 ASN 29 13.784 -15.887 1.166
180 HD22 ASN 29 HD22 ASN 29 12.036 -16.211 0.980
181 H GLY 30 H GLY 30 13.764 -11.427 5.232
182 HA2 GLY 30 HA2 GLY 30 15.434 -9.967 6.013
183 HA3 GLY 30 HA3 GLY 30 16.663 -10.930 5.182
184 H PHE 31 H PHE 31 13.929 -9.863 3.477
185 HA PHE 31 HA PHE 31 15.365 -7.447 2.334
186 HB2 PHE 31 HB2 PHE 31 13.849 -9.620 0.779
187 HB3 PHE 31 HB3 PHE 31 14.232 -8.038 0.152
188 HD1 PHE 31 HD1 PHE 31 15.660 -11.333 1.041
189 HD2 PHE 31 HD2 PHE 31 16.547 -7.370 -0.440
190 HE1 PHE 31 HE1 PHE 31 17.827 -12.148 0.302
191 HE2 PHE 31 HE2 PHE 31 18.768 -8.185 -1.151
192 HZ PHE 31 HZ PHE 31 19.380 -10.621 -0.837
193 H CYS 32 H CYS 32 14.069 -5.801 1.707
194 HA CYS 32 HA CYS 32 11.724 -5.461 3.310
195 HB2 CYS 32 HB2 CYS 32 13.530 -3.672 2.351
196 HB3 CYS 32 HB3 CYS 32 12.464 -3.753 0.968
197 H GLY 33 H GLY 33 9.643 -4.860 2.615
198 HA2 GLY 33 HA2 GLY 33 8.781 -5.638 -0.117
199 HA3 GLY 33 HA3 GLY 33 8.267 -6.741 1.141
Start of MODEL 10
1 H1 GLY 1 H1 GLY 1 1.273 -2.371 0.043
2 H2 GLY 1 H2 GLY 1 1.561 -1.211 -1.054
3 H3 GLY 1 H3 GLY 1 2.587 -2.496 -0.957
4 HA2 GLY 1 HA2 GLY 1 2.083 -0.519 1.062
5 HA3 GLY 1 HA3 GLY 1 3.256 -1.815 1.246
6 H CYS 2 H CYS 2 4.683 0.069 1.680
7 HA CYS 2 HA CYS 2 6.353 1.436 1.192
8 HB2 CYS 2 HB2 CYS 2 6.247 -0.148 -1.383
9 HB3 CYS 2 HB3 CYS 2 7.388 1.195 -1.183
10 HA PRO 3 HA PRO 3 4.731 5.031 -0.559
11 HB2 PRO 3 HB2 PRO 3 6.739 6.793 -0.641
12 HB3 PRO 3 HB3 PRO 3 6.019 6.157 0.891
13 HG2 PRO 3 HG2 PRO 3 8.586 5.323 -0.504
14 HG3 PRO 3 HG3 PRO 3 8.238 5.676 1.236
15 HD2 PRO 3 HD2 PRO 3 8.298 3.107 0.095
16 HD3 PRO 3 HD3 PRO 3 7.397 3.569 1.590
17 H ARG 4 H ARG 4 3.988 4.936 -2.487
18 HA ARG 4 HA ARG 4 3.919 4.461 -4.679
19 HB2 ARG 4 HB2 ARG 4 5.600 6.812 -4.752
20 HB3 ARG 4 HB3 ARG 4 4.630 6.342 -5.979
21 HG2 ARG 4 HG2 ARG 4 2.730 6.820 -4.713
22 HG3 ARG 4 HG3 ARG 4 3.651 7.172 -3.411
23 HD2 ARG 4 HD2 ARG 4 4.556 9.047 -4.548
24 HD3 ARG 4 HD3 ARG 4 3.660 8.688 -5.865
25 HE ARG 4 HE ARG 4 1.902 9.003 -3.790
26 HH11 ARG 4 HH11 ARG 4 0.762 10.934 -3.488
27 HH12 ARG 4 HH12 ARG 4 1.345 12.404 -4.193
28 HH21 ARG 4 HH21 ARG 4 4.149 10.918 -5.668
29 HH22 ARG 4 HH22 ARG 4 3.275 12.395 -5.436
30 HA PRO 5 HA PRO 5 8.110 2.676 -5.190
31 HB2 PRO 5 HB2 PRO 5 7.544 0.014 -5.574
32 HB3 PRO 5 HB3 PRO 5 7.503 0.751 -3.941
33 HG2 PRO 5 HG2 PRO 5 5.197 0.241 -5.821
34 HG3 PRO 5 HG3 PRO 5 5.405 -0.224 -4.090
35 HD2 PRO 5 HD2 PRO 5 4.065 1.990 -4.767
36 HD3 PRO 5 HD3 PRO 5 5.116 1.930 -3.310
37 H ARG 6 H ARG 6 9.232 2.368 -7.118
38 HA ARG 6 HA ARG 6 7.731 3.114 -9.489
39 HB2 ARG 6 HB2 ARG 6 10.015 3.898 -9.047
40 HB3 ARG 6 HB3 ARG 6 10.619 2.256 -9.300
41 HG2 ARG 6 HG2 ARG 6 9.955 2.262 -11.639
42 HG3 ARG 6 HG3 ARG 6 9.169 3.833 -11.472
43 HD2 ARG 6 HD2 ARG 6 12.067 3.480 -10.719
44 HD3 ARG 6 HD3 ARG 6 11.517 3.837 -12.354
45 HE ARG 6 HE ARG 6 10.231 5.659 -10.679
46 HH11 ARG 6 HH11 ARG 6 13.487 4.935 -11.823
47 HH12 ARG 6 HH12 ARG 6 14.025 6.600 -11.775
48 HH21 ARG 6 HH21 ARG 6 10.954 7.806 -10.658
49 HH22 ARG 6 HH22 ARG 6 12.572 8.197 -11.122
50 H GLY 7 H GLY 7 9.074 0.097 -8.266
51 HA2 GLY 7 HA2 GLY 7 8.434 -2.070 -8.849
52 HA3 GLY 7 HA3 GLY 7 7.511 -1.404 -10.209
53 H ASP 8 H ASP 8 10.694 -0.243 -9.952
54 HA ASP 8 HA ASP 8 11.750 -2.145 -11.951
55 HB2 ASP 8 HB2 ASP 8 11.272 0.141 -12.876
56 HB3 ASP 8 HB3 ASP 8 12.271 0.838 -11.604
57 H ASN 9 H ASN 9 12.259 -0.341 -9.016
58 HA ASN 9 HA ASN 9 15.132 -0.622 -8.956
59 HB2 ASN 9 HB2 ASN 9 13.088 0.018 -6.815
60 HB3 ASN 9 HB3 ASN 9 14.855 0.046 -6.548
61 HD21 ASN 9 HD21 ASN 9 13.579 2.246 -5.973
62 HD22 ASN 9 HD22 ASN 9 13.840 3.509 -7.201
63 HA PRO 10 HA PRO 10 15.446 -4.782 -7.403
64 HB2 PRO 10 HB2 PRO 10 17.930 -4.689 -6.284
65 HB3 PRO 10 HB3 PRO 10 17.693 -4.692 -8.047
66 HG2 PRO 10 HG2 PRO 10 18.278 -2.320 -6.282
67 HG3 PRO 10 HG3 PRO 10 18.910 -2.770 -7.879
68 HD2 PRO 10 HD2 PRO 10 16.928 -0.958 -7.597
69 HD3 PRO 10 HD3 PRO 10 17.014 -2.079 -8.976
70 HA PRO 11 HA PRO 11 14.371 -4.490 -3.138
71 HB2 PRO 11 HB2 PRO 11 15.170 -6.845 -2.045
72 HB3 PRO 11 HB3 PRO 11 13.846 -6.779 -3.226
73 HG2 PRO 11 HG2 PRO 11 16.754 -7.412 -3.639
74 HG3 PRO 11 HG3 PRO 11 15.306 -8.349 -4.218
75 HD2 PRO 11 HD2 PRO 11 16.602 -6.644 -5.841
76 HD3 PRO 11 HD3 PRO 11 14.842 -6.883 -5.949
77 H LEU 12 H LEU 12 15.162 -4.342 -0.975
78 HA LEU 12 HA LEU 12 18.148 -4.109 -0.729
79 HB2 LEU 12 HB2 LEU 12 17.833 -2.180 0.741
80 HB3 LEU 12 HB3 LEU 12 17.132 -1.828 -0.850
81 HG LEU 12 HG LEU 12 15.239 -2.785 1.259
82 HD11 LEU 12 HD11 LEU 12 15.093 -0.601 2.257
83 HD12 LEU 12 HD12 LEU 12 16.465 -0.040 1.261
84 HD13 LEU 12 HD13 LEU 12 16.726 -1.322 2.483
85 HD21 LEU 12 HD21 LEU 12 13.747 -1.183 0.134
86 HD22 LEU 12 HD22 LEU 12 14.507 -2.228 -1.065
87 HD23 LEU 12 HD23 LEU 12 15.093 -0.549 -0.857
88 H THR 13 H THR 13 18.943 -4.530 1.387
89 HA THR 13 HA THR 13 17.443 -6.686 2.601
90 HB THR 13 HB THR 13 19.387 -6.637 4.228
91 HG1 THR 13 HG1 THR 13 20.735 -5.047 4.137
92 HG21 THR 13 HG21 THR 13 20.903 -7.632 2.652
93 HG22 THR 13 HG22 THR 13 20.115 -6.746 1.277
94 HG23 THR 13 HG23 THR 13 19.231 -8.021 2.147
95 H CYS 14 H CYS 14 16.929 -6.940 4.805
96 HA CYS 14 HA CYS 14 17.007 -4.528 6.532
97 HB2 CYS 14 HB2 CYS 14 14.584 -4.596 6.972
98 HB3 CYS 14 HB3 CYS 14 14.843 -4.330 5.213
99 H SER 15 H SER 15 16.228 -5.157 8.775
100 HA SER 15 HA SER 15 16.126 -8.093 9.230
101 HB2 SER 15 HB2 SER 15 18.337 -7.846 9.750
102 HB3 SER 15 HB3 SER 15 18.152 -6.196 10.327
103 HG SER 15 HG SER 15 18.464 -7.872 11.972
104 H GLN 16 H GLN 16 15.365 -4.796 9.915
105 HA GLN 16 HA GLN 16 13.012 -5.727 11.493
106 HB2 GLN 16 HB2 GLN 16 13.150 -3.582 12.795
107 HB3 GLN 16 HB3 GLN 16 14.454 -4.715 13.142
108 HG2 GLN 16 HG2 GLN 16 15.962 -3.341 11.717
109 HG3 GLN 16 HG3 GLN 16 14.629 -2.230 11.335
110 HE21 GLN 16 HE21 GLN 16 17.286 -2.403 13.087
111 HE22 GLN 16 HE22 GLN 16 16.862 -1.462 14.525
112 H ASP 17 H ASP 17 11.263 -3.847 11.159
113 HA ASP 17 HA ASP 17 11.180 -3.268 8.348
114 HB2 ASP 17 HB2 ASP 17 9.006 -2.454 8.761
115 HB3 ASP 17 HB3 ASP 17 9.207 -3.748 9.919
116 H SER 18 H SER 18 12.262 -1.551 11.151
117 HA SER 18 HA SER 18 12.017 1.112 10.071
118 HB2 SER 18 HB2 SER 18 12.461 0.455 12.526
119 HB3 SER 18 HB3 SER 18 14.131 0.129 12.019
120 HG SER 18 HG SER 18 12.757 2.629 11.750
121 H ASP 19 H ASP 19 14.123 -1.417 9.063
122 HA ASP 19 HA ASP 19 16.370 0.191 8.209
123 HB2 ASP 19 HB2 ASP 19 15.387 -2.561 7.478
124 HB3 ASP 19 HB3 ASP 19 16.891 -1.857 6.795
125 H CYS 20 H CYS 20 13.201 -0.088 7.197
126 HA CYS 20 HA CYS 20 13.992 0.660 4.374
127 HB2 CYS 20 HB2 CYS 20 12.724 -1.551 4.992
128 HB3 CYS 20 HB3 CYS 20 11.317 -0.528 5.017
129 H LEU 21 H LEU 21 11.745 1.534 3.251
130 HA LEU 21 HA LEU 21 11.619 4.192 4.397
131 HB2 LEU 21 HB2 LEU 21 10.243 2.962 2.030
132 HB3 LEU 21 HB3 LEU 21 10.212 4.676 2.389
133 HG LEU 21 HG LEU 21 12.693 3.095 1.579
134 HD11 LEU 21 HD11 LEU 21 11.126 3.324 -0.265
135 HD12 LEU 21 HD12 LEU 21 12.523 4.407 -0.549
136 HD13 LEU 21 HD13 LEU 21 10.982 5.081 -0.001
137 HD21 LEU 21 HD21 LEU 21 13.281 5.009 2.971
138 HD22 LEU 21 HD22 LEU 21 12.285 6.115 1.994
139 HD23 LEU 21 HD23 LEU 21 13.737 5.344 1.265
140 H ALA 22 H ALA 22 9.684 5.342 4.989
141 HA ALA 22 HA ALA 22 7.957 3.907 6.721
142 HB1 ALA 22 HB1 ALA 22 6.652 6.071 6.865
143 HB2 ALA 22 HB2 ALA 22 8.412 6.382 6.987
144 HB3 ALA 22 HB3 ALA 22 7.547 6.708 5.448
145 H GLY 23 H GLY 23 6.297 2.574 6.278
146 HA2 GLY 23 HA2 GLY 23 4.117 2.186 5.028
147 HA3 GLY 23 HA3 GLY 23 4.890 2.858 3.618
148 H CYS 24 H CYS 24 7.371 1.152 4.727
149 HA CYS 24 HA CYS 24 6.670 -1.227 3.091
150 HB2 CYS 24 HB2 CYS 24 9.284 -0.067 3.998
151 HB3 CYS 24 HB3 CYS 24 9.104 -1.532 3.010
152 H VAL 25 H VAL 25 7.637 -3.289 3.875
153 HA VAL 25 HA VAL 25 7.781 -3.387 6.917
154 HB VAL 25 HB VAL 25 6.786 -5.715 6.711
155 HG11 VAL 25 HG11 VAL 25 4.419 -4.937 6.434
156 HG12 VAL 25 HG12 VAL 25 5.340 -3.948 7.529
157 HG13 VAL 25 HG13 VAL 25 5.023 -3.349 5.939
158 HG21 VAL 25 HG21 VAL 25 5.829 -4.700 3.941
159 HG22 VAL 25 HG22 VAL 25 7.204 -5.840 4.125
160 HG23 VAL 25 HG23 VAL 25 5.573 -6.324 4.627
161 H CYS 26 H CYS 26 8.903 -5.566 7.510
162 HA CYS 26 HA CYS 26 11.018 -6.120 5.518
163 HB2 CYS 26 HB2 CYS 26 11.904 -5.032 7.596
164 HB3 CYS 26 HB3 CYS 26 11.212 -6.352 8.539
165 H GLY 27 H GLY 27 11.102 -8.125 4.662
166 HA2 GLY 27 HA2 GLY 27 9.079 -9.985 5.777
167 HA3 GLY 27 HA3 GLY 27 9.867 -10.028 4.218
168 HA PRO 28 HA PRO 28 11.610 -13.197 7.317
169 HB2 PRO 28 HB2 PRO 28 10.720 -15.502 6.242
170 HB3 PRO 28 HB3 PRO 28 9.696 -14.415 7.231
171 HG2 PRO 28 HG2 PRO 28 9.936 -14.518 4.219
172 HG3 PRO 28 HG3 PRO 28 8.471 -14.747 5.241
173 HD2 PRO 28 HD2 PRO 28 9.078 -12.366 4.149
174 HD3 PRO 28 HD3 PRO 28 8.352 -12.519 5.822
175 H ASN 29 H ASN 29 11.873 -12.678 3.827
176 HA ASN 29 HA ASN 29 14.172 -14.488 3.564
177 HB2 ASN 29 HB2 ASN 29 12.985 -12.432 1.625
178 HB3 ASN 29 HB3 ASN 29 14.369 -13.407 1.254
179 HD21 ASN 29 HD21 ASN 29 13.620 -14.785 -0.353
180 HD22 ASN 29 HD22 ASN 29 12.168 -15.764 -0.138
181 H GLY 30 H GLY 30 13.725 -11.496 5.100
182 HA2 GLY 30 HA2 GLY 30 15.368 -10.108 5.961
183 HA3 GLY 30 HA3 GLY 30 16.646 -11.026 5.041
184 H PHE 31 H PHE 31 13.906 -9.900 3.351
185 HA PHE 31 HA PHE 31 15.371 -7.457 2.331
186 HB2 PHE 31 HB2 PHE 31 13.673 -9.419 0.709
187 HB3 PHE 31 HB3 PHE 31 14.275 -7.841 0.121
188 HD1 PHE 31 HD1 PHE 31 14.970 -11.357 0.330
189 HD2 PHE 31 HD2 PHE 31 16.890 -7.492 0.146
190 HE1 PHE 31 HE1 PHE 31 16.997 -12.468 -0.456
191 HE2 PHE 31 HE2 PHE 31 18.981 -8.609 -0.599
192 HZ PHE 31 HZ PHE 31 18.973 -11.120 -0.964
193 H CYS 32 H CYS 32 14.145 -5.729 1.892
194 HA CYS 32 HA CYS 32 11.768 -5.331 3.455
195 HB2 CYS 32 HB2 CYS 32 13.517 -3.489 2.829
196 HB3 CYS 32 HB3 CYS 32 12.984 -3.665 1.174
197 H GLY 33 H GLY 33 9.678 -4.883 2.726
198 HA2 GLY 33 HA2 GLY 33 9.005 -5.679 -0.075
199 HA3 GLY 33 HA3 GLY 33 8.304 -6.648 1.210
Start of MODEL 11
1 H1 GLY 1 H1 GLY 1 1.810 -0.298 0.819
2 H2 GLY 1 H2 GLY 1 2.880 0.680 1.536
3 H3 GLY 1 H3 GLY 1 2.166 1.149 0.137
4 HA2 GLY 1 HA2 GLY 1 3.970 -1.049 0.492
5 HA3 GLY 1 HA3 GLY 1 3.138 -0.627 -1.013
6 H CYS 2 H CYS 2 5.863 -0.710 -1.103
7 HA CYS 2 HA CYS 2 7.053 1.824 -0.458
8 HB2 CYS 2 HB2 CYS 2 7.893 -0.447 -2.299
9 HB3 CYS 2 HB3 CYS 2 8.983 0.861 -1.774
10 HA PRO 3 HA PRO 3 6.282 4.065 -4.108
11 HB2 PRO 3 HB2 PRO 3 8.314 5.764 -4.437
12 HB3 PRO 3 HB3 PRO 3 7.214 5.818 -3.037
13 HG2 PRO 3 HG2 PRO 3 9.981 4.548 -3.178
14 HG3 PRO 3 HG3 PRO 3 9.302 5.748 -2.010
15 HD2 PRO 3 HD2 PRO 3 9.346 2.998 -1.554
16 HD3 PRO 3 HD3 PRO 3 8.109 4.105 -0.867
17 H ARG 4 H ARG 4 6.996 4.512 -6.394
18 HA ARG 4 HA ARG 4 8.949 2.476 -7.318
19 HB2 ARG 4 HB2 ARG 4 6.363 3.226 -8.680
20 HB3 ARG 4 HB3 ARG 4 7.489 1.965 -9.211
21 HG2 ARG 4 HG2 ARG 4 6.889 0.697 -7.188
22 HG3 ARG 4 HG3 ARG 4 5.785 1.989 -6.717
23 HD2 ARG 4 HD2 ARG 4 4.422 1.579 -8.774
24 HD3 ARG 4 HD3 ARG 4 5.560 0.381 -9.317
25 HE ARG 4 HE ARG 4 4.707 -1.156 -7.863
26 HH11 ARG 4 HH11 ARG 4 3.350 1.966 -7.122
27 HH12 ARG 4 HH12 ARG 4 2.113 1.392 -6.060
28 HH21 ARG 4 HH21 ARG 4 3.147 -1.932 -6.392
29 HH22 ARG 4 HH22 ARG 4 2.013 -0.831 -5.637
30 HA PRO 5 HA PRO 5 9.770 6.615 -9.248
31 HB2 PRO 5 HB2 PRO 5 12.356 6.936 -8.727
32 HB3 PRO 5 HB3 PRO 5 11.073 7.367 -7.543
33 HG2 PRO 5 HG2 PRO 5 12.663 4.787 -7.631
34 HG3 PRO 5 HG3 PRO 5 12.417 5.920 -6.281
35 HD2 PRO 5 HD2 PRO 5 10.876 3.787 -6.559
36 HD3 PRO 5 HD3 PRO 5 10.217 5.346 -6.077
37 H ARG 6 H ARG 6 11.101 3.434 -9.572
38 HA ARG 6 HA ARG 6 11.969 4.102 -12.377
39 HB2 ARG 6 HB2 ARG 6 13.491 2.300 -10.461
40 HB3 ARG 6 HB3 ARG 6 13.842 2.507 -12.191
41 HG2 ARG 6 HG2 ARG 6 13.854 4.776 -10.247
42 HG3 ARG 6 HG3 ARG 6 15.294 3.769 -10.562
43 HD2 ARG 6 HD2 ARG 6 15.042 4.359 -13.022
44 HD3 ARG 6 HD3 ARG 6 13.711 5.424 -12.578
45 HE ARG 6 HE ARG 6 15.877 6.247 -11.004
46 HH11 ARG 6 HH11 ARG 6 15.269 5.879 -14.487
47 HH12 ARG 6 HH12 ARG 6 16.337 7.197 -14.919
48 HH21 ARG 6 HH21 ARG 6 17.263 7.924 -11.666
49 HH22 ARG 6 HH22 ARG 6 17.491 8.218 -13.370
50 H GLY 7 H GLY 7 11.318 1.419 -10.038
51 HA2 GLY 7 HA2 GLY 7 9.575 -0.197 -10.220
52 HA3 GLY 7 HA3 GLY 7 9.275 0.363 -11.870
53 H ASP 8 H ASP 8 12.589 0.029 -11.467
54 HA ASP 8 HA ASP 8 12.604 -2.755 -12.485
55 HB2 ASP 8 HB2 ASP 8 13.101 -0.875 -14.167
56 HB3 ASP 8 HB3 ASP 8 14.537 -0.524 -13.168
57 H ASN 9 H ASN 9 13.215 -1.179 -9.773
58 HA ASN 9 HA ASN 9 16.077 -1.936 -9.532
59 HB2 ASN 9 HB2 ASN 9 16.270 -0.058 -8.330
60 HB3 ASN 9 HB3 ASN 9 14.567 0.278 -8.660
61 HD21 ASN 9 HD21 ASN 9 12.985 -0.779 -7.113
62 HD22 ASN 9 HD22 ASN 9 13.492 -0.800 -5.480
63 HA PRO 10 HA PRO 10 15.172 -5.516 -7.048
64 HB2 PRO 10 HB2 PRO 10 17.496 -5.813 -5.691
65 HB3 PRO 10 HB3 PRO 10 17.374 -6.057 -7.424
66 HG2 PRO 10 HG2 PRO 10 18.423 -3.651 -5.946
67 HG3 PRO 10 HG3 PRO 10 19.093 -4.490 -7.340
68 HD2 PRO 10 HD2 PRO 10 17.580 -2.228 -7.585
69 HD3 PRO 10 HD3 PRO 10 17.598 -3.525 -8.833
70 HA PRO 11 HA PRO 11 14.069 -4.176 -2.969
71 HB2 PRO 11 HB2 PRO 11 14.191 -6.395 -1.459
72 HB3 PRO 11 HB3 PRO 11 12.948 -6.210 -2.667
73 HG2 PRO 11 HG2 PRO 11 15.568 -7.657 -2.947
74 HG3 PRO 11 HG3 PRO 11 13.900 -8.286 -3.345
75 HD2 PRO 11 HD2 PRO 11 15.530 -7.262 -5.229
76 HD3 PRO 11 HD3 PRO 11 13.771 -6.992 -5.320
77 H LEU 12 H LEU 12 15.007 -3.557 -0.958
78 HA LEU 12 HA LEU 12 17.992 -3.943 -0.830
79 HB2 LEU 12 HB2 LEU 12 17.902 -2.183 0.900
80 HB3 LEU 12 HB3 LEU 12 17.196 -1.621 -0.603
81 HG LEU 12 HG LEU 12 15.187 -2.647 1.245
82 HD11 LEU 12 HD11 LEU 12 16.816 -0.266 2.100
83 HD12 LEU 12 HD12 LEU 12 16.708 -1.832 2.903
84 HD13 LEU 12 HD13 LEU 12 15.266 -0.820 2.841
85 HD21 LEU 12 HD21 LEU 12 14.068 -0.559 0.610
86 HD22 LEU 12 HD22 LEU 12 14.720 -1.412 -0.802
87 HD23 LEU 12 HD23 LEU 12 15.557 0.039 -0.162
88 H THR 13 H THR 13 18.913 -4.687 1.212
89 HA THR 13 HA THR 13 17.302 -6.729 2.475
90 HB THR 13 HB THR 13 19.366 -6.890 3.938
91 HG1 THR 13 HG1 THR 13 21.180 -5.773 3.228
92 HG21 THR 13 HG21 THR 13 20.563 -8.082 2.267
93 HG22 THR 13 HG22 THR 13 19.760 -7.148 0.957
94 HG23 THR 13 HG23 THR 13 18.804 -8.288 1.949
95 H CYS 14 H CYS 14 16.979 -6.943 4.753
96 HA CYS 14 HA CYS 14 17.258 -4.492 6.401
97 HB2 CYS 14 HB2 CYS 14 14.806 -4.537 6.937
98 HB3 CYS 14 HB3 CYS 14 15.060 -4.204 5.201
99 H SER 15 H SER 15 16.688 -4.976 8.689
100 HA SER 15 HA SER 15 16.687 -7.907 9.257
101 HB2 SER 15 HB2 SER 15 18.791 -7.603 9.978
102 HB3 SER 15 HB3 SER 15 18.625 -5.830 10.050
103 HG SER 15 HG SER 15 17.155 -7.297 11.905
104 H GLN 16 H GLN 16 15.371 -4.826 9.696
105 HA GLN 16 HA GLN 16 13.267 -6.001 11.418
106 HB2 GLN 16 HB2 GLN 16 13.260 -4.180 13.041
107 HB3 GLN 16 HB3 GLN 16 14.796 -5.049 13.070
108 HG2 GLN 16 HG2 GLN 16 15.725 -3.218 11.592
109 HG3 GLN 16 HG3 GLN 16 14.275 -2.288 11.868
110 HE21 GLN 16 HE21 GLN 16 13.734 -1.695 14.151
111 HE22 GLN 16 HE22 GLN 16 15.043 -1.525 15.316
112 H ASP 17 H ASP 17 11.326 -4.474 11.358
113 HA ASP 17 HA ASP 17 10.810 -3.524 8.774
114 HB2 ASP 17 HB2 ASP 17 9.525 -3.482 11.451
115 HB3 ASP 17 HB3 ASP 17 9.024 -2.182 10.299
116 H SER 18 H SER 18 12.153 -1.818 11.559
117 HA SER 18 HA SER 18 11.543 0.830 10.479
118 HB2 SER 18 HB2 SER 18 12.062 0.356 12.877
119 HB3 SER 18 HB3 SER 18 13.746 0.012 12.401
120 HG SER 18 HG SER 18 12.796 2.400 11.478
121 H ASP 19 H ASP 19 13.958 -1.515 9.441
122 HA ASP 19 HA ASP 19 15.950 0.362 8.584
123 HB2 ASP 19 HB2 ASP 19 15.205 -2.445 7.677
124 HB3 ASP 19 HB3 ASP 19 16.606 -1.518 6.984
125 H CYS 20 H CYS 20 12.859 -0.677 7.460
126 HA CYS 20 HA CYS 20 13.313 0.297 4.663
127 HB2 CYS 20 HB2 CYS 20 10.820 -0.753 6.084
128 HB3 CYS 20 HB3 CYS 20 10.947 -0.338 4.396
129 H LEU 21 H LEU 21 11.473 1.555 3.683
130 HA LEU 21 HA LEU 21 11.329 4.136 5.021
131 HB2 LEU 21 HB2 LEU 21 10.046 3.114 2.495
132 HB3 LEU 21 HB3 LEU 21 10.032 4.781 2.977
133 HG LEU 21 HG LEU 21 12.493 3.232 2.008
134 HD11 LEU 21 HD11 LEU 21 10.943 5.541 0.730
135 HD12 LEU 21 HD12 LEU 21 10.818 3.871 0.235
136 HD13 LEU 21 HD13 LEU 21 12.380 4.676 0.059
137 HD21 LEU 21 HD21 LEU 21 13.636 5.421 2.085
138 HD22 LEU 21 HD22 LEU 21 13.098 4.908 3.721
139 HD23 LEU 21 HD23 LEU 21 12.181 6.178 2.817
140 H ALA 22 H ALA 22 9.155 5.246 5.259
141 HA ALA 22 HA ALA 22 7.272 3.633 6.747
142 HB1 ALA 22 HB1 ALA 22 6.802 6.416 5.437
143 HB2 ALA 22 HB2 ALA 22 5.823 5.711 6.715
144 HB3 ALA 22 HB3 ALA 22 7.487 6.210 7.045
145 H GLY 23 H GLY 23 5.418 2.509 5.983
146 HA2 GLY 23 HA2 GLY 23 3.787 1.910 4.261
147 HA3 GLY 23 HA3 GLY 23 4.762 2.711 3.046
148 H CYS 24 H CYS 24 7.068 1.040 4.630
149 HA CYS 24 HA CYS 24 6.737 -1.379 2.892
150 HB2 CYS 24 HB2 CYS 24 9.156 0.174 3.753
151 HB3 CYS 24 HB3 CYS 24 9.221 -1.307 2.789
152 H VAL 25 H VAL 25 7.772 -3.308 3.784
153 HA VAL 25 HA VAL 25 8.058 -3.207 6.808
154 HB VAL 25 HB VAL 25 7.033 -5.511 6.855
155 HG11 VAL 25 HG11 VAL 25 5.290 -3.217 5.866
156 HG12 VAL 25 HG12 VAL 25 4.620 -4.771 6.418
157 HG13 VAL 25 HG13 VAL 25 5.586 -3.757 7.539
158 HG21 VAL 25 HG21 VAL 25 5.634 -6.197 4.798
159 HG22 VAL 25 HG22 VAL 25 6.365 -4.824 3.893
160 HG23 VAL 25 HG23 VAL 25 7.374 -6.175 4.467
161 H CYS 26 H CYS 26 9.224 -5.250 7.520
162 HA CYS 26 HA CYS 26 11.258 -5.993 5.458
163 HB2 CYS 26 HB2 CYS 26 12.138 -4.995 7.630
164 HB3 CYS 26 HB3 CYS 26 11.407 -6.352 8.483
165 H GLY 27 H GLY 27 11.371 -8.167 4.785
166 HA2 GLY 27 HA2 GLY 27 9.147 -9.783 5.948
167 HA3 GLY 27 HA3 GLY 27 9.900 -9.945 4.357
168 HA PRO 28 HA PRO 28 11.583 -13.134 7.551
169 HB2 PRO 28 HB2 PRO 28 10.445 -14.978 5.486
170 HB3 PRO 28 HB3 PRO 28 10.407 -15.102 7.267
171 HG2 PRO 28 HG2 PRO 28 8.189 -14.507 5.914
172 HG3 PRO 28 HG3 PRO 28 8.568 -13.629 7.424
173 HD2 PRO 28 HD2 PRO 28 9.065 -12.796 4.556
174 HD3 PRO 28 HD3 PRO 28 8.322 -11.861 5.931
175 H ASN 29 H ASN 29 11.575 -12.613 4.066
176 HA ASN 29 HA ASN 29 13.736 -14.373 3.389
177 HB2 ASN 29 HB2 ASN 29 12.795 -11.796 1.964
178 HB3 ASN 29 HB3 ASN 29 13.680 -13.159 1.252
179 HD21 ASN 29 HD21 ASN 29 12.473 -14.740 0.314
180 HD22 ASN 29 HD22 ASN 29 10.730 -14.794 0.516
181 H GLY 30 H GLY 30 13.611 -11.363 5.132
182 HA2 GLY 30 HA2 GLY 30 15.378 -10.147 6.022
183 HA3 GLY 30 HA3 GLY 30 16.547 -11.130 5.042
184 H PHE 31 H PHE 31 13.925 -9.965 3.320
185 HA PHE 31 HA PHE 31 15.399 -7.519 2.276
186 HB2 PHE 31 HB2 PHE 31 13.764 -9.644 0.743
187 HB3 PHE 31 HB3 PHE 31 14.099 -8.000 0.150
188 HD1 PHE 31 HD1 PHE 31 15.518 -11.363 0.739
189 HD2 PHE 31 HD2 PHE 31 16.432 -7.264 -0.461
190 HE1 PHE 31 HE1 PHE 31 17.675 -12.124 -0.148
191 HE2 PHE 31 HE2 PHE 31 18.622 -8.057 -1.314
192 HZ PHE 31 HZ PHE 31 19.187 -10.514 -1.219
193 H CYS 32 H CYS 32 14.166 -5.816 1.797
194 HA CYS 32 HA CYS 32 11.777 -5.408 3.334
195 HB2 CYS 32 HB2 CYS 32 13.717 -3.701 2.653
196 HB3 CYS 32 HB3 CYS 32 12.847 -3.656 1.116
197 H GLY 33 H GLY 33 9.708 -4.839 2.589
198 HA2 GLY 33 HA2 GLY 33 9.090 -5.371 -0.261
199 HA3 GLY 33 HA3 GLY 33 8.414 -6.521 0.897
Start of MODEL 12
1 H1 GLY 1 H1 GLY 1 1.886 1.158 0.277
2 H2 GLY 1 H2 GLY 1 2.920 2.226 0.883
3 H3 GLY 1 H3 GLY 1 2.505 2.326 -0.704
4 HA2 GLY 1 HA2 GLY 1 3.954 0.140 0.520
5 HA3 GLY 1 HA3 GLY 1 3.474 0.275 -1.177
6 H CYS 2 H CYS 2 6.040 -0.043 -1.182
7 HA CYS 2 HA CYS 2 7.531 2.383 -0.658
8 HB2 CYS 2 HB2 CYS 2 8.178 -0.124 -2.277
9 HB3 CYS 2 HB3 CYS 2 9.399 1.021 -1.689
10 HA PRO 3 HA PRO 3 7.133 4.218 -4.549
11 HB2 PRO 3 HB2 PRO 3 9.516 5.316 -5.228
12 HB3 PRO 3 HB3 PRO 3 8.501 5.917 -3.867
13 HG2 PRO 3 HG2 PRO 3 10.853 4.040 -3.720
14 HG3 PRO 3 HG3 PRO 3 10.544 5.580 -2.844
15 HD2 PRO 3 HD2 PRO 3 9.989 3.100 -1.786
16 HD3 PRO 3 HD3 PRO 3 8.990 4.552 -1.447
17 H ARG 4 H ARG 4 7.458 3.832 -6.800
18 HA ARG 4 HA ARG 4 8.952 1.445 -7.360
19 HB2 ARG 4 HB2 ARG 4 7.014 0.970 -8.951
20 HB3 ARG 4 HB3 ARG 4 6.814 0.620 -7.369
21 HG2 ARG 4 HG2 ARG 4 5.564 2.550 -7.045
22 HG3 ARG 4 HG3 ARG 4 5.881 3.056 -8.565
23 HD2 ARG 4 HD2 ARG 4 3.763 2.190 -8.697
24 HD3 ARG 4 HD3 ARG 4 4.708 1.009 -9.313
25 HE ARG 4 HE ARG 4 4.415 0.547 -6.607
26 HH11 ARG 4 HH11 ARG 4 2.988 -1.042 -5.862
27 HH12 ARG 4 HH12 ARG 4 1.722 -1.623 -6.892
28 HH21 ARG 4 HH21 ARG 4 2.583 0.437 -9.587
29 HH22 ARG 4 HH22 ARG 4 1.492 -0.780 -9.015
30 HA PRO 5 HA PRO 5 9.838 4.678 -10.526
31 HB2 PRO 5 HB2 PRO 5 12.491 4.834 -10.390
32 HB3 PRO 5 HB3 PRO 5 11.423 5.704 -9.244
33 HG2 PRO 5 HG2 PRO 5 12.805 3.081 -8.801
34 HG3 PRO 5 HG3 PRO 5 12.804 4.554 -7.808
35 HD2 PRO 5 HD2 PRO 5 11.130 2.563 -7.291
36 HD3 PRO 5 HD3 PRO 5 10.645 4.263 -7.168
37 H ARG 6 H ARG 6 10.989 1.447 -10.014
38 HA ARG 6 HA ARG 6 11.511 1.062 -12.847
39 HB2 ARG 6 HB2 ARG 6 13.383 0.539 -10.809
40 HB3 ARG 6 HB3 ARG 6 13.295 -0.517 -12.051
41 HG2 ARG 6 HG2 ARG 6 14.888 0.861 -12.782
42 HG3 ARG 6 HG3 ARG 6 13.568 1.535 -13.468
43 HD2 ARG 6 HD2 ARG 6 13.456 3.085 -11.633
44 HD3 ARG 6 HD3 ARG 6 14.845 2.454 -11.052
45 HE ARG 6 HE ARG 6 16.076 3.586 -12.592
46 HH11 ARG 6 HH11 ARG 6 16.311 5.183 -14.178
47 HH12 ARG 6 HH12 ARG 6 14.917 5.799 -15.000
48 HH21 ARG 6 HH21 ARG 6 12.647 3.775 -13.268
49 HH22 ARG 6 HH22 ARG 6 12.829 4.997 -14.481
50 H GLY 7 H GLY 7 10.734 -0.982 -13.634
51 HA2 GLY 7 HA2 GLY 7 8.795 -2.171 -11.741
52 HA3 GLY 7 HA3 GLY 7 8.978 -2.539 -13.480
53 H ASP 8 H ASP 8 12.000 -2.728 -12.940
54 HA ASP 8 HA ASP 8 11.985 -5.538 -12.016
55 HB2 ASP 8 HB2 ASP 8 13.997 -5.839 -13.332
56 HB3 ASP 8 HB3 ASP 8 12.797 -5.049 -14.359
57 H ASN 9 H ASN 9 12.206 -2.985 -10.384
58 HA ASN 9 HA ASN 9 14.919 -2.560 -9.701
59 HB2 ASN 9 HB2 ASN 9 14.114 -1.229 -7.873
60 HB3 ASN 9 HB3 ASN 9 12.883 -1.092 -9.143
61 HD21 ASN 9 HD21 ASN 9 10.884 -2.289 -8.817
62 HD22 ASN 9 HD22 ASN 9 10.465 -2.778 -7.200
63 HA PRO 10 HA PRO 10 15.852 -6.183 -7.331
64 HB2 PRO 10 HB2 PRO 10 18.128 -5.341 -6.100
65 HB3 PRO 10 HB3 PRO 10 18.106 -5.676 -7.843
66 HG2 PRO 10 HG2 PRO 10 17.950 -3.028 -6.474
67 HG3 PRO 10 HG3 PRO 10 18.870 -3.555 -7.877
68 HD2 PRO 10 HD2 PRO 10 16.572 -2.215 -8.117
69 HD3 PRO 10 HD3 PRO 10 17.087 -3.481 -9.282
70 HA PRO 11 HA PRO 11 14.438 -5.151 -3.249
71 HB2 PRO 11 HB2 PRO 11 15.131 -7.290 -1.786
72 HB3 PRO 11 HB3 PRO 11 13.887 -7.418 -3.047
73 HG2 PRO 11 HG2 PRO 11 16.857 -8.112 -3.168
74 HG3 PRO 11 HG3 PRO 11 15.442 -9.154 -3.702
75 HD2 PRO 11 HD2 PRO 11 16.847 -7.640 -5.485
76 HD3 PRO 11 HD3 PRO 11 15.097 -7.950 -5.678
77 H LEU 12 H LEU 12 15.151 -4.599 -1.174
78 HA LEU 12 HA LEU 12 18.149 -4.297 -0.892
79 HB2 LEU 12 HB2 LEU 12 17.765 -2.346 0.469
80 HB3 LEU 12 HB3 LEU 12 16.958 -2.107 -1.083
81 HG LEU 12 HG LEU 12 15.040 -3.194 0.745
82 HD11 LEU 12 HD11 LEU 12 14.973 -1.491 2.428
83 HD12 LEU 12 HD12 LEU 12 16.473 -0.762 1.766
84 HD13 LEU 12 HD13 LEU 12 16.533 -2.393 2.486
85 HD21 LEU 12 HD21 LEU 12 13.845 -1.169 0.181
86 HD22 LEU 12 HD22 LEU 12 14.576 -1.892 -1.255
87 HD23 LEU 12 HD23 LEU 12 15.317 -0.438 -0.521
88 H THR 13 H THR 13 19.019 -4.764 1.187
89 HA THR 13 HA THR 13 17.455 -6.835 2.523
90 HB THR 13 HB THR 13 19.497 -6.914 4.019
91 HG1 THR 13 HG1 THR 13 21.306 -5.766 3.327
92 HG21 THR 13 HG21 THR 13 20.025 -7.132 1.019
93 HG22 THR 13 HG22 THR 13 19.056 -8.277 1.970
94 HG23 THR 13 HG23 THR 13 20.774 -8.073 2.345
95 H CYS 14 H CYS 14 16.955 -6.974 4.712
96 HA CYS 14 HA CYS 14 17.353 -4.585 6.396
97 HB2 CYS 14 HB2 CYS 14 14.901 -4.449 6.958
98 HB3 CYS 14 HB3 CYS 14 15.165 -4.128 5.214
99 H SER 15 H SER 15 16.673 -5.045 8.663
100 HA SER 15 HA SER 15 16.544 -7.973 9.254
101 HB2 SER 15 HB2 SER 15 18.695 -7.784 9.928
102 HB3 SER 15 HB3 SER 15 18.657 -6.023 9.906
103 HG SER 15 HG SER 15 17.305 -7.440 11.909
104 H GLN 16 H GLN 16 15.379 -4.832 9.603
105 HA GLN 16 HA GLN 16 13.412 -5.787 11.620
106 HB2 GLN 16 HB2 GLN 16 13.603 -3.656 12.873
107 HB3 GLN 16 HB3 GLN 16 15.012 -4.667 12.991
108 HG2 GLN 16 HG2 GLN 16 16.145 -3.194 11.284
109 HG3 GLN 16 HG3 GLN 16 14.770 -2.097 11.286
110 HE21 GLN 16 HE21 GLN 16 17.233 -1.112 11.930
111 HE22 GLN 16 HE22 GLN 16 17.330 -0.776 13.680
112 H ASP 17 H ASP 17 11.478 -4.280 11.471
113 HA ASP 17 HA ASP 17 10.888 -3.401 8.828
114 HB2 ASP 17 HB2 ASP 17 9.582 -2.879 11.516
115 HB3 ASP 17 HB3 ASP 17 8.900 -2.380 9.935
116 H SER 18 H SER 18 12.277 -1.798 11.650
117 HA SER 18 HA SER 18 11.754 0.924 10.761
118 HB2 SER 18 HB2 SER 18 14.007 -0.111 12.538
119 HB3 SER 18 HB3 SER 18 13.394 1.570 12.404
120 HG SER 18 HG SER 18 12.351 -0.660 13.661
121 H ASP 19 H ASP 19 13.908 -1.414 9.439
122 HA ASP 19 HA ASP 19 15.963 0.431 8.515
123 HB2 ASP 19 HB2 ASP 19 15.086 -2.332 7.603
124 HB3 ASP 19 HB3 ASP 19 16.474 -1.423 6.859
125 H CYS 20 H CYS 20 12.764 -0.416 7.658
126 HA CYS 20 HA CYS 20 13.070 0.571 4.824
127 HB2 CYS 20 HB2 CYS 20 10.783 -0.846 6.268
128 HB3 CYS 20 HB3 CYS 20 10.809 -0.381 4.562
129 H LEU 21 H LEU 21 11.155 1.781 3.964
130 HA LEU 21 HA LEU 21 10.814 4.207 5.527
131 HB2 LEU 21 HB2 LEU 21 9.647 3.319 2.903
132 HB3 LEU 21 HB3 LEU 21 9.478 4.939 3.533
133 HG LEU 21 HG LEU 21 12.152 3.747 2.618
134 HD11 LEU 21 HD11 LEU 21 10.301 5.783 1.258
135 HD12 LEU 21 HD12 LEU 21 10.474 4.114 0.754
136 HD13 LEU 21 HD13 LEU 21 11.860 5.193 0.623
137 HD21 LEU 21 HD21 LEU 21 12.941 6.064 2.780
138 HD22 LEU 21 HD22 LEU 21 12.333 5.513 4.344
139 HD23 LEU 21 HD23 LEU 21 11.364 6.595 3.360
140 H ALA 22 H ALA 22 8.612 5.135 5.956
141 HA ALA 22 HA ALA 22 6.816 3.214 7.184
142 HB1 ALA 22 HB1 ALA 22 5.243 5.208 7.421
143 HB2 ALA 22 HB2 ALA 22 6.897 5.658 7.935
144 HB3 ALA 22 HB3 ALA 22 6.269 6.146 6.323
145 H GLY 23 H GLY 23 5.177 2.001 6.259
146 HA2 GLY 23 HA2 GLY 23 3.529 1.609 4.434
147 HA3 GLY 23 HA3 GLY 23 4.474 2.630 3.375
148 H CYS 24 H CYS 24 6.875 1.004 4.743
149 HA CYS 24 HA CYS 24 6.775 -1.253 2.782
150 HB2 CYS 24 HB2 CYS 24 9.056 0.458 3.826
151 HB3 CYS 24 HB3 CYS 24 9.294 -0.950 2.780
152 H VAL 25 H VAL 25 7.750 -3.188 3.650
153 HA VAL 25 HA VAL 25 7.941 -3.196 6.695
154 HB VAL 25 HB VAL 25 6.821 -5.488 6.616
155 HG11 VAL 25 HG11 VAL 25 5.196 -3.043 5.709
156 HG12 VAL 25 HG12 VAL 25 4.452 -4.596 6.214
157 HG13 VAL 25 HG13 VAL 25 5.442 -3.662 7.369
158 HG21 VAL 25 HG21 VAL 25 7.188 -5.980 4.149
159 HG22 VAL 25 HG22 VAL 25 5.483 -6.040 4.559
160 HG23 VAL 25 HG23 VAL 25 6.091 -4.619 3.715
161 H CYS 26 H CYS 26 9.109 -5.145 7.472
162 HA CYS 26 HA CYS 26 11.138 -5.986 5.501
163 HB2 CYS 26 HB2 CYS 26 11.983 -4.815 7.596
164 HB3 CYS 26 HB3 CYS 26 11.313 -6.186 8.505
165 H GLY 27 H GLY 27 11.171 -8.059 4.792
166 HA2 GLY 27 HA2 GLY 27 9.106 -9.779 6.113
167 HA3 GLY 27 HA3 GLY 27 9.737 -9.870 4.451
168 HA PRO 28 HA PRO 28 11.514 -13.231 7.354
169 HB2 PRO 28 HB2 PRO 28 10.354 -14.949 5.195
170 HB3 PRO 28 HB3 PRO 28 10.304 -15.180 6.968
171 HG2 PRO 28 HG2 PRO 28 8.159 -14.434 5.622
172 HG3 PRO 28 HG3 PRO 28 8.578 -13.677 7.201
173 HD2 PRO 28 HD2 PRO 28 8.999 -12.642 4.409
174 HD3 PRO 28 HD3 PRO 28 8.309 -11.821 5.901
175 H ASN 29 H ASN 29 11.765 -12.501 3.912
176 HA ASN 29 HA ASN 29 13.964 -14.412 3.505
177 HB2 ASN 29 HB2 ASN 29 12.989 -12.123 1.680
178 HB3 ASN 29 HB3 ASN 29 14.074 -13.462 1.269
179 HD21 ASN 29 HD21 ASN 29 11.430 -12.633 0.175
180 HD22 ASN 29 HD22 ASN 29 10.456 -14.066 0.323
181 H GLY 30 H GLY 30 13.712 -11.470 5.188
182 HA2 GLY 30 HA2 GLY 30 15.417 -10.124 5.994
183 HA3 GLY 30 HA3 GLY 30 16.617 -11.037 5.059
184 H PHE 31 H PHE 31 13.890 -9.932 3.392
185 HA PHE 31 HA PHE 31 15.344 -7.518 2.258
186 HB2 PHE 31 HB2 PHE 31 13.490 -9.465 0.788
187 HB3 PHE 31 HB3 PHE 31 14.171 -7.941 0.145
188 HD1 PHE 31 HD1 PHE 31 14.563 -11.420 0.159
189 HD2 PHE 31 HD2 PHE 31 16.919 -7.821 0.271
190 HE1 PHE 31 HE1 PHE 31 16.474 -12.703 -0.662
191 HE2 PHE 31 HE2 PHE 31 18.883 -9.076 -0.503
192 HZ PHE 31 HZ PHE 31 18.625 -11.578 -1.038
193 H CYS 32 H CYS 32 14.118 -5.783 1.769
194 HA CYS 32 HA CYS 32 11.719 -5.410 3.338
195 HB2 CYS 32 HB2 CYS 32 13.662 -3.627 2.780
196 HB3 CYS 32 HB3 CYS 32 12.792 -3.522 1.256
197 H GLY 33 H GLY 33 9.680 -4.783 2.564
198 HA2 GLY 33 HA2 GLY 33 9.163 -5.383 -0.342
199 HA3 GLY 33 HA3 GLY 33 8.234 -6.264 0.868
Start of MODEL 13
1 H1 GLY 1 H1 GLY 1 5.883 -2.674 -0.630
2 H2 GLY 1 H2 GLY 1 4.290 -2.910 -0.973
3 H3 GLY 1 H3 GLY 1 5.413 -2.980 -2.181
4 HA2 GLY 1 HA2 GLY 1 4.204 -0.932 -2.276
5 HA3 GLY 1 HA3 GLY 1 4.714 -0.606 -0.611
6 H CYS 2 H CYS 2 6.173 0.933 -0.602
7 HA CYS 2 HA CYS 2 8.155 1.959 -0.848
8 HB2 CYS 2 HB2 CYS 2 9.205 -0.528 -2.193
9 HB3 CYS 2 HB3 CYS 2 10.060 0.598 -1.126
10 HA PRO 3 HA PRO 3 8.675 3.692 -4.808
11 HB2 PRO 3 HB2 PRO 3 11.331 4.340 -5.056
12 HB3 PRO 3 HB3 PRO 3 10.228 5.237 -3.964
13 HG2 PRO 3 HG2 PRO 3 12.108 2.987 -3.300
14 HG3 PRO 3 HG3 PRO 3 11.939 4.584 -2.503
15 HD2 PRO 3 HD2 PRO 3 10.749 2.400 -1.497
16 HD3 PRO 3 HD3 PRO 3 9.912 3.986 -1.495
17 H ARG 4 H ARG 4 9.045 2.967 -6.900
18 HA ARG 4 HA ARG 4 9.766 0.209 -7.167
19 HB2 ARG 4 HB2 ARG 4 9.389 0.484 -9.544
20 HB3 ARG 4 HB3 ARG 4 8.125 1.345 -8.658
21 HG2 ARG 4 HG2 ARG 4 9.313 3.484 -9.084
22 HG3 ARG 4 HG3 ARG 4 10.562 2.592 -9.984
23 HD2 ARG 4 HD2 ARG 4 8.803 1.750 -11.529
24 HD3 ARG 4 HD3 ARG 4 7.603 2.743 -10.672
25 HE ARG 4 HE ARG 4 9.794 4.373 -11.506
26 HH11 ARG 4 HH11 ARG 4 7.068 2.642 -12.928
27 HH12 ARG 4 HH12 ARG 4 6.948 3.730 -14.291
28 HH21 ARG 4 HH21 ARG 4 9.583 5.739 -13.270
29 HH22 ARG 4 HH22 ARG 4 8.357 5.449 -14.474
30 HA PRO 5 HA PRO 5 14.083 0.652 -7.662
31 HB2 PRO 5 HB2 PRO 5 14.785 -1.528 -9.130
32 HB3 PRO 5 HB3 PRO 5 14.187 -1.662 -7.448
33 HG2 PRO 5 HG2 PRO 5 12.638 -1.976 -10.017
34 HG3 PRO 5 HG3 PRO 5 12.720 -3.074 -8.602
35 HD2 PRO 5 HD2 PRO 5 10.715 -1.307 -8.934
36 HD3 PRO 5 HD3 PRO 5 11.379 -1.684 -7.305
37 H ARG 6 H ARG 6 15.839 0.884 -9.284
38 HA ARG 6 HA ARG 6 15.037 2.733 -11.374
39 HB2 ARG 6 HB2 ARG 6 17.685 1.443 -10.589
40 HB3 ARG 6 HB3 ARG 6 17.529 2.689 -11.848
41 HG2 ARG 6 HG2 ARG 6 16.556 4.228 -10.194
42 HG3 ARG 6 HG3 ARG 6 16.816 3.029 -8.916
43 HD2 ARG 6 HD2 ARG 6 19.205 3.115 -9.204
44 HD3 ARG 6 HD3 ARG 6 19.049 4.049 -10.696
45 HE ARG 6 HE ARG 6 18.752 5.992 -9.492
46 HH11 ARG 6 HH11 ARG 6 18.577 3.295 -7.206
47 HH12 ARG 6 HH12 ARG 6 18.654 4.349 -5.821
48 HH21 ARG 6 HH21 ARG 6 18.847 7.268 -7.681
49 HH22 ARG 6 HH22 ARG 6 18.793 6.552 -6.087
50 H GLY 7 H GLY 7 15.489 -0.612 -11.284
51 HA2 GLY 7 HA2 GLY 7 15.004 -0.997 -14.106
52 HA3 GLY 7 HA3 GLY 7 16.702 -1.402 -13.632
53 H ASP 8 H ASP 8 16.061 -3.763 -13.866
54 HA ASP 8 HA ASP 8 14.003 -4.838 -12.149
55 HB2 ASP 8 HB2 ASP 8 16.262 -6.203 -13.638
56 HB3 ASP 8 HB3 ASP 8 14.811 -6.982 -12.978
57 H ASN 9 H ASN 9 16.321 -3.327 -10.874
58 HA ASN 9 HA ASN 9 18.052 -5.079 -9.527
59 HB2 ASN 9 HB2 ASN 9 16.922 -2.409 -8.605
60 HB3 ASN 9 HB3 ASN 9 18.293 -3.234 -7.849
61 HD21 ASN 9 HD21 ASN 9 18.773 -0.777 -8.600
62 HD22 ASN 9 HD22 ASN 9 19.714 -0.711 -10.079
63 HA PRO 10 HA PRO 10 15.347 -6.944 -6.540
64 HB2 PRO 10 HB2 PRO 10 17.124 -7.762 -4.642
65 HB3 PRO 10 HB3 PRO 10 17.102 -8.476 -6.295
66 HG2 PRO 10 HG2 PRO 10 18.850 -6.281 -5.203
67 HG3 PRO 10 HG3 PRO 10 19.321 -7.778 -6.065
68 HD2 PRO 10 HD2 PRO 10 19.070 -5.416 -7.352
69 HD3 PRO 10 HD3 PRO 10 18.590 -6.952 -8.140
70 HA PRO 11 HA PRO 11 14.483 -4.015 -3.327
71 HB2 PRO 11 HB2 PRO 11 13.566 -5.521 -1.234
72 HB3 PRO 11 HB3 PRO 11 12.635 -5.322 -2.741
73 HG2 PRO 11 HG2 PRO 11 14.498 -7.548 -1.955
74 HG3 PRO 11 HG3 PRO 11 12.796 -7.658 -2.523
75 HD2 PRO 11 HD2 PRO 11 14.851 -8.021 -4.206
76 HD3 PRO 11 HD3 PRO 11 13.407 -7.086 -4.733
77 H LEU 12 H LEU 12 15.159 -3.207 -1.213
78 HA LEU 12 HA LEU 12 17.928 -3.758 -0.660
79 HB2 LEU 12 HB2 LEU 12 17.665 -2.072 1.103
80 HB3 LEU 12 HB3 LEU 12 16.982 -1.520 -0.423
81 HG LEU 12 HG LEU 12 14.816 -2.665 0.953
82 HD11 LEU 12 HD11 LEU 12 16.454 -0.865 2.778
83 HD12 LEU 12 HD12 LEU 12 16.114 -2.592 3.032
84 HD13 LEU 12 HD13 LEU 12 14.786 -1.419 3.074
85 HD21 LEU 12 HD21 LEU 12 13.986 -0.343 0.994
86 HD22 LEU 12 HD22 LEU 12 14.743 -0.739 -0.565
87 HD23 LEU 12 HD23 LEU 12 15.628 0.244 0.628
88 H THR 13 H THR 13 18.846 -4.508 1.291
89 HA THR 13 HA THR 13 17.396 -6.756 2.490
90 HB THR 13 HB THR 13 19.554 -6.981 3.800
91 HG1 THR 13 HG1 THR 13 20.028 -4.677 3.594
92 HG21 THR 13 HG21 THR 13 19.871 -6.770 0.782
93 HG22 THR 13 HG22 THR 13 19.284 -8.190 1.687
94 HG23 THR 13 HG23 THR 13 20.962 -7.639 1.893
95 H CYS 14 H CYS 14 16.898 -6.951 4.713
96 HA CYS 14 HA CYS 14 17.239 -4.595 6.459
97 HB2 CYS 14 HB2 CYS 14 14.801 -4.582 6.966
98 HB3 CYS 14 HB3 CYS 14 15.130 -4.134 5.282
99 H SER 15 H SER 15 16.446 -5.199 8.639
100 HA SER 15 HA SER 15 16.313 -8.148 9.126
101 HB2 SER 15 HB2 SER 15 18.422 -7.955 9.917
102 HB3 SER 15 HB3 SER 15 18.313 -6.181 10.009
103 HG SER 15 HG SER 15 18.457 -6.944 12.089
104 H GLN 16 H GLN 16 15.501 -4.829 9.901
105 HA GLN 16 HA GLN 16 13.132 -5.833 11.433
106 HB2 GLN 16 HB2 GLN 16 13.292 -3.758 12.819
107 HB3 GLN 16 HB3 GLN 16 14.670 -4.844 13.075
108 HG2 GLN 16 HG2 GLN 16 16.041 -3.459 11.568
109 HG3 GLN 16 HG3 GLN 16 14.669 -2.383 11.292
110 HE21 GLN 16 HE21 GLN 16 16.891 -1.229 12.043
111 HE22 GLN 16 HE22 GLN 16 16.810 -0.741 13.735
112 H ASP 17 H ASP 17 11.330 -4.182 11.238
113 HA ASP 17 HA ASP 17 11.035 -3.444 8.449
114 HB2 ASP 17 HB2 ASP 17 8.859 -2.601 9.110
115 HB3 ASP 17 HB3 ASP 17 9.140 -4.177 9.864
116 H SER 18 H SER 18 12.119 -1.851 11.335
117 HA SER 18 HA SER 18 11.752 0.843 10.460
118 HB2 SER 18 HB2 SER 18 12.124 0.184 12.808
119 HB3 SER 18 HB3 SER 18 13.789 -0.302 12.408
120 HG SER 18 HG SER 18 13.890 1.982 11.530
121 H ASP 19 H ASP 19 13.836 -1.489 9.170
122 HA ASP 19 HA ASP 19 16.041 0.349 8.482
123 HB2 ASP 19 HB2 ASP 19 15.324 -2.438 7.478
124 HB3 ASP 19 HB3 ASP 19 16.797 -1.562 7.056
125 H CYS 20 H CYS 20 12.868 -0.305 7.422
126 HA CYS 20 HA CYS 20 13.424 0.296 4.577
127 HB2 CYS 20 HB2 CYS 20 10.983 -0.725 6.046
128 HB3 CYS 20 HB3 CYS 20 11.015 -0.324 4.336
129 H LEU 21 H LEU 21 11.660 1.568 3.464
130 HA LEU 21 HA LEU 21 11.397 4.206 4.610
131 HB2 LEU 21 HB2 LEU 21 9.898 2.875 2.311
132 HB3 LEU 21 HB3 LEU 21 9.862 4.580 2.693
133 HG LEU 21 HG LEU 21 11.165 4.425 0.786
134 HD11 LEU 21 HD11 LEU 21 12.195 5.850 2.548
135 HD12 LEU 21 HD12 LEU 21 13.375 5.195 1.399
136 HD13 LEU 21 HD13 LEU 21 13.229 4.481 3.015
137 HD21 LEU 21 HD21 LEU 21 11.561 1.938 0.899
138 HD22 LEU 21 HD22 LEU 21 12.935 2.255 1.996
139 HD23 LEU 21 HD23 LEU 21 12.950 2.889 0.341
140 H ALA 22 H ALA 22 9.411 5.149 5.390
141 HA ALA 22 HA ALA 22 7.734 3.440 6.938
142 HB1 ALA 22 HB1 ALA 22 7.210 6.263 5.885
143 HB2 ALA 22 HB2 ALA 22 6.306 5.460 7.189
144 HB3 ALA 22 HB3 ALA 22 8.024 5.862 7.421
145 H GLY 23 H GLY 23 5.880 2.361 6.397
146 HA2 GLY 23 HA2 GLY 23 3.944 1.945 5.064
147 HA3 GLY 23 HA3 GLY 23 4.660 2.889 3.741
148 H CYS 24 H CYS 24 7.112 1.000 4.953
149 HA CYS 24 HA CYS 24 6.468 -1.341 3.194
150 HB2 CYS 24 HB2 CYS 24 9.145 -0.052 3.758
151 HB3 CYS 24 HB3 CYS 24 8.896 -1.523 2.823
152 H VAL 25 H VAL 25 7.625 -3.326 3.980
153 HA VAL 25 HA VAL 25 8.232 -3.199 6.912
154 HB VAL 25 HB VAL 25 7.059 -5.386 7.216
155 HG11 VAL 25 HG11 VAL 25 4.774 -4.510 7.255
156 HG12 VAL 25 HG12 VAL 25 5.913 -3.232 7.740
157 HG13 VAL 25 HG13 VAL 25 5.212 -3.220 6.105
158 HG21 VAL 25 HG21 VAL 25 7.124 -6.199 4.864
159 HG22 VAL 25 HG22 VAL 25 5.467 -6.196 5.494
160 HG23 VAL 25 HG23 VAL 25 5.984 -4.912 4.379
161 H CYS 26 H CYS 26 9.444 -5.189 7.630
162 HA CYS 26 HA CYS 26 11.295 -6.017 5.458
163 HB2 CYS 26 HB2 CYS 26 12.201 -5.134 7.610
164 HB3 CYS 26 HB3 CYS 26 11.478 -6.512 8.464
165 H GLY 27 H GLY 27 11.133 -8.012 4.550
166 HA2 GLY 27 HA2 GLY 27 8.995 -9.751 5.581
167 HA3 GLY 27 HA3 GLY 27 9.827 -9.894 4.030
168 HA PRO 28 HA PRO 28 11.305 -13.019 7.353
169 HB2 PRO 28 HB2 PRO 28 10.314 -14.904 5.231
170 HB3 PRO 28 HB3 PRO 28 10.177 -15.023 7.009
171 HG2 PRO 28 HG2 PRO 28 8.064 -14.365 5.558
172 HG3 PRO 28 HG3 PRO 28 8.420 -13.483 7.093
173 HD2 PRO 28 HD2 PRO 28 8.990 -12.653 4.239
174 HD3 PRO 28 HD3 PRO 28 8.267 -11.704 5.591
175 H ASN 29 H ASN 29 11.860 -12.454 3.962
176 HA ASN 29 HA ASN 29 14.074 -14.392 3.798
177 HB2 ASN 29 HB2 ASN 29 13.013 -12.295 1.836
178 HB3 ASN 29 HB3 ASN 29 14.331 -13.426 1.498
179 HD21 ASN 29 HD21 ASN 29 12.552 -13.674 -0.280
180 HD22 ASN 29 HD22 ASN 29 11.474 -15.021 -0.014
181 H GLY 30 H GLY 30 13.820 -11.412 5.276
182 HA2 GLY 30 HA2 GLY 30 15.543 -10.036 6.037
183 HA3 GLY 30 HA3 GLY 30 16.702 -10.982 5.080
184 H PHE 31 H PHE 31 13.855 -9.844 3.485
185 HA PHE 31 HA PHE 31 15.333 -7.564 2.266
186 HB2 PHE 31 HB2 PHE 31 13.666 -9.681 0.869
187 HB3 PHE 31 HB3 PHE 31 14.104 -8.134 0.153
188 HD1 PHE 31 HD1 PHE 31 15.219 -11.498 0.864
189 HD2 PHE 31 HD2 PHE 31 16.549 -7.559 -0.208
190 HE1 PHE 31 HE1 PHE 31 17.360 -12.457 0.062
191 HE2 PHE 31 HE2 PHE 31 18.692 -8.514 -1.043
192 HZ PHE 31 HZ PHE 31 19.102 -10.959 -0.907
193 H CYS 32 H CYS 32 14.063 -5.826 1.669
194 HA CYS 32 HA CYS 32 11.736 -5.473 3.342
195 HB2 CYS 32 HB2 CYS 32 13.549 -3.783 2.657
196 HB3 CYS 32 HB3 CYS 32 12.702 -3.669 1.113
197 H GLY 33 H GLY 33 9.570 -4.777 2.568
198 HA2 GLY 33 HA2 GLY 33 8.971 -5.237 -0.273
199 HA3 GLY 33 HA3 GLY 33 8.189 -6.347 0.868
Start of MODEL 14
1 H1 GLY 1 H1 GLY 1 4.572 4.254 -2.097
2 H2 GLY 1 H2 GLY 1 5.879 5.054 -1.640
3 H3 GLY 1 H3 GLY 1 5.843 4.426 -3.148
4 HA2 GLY 1 HA2 GLY 1 5.861 2.963 -0.665
5 HA3 GLY 1 HA3 GLY 1 5.756 2.221 -2.252
6 H CYS 2 H CYS 2 7.849 1.191 -1.253
7 HA CYS 2 HA CYS 2 10.202 2.779 -1.061
8 HB2 CYS 2 HB2 CYS 2 9.549 -0.129 -1.152
9 HB3 CYS 2 HB3 CYS 2 11.242 0.336 -1.472
10 HA PRO 3 HA PRO 3 10.631 3.529 -5.172
11 HB2 PRO 3 HB2 PRO 3 13.097 4.529 -5.485
12 HB3 PRO 3 HB3 PRO 3 11.859 5.293 -4.442
13 HG2 PRO 3 HG2 PRO 3 14.100 3.459 -3.550
14 HG3 PRO 3 HG3 PRO 3 13.680 5.137 -3.025
15 HD2 PRO 3 HD2 PRO 3 12.754 2.907 -1.700
16 HD3 PRO 3 HD3 PRO 3 11.769 4.391 -1.871
17 H ARG 4 H ARG 4 11.332 2.925 -7.213
18 HA ARG 4 HA ARG 4 13.286 0.713 -7.423
19 HB2 ARG 4 HB2 ARG 4 10.814 1.148 -9.064
20 HB3 ARG 4 HB3 ARG 4 11.976 -0.136 -9.340
21 HG2 ARG 4 HG2 ARG 4 11.357 -1.190 -7.257
22 HG3 ARG 4 HG3 ARG 4 10.212 0.123 -6.874
23 HD2 ARG 4 HD2 ARG 4 9.114 -1.961 -7.786
24 HD3 ARG 4 HD3 ARG 4 8.791 -0.532 -8.813
25 HE ARG 4 HE ARG 4 11.047 -2.045 -9.794
26 HH11 ARG 4 HH11 ARG 4 7.536 -2.182 -9.551
27 HH12 ARG 4 HH12 ARG 4 7.367 -3.173 -11.016
28 HH21 ARG 4 HH21 ARG 4 10.830 -3.301 -11.646
29 HH22 ARG 4 HH22 ARG 4 9.242 -3.813 -12.195
30 HA PRO 5 HA PRO 5 14.340 4.635 -9.632
31 HB2 PRO 5 HB2 PRO 5 16.977 4.673 -9.259
32 HB3 PRO 5 HB3 PRO 5 15.826 5.181 -7.988
33 HG2 PRO 5 HG2 PRO 5 17.090 2.485 -8.276
34 HG3 PRO 5 HG3 PRO 5 17.078 3.584 -6.876
35 HD2 PRO 5 HD2 PRO 5 15.295 1.671 -7.058
36 HD3 PRO 5 HD3 PRO 5 14.841 3.320 -6.535
37 H ARG 6 H ARG 6 15.558 1.404 -10.078
38 HA ARG 6 HA ARG 6 16.530 2.203 -12.800
39 HB2 ARG 6 HB2 ARG 6 18.134 0.944 -11.329
40 HB3 ARG 6 HB3 ARG 6 17.018 -0.449 -11.400
41 HG2 ARG 6 HG2 ARG 6 17.807 -1.079 -13.409
42 HG3 ARG 6 HG3 ARG 6 17.607 0.573 -14.076
43 HD2 ARG 6 HD2 ARG 6 19.885 0.008 -12.198
44 HD3 ARG 6 HD3 ARG 6 19.951 -0.410 -13.878
45 HE ARG 6 HE ARG 6 19.033 2.236 -13.753
46 HH11 ARG 6 HH11 ARG 6 21.997 0.359 -13.379
47 HH12 ARG 6 HH12 ARG 6 23.033 1.692 -13.849
48 HH21 ARG 6 HH21 ARG 6 20.428 3.902 -14.312
49 HH22 ARG 6 HH22 ARG 6 22.126 3.678 -14.340
50 H GLY 7 H GLY 7 14.384 0.042 -10.921
51 HA2 GLY 7 HA2 GLY 7 12.196 -0.551 -11.683
52 HA3 GLY 7 HA3 GLY 7 12.735 -0.314 -13.367
53 H ASP 8 H ASP 8 15.289 -1.710 -12.836
54 HA ASP 8 HA ASP 8 14.352 -4.532 -12.879
55 HB2 ASP 8 HB2 ASP 8 17.025 -3.262 -13.625
56 HB3 ASP 8 HB3 ASP 8 16.594 -4.993 -13.871
57 H ASN 9 H ASN 9 15.367 -2.286 -10.692
58 HA ASN 9 HA ASN 9 17.646 -3.709 -9.565
59 HB2 ASN 9 HB2 ASN 9 17.493 -1.941 -7.799
60 HB3 ASN 9 HB3 ASN 9 17.412 -1.297 -9.446
61 HD21 ASN 9 HD21 ASN 9 15.679 -2.022 -6.507
62 HD22 ASN 9 HD22 ASN 9 14.268 -0.993 -6.829
63 HA PRO 10 HA PRO 10 15.449 -6.626 -6.972
64 HB2 PRO 10 HB2 PRO 10 17.466 -7.252 -5.240
65 HB3 PRO 10 HB3 PRO 10 17.471 -7.803 -6.927
66 HG2 PRO 10 HG2 PRO 10 18.951 -5.504 -5.737
67 HG3 PRO 10 HG3 PRO 10 19.479 -6.768 -6.862
68 HD2 PRO 10 HD2 PRO 10 18.768 -4.334 -7.765
69 HD3 PRO 10 HD3 PRO 10 18.418 -5.831 -8.664
70 HA PRO 11 HA PRO 11 14.265 -4.326 -3.390
71 HB2 PRO 11 HB2 PRO 11 13.746 -6.194 -1.492
72 HB3 PRO 11 HB3 PRO 11 12.698 -6.025 -2.899
73 HG2 PRO 11 HG2 PRO 11 14.998 -7.937 -2.451
74 HG3 PRO 11 HG3 PRO 11 13.294 -8.342 -3.021
75 HD2 PRO 11 HD2 PRO 11 15.299 -8.074 -4.781
76 HD3 PRO 11 HD3 PRO 11 13.675 -7.444 -5.142
77 H LEU 12 H LEU 12 15.065 -3.456 -1.484
78 HA LEU 12 HA LEU 12 17.925 -3.866 -0.938
79 HB2 LEU 12 HB2 LEU 12 17.644 -2.151 0.724
80 HB3 LEU 12 HB3 LEU 12 16.840 -1.614 -0.734
81 HG LEU 12 HG LEU 12 15.239 -2.786 1.528
82 HD11 LEU 12 HD11 LEU 12 15.051 -0.611 2.544
83 HD12 LEU 12 HD12 LEU 12 16.244 0.079 1.368
84 HD13 LEU 12 HD13 LEU 12 16.743 -1.189 2.537
85 HD21 LEU 12 HD21 LEU 12 13.483 -1.181 0.641
86 HD22 LEU 12 HD22 LEU 12 14.003 -2.375 -0.558
87 HD23 LEU 12 HD23 LEU 12 14.616 -0.703 -0.638
88 H THR 13 H THR 13 18.800 -4.454 1.159
89 HA THR 13 HA THR 13 17.364 -6.722 2.367
90 HB THR 13 HB THR 13 19.375 -6.733 3.833
91 HG1 THR 13 HG1 THR 13 20.668 -5.101 3.782
92 HG21 THR 13 HG21 THR 13 19.333 -8.128 1.901
93 HG22 THR 13 HG22 THR 13 20.913 -7.340 1.885
94 HG23 THR 13 HG23 THR 13 19.639 -6.744 0.801
95 H CYS 14 H CYS 14 17.017 -6.999 4.658
96 HA CYS 14 HA CYS 14 17.146 -4.557 6.316
97 HB2 CYS 14 HB2 CYS 14 14.714 -4.604 6.880
98 HB3 CYS 14 HB3 CYS 14 14.938 -4.354 5.136
99 H SER 15 H SER 15 16.591 -5.060 8.649
100 HA SER 15 HA SER 15 16.540 -8.009 9.149
101 HB2 SER 15 HB2 SER 15 18.626 -7.786 9.923
102 HB3 SER 15 HB3 SER 15 18.544 -6.021 9.935
103 HG SER 15 HG SER 15 17.049 -7.443 11.816
104 H GLN 16 H GLN 16 15.337 -4.875 9.662
105 HA GLN 16 HA GLN 16 13.259 -5.965 11.488
106 HB2 GLN 16 HB2 GLN 16 13.373 -3.878 12.860
107 HB3 GLN 16 HB3 GLN 16 14.754 -4.908 13.014
108 HG2 GLN 16 HG2 GLN 16 16.035 -3.417 11.465
109 HG3 GLN 16 HG3 GLN 16 14.657 -2.305 11.355
110 HE21 GLN 16 HE21 GLN 16 16.897 -1.173 12.214
111 HE22 GLN 16 HE22 GLN 16 16.869 -0.894 13.993
112 H ASP 17 H ASP 17 11.362 -4.454 11.457
113 HA ASP 17 HA ASP 17 10.680 -3.502 8.881
114 HB2 ASP 17 HB2 ASP 17 9.100 -4.184 10.575
115 HB3 ASP 17 HB3 ASP 17 9.669 -2.915 11.676
116 H SER 18 H SER 18 12.116 -1.865 11.679
117 HA SER 18 HA SER 18 11.744 0.827 10.759
118 HB2 SER 18 HB2 SER 18 14.228 0.467 12.221
119 HB3 SER 18 HB3 SER 18 12.679 1.172 12.738
120 HG SER 18 HG SER 18 13.369 -0.772 13.931
121 H ASP 19 H ASP 19 13.891 -1.628 9.442
122 HA ASP 19 HA ASP 19 15.971 0.206 8.547
123 HB2 ASP 19 HB2 ASP 19 15.216 -2.623 7.808
124 HB3 ASP 19 HB3 ASP 19 16.600 -1.742 7.032
125 H CYS 20 H CYS 20 12.801 -0.422 7.681
126 HA CYS 20 HA CYS 20 13.273 0.423 4.814
127 HB2 CYS 20 HB2 CYS 20 10.851 -0.881 6.130
128 HB3 CYS 20 HB3 CYS 20 10.991 -0.382 4.437
129 H LEU 21 H LEU 21 11.384 1.707 3.885
130 HA LEU 21 HA LEU 21 11.242 4.173 5.442
131 HB2 LEU 21 HB2 LEU 21 9.998 3.322 2.824
132 HB3 LEU 21 HB3 LEU 21 9.966 4.974 3.432
133 HG LEU 21 HG LEU 21 12.463 3.531 2.492
134 HD11 LEU 21 HD11 LEU 21 12.363 5.000 0.515
135 HD12 LEU 21 HD12 LEU 21 10.931 5.823 1.180
136 HD13 LEU 21 HD13 LEU 21 10.843 4.127 0.665
137 HD21 LEU 21 HD21 LEU 21 13.015 5.176 4.197
138 HD22 LEU 21 HD22 LEU 21 12.045 6.436 3.349
139 HD23 LEU 21 HD23 LEU 21 13.557 5.771 2.584
140 H ALA 22 H ALA 22 9.165 5.230 5.901
141 HA ALA 22 HA ALA 22 7.244 3.485 7.179
142 HB1 ALA 22 HB1 ALA 22 5.823 5.585 7.396
143 HB2 ALA 22 HB2 ALA 22 7.517 5.982 7.826
144 HB3 ALA 22 HB3 ALA 22 6.895 6.443 6.229
145 H GLY 23 H GLY 23 5.630 2.288 6.254
146 HA2 GLY 23 HA2 GLY 23 3.868 1.994 4.516
147 HA3 GLY 23 HA3 GLY 23 4.823 2.944 3.414
148 H CYS 24 H CYS 24 7.104 1.063 4.794
149 HA CYS 24 HA CYS 24 6.748 -1.161 2.811
150 HB2 CYS 24 HB2 CYS 24 9.258 0.219 3.730
151 HB3 CYS 24 HB3 CYS 24 9.194 -1.130 2.583
152 H VAL 25 H VAL 25 7.774 -3.184 3.713
153 HA VAL 25 HA VAL 25 8.137 -3.016 6.726
154 HB VAL 25 HB VAL 25 6.930 -5.223 6.926
155 HG11 VAL 25 HG11 VAL 25 5.739 -2.970 7.311
156 HG12 VAL 25 HG12 VAL 25 5.015 -3.235 5.697
157 HG13 VAL 25 HG13 VAL 25 4.743 -4.401 6.996
158 HG21 VAL 25 HG21 VAL 25 7.132 -5.971 4.501
159 HG22 VAL 25 HG22 VAL 25 5.450 -5.927 4.972
160 HG23 VAL 25 HG23 VAL 25 6.117 -4.616 3.984
161 H CYS 26 H CYS 26 9.150 -5.098 7.530
162 HA CYS 26 HA CYS 26 11.117 -6.008 5.521
163 HB2 CYS 26 HB2 CYS 26 12.030 -4.963 7.628
164 HB3 CYS 26 HB3 CYS 26 11.277 -6.316 8.520
165 H GLY 27 H GLY 27 11.044 -8.062 4.704
166 HA2 GLY 27 HA2 GLY 27 8.996 -9.804 5.976
167 HA3 GLY 27 HA3 GLY 27 9.719 -9.923 4.335
168 HA PRO 28 HA PRO 28 11.539 -12.984 7.436
169 HB2 PRO 28 HB2 PRO 28 10.648 -15.360 6.539
170 HB3 PRO 28 HB3 PRO 28 9.634 -14.194 7.469
171 HG2 PRO 28 HG2 PRO 28 9.884 -14.456 4.443
172 HG3 PRO 28 HG3 PRO 28 8.404 -14.644 5.479
173 HD2 PRO 28 HD2 PRO 28 9.014 -12.301 4.255
174 HD3 PRO 28 HD3 PRO 28 8.293 -12.386 5.921
175 H ASN 29 H ASN 29 11.867 -12.464 4.050
176 HA ASN 29 HA ASN 29 14.035 -14.427 3.680
177 HB2 ASN 29 HB2 ASN 29 12.315 -13.649 1.862
178 HB3 ASN 29 HB3 ASN 29 13.281 -12.144 1.738
179 HD21 ASN 29 HD21 ASN 29 13.658 -12.808 -0.489
180 HD22 ASN 29 HD22 ASN 29 14.891 -13.997 -0.891
181 H GLY 30 H GLY 30 13.724 -11.425 5.244
182 HA2 GLY 30 HA2 GLY 30 15.379 -10.004 6.034
183 HA3 GLY 30 HA3 GLY 30 16.647 -10.973 5.234
184 H PHE 31 H PHE 31 13.911 -9.890 3.426
185 HA PHE 31 HA PHE 31 15.410 -7.483 2.311
186 HB2 PHE 31 HB2 PHE 31 13.801 -9.651 0.802
187 HB3 PHE 31 HB3 PHE 31 14.227 -8.045 0.122
188 HD1 PHE 31 HD1 PHE 31 15.472 -11.428 0.918
189 HD2 PHE 31 HD2 PHE 31 16.622 -7.504 -0.427
190 HE1 PHE 31 HE1 PHE 31 17.595 -12.364 0.173
191 HE2 PHE 31 HE2 PHE 31 18.784 -8.401 -1.149
192 HZ PHE 31 HZ PHE 31 19.240 -10.892 -0.923
193 H CYS 32 H CYS 32 14.132 -5.814 1.749
194 HA CYS 32 HA CYS 32 11.766 -5.482 3.362
195 HB2 CYS 32 HB2 CYS 32 13.646 -3.686 2.658
196 HB3 CYS 32 HB3 CYS 32 12.695 -3.645 1.172
197 H GLY 33 H GLY 33 9.710 -4.987 2.648
198 HA2 GLY 33 HA2 GLY 33 8.996 -5.471 -0.182
199 HA3 GLY 33 HA3 GLY 33 8.432 -6.704 0.969
Start of MODEL 15
1 H1 GLY 1 H1 GLY 1 3.707 -3.052 -2.421
2 H2 GLY 1 H2 GLY 1 3.814 -1.445 -2.435
3 H3 GLY 1 H3 GLY 1 4.374 -2.306 -3.735
4 HA2 GLY 1 HA2 GLY 1 5.473 -2.627 -1.101
5 HA3 GLY 1 HA3 GLY 1 6.132 -3.118 -2.663
6 H CYS 2 H CYS 2 7.971 -1.827 -1.440
7 HA CYS 2 HA CYS 2 7.764 0.972 -1.338
8 HB2 CYS 2 HB2 CYS 2 10.282 -0.662 -1.750
9 HB3 CYS 2 HB3 CYS 2 10.172 0.926 -0.994
10 HA PRO 3 HA PRO 3 8.476 2.167 -5.420
11 HB2 PRO 3 HB2 PRO 3 9.382 4.668 -5.319
12 HB3 PRO 3 HB3 PRO 3 7.780 4.201 -4.689
13 HG2 PRO 3 HG2 PRO 3 10.285 4.696 -3.108
14 HG3 PRO 3 HG3 PRO 3 8.597 5.279 -2.863
15 HD2 PRO 3 HD2 PRO 3 9.748 3.023 -1.649
16 HD3 PRO 3 HD3 PRO 3 7.996 3.306 -1.826
17 H ARG 4 H ARG 4 9.992 2.432 -7.073
18 HA ARG 4 HA ARG 4 12.786 2.415 -6.553
19 HB2 ARG 4 HB2 ARG 4 13.119 0.371 -7.808
20 HB3 ARG 4 HB3 ARG 4 12.576 0.174 -6.281
21 HG2 ARG 4 HG2 ARG 4 10.370 -0.134 -7.151
22 HG3 ARG 4 HG3 ARG 4 10.987 -0.051 -8.661
23 HD2 ARG 4 HD2 ARG 4 11.007 -2.268 -8.415
24 HD3 ARG 4 HD3 ARG 4 12.471 -1.944 -7.768
25 HE ARG 4 HE ARG 4 10.084 -2.551 -6.263
26 HH11 ARG 4 HH11 ARG 4 10.440 -3.464 -4.224
27 HH12 ARG 4 HH12 ARG 4 12.053 -3.626 -3.616
28 HH21 ARG 4 HH21 ARG 4 13.563 -2.217 -6.441
29 HH22 ARG 4 HH22 ARG 4 13.834 -2.916 -4.880
30 HA PRO 5 HA PRO 5 12.378 4.594 -10.302
31 HB2 PRO 5 HB2 PRO 5 14.785 4.602 -11.399
32 HB3 PRO 5 HB3 PRO 5 14.460 5.453 -9.862
33 HG2 PRO 5 HG2 PRO 5 15.609 2.701 -10.206
34 HG3 PRO 5 HG3 PRO 5 16.225 4.068 -9.249
35 HD2 PRO 5 HD2 PRO 5 14.763 2.153 -8.130
36 HD3 PRO 5 HD3 PRO 5 14.609 3.871 -7.690
37 H ARG 6 H ARG 6 13.524 1.298 -10.508
38 HA ARG 6 HA ARG 6 12.294 0.995 -13.186
39 HB2 ARG 6 HB2 ARG 6 15.143 0.159 -12.521
40 HB3 ARG 6 HB3 ARG 6 14.244 -0.484 -13.913
41 HG2 ARG 6 HG2 ARG 6 14.165 1.635 -14.962
42 HG3 ARG 6 HG3 ARG 6 14.898 2.431 -13.503
43 HD2 ARG 6 HD2 ARG 6 16.935 1.214 -13.795
44 HD3 ARG 6 HD3 ARG 6 16.255 0.251 -15.060
45 HE ARG 6 HE ARG 6 17.235 2.993 -15.364
46 HH11 ARG 6 HH11 ARG 6 15.541 0.272 -16.874
47 HH12 ARG 6 HH12 ARG 6 15.791 0.902 -18.495
48 HH21 ARG 6 HH21 ARG 6 17.484 3.691 -17.406
49 HH22 ARG 6 HH22 ARG 6 16.882 2.777 -18.778
50 H GLY 7 H GLY 7 11.747 -1.394 -13.374
51 HA2 GLY 7 HA2 GLY 7 11.245 -2.376 -10.623
52 HA3 GLY 7 HA3 GLY 7 10.445 -2.903 -12.137
53 H ASP 8 H ASP 8 13.845 -2.733 -12.494
54 HA ASP 8 HA ASP 8 13.969 -5.657 -12.519
55 HB2 ASP 8 HB2 ASP 8 14.935 -4.253 -14.366
56 HB3 ASP 8 HB3 ASP 8 16.092 -3.629 -13.179
57 H ASN 9 H ASN 9 15.250 -2.899 -10.647
58 HA ASN 9 HA ASN 9 17.325 -4.504 -9.509
59 HB2 ASN 9 HB2 ASN 9 17.665 -2.562 -7.936
60 HB3 ASN 9 HB3 ASN 9 17.606 -2.122 -9.663
61 HD21 ASN 9 HD21 ASN 9 16.138 -0.554 -10.254
62 HD22 ASN 9 HD22 ASN 9 14.874 0.024 -9.168
63 HA PRO 10 HA PRO 10 15.227 -6.665 -6.400
64 HB2 PRO 10 HB2 PRO 10 17.219 -7.270 -4.653
65 HB3 PRO 10 HB3 PRO 10 17.122 -7.996 -6.287
66 HG2 PRO 10 HG2 PRO 10 18.814 -5.685 -5.353
67 HG3 PRO 10 HG3 PRO 10 19.218 -7.077 -6.358
68 HD2 PRO 10 HD2 PRO 10 18.639 -4.708 -7.500
69 HD3 PRO 10 HD3 PRO 10 18.212 -6.255 -8.229
70 HA PRO 11 HA PRO 11 14.273 -3.938 -3.030
71 HB2 PRO 11 HB2 PRO 11 13.544 -5.667 -1.084
72 HB3 PRO 11 HB3 PRO 11 12.494 -5.362 -2.487
73 HG2 PRO 11 HG2 PRO 11 14.477 -7.606 -2.046
74 HG3 PRO 11 HG3 PRO 11 12.725 -7.725 -2.584
75 HD2 PRO 11 HD2 PRO 11 14.742 -7.805 -4.329
76 HD3 PRO 11 HD3 PRO 11 13.225 -6.959 -4.754
77 H LEU 12 H LEU 12 15.175 -3.112 -1.090
78 HA LEU 12 HA LEU 12 17.978 -3.791 -0.672
79 HB2 LEU 12 HB2 LEU 12 17.816 -2.138 1.166
80 HB3 LEU 12 HB3 LEU 12 17.156 -1.508 -0.317
81 HG LEU 12 HG LEU 12 15.008 -2.577 1.247
82 HD11 LEU 12 HD11 LEU 12 15.070 -1.080 3.143
83 HD12 LEU 12 HD12 LEU 12 16.711 -0.509 2.690
84 HD13 LEU 12 HD13 LEU 12 16.439 -2.222 3.185
85 HD21 LEU 12 HD21 LEU 12 15.739 0.274 0.439
86 HD22 LEU 12 HD22 LEU 12 14.125 -0.313 0.891
87 HD23 LEU 12 HD23 LEU 12 14.866 -0.901 -0.609
88 H THR 13 H THR 13 18.961 -4.565 1.264
89 HA THR 13 HA THR 13 17.467 -6.745 2.489
90 HB THR 13 HB THR 13 19.447 -6.941 3.972
91 HG1 THR 13 HG1 THR 13 20.819 -5.086 2.389
92 HG21 THR 13 HG21 THR 13 20.947 -7.663 2.248
93 HG22 THR 13 HG22 THR 13 20.116 -6.653 1.008
94 HG23 THR 13 HG23 THR 13 19.275 -8.030 1.752
95 H CYS 14 H CYS 14 16.937 -6.994 4.729
96 HA CYS 14 HA CYS 14 17.187 -4.604 6.477
97 HB2 CYS 14 HB2 CYS 14 14.742 -4.510 6.918
98 HB3 CYS 14 HB3 CYS 14 15.076 -4.203 5.204
99 H SER 15 H SER 15 16.325 -5.143 8.720
100 HA SER 15 HA SER 15 16.011 -8.065 9.173
101 HB2 SER 15 HB2 SER 15 18.033 -8.141 10.060
102 HB3 SER 15 HB3 SER 15 18.182 -6.379 10.141
103 HG SER 15 HG SER 15 16.384 -7.620 11.885
104 H GLN 16 H GLN 16 15.192 -4.792 9.755
105 HA GLN 16 HA GLN 16 12.835 -5.704 11.368
106 HB2 GLN 16 HB2 GLN 16 13.041 -3.511 12.619
107 HB3 GLN 16 HB3 GLN 16 14.248 -4.699 13.021
108 HG2 GLN 16 HG2 GLN 16 15.861 -3.509 11.520
109 HG3 GLN 16 HG3 GLN 16 14.693 -2.203 11.282
110 HE21 GLN 16 HE21 GLN 16 16.766 -1.115 12.215
111 HE22 GLN 16 HE22 GLN 16 16.789 -0.911 13.984
112 H ASP 17 H ASP 17 11.085 -3.873 10.973
113 HA ASP 17 HA ASP 17 11.094 -3.149 8.196
114 HB2 ASP 17 HB2 ASP 17 8.915 -2.465 8.492
115 HB3 ASP 17 HB3 ASP 17 9.082 -3.776 9.655
116 H SER 18 H SER 18 12.034 -1.601 11.159
117 HA SER 18 HA SER 18 11.925 1.143 10.285
118 HB2 SER 18 HB2 SER 18 14.163 0.714 12.025
119 HB3 SER 18 HB3 SER 18 12.536 1.334 12.410
120 HG SER 18 HG SER 18 13.110 -0.631 13.579
121 H ASP 19 H ASP 19 14.020 -1.393 9.168
122 HA ASP 19 HA ASP 19 16.313 0.328 8.526
123 HB2 ASP 19 HB2 ASP 19 15.489 -2.401 7.493
124 HB3 ASP 19 HB3 ASP 19 17.052 -1.591 7.110
125 H CYS 20 H CYS 20 13.223 -0.182 7.317
126 HA CYS 20 HA CYS 20 14.033 0.672 4.545
127 HB2 CYS 20 HB2 CYS 20 12.702 -1.542 5.183
128 HB3 CYS 20 HB3 CYS 20 11.306 -0.477 5.166
129 H LEU 21 H LEU 21 11.573 1.525 3.562
130 HA LEU 21 HA LEU 21 11.581 4.201 4.654
131 HB2 LEU 21 HB2 LEU 21 9.901 2.991 2.489
132 HB3 LEU 21 HB3 LEU 21 10.010 4.707 2.821
133 HG LEU 21 HG LEU 21 12.155 2.949 1.547
134 HD11 LEU 21 HD11 LEU 21 10.231 3.742 0.164
135 HD12 LEU 21 HD12 LEU 21 11.803 4.428 -0.382
136 HD13 LEU 21 HD13 LEU 21 10.662 5.417 0.539
137 HD21 LEU 21 HD21 LEU 21 13.267 4.572 3.037
138 HD22 LEU 21 HD22 LEU 21 12.316 5.918 2.336
139 HD23 LEU 21 HD23 LEU 21 13.523 5.034 1.331
140 H ALA 22 H ALA 22 9.577 5.303 5.368
141 HA ALA 22 HA ALA 22 8.131 3.711 7.317
142 HB1 ALA 22 HB1 ALA 22 7.294 6.524 6.217
143 HB2 ALA 22 HB2 ALA 22 6.765 5.784 7.738
144 HB3 ALA 22 HB3 ALA 22 8.455 6.298 7.534
145 H GLY 23 H GLY 23 6.312 2.498 7.079
146 HA2 GLY 23 HA2 GLY 23 4.194 1.876 6.015
147 HA3 GLY 23 HA3 GLY 23 4.675 2.748 4.571
148 H CYS 24 H CYS 24 7.440 1.260 4.904
149 HA CYS 24 HA CYS 24 6.613 -0.994 3.168
150 HB2 CYS 24 HB2 CYS 24 9.240 0.228 3.969
151 HB3 CYS 24 HB3 CYS 24 9.136 -1.313 3.146
152 H VAL 25 H VAL 25 7.632 -3.176 3.741
153 HA VAL 25 HA VAL 25 7.762 -3.435 6.784
154 HB VAL 25 HB VAL 25 6.767 -5.691 6.504
155 HG11 VAL 25 HG11 VAL 25 5.407 -3.592 7.128
156 HG12 VAL 25 HG12 VAL 25 4.841 -3.611 5.429
157 HG13 VAL 25 HG13 VAL 25 4.521 -5.010 6.513
158 HG21 VAL 25 HG21 VAL 25 5.487 -6.143 4.319
159 HG22 VAL 25 HG22 VAL 25 6.209 -4.661 3.635
160 HG23 VAL 25 HG23 VAL 25 7.246 -6.049 4.029
161 H CYS 26 H CYS 26 8.774 -5.650 7.350
162 HA CYS 26 HA CYS 26 10.946 -6.205 5.445
163 HB2 CYS 26 HB2 CYS 26 11.816 -5.003 7.475
164 HB3 CYS 26 HB3 CYS 26 11.190 -6.355 8.438
165 H GLY 27 H GLY 27 10.842 -8.255 4.612
166 HA2 GLY 27 HA2 GLY 27 9.006 -10.098 6.020
167 HA3 GLY 27 HA3 GLY 27 9.631 -10.231 4.383
168 HA PRO 28 HA PRO 28 11.873 -12.946 7.579
169 HB2 PRO 28 HB2 PRO 28 11.180 -15.440 6.805
170 HB3 PRO 28 HB3 PRO 28 10.115 -14.370 7.773
171 HG2 PRO 28 HG2 PRO 28 10.167 -14.741 4.771
172 HG3 PRO 28 HG3 PRO 28 8.797 -14.993 5.939
173 HD2 PRO 28 HD2 PRO 28 9.095 -12.689 4.538
174 HD3 PRO 28 HD3 PRO 28 8.495 -12.740 6.270
175 H ASN 29 H ASN 29 11.818 -12.788 4.059
176 HA ASN 29 HA ASN 29 14.147 -14.478 3.600
177 HB2 ASN 29 HB2 ASN 29 12.302 -13.808 1.896
178 HB3 ASN 29 HB3 ASN 29 13.170 -12.239 1.722
179 HD21 ASN 29 HD21 ASN 29 13.530 -12.859 -0.526
180 HD22 ASN 29 HD22 ASN 29 14.795 -14.007 -0.968
181 H GLY 30 H GLY 30 13.795 -11.480 5.183
182 HA2 GLY 30 HA2 GLY 30 15.449 -10.063 5.926
183 HA3 GLY 30 HA3 GLY 30 16.682 -10.982 5.043
184 H PHE 31 H PHE 31 13.914 -9.896 3.364
185 HA PHE 31 HA PHE 31 15.344 -7.435 2.302
186 HB2 PHE 31 HB2 PHE 31 13.727 -9.485 0.704
187 HB3 PHE 31 HB3 PHE 31 14.283 -7.911 0.120
188 HD1 PHE 31 HD1 PHE 31 15.221 -11.387 0.641
189 HD2 PHE 31 HD2 PHE 31 16.823 -7.459 -0.097
190 HE1 PHE 31 HE1 PHE 31 17.312 -12.434 -0.087
191 HE2 PHE 31 HE2 PHE 31 18.958 -8.482 -0.780
192 HZ PHE 31 HZ PHE 31 19.176 -11.012 -0.836
193 H CYS 32 H CYS 32 14.118 -5.753 1.812
194 HA CYS 32 HA CYS 32 11.738 -5.392 3.386
195 HB2 CYS 32 HB2 CYS 32 13.509 -3.567 2.863
196 HB3 CYS 32 HB3 CYS 32 12.905 -3.602 1.220
197 H GLY 33 H GLY 33 9.661 -5.055 2.811
198 HA2 GLY 33 HA2 GLY 33 8.971 -5.867 -0.003
199 HA3 GLY 33 HA3 GLY 33 7.955 -6.252 1.394
Start of MODEL 16
1 H1 GLY 1 H1 GLY 1 7.835 -3.083 -3.512
2 H2 GLY 1 H2 GLY 1 7.771 -3.277 -1.819
3 H3 GLY 1 H3 GLY 1 6.447 -3.570 -2.784
4 HA2 GLY 1 HA2 GLY 1 6.189 -1.333 -3.371
5 HA3 GLY 1 HA3 GLY 1 6.301 -1.446 -1.583
6 H CYS 2 H CYS 2 7.032 0.697 -1.432
7 HA CYS 2 HA CYS 2 8.487 2.346 -1.203
8 HB2 CYS 2 HB2 CYS 2 10.797 0.452 -1.596
9 HB3 CYS 2 HB3 CYS 2 10.612 1.764 -0.445
10 HA PRO 3 HA PRO 3 9.922 3.833 -4.983
11 HB2 PRO 3 HB2 PRO 3 11.472 5.941 -4.555
12 HB3 PRO 3 HB3 PRO 3 9.772 5.877 -3.986
13 HG2 PRO 3 HG2 PRO 3 12.266 5.341 -2.373
14 HG3 PRO 3 HG3 PRO 3 10.884 6.458 -2.053
15 HD2 PRO 3 HD2 PRO 3 11.102 3.844 -1.050
16 HD3 PRO 3 HD3 PRO 3 9.555 4.684 -1.317
17 H ARG 4 H ARG 4 11.618 3.813 -6.612
18 HA ARG 4 HA ARG 4 14.215 2.800 -5.688
19 HB2 ARG 4 HB2 ARG 4 12.561 1.648 -7.967
20 HB3 ARG 4 HB3 ARG 4 14.166 1.090 -7.503
21 HG2 ARG 4 HG2 ARG 4 13.093 -0.524 -6.384
22 HG3 ARG 4 HG3 ARG 4 12.721 0.709 -5.170
23 HD2 ARG 4 HD2 ARG 4 10.639 -0.492 -5.863
24 HD3 ARG 4 HD3 ARG 4 10.565 1.217 -6.391
25 HE ARG 4 HE ARG 4 10.647 0.492 -8.631
26 HH11 ARG 4 HH11 ARG 4 10.830 -2.307 -6.471
27 HH12 ARG 4 HH12 ARG 4 10.359 -3.401 -7.752
28 HH21 ARG 4 HH21 ARG 4 10.035 -0.947 -10.152
29 HH22 ARG 4 HH22 ARG 4 9.876 -2.628 -9.832
30 HA PRO 5 HA PRO 5 15.183 5.900 -8.744
31 HB2 PRO 5 HB2 PRO 5 17.739 5.505 -9.243
32 HB3 PRO 5 HB3 PRO 5 17.208 6.064 -7.637
33 HG2 PRO 5 HG2 PRO 5 17.804 3.200 -8.467
34 HG3 PRO 5 HG3 PRO 5 18.429 4.119 -7.071
35 HD2 PRO 5 HD2 PRO 5 16.343 2.515 -6.817
36 HD3 PRO 5 HD3 PRO 5 16.487 4.085 -5.973
37 H ARG 6 H ARG 6 15.557 2.493 -9.346
38 HA ARG 6 HA ARG 6 15.201 2.986 -12.282
39 HB2 ARG 6 HB2 ARG 6 17.289 1.079 -11.190
40 HB3 ARG 6 HB3 ARG 6 16.908 1.313 -12.884
41 HG2 ARG 6 HG2 ARG 6 17.652 3.606 -12.760
42 HG3 ARG 6 HG3 ARG 6 18.028 3.357 -11.006
43 HD2 ARG 6 HD2 ARG 6 19.590 1.534 -11.704
44 HD3 ARG 6 HD3 ARG 6 19.248 1.990 -13.365
45 HE ARG 6 HE ARG 6 20.088 4.367 -12.032
46 HH11 ARG 6 HH11 ARG 6 21.356 1.298 -13.290
47 HH12 ARG 6 HH12 ARG 6 22.933 1.950 -13.625
48 HH21 ARG 6 HH21 ARG 6 22.224 5.093 -12.405
49 HH22 ARG 6 HH22 ARG 6 23.410 3.992 -13.090
50 H GLY 7 H GLY 7 15.363 0.487 -9.681
51 HA2 GLY 7 HA2 GLY 7 13.523 -0.866 -9.050
52 HA3 GLY 7 HA3 GLY 7 12.687 -0.428 -10.537
53 H ASP 8 H ASP 8 15.537 -1.133 -11.780
54 HA ASP 8 HA ASP 8 14.869 -3.905 -12.364
55 HB2 ASP 8 HB2 ASP 8 17.327 -2.263 -13.077
56 HB3 ASP 8 HB3 ASP 8 16.878 -3.815 -13.801
57 H ASN 9 H ASN 9 16.400 -2.318 -9.912
58 HA ASN 9 HA ASN 9 18.641 -4.126 -9.475
59 HB2 ASN 9 HB2 ASN 9 19.393 -2.454 -8.074
60 HB3 ASN 9 HB3 ASN 9 18.148 -1.475 -8.840
61 HD21 ASN 9 HD21 ASN 9 15.856 -2.231 -7.667
62 HD22 ASN 9 HD22 ASN 9 15.973 -1.984 -5.968
63 HA PRO 10 HA PRO 10 16.459 -7.090 -6.925
64 HB2 PRO 10 HB2 PRO 10 18.271 -7.659 -4.960
65 HB3 PRO 10 HB3 PRO 10 18.483 -8.182 -6.652
66 HG2 PRO 10 HG2 PRO 10 19.743 -5.867 -5.276
67 HG3 PRO 10 HG3 PRO 10 20.427 -7.091 -6.350
68 HD2 PRO 10 HD2 PRO 10 19.737 -4.660 -7.270
69 HD3 PRO 10 HD3 PRO 10 19.570 -6.123 -8.266
70 HA PRO 11 HA PRO 11 14.727 -4.843 -3.550
71 HB2 PRO 11 HB2 PRO 11 14.167 -6.658 -1.615
72 HB3 PRO 11 HB3 PRO 11 13.216 -6.582 -3.123
73 HG2 PRO 11 HG2 PRO 11 15.581 -8.404 -2.460
74 HG3 PRO 11 HG3 PRO 11 13.953 -8.883 -3.138
75 HD2 PRO 11 HD2 PRO 11 16.095 -8.547 -4.710
76 HD3 PRO 11 HD3 PRO 11 14.463 -8.055 -5.272
77 H LEU 12 H LEU 12 15.297 -3.809 -1.598
78 HA LEU 12 HA LEU 12 18.120 -4.059 -0.862
79 HB2 LEU 12 HB2 LEU 12 17.692 -2.187 0.602
80 HB3 LEU 12 HB3 LEU 12 17.021 -1.848 -0.993
81 HG LEU 12 HG LEU 12 14.933 -2.927 0.649
82 HD11 LEU 12 HD11 LEU 12 16.278 -0.484 1.825
83 HD12 LEU 12 HD12 LEU 12 16.249 -2.102 2.558
84 HD13 LEU 12 HD13 LEU 12 14.735 -1.224 2.335
85 HD21 LEU 12 HD21 LEU 12 14.720 -1.576 -1.422
86 HD22 LEU 12 HD22 LEU 12 15.438 -0.178 -0.585
87 HD23 LEU 12 HD23 LEU 12 13.876 -0.813 -0.030
88 H THR 13 H THR 13 18.943 -4.521 1.226
89 HA THR 13 HA THR 13 17.579 -6.714 2.497
90 HB THR 13 HB THR 13 19.408 -6.546 4.133
91 HG1 THR 13 HG1 THR 13 20.969 -4.997 3.937
92 HG21 THR 13 HG21 THR 13 20.367 -6.397 1.259
93 HG22 THR 13 HG22 THR 13 19.515 -7.762 1.945
94 HG23 THR 13 HG23 THR 13 21.083 -7.295 2.602
95 H CYS 14 H CYS 14 17.035 -6.949 4.717
96 HA CYS 14 HA CYS 14 17.036 -4.462 6.342
97 HB2 CYS 14 HB2 CYS 14 14.621 -4.598 6.847
98 HB3 CYS 14 HB3 CYS 14 14.844 -4.464 5.098
99 H SER 15 H SER 15 16.509 -4.920 8.625
100 HA SER 15 HA SER 15 16.682 -7.825 9.296
101 HB2 SER 15 HB2 SER 15 18.878 -7.405 9.811
102 HB3 SER 15 HB3 SER 15 18.616 -5.665 9.934
103 HG SER 15 HG SER 15 19.097 -6.923 11.895
104 H GLN 16 H GLN 16 15.637 -4.556 9.823
105 HA GLN 16 HA GLN 16 13.453 -5.652 11.562
106 HB2 GLN 16 HB2 GLN 16 13.499 -3.552 12.885
107 HB3 GLN 16 HB3 GLN 16 14.866 -4.611 13.146
108 HG2 GLN 16 HG2 GLN 16 16.290 -3.133 11.826
109 HG3 GLN 16 HG3 GLN 16 14.905 -2.078 11.409
110 HE21 GLN 16 HE21 GLN 16 17.552 -2.135 13.279
111 HE22 GLN 16 HE22 GLN 16 16.965 -1.311 14.743
112 H ASP 17 H ASP 17 11.587 -3.963 11.515
113 HA ASP 17 HA ASP 17 11.002 -3.320 8.796
114 HB2 ASP 17 HB2 ASP 17 8.924 -2.514 9.635
115 HB3 ASP 17 HB3 ASP 17 9.319 -3.945 10.585
116 H SER 18 H SER 18 12.493 -1.577 11.464
117 HA SER 18 HA SER 18 11.915 1.073 10.433
118 HB2 SER 18 HB2 SER 18 12.680 0.621 12.751
119 HB3 SER 18 HB3 SER 18 14.283 0.189 12.133
120 HG SER 18 HG SER 18 14.517 2.366 11.538
121 H ASP 19 H ASP 19 14.081 -1.384 9.225
122 HA ASP 19 HA ASP 19 16.081 0.347 8.030
123 HB2 ASP 19 HB2 ASP 19 15.117 -2.458 7.467
124 HB3 ASP 19 HB3 ASP 19 16.419 -1.639 6.509
125 H CYS 20 H CYS 20 12.793 -0.350 7.476
126 HA CYS 20 HA CYS 20 12.917 0.461 4.557
127 HB2 CYS 20 HB2 CYS 20 10.667 -0.784 6.202
128 HB3 CYS 20 HB3 CYS 20 10.631 -0.418 4.508
129 H LEU 21 H LEU 21 10.828 1.688 3.921
130 HA LEU 21 HA LEU 21 10.760 4.138 5.505
131 HB2 LEU 21 HB2 LEU 21 9.332 3.347 2.952
132 HB3 LEU 21 HB3 LEU 21 9.213 4.914 3.704
133 HG LEU 21 HG LEU 21 11.804 5.048 3.250
134 HD11 LEU 21 HD11 LEU 21 12.092 2.812 2.300
135 HD12 LEU 21 HD12 LEU 21 12.390 4.080 1.063
136 HD13 LEU 21 HD13 LEU 21 10.847 3.161 1.082
137 HD21 LEU 21 HD21 LEU 21 9.544 5.488 1.251
138 HD22 LEU 21 HD22 LEU 21 11.155 6.154 1.042
139 HD23 LEU 21 HD23 LEU 21 10.174 6.613 2.435
140 H ALA 22 H ALA 22 8.601 5.016 6.216
141 HA ALA 22 HA ALA 22 6.964 3.021 7.555
142 HB1 ALA 22 HB1 ALA 22 6.972 5.381 8.486
143 HB2 ALA 22 HB2 ALA 22 6.375 6.027 6.956
144 HB3 ALA 22 HB3 ALA 22 5.335 5.010 7.964
145 H GLY 23 H GLY 23 5.329 1.808 6.763
146 HA2 GLY 23 HA2 GLY 23 3.474 1.372 5.163
147 HA3 GLY 23 HA3 GLY 23 4.204 2.474 4.032
148 H CYS 24 H CYS 24 6.864 0.931 4.967
149 HA CYS 24 HA CYS 24 6.574 -1.286 2.997
150 HB2 CYS 24 HB2 CYS 24 8.886 0.491 3.756
151 HB3 CYS 24 HB3 CYS 24 9.111 -1.020 2.889
152 H VAL 25 H VAL 25 7.704 -3.265 3.746
153 HA VAL 25 HA VAL 25 8.114 -3.250 6.790
154 HB VAL 25 HB VAL 25 6.978 -5.513 6.844
155 HG11 VAL 25 HG11 VAL 25 4.724 -4.680 6.973
156 HG12 VAL 25 HG12 VAL 25 5.806 -3.417 7.565
157 HG13 VAL 25 HG13 VAL 25 5.123 -3.296 5.976
158 HG21 VAL 25 HG21 VAL 25 7.113 -5.966 4.320
159 HG22 VAL 25 HG22 VAL 25 5.464 -6.107 4.906
160 HG23 VAL 25 HG23 VAL 25 5.950 -4.634 4.064
161 H CYS 26 H CYS 26 9.176 -5.238 7.533
162 HA CYS 26 HA CYS 26 11.226 -6.060 5.565
163 HB2 CYS 26 HB2 CYS 26 12.058 -4.961 7.643
164 HB3 CYS 26 HB3 CYS 26 11.287 -6.254 8.589
165 H GLY 27 H GLY 27 10.953 -8.064 4.615
166 HA2 GLY 27 HA2 GLY 27 8.997 -9.845 5.885
167 HA3 GLY 27 HA3 GLY 27 9.648 -9.912 4.270
168 HA PRO 28 HA PRO 28 11.298 -13.356 7.187
169 HB2 PRO 28 HB2 PRO 28 10.221 -14.992 4.958
170 HB3 PRO 28 HB3 PRO 28 10.116 -15.277 6.706
171 HG2 PRO 28 HG2 PRO 28 7.972 -14.498 5.379
172 HG3 PRO 28 HG3 PRO 28 8.405 -13.721 6.957
173 HD2 PRO 28 HD2 PRO 28 8.921 -12.743 4.161
174 HD3 PRO 28 HD3 PRO 28 8.168 -11.892 5.583
175 H ASN 29 H ASN 29 11.695 -12.593 3.732
176 HA ASN 29 HA ASN 29 13.900 -14.495 3.402
177 HB2 ASN 29 HB2 ASN 29 13.082 -12.118 1.595
178 HB3 ASN 29 HB3 ASN 29 14.188 -13.423 1.222
179 HD21 ASN 29 HD21 ASN 29 12.038 -12.804 -0.399
180 HD22 ASN 29 HD22 ASN 29 10.905 -14.118 -0.315
181 H GLY 30 H GLY 30 13.550 -11.522 5.067
182 HA2 GLY 30 HA2 GLY 30 15.254 -10.258 6.056
183 HA3 GLY 30 HA3 GLY 30 16.494 -11.188 5.149
184 H PHE 31 H PHE 31 13.872 -9.906 3.402
185 HA PHE 31 HA PHE 31 15.409 -7.471 2.446
186 HB2 PHE 31 HB2 PHE 31 13.805 -9.465 0.728
187 HB3 PHE 31 HB3 PHE 31 14.421 -7.884 0.218
188 HD1 PHE 31 HD1 PHE 31 15.255 -11.391 0.790
189 HD2 PHE 31 HD2 PHE 31 16.951 -7.496 0.028
190 HE1 PHE 31 HE1 PHE 31 17.358 -12.478 0.158
191 HE2 PHE 31 HE2 PHE 31 19.088 -8.548 -0.568
192 HZ PHE 31 HZ PHE 31 19.267 -11.098 -0.562
193 H CYS 32 H CYS 32 14.245 -5.761 1.927
194 HA CYS 32 HA CYS 32 11.794 -5.367 3.389
195 HB2 CYS 32 HB2 CYS 32 13.736 -3.620 2.922
196 HB3 CYS 32 HB3 CYS 32 12.992 -3.537 1.316
197 H GLY 33 H GLY 33 9.755 -4.777 2.560
198 HA2 GLY 33 HA2 GLY 33 9.296 -5.146 -0.358
199 HA3 GLY 33 HA3 GLY 33 8.473 -6.265 0.686
Start of MODEL 17
1 H1 GLY 1 H1 GLY 1 6.006 4.492 -2.769
2 H2 GLY 1 H2 GLY 1 5.036 4.529 -1.478
3 H3 GLY 1 H3 GLY 1 6.665 4.698 -1.265
4 HA2 GLY 1 HA2 GLY 1 5.733 2.532 -0.667
5 HA3 GLY 1 HA3 GLY 1 5.506 2.269 -2.403
6 H CYS 2 H CYS 2 7.163 0.454 -1.641
7 HA CYS 2 HA CYS 2 9.826 1.312 -1.086
8 HB2 CYS 2 HB2 CYS 2 9.024 -1.420 -2.072
9 HB3 CYS 2 HB3 CYS 2 10.305 -1.028 -0.912
10 HA PRO 3 HA PRO 3 11.037 1.694 -5.275
11 HB2 PRO 3 HB2 PRO 3 13.720 1.840 -5.212
12 HB3 PRO 3 HB3 PRO 3 12.663 3.110 -4.503
13 HG2 PRO 3 HG2 PRO 3 14.053 0.833 -3.078
14 HG3 PRO 3 HG3 PRO 3 14.083 2.595 -2.747
15 HD2 PRO 3 HD2 PRO 3 12.344 0.815 -1.492
16 HD3 PRO 3 HD3 PRO 3 11.937 2.527 -1.808
17 H ARG 4 H ARG 4 11.811 0.440 -7.069
18 HA ARG 4 HA ARG 4 12.124 -2.432 -6.342
19 HB2 ARG 4 HB2 ARG 4 11.520 -1.096 -9.042
20 HB3 ARG 4 HB3 ARG 4 11.636 -2.818 -8.773
21 HG2 ARG 4 HG2 ARG 4 9.773 -2.649 -7.140
22 HG3 ARG 4 HG3 ARG 4 9.598 -0.931 -7.651
23 HD2 ARG 4 HD2 ARG 4 9.115 -1.677 -9.992
24 HD3 ARG 4 HD3 ARG 4 9.405 -3.338 -9.519
25 HE ARG 4 HE ARG 4 7.367 -3.437 -8.438
26 HH11 ARG 4 HH11 ARG 4 7.931 -0.201 -9.586
27 HH12 ARG 4 HH12 ARG 4 6.309 0.360 -9.324
28 HH21 ARG 4 HH21 ARG 4 5.264 -2.730 -8.070
29 HH22 ARG 4 HH22 ARG 4 4.820 -1.079 -8.465
30 HA PRO 5 HA PRO 5 16.408 -2.052 -7.214
31 HB2 PRO 5 HB2 PRO 5 17.113 -4.535 -8.036
32 HB3 PRO 5 HB3 PRO 5 16.475 -4.254 -6.400
33 HG2 PRO 5 HG2 PRO 5 14.993 -5.233 -8.831
34 HG3 PRO 5 HG3 PRO 5 15.051 -5.933 -7.178
35 HD2 PRO 5 HD2 PRO 5 13.073 -4.363 -7.944
36 HD3 PRO 5 HD3 PRO 5 13.759 -4.328 -6.282
37 H ARG 6 H ARG 6 18.082 -2.109 -8.966
38 HA ARG 6 HA ARG 6 17.171 -0.883 -11.252
39 HB2 ARG 6 HB2 ARG 6 19.366 -0.537 -10.434
40 HB3 ARG 6 HB3 ARG 6 19.769 -2.068 -10.836
41 HG2 ARG 6 HG2 ARG 6 19.467 -1.495 -13.139
42 HG3 ARG 6 HG3 ARG 6 19.197 0.051 -12.686
43 HD2 ARG 6 HD2 ARG 6 21.370 0.324 -11.986
44 HD3 ARG 6 HD3 ARG 6 21.655 -1.284 -12.023
45 HE ARG 6 HE ARG 6 21.051 -0.485 -14.589
46 HH11 ARG 6 HH11 ARG 6 22.687 -0.180 -16.121
47 HH12 ARG 6 HH12 ARG 6 24.323 0.062 -15.606
48 HH21 ARG 6 HH21 ARG 6 23.581 -0.158 -12.193
49 HH22 ARG 6 HH22 ARG 6 24.832 0.075 -13.368
50 H GLY 7 H GLY 7 18.076 -4.176 -10.675
51 HA2 GLY 7 HA2 GLY 7 16.182 -5.364 -12.113
52 HA3 GLY 7 HA3 GLY 7 17.329 -5.021 -13.382
53 H ASP 8 H ASP 8 19.799 -5.581 -12.189
54 HA ASP 8 HA ASP 8 19.666 -8.513 -12.150
55 HB2 ASP 8 HB2 ASP 8 21.354 -7.264 -13.562
56 HB3 ASP 8 HB3 ASP 8 21.977 -6.512 -12.071
57 H ASN 9 H ASN 9 20.179 -5.787 -10.065
58 HA ASN 9 HA ASN 9 21.403 -7.454 -7.971
59 HB2 ASN 9 HB2 ASN 9 21.522 -5.308 -6.776
60 HB3 ASN 9 HB3 ASN 9 21.944 -5.033 -8.459
61 HD21 ASN 9 HD21 ASN 9 20.100 -4.047 -5.830
62 HD22 ASN 9 HD22 ASN 9 18.962 -3.022 -6.687
63 HA PRO 10 HA PRO 10 17.515 -8.593 -6.060
64 HB2 PRO 10 HB2 PRO 10 18.219 -8.925 -3.442
65 HB3 PRO 10 HB3 PRO 10 18.748 -10.027 -4.728
66 HG2 PRO 10 HG2 PRO 10 20.262 -7.760 -3.487
67 HG3 PRO 10 HG3 PRO 10 20.774 -9.417 -3.864
68 HD2 PRO 10 HD2 PRO 10 21.362 -7.371 -5.527
69 HD3 PRO 10 HD3 PRO 10 21.027 -9.006 -6.124
70 HA PRO 11 HA PRO 11 15.638 -4.984 -4.197
71 HB2 PRO 11 HB2 PRO 11 14.013 -6.049 -2.275
72 HB3 PRO 11 HB3 PRO 11 13.586 -6.156 -4.004
73 HG2 PRO 11 HG2 PRO 11 14.938 -8.203 -2.233
74 HG3 PRO 11 HG3 PRO 11 13.513 -8.416 -3.386
75 HD2 PRO 11 HD2 PRO 11 15.987 -9.092 -4.109
76 HD3 PRO 11 HD3 PRO 11 14.859 -8.316 -5.290
77 H LEU 12 H LEU 12 15.562 -3.777 -2.099
78 HA LEU 12 HA LEU 12 18.113 -3.961 -0.802
79 HB2 LEU 12 HB2 LEU 12 17.447 -2.118 0.542
80 HB3 LEU 12 HB3 LEU 12 16.870 -1.841 -1.092
81 HG LEU 12 HG LEU 12 14.691 -2.975 0.271
82 HD11 LEU 12 HD11 LEU 12 15.942 -0.736 1.884
83 HD12 LEU 12 HD12 LEU 12 15.849 -2.428 2.380
84 HD13 LEU 12 HD13 LEU 12 14.364 -1.494 2.145
85 HD21 LEU 12 HD21 LEU 12 14.658 -1.340 -1.580
86 HD22 LEU 12 HD22 LEU 12 15.336 -0.111 -0.485
87 HD23 LEU 12 HD23 LEU 12 13.733 -0.720 -0.163
88 H THR 13 H THR 13 18.721 -4.428 1.283
89 HA THR 13 HA THR 13 17.117 -6.607 2.465
90 HB THR 13 HB THR 13 19.150 -6.737 3.906
91 HG1 THR 13 HG1 THR 13 20.896 -5.467 3.448
92 HG21 THR 13 HG21 THR 13 19.644 -6.820 0.934
93 HG22 THR 13 HG22 THR 13 18.726 -8.002 1.851
94 HG23 THR 13 HG23 THR 13 20.424 -7.793 2.174
95 H CYS 14 H CYS 14 16.969 -6.866 4.861
96 HA CYS 14 HA CYS 14 17.119 -4.346 6.358
97 HB2 CYS 14 HB2 CYS 14 14.656 -4.492 6.997
98 HB3 CYS 14 HB3 CYS 14 14.879 -4.201 5.272
99 H SER 15 H SER 15 16.872 -4.825 8.746
100 HA SER 15 HA SER 15 16.935 -7.790 9.307
101 HB2 SER 15 HB2 SER 15 19.034 -7.413 9.998
102 HB3 SER 15 HB3 SER 15 18.820 -5.649 9.972
103 HG SER 15 HG SER 15 19.189 -6.562 12.078
104 H GLN 16 H GLN 16 15.514 -4.725 9.804
105 HA GLN 16 HA GLN 16 13.601 -5.958 11.692
106 HB2 GLN 16 HB2 GLN 16 13.525 -3.859 13.035
107 HB3 GLN 16 HB3 GLN 16 15.015 -4.790 13.201
108 HG2 GLN 16 HG2 GLN 16 16.143 -3.234 11.636
109 HG3 GLN 16 HG3 GLN 16 14.683 -2.222 11.504
110 HE21 GLN 16 HE21 GLN 16 16.713 -0.773 12.312
111 HE22 GLN 16 HE22 GLN 16 16.694 -0.546 14.079
112 H ASP 17 H ASP 17 11.542 -4.603 11.650
113 HA ASP 17 HA ASP 17 10.731 -3.796 9.065
114 HB2 ASP 17 HB2 ASP 17 9.125 -4.451 10.596
115 HB3 ASP 17 HB3 ASP 17 9.770 -3.403 11.865
116 H SER 18 H SER 18 12.034 -1.969 11.797
117 HA SER 18 HA SER 18 11.576 0.668 10.782
118 HB2 SER 18 HB2 SER 18 14.048 0.518 12.237
119 HB3 SER 18 HB3 SER 18 12.454 1.106 12.754
120 HG SER 18 HG SER 18 13.413 -0.833 13.911
121 H ASP 19 H ASP 19 13.857 -1.677 9.530
122 HA ASP 19 HA ASP 19 15.853 0.307 8.644
123 HB2 ASP 19 HB2 ASP 19 15.334 -2.614 8.035
124 HB3 ASP 19 HB3 ASP 19 16.635 -1.673 7.204
125 H CYS 20 H CYS 20 12.768 -0.523 7.668
126 HA CYS 20 HA CYS 20 13.328 -0.033 4.760
127 HB2 CYS 20 HB2 CYS 20 10.853 -0.929 6.264
128 HB3 CYS 20 HB3 CYS 20 10.843 -0.478 4.587
129 H LEU 21 H LEU 21 11.493 1.198 3.602
130 HA LEU 21 HA LEU 21 11.696 3.940 4.548
131 HB2 LEU 21 HB2 LEU 21 10.456 2.707 2.077
132 HB3 LEU 21 HB3 LEU 21 10.473 4.422 2.420
133 HG LEU 21 HG LEU 21 13.047 4.243 2.323
134 HD11 LEU 21 HD11 LEU 21 13.338 1.849 2.200
135 HD12 LEU 21 HD12 LEU 21 13.904 2.641 0.691
136 HD13 LEU 21 HD13 LEU 21 12.345 1.749 0.742
137 HD21 LEU 21 HD21 LEU 21 11.705 5.545 0.762
138 HD22 LEU 21 HD22 LEU 21 11.160 4.062 -0.068
139 HD23 LEU 21 HD23 LEU 21 12.839 4.579 -0.225
140 H ALA 22 H ALA 22 9.720 5.298 4.643
141 HA ALA 22 HA ALA 22 7.795 4.215 6.452
142 HB1 ALA 22 HB1 ALA 22 8.199 6.686 6.369
143 HB2 ALA 22 HB2 ALA 22 7.541 6.797 4.738
144 HB3 ALA 22 HB3 ALA 22 6.482 6.373 6.114
145 H GLY 23 H GLY 23 6.147 2.887 6.189
146 HA2 GLY 23 HA2 GLY 23 4.078 2.228 5.040
147 HA3 GLY 23 HA3 GLY 23 4.763 2.793 3.518
148 H CYS 24 H CYS 24 7.352 1.236 4.610
149 HA CYS 24 HA CYS 24 6.581 -1.214 3.075
150 HB2 CYS 24 HB2 CYS 24 9.225 0.180 3.632
151 HB3 CYS 24 HB3 CYS 24 9.104 -1.355 2.756
152 H VAL 25 H VAL 25 7.572 -3.220 3.915
153 HA VAL 25 HA VAL 25 8.103 -3.045 6.908
154 HB VAL 25 HB VAL 25 6.915 -5.265 7.101
155 HG11 VAL 25 HG11 VAL 25 5.236 -2.921 6.173
156 HG12 VAL 25 HG12 VAL 25 4.573 -4.374 6.969
157 HG13 VAL 25 HG13 VAL 25 5.717 -3.346 7.853
158 HG21 VAL 25 HG21 VAL 25 5.792 -4.596 4.291
159 HG22 VAL 25 HG22 VAL 25 7.077 -5.830 4.617
160 HG23 VAL 25 HG23 VAL 25 5.445 -6.053 5.285
161 H CYS 26 H CYS 26 9.197 -5.067 7.662
162 HA CYS 26 HA CYS 26 11.183 -5.897 5.617
163 HB2 CYS 26 HB2 CYS 26 11.991 -5.020 7.825
164 HB3 CYS 26 HB3 CYS 26 11.243 -6.439 8.590
165 H GLY 27 H GLY 27 11.284 -7.950 4.760
166 HA2 GLY 27 HA2 GLY 27 9.098 -9.742 5.624
167 HA3 GLY 27 HA3 GLY 27 10.030 -9.766 4.136
168 HA PRO 28 HA PRO 28 11.458 -12.930 7.372
169 HB2 PRO 28 HB2 PRO 28 10.519 -15.261 6.432
170 HB3 PRO 28 HB3 PRO 28 9.502 -14.072 7.322
171 HG2 PRO 28 HG2 PRO 28 9.865 -14.385 4.319
172 HG3 PRO 28 HG3 PRO 28 8.357 -14.493 5.302
173 HD2 PRO 28 HD2 PRO 28 9.104 -12.173 4.069
174 HD3 PRO 28 HD3 PRO 28 8.307 -12.190 5.730
175 H ASN 29 H ASN 29 11.836 -12.641 3.875
176 HA ASN 29 HA ASN 29 14.071 -14.547 3.789
177 HB2 ASN 29 HB2 ASN 29 13.028 -12.551 1.702
178 HB3 ASN 29 HB3 ASN 29 14.212 -13.807 1.434
179 HD21 ASN 29 HD21 ASN 29 13.501 -16.044 1.375
180 HD22 ASN 29 HD22 ASN 29 11.776 -16.370 1.149
181 H GLY 30 H GLY 30 13.724 -11.505 5.107
182 HA2 GLY 30 HA2 GLY 30 15.454 -10.155 5.898
183 HA3 GLY 30 HA3 GLY 30 16.665 -11.034 4.941
184 H PHE 31 H PHE 31 13.926 -10.043 3.219
185 HA PHE 31 HA PHE 31 15.361 -7.588 2.084
186 HB2 PHE 31 HB2 PHE 31 13.443 -9.582 0.698
187 HB3 PHE 31 HB3 PHE 31 14.063 -8.042 0.014
188 HD1 PHE 31 HD1 PHE 31 14.516 -11.538 0.183
189 HD2 PHE 31 HD2 PHE 31 16.785 -7.885 -0.018
190 HE1 PHE 31 HE1 PHE 31 16.409 -12.838 -0.657
191 HE2 PHE 31 HE2 PHE 31 18.734 -9.160 -0.822
192 HZ PHE 31 HZ PHE 31 18.511 -11.688 -1.186
193 H CYS 32 H CYS 32 14.098 -5.798 1.649
194 HA CYS 32 HA CYS 32 11.786 -5.430 3.388
195 HB2 CYS 32 HB2 CYS 32 13.617 -3.641 2.638
196 HB3 CYS 32 HB3 CYS 32 12.677 -3.674 1.105
197 H GLY 33 H GLY 33 9.680 -4.918 2.654
198 HA2 GLY 33 HA2 GLY 33 9.025 -5.667 -0.155
199 HA3 GLY 33 HA3 GLY 33 8.323 -6.687 1.120
Start of MODEL 18
1 H1 GLY 1 H1 GLY 1 3.403 -1.001 -0.159
2 H2 GLY 1 H2 GLY 1 3.921 -0.119 1.134
3 H3 GLY 1 H3 GLY 1 3.216 0.639 -0.155
4 HA2 GLY 1 HA2 GLY 1 5.799 -0.759 -0.149
5 HA3 GLY 1 HA3 GLY 1 5.028 -0.055 -1.592
6 H CYS 2 H CYS 2 7.557 0.717 -0.834
7 HA CYS 2 HA CYS 2 7.588 3.005 0.898
8 HB2 CYS 2 HB2 CYS 2 9.494 1.928 -1.211
9 HB3 CYS 2 HB3 CYS 2 9.832 3.371 -0.264
10 HA PRO 3 HA PRO 3 6.242 6.056 -1.956
11 HB2 PRO 3 HB2 PRO 3 7.417 8.341 -1.104
12 HB3 PRO 3 HB3 PRO 3 6.231 7.463 -0.085
13 HG2 PRO 3 HG2 PRO 3 9.228 7.397 0.003
14 HG3 PRO 3 HG3 PRO 3 8.055 7.627 1.338
15 HD2 PRO 3 HD2 PRO 3 9.204 5.218 0.743
16 HD3 PRO 3 HD3 PRO 3 7.577 5.357 1.456
17 H ARG 4 H ARG 4 6.877 7.549 -3.667
18 HA ARG 4 HA ARG 4 8.037 8.149 -5.545
19 HB2 ARG 4 HB2 ARG 4 10.478 7.982 -3.764
20 HB3 ARG 4 HB3 ARG 4 10.374 8.799 -5.325
21 HG2 ARG 4 HG2 ARG 4 8.581 10.278 -4.353
22 HG3 ARG 4 HG3 ARG 4 8.910 9.537 -2.773
23 HD2 ARG 4 HD2 ARG 4 11.288 10.268 -2.982
24 HD3 ARG 4 HD3 ARG 4 10.883 11.067 -4.510
25 HE ARG 4 HE ARG 4 9.119 11.968 -2.440
26 HH11 ARG 4 HH11 ARG 4 12.474 12.366 -3.474
27 HH12 ARG 4 HH12 ARG 4 12.605 13.938 -2.741
28 HH21 ARG 4 HH21 ARG 4 9.363 13.990 -1.525
29 HH22 ARG 4 HH22 ARG 4 10.874 14.835 -1.658
30 HA PRO 5 HA PRO 5 9.004 3.744 -6.670
31 HB2 PRO 5 HB2 PRO 5 7.769 4.909 -9.173
32 HB3 PRO 5 HB3 PRO 5 7.516 3.296 -8.435
33 HG2 PRO 5 HG2 PRO 5 5.666 5.141 -8.173
34 HG3 PRO 5 HG3 PRO 5 6.147 4.153 -6.754
35 HD2 PRO 5 HD2 PRO 5 6.955 6.971 -7.476
36 HD3 PRO 5 HD3 PRO 5 6.423 6.298 -5.900
37 H ARG 6 H ARG 6 10.629 2.944 -7.967
38 HA ARG 6 HA ARG 6 12.339 4.999 -9.335
39 HB2 ARG 6 HB2 ARG 6 13.219 2.514 -7.834
40 HB3 ARG 6 HB3 ARG 6 14.263 3.777 -8.506
41 HG2 ARG 6 HG2 ARG 6 13.208 5.390 -6.923
42 HG3 ARG 6 HG3 ARG 6 12.282 4.063 -6.216
43 HD2 ARG 6 HD2 ARG 6 14.174 4.405 -4.823
44 HD3 ARG 6 HD3 ARG 6 14.416 2.887 -5.707
45 HE ARG 6 HE ARG 6 15.628 5.063 -7.130
46 HH11 ARG 6 HH11 ARG 6 16.140 3.034 -4.295
47 HH12 ARG 6 HH12 ARG 6 17.865 3.273 -4.310
48 HH21 ARG 6 HH21 ARG 6 17.842 5.312 -7.118
49 HH22 ARG 6 HH22 ARG 6 18.820 4.550 -5.895
50 H GLY 7 H GLY 7 10.367 2.559 -10.021
51 HA2 GLY 7 HA2 GLY 7 10.292 1.528 -12.214
52 HA3 GLY 7 HA3 GLY 7 12.066 1.520 -12.244
53 H ASP 8 H ASP 8 11.782 -0.808 -12.742
54 HA ASP 8 HA ASP 8 10.558 -2.611 -10.881
55 HB2 ASP 8 HB2 ASP 8 12.527 -3.115 -13.129
56 HB3 ASP 8 HB3 ASP 8 11.486 -4.332 -12.364
57 H ASN 9 H ASN 9 12.849 -0.896 -9.881
58 HA ASN 9 HA ASN 9 15.161 -2.356 -9.488
59 HB2 ASN 9 HB2 ASN 9 15.764 -0.737 -7.849
60 HB3 ASN 9 HB3 ASN 9 14.760 0.101 -9.043
61 HD21 ASN 9 HD21 ASN 9 12.189 -0.865 -8.039
62 HD22 ASN 9 HD22 ASN 9 11.939 -0.046 -6.520
63 HA PRO 10 HA PRO 10 14.141 -5.489 -6.586
64 HB2 PRO 10 HB2 PRO 10 16.572 -6.134 -5.543
65 HB3 PRO 10 HB3 PRO 10 16.176 -6.433 -7.271
66 HG2 PRO 10 HG2 PRO 10 17.633 -4.100 -6.047
67 HG3 PRO 10 HG3 PRO 10 18.143 -5.158 -7.399
68 HD2 PRO 10 HD2 PRO 10 16.947 -2.771 -7.831
69 HD3 PRO 10 HD3 PRO 10 16.616 -4.192 -8.891
70 HA PRO 11 HA PRO 11 13.755 -3.554 -2.653
71 HB2 PRO 11 HB2 PRO 11 13.482 -5.613 -0.883
72 HB3 PRO 11 HB3 PRO 11 12.229 -5.247 -2.116
73 HG2 PRO 11 HG2 PRO 11 14.457 -7.275 -2.228
74 HG3 PRO 11 HG3 PRO 11 12.700 -7.502 -2.534
75 HD2 PRO 11 HD2 PRO 11 14.463 -7.132 -4.549
76 HD3 PRO 11 HD3 PRO 11 12.807 -6.444 -4.616
77 H LEU 12 H LEU 12 14.871 -3.001 -0.739
78 HA LEU 12 HA LEU 12 17.722 -3.654 -0.689
79 HB2 LEU 12 HB2 LEU 12 17.871 -2.110 1.135
80 HB3 LEU 12 HB3 LEU 12 16.947 -1.366 -0.148
81 HG LEU 12 HG LEU 12 15.455 -2.668 2.130
82 HD11 LEU 12 HD11 LEU 12 17.222 -1.396 3.239
83 HD12 LEU 12 HD12 LEU 12 15.658 -0.589 3.444
84 HD13 LEU 12 HD13 LEU 12 16.826 0.045 2.262
85 HD21 LEU 12 HD21 LEU 12 14.980 -0.153 0.460
86 HD22 LEU 12 HD22 LEU 12 13.916 -0.746 1.756
87 HD23 LEU 12 HD23 LEU 12 14.139 -1.708 0.286
88 H THR 13 H THR 13 18.772 -4.506 1.267
89 HA THR 13 HA THR 13 17.330 -6.769 2.437
90 HB THR 13 HB THR 13 19.492 -7.015 3.765
91 HG1 THR 13 HG1 THR 13 19.974 -4.709 3.597
92 HG21 THR 13 HG21 THR 13 19.226 -8.169 1.605
93 HG22 THR 13 HG22 THR 13 20.898 -7.641 1.887
94 HG23 THR 13 HG23 THR 13 19.865 -6.734 0.758
95 H CYS 14 H CYS 14 16.942 -6.994 4.736
96 HA CYS 14 HA CYS 14 17.214 -4.628 6.451
97 HB2 CYS 14 HB2 CYS 14 14.786 -4.559 6.938
98 HB3 CYS 14 HB3 CYS 14 15.112 -4.169 5.242
99 H SER 15 H SER 15 16.490 -5.183 8.646
100 HA SER 15 HA SER 15 16.211 -8.122 9.154
101 HB2 SER 15 HB2 SER 15 18.306 -8.015 9.965
102 HB3 SER 15 HB3 SER 15 18.302 -6.247 10.039
103 HG SER 15 HG SER 15 16.698 -7.628 11.874
104 H GLN 16 H GLN 16 15.268 -4.847 9.678
105 HA GLN 16 HA GLN 16 12.984 -5.770 11.338
106 HB2 GLN 16 HB2 GLN 16 13.198 -3.694 12.725
107 HB3 GLN 16 HB3 GLN 16 14.513 -4.845 13.010
108 HG2 GLN 16 HG2 GLN 16 16.006 -3.563 11.582
109 HG3 GLN 16 HG3 GLN 16 14.713 -2.440 11.167
110 HE21 GLN 16 HE21 GLN 16 16.889 -1.325 11.981
111 HE22 GLN 16 HE22 GLN 16 16.738 -0.749 13.638
112 H ASP 17 H ASP 17 11.205 -4.073 11.112
113 HA ASP 17 HA ASP 17 11.021 -3.299 8.316
114 HB2 ASP 17 HB2 ASP 17 8.857 -2.358 8.946
115 HB3 ASP 17 HB3 ASP 17 9.039 -3.984 9.621
116 H SER 18 H SER 18 12.006 -1.764 11.274
117 HA SER 18 HA SER 18 11.814 0.960 10.574
118 HB2 SER 18 HB2 SER 18 14.172 0.301 12.133
119 HB3 SER 18 HB3 SER 18 12.690 1.145 12.640
120 HG SER 18 HG SER 18 13.235 -1.041 13.609
121 H ASP 19 H ASP 19 13.877 -1.422 9.186
122 HA ASP 19 HA ASP 19 16.085 0.395 8.536
123 HB2 ASP 19 HB2 ASP 19 15.312 -2.343 7.451
124 HB3 ASP 19 HB3 ASP 19 16.800 -1.491 7.051
125 H CYS 20 H CYS 20 12.931 -0.198 7.370
126 HA CYS 20 HA CYS 20 13.620 0.784 4.626
127 HB2 CYS 20 HB2 CYS 20 11.150 -0.649 5.679
128 HB3 CYS 20 HB3 CYS 20 11.395 -0.081 4.024
129 H LEU 21 H LEU 21 11.777 2.136 3.662
130 HA LEU 21 HA LEU 21 11.305 4.403 5.450
131 HB2 LEU 21 HB2 LEU 21 10.261 3.876 2.639
132 HB3 LEU 21 HB3 LEU 21 10.147 5.404 3.502
133 HG LEU 21 HG LEU 21 12.680 4.089 2.497
134 HD11 LEU 21 HD11 LEU 21 12.809 6.074 1.033
135 HD12 LEU 21 HD12 LEU 21 11.225 6.605 1.631
136 HD13 LEU 21 HD13 LEU 21 11.373 5.083 0.716
137 HD21 LEU 21 HD21 LEU 21 13.813 6.213 3.204
138 HD22 LEU 21 HD22 LEU 21 13.200 5.268 4.569
139 HD23 LEU 21 HD23 LEU 21 12.305 6.703 4.025
140 H ALA 22 H ALA 22 9.193 5.170 6.047
141 HA ALA 22 HA ALA 22 7.390 3.177 6.919
142 HB1 ALA 22 HB1 ALA 22 5.833 5.067 7.319
143 HB2 ALA 22 HB2 ALA 22 7.478 5.481 7.863
144 HB3 ALA 22 HB3 ALA 22 6.854 6.134 6.321
145 H GLY 23 H GLY 23 5.715 2.156 5.961
146 HA2 GLY 23 HA2 GLY 23 3.963 2.083 4.257
147 HA3 GLY 23 HA3 GLY 23 5.058 2.937 3.145
148 H CYS 24 H CYS 24 7.260 1.170 4.514
149 HA CYS 24 HA CYS 24 6.762 -1.311 2.904
150 HB2 CYS 24 HB2 CYS 24 9.226 0.301 3.552
151 HB3 CYS 24 HB3 CYS 24 9.351 -1.418 3.265
152 H VAL 25 H VAL 25 7.824 -3.236 3.881
153 HA VAL 25 HA VAL 25 8.155 -3.101 6.857
154 HB VAL 25 HB VAL 25 6.942 -5.288 7.048
155 HG11 VAL 25 HG11 VAL 25 5.770 -3.133 7.504
156 HG12 VAL 25 HG12 VAL 25 5.167 -3.121 5.830
157 HG13 VAL 25 HG13 VAL 25 4.665 -4.414 6.954
158 HG21 VAL 25 HG21 VAL 25 6.068 -4.790 4.165
159 HG22 VAL 25 HG22 VAL 25 7.193 -6.065 4.696
160 HG23 VAL 25 HG23 VAL 25 5.496 -6.091 5.223
161 H CYS 26 H CYS 26 9.273 -5.224 7.581
162 HA CYS 26 HA CYS 26 11.222 -6.025 5.474
163 HB2 CYS 26 HB2 CYS 26 12.082 -5.094 7.632
164 HB3 CYS 26 HB3 CYS 26 11.372 -6.477 8.474
165 H GLY 27 H GLY 27 11.174 -8.070 4.644
166 HA2 GLY 27 HA2 GLY 27 9.029 -9.796 5.700
167 HA3 GLY 27 HA3 GLY 27 9.789 -9.925 4.112
168 HA PRO 28 HA PRO 28 11.431 -13.051 7.375
169 HB2 PRO 28 HB2 PRO 28 10.359 -14.956 5.305
170 HB3 PRO 28 HB3 PRO 28 10.290 -15.063 7.096
171 HG2 PRO 28 HG2 PRO 28 8.129 -14.401 5.746
172 HG3 PRO 28 HG3 PRO 28 8.562 -13.517 7.231
173 HD2 PRO 28 HD2 PRO 28 8.985 -12.700 4.368
174 HD3 PRO 28 HD3 PRO 28 8.318 -11.746 5.744
175 H ASN 29 H ASN 29 11.870 -12.473 3.986
176 HA ASN 29 HA ASN 29 14.066 -14.410 3.699
177 HB2 ASN 29 HB2 ASN 29 13.062 -12.205 1.852
178 HB3 ASN 29 HB3 ASN 29 14.295 -13.399 1.422
179 HD21 ASN 29 HD21 ASN 29 11.714 -12.860 0.194
180 HD22 ASN 29 HD22 ASN 29 10.826 -14.363 0.266
181 H GLY 30 H GLY 30 13.870 -11.465 5.257
182 HA2 GLY 30 HA2 GLY 30 15.633 -10.127 6.027
183 HA3 GLY 30 HA3 GLY 30 16.768 -11.061 5.039
184 H PHE 31 H PHE 31 13.917 -9.918 3.495
185 HA PHE 31 HA PHE 31 15.362 -7.587 2.308
186 HB2 PHE 31 HB2 PHE 31 13.821 -9.790 0.895
187 HB3 PHE 31 HB3 PHE 31 14.031 -8.185 0.199
188 HD1 PHE 31 HD1 PHE 31 15.728 -11.341 1.062
189 HD2 PHE 31 HD2 PHE 31 16.223 -7.374 -0.530
190 HE1 PHE 31 HE1 PHE 31 17.970 -11.983 0.170
191 HE2 PHE 31 HE2 PHE 31 18.443 -8.005 -1.453
192 HZ PHE 31 HZ PHE 31 19.332 -10.320 -1.098
193 H CYS 32 H CYS 32 14.087 -5.893 1.717
194 HA CYS 32 HA CYS 32 11.792 -5.490 3.400
195 HB2 CYS 32 HB2 CYS 32 13.616 -3.854 2.502
196 HB3 CYS 32 HB3 CYS 32 12.631 -3.786 1.038
197 H GLY 33 H GLY 33 9.636 -4.714 2.574
198 HA2 GLY 33 HA2 GLY 33 8.887 -5.444 -0.164
199 HA3 GLY 33 HA3 GLY 33 8.158 -6.454 1.111
Start of MODEL 19
1 H1 GLY 1 H1 GLY 1 3.370 2.264 -0.285
2 H2 GLY 1 H2 GLY 1 4.560 3.404 -0.059
3 H3 GLY 1 H3 GLY 1 4.008 3.070 -1.556
4 HA2 GLY 1 HA2 GLY 1 5.436 1.163 0.192
5 HA3 GLY 1 HA3 GLY 1 4.930 0.882 -1.491
6 H CYS 2 H CYS 2 7.549 0.515 -0.919
7 HA CYS 2 HA CYS 2 9.146 2.914 -0.925
8 HB2 CYS 2 HB2 CYS 2 9.649 -0.051 -1.276
9 HB3 CYS 2 HB3 CYS 2 10.971 1.091 -1.488
10 HA PRO 3 HA PRO 3 9.286 3.890 -5.111
11 HB2 PRO 3 HB2 PRO 3 11.810 4.764 -5.602
12 HB3 PRO 3 HB3 PRO 3 10.697 5.645 -4.500
13 HG2 PRO 3 HG2 PRO 3 12.840 3.618 -3.803
14 HG3 PRO 3 HG3 PRO 3 12.587 5.286 -3.133
15 HD2 PRO 3 HD2 PRO 3 11.617 3.134 -1.861
16 HD3 PRO 3 HD3 PRO 3 10.657 4.661 -1.949
17 H ARG 4 H ARG 4 9.569 3.090 -7.156
18 HA ARG 4 HA ARG 4 11.495 0.793 -7.477
19 HB2 ARG 4 HB2 ARG 4 9.622 -0.103 -8.998
20 HB3 ARG 4 HB3 ARG 4 9.449 -0.286 -7.237
21 HG2 ARG 4 HG2 ARG 4 7.872 1.489 -7.128
22 HG3 ARG 4 HG3 ARG 4 8.137 1.953 -8.813
23 HD2 ARG 4 HD2 ARG 4 7.229 -0.228 -9.547
24 HD3 ARG 4 HD3 ARG 4 6.968 -0.677 -7.872
25 HE ARG 4 HE ARG 4 5.100 0.695 -7.771
26 HH11 ARG 4 HH11 ARG 4 6.825 1.330 -10.814
27 HH12 ARG 4 HH12 ARG 4 5.498 2.239 -11.484
28 HH21 ARG 4 HH21 ARG 4 3.470 1.872 -8.708
29 HH22 ARG 4 HH22 ARG 4 3.628 2.562 -10.298
30 HA PRO 5 HA PRO 5 11.879 4.109 -10.667
31 HB2 PRO 5 HB2 PRO 5 14.600 4.332 -10.763
32 HB3 PRO 5 HB3 PRO 5 13.611 5.061 -9.447
33 HG2 PRO 5 HG2 PRO 5 15.065 2.396 -9.509
34 HG3 PRO 5 HG3 PRO 5 15.174 3.703 -8.284
35 HD2 PRO 5 HD2 PRO 5 13.632 1.569 -7.925
36 HD3 PRO 5 HD3 PRO 5 13.115 3.213 -7.372
37 H ARG 6 H ARG 6 12.914 0.820 -10.637
38 HA ARG 6 HA ARG 6 13.416 0.934 -13.459
39 HB2 ARG 6 HB2 ARG 6 14.618 -0.943 -11.588
40 HB3 ARG 6 HB3 ARG 6 14.928 -0.941 -13.192
41 HG2 ARG 6 HG2 ARG 6 15.925 1.231 -12.930
42 HG3 ARG 6 HG3 ARG 6 15.739 1.072 -11.315
43 HD2 ARG 6 HD2 ARG 6 17.120 -0.923 -11.436
44 HD3 ARG 6 HD3 ARG 6 17.426 -0.548 -12.996
45 HE ARG 6 HE ARG 6 18.514 0.729 -10.697
46 HH11 ARG 6 HH11 ARG 6 20.204 2.191 -11.046
47 HH12 ARG 6 HH12 ARG 6 20.572 2.723 -12.653
48 HH21 ARG 6 HH21 ARG 6 18.049 0.825 -14.164
49 HH22 ARG 6 HH22 ARG 6 19.343 1.945 -14.430
50 H GLY 7 H GLY 7 12.050 -0.962 -10.890
51 HA2 GLY 7 HA2 GLY 7 10.231 -2.446 -11.034
52 HA3 GLY 7 HA3 GLY 7 10.158 -2.155 -12.769
53 H ASP 8 H ASP 8 13.299 -2.771 -11.923
54 HA ASP 8 HA ASP 8 13.137 -5.667 -12.631
55 HB2 ASP 8 HB2 ASP 8 13.760 -4.160 -14.495
56 HB3 ASP 8 HB3 ASP 8 15.104 -3.517 -13.523
57 H ASN 9 H ASN 9 14.663 -3.184 -10.638
58 HA ASN 9 HA ASN 9 16.895 -4.869 -9.921
59 HB2 ASN 9 HB2 ASN 9 17.653 -2.763 -9.867
60 HB3 ASN 9 HB3 ASN 9 16.046 -2.075 -9.636
61 HD21 ASN 9 HD21 ASN 9 15.084 -2.291 -7.465
62 HD22 ASN 9 HD22 ASN 9 16.195 -2.052 -6.124
63 HA PRO 10 HA PRO 10 14.886 -6.889 -6.587
64 HB2 PRO 10 HB2 PRO 10 16.981 -7.570 -4.989
65 HB3 PRO 10 HB3 PRO 10 16.779 -8.256 -6.638
66 HG2 PRO 10 HG2 PRO 10 18.454 -5.982 -5.704
67 HG3 PRO 10 HG3 PRO 10 18.909 -7.376 -6.720
68 HD2 PRO 10 HD2 PRO 10 18.290 -4.967 -7.766
69 HD3 PRO 10 HD3 PRO 10 17.883 -6.500 -8.629
70 HA PRO 11 HA PRO 11 14.141 -4.190 -3.230
71 HB2 PRO 11 HB2 PRO 11 13.587 -5.813 -1.092
72 HB3 PRO 11 HB3 PRO 11 12.495 -5.655 -2.521
73 HG2 PRO 11 HG2 PRO 11 14.587 -7.722 -1.998
74 HG3 PRO 11 HG3 PRO 11 12.878 -7.949 -2.385
75 HD2 PRO 11 HD2 PRO 11 14.768 -8.122 -4.267
76 HD3 PRO 11 HD3 PRO 11 13.210 -7.286 -4.628
77 H LEU 12 H LEU 12 14.950 -3.364 -1.211
78 HA LEU 12 HA LEU 12 17.811 -3.831 -0.814
79 HB2 LEU 12 HB2 LEU 12 17.635 -2.017 0.836
80 HB3 LEU 12 HB3 LEU 12 16.897 -1.561 -0.676
81 HG LEU 12 HG LEU 12 14.772 -2.619 0.814
82 HD11 LEU 12 HD11 LEU 12 14.883 -1.278 2.904
83 HD12 LEU 12 HD12 LEU 12 16.565 -0.881 2.544
84 HD13 LEU 12 HD13 LEU 12 16.081 -2.566 2.839
85 HD21 LEU 12 HD21 LEU 12 14.021 -0.235 0.889
86 HD22 LEU 12 HD22 LEU 12 14.659 -0.666 -0.716
87 HD23 LEU 12 HD23 LEU 12 15.638 0.298 0.434
88 H THR 13 H THR 13 18.775 -4.427 1.230
89 HA THR 13 HA THR 13 17.357 -6.722 2.426
90 HB THR 13 HB THR 13 19.567 -6.768 3.792
91 HG1 THR 13 HG1 THR 13 20.194 -4.652 3.468
92 HG21 THR 13 HG21 THR 13 19.730 -6.891 0.763
93 HG22 THR 13 HG22 THR 13 19.286 -8.239 1.843
94 HG23 THR 13 HG23 THR 13 20.933 -7.541 1.882
95 H CYS 14 H CYS 14 16.958 -6.945 4.667
96 HA CYS 14 HA CYS 14 17.194 -4.632 6.467
97 HB2 CYS 14 HB2 CYS 14 14.811 -4.561 6.963
98 HB3 CYS 14 HB3 CYS 14 15.091 -4.274 5.250
99 H SER 15 H SER 15 16.313 -5.234 8.595
100 HA SER 15 HA SER 15 16.318 -8.178 9.147
101 HB2 SER 15 HB2 SER 15 18.516 -7.698 9.743
102 HB3 SER 15 HB3 SER 15 18.172 -6.037 10.095
103 HG SER 15 HG SER 15 18.131 -6.638 12.091
104 H GLN 16 H GLN 16 15.442 -4.849 9.938
105 HA GLN 16 HA GLN 16 13.095 -5.832 11.510
106 HB2 GLN 16 HB2 GLN 16 13.394 -3.909 13.002
107 HB3 GLN 16 HB3 GLN 16 14.770 -4.987 13.110
108 HG2 GLN 16 HG2 GLN 16 16.064 -3.476 11.585
109 HG3 GLN 16 HG3 GLN 16 14.722 -2.339 11.593
110 HE21 GLN 16 HE21 GLN 16 13.938 -2.263 14.226
111 HE22 GLN 16 HE22 GLN 16 15.275 -1.701 15.224
112 H ASP 17 H ASP 17 11.358 -4.129 11.399
113 HA ASP 17 HA ASP 17 10.970 -3.380 8.626
114 HB2 ASP 17 HB2 ASP 17 8.893 -2.369 9.388
115 HB3 ASP 17 HB3 ASP 17 9.083 -3.912 10.232
116 H SER 18 H SER 18 12.239 -1.739 11.429
117 HA SER 18 HA SER 18 11.866 0.940 10.550
118 HB2 SER 18 HB2 SER 18 12.327 0.246 12.881
119 HB3 SER 18 HB3 SER 18 13.992 -0.150 12.421
120 HG SER 18 HG SER 18 14.226 2.032 11.699
121 H ASP 19 H ASP 19 13.884 -1.464 9.260
122 HA ASP 19 HA ASP 19 16.103 0.277 8.444
123 HB2 ASP 19 HB2 ASP 19 15.166 -2.491 7.566
124 HB3 ASP 19 HB3 ASP 19 16.653 -1.705 6.961
125 H CYS 20 H CYS 20 12.872 -0.096 7.560
126 HA CYS 20 HA CYS 20 13.401 0.567 4.704
127 HB2 CYS 20 HB2 CYS 20 10.939 -0.625 6.040
128 HB3 CYS 20 HB3 CYS 20 11.109 -0.239 4.357
129 H LEU 21 H LEU 21 11.575 1.845 3.708
130 HA LEU 21 HA LEU 21 11.229 4.327 5.197
131 HB2 LEU 21 HB2 LEU 21 10.005 3.392 2.590
132 HB3 LEU 21 HB3 LEU 21 9.928 5.036 3.196
133 HG LEU 21 HG LEU 21 12.492 3.568 2.397
134 HD11 LEU 21 HD11 LEU 21 10.875 5.743 1.010
135 HD12 LEU 21 HD12 LEU 21 11.000 4.054 0.505
136 HD13 LEU 21 HD13 LEU 21 12.458 5.053 0.455
137 HD21 LEU 21 HD21 LEU 21 11.992 6.495 3.188
138 HD22 LEU 21 HD22 LEU 21 13.514 5.877 2.464
139 HD23 LEU 21 HD23 LEU 21 13.003 5.299 4.074
140 H ALA 22 H ALA 22 9.094 5.239 5.696
141 HA ALA 22 HA ALA 22 7.409 3.453 7.090
142 HB1 ALA 22 HB1 ALA 22 7.619 5.883 7.580
143 HB2 ALA 22 HB2 ALA 22 6.818 6.250 6.038
144 HB3 ALA 22 HB3 ALA 22 5.947 5.390 7.336
145 H GLY 23 H GLY 23 5.753 2.229 6.404
146 HA2 GLY 23 HA2 GLY 23 3.865 1.738 5.054
147 HA3 GLY 23 HA3 GLY 23 4.518 2.779 3.792
148 H CYS 24 H CYS 24 7.070 0.997 4.916
149 HA CYS 24 HA CYS 24 6.616 -1.238 2.915
150 HB2 CYS 24 HB2 CYS 24 9.239 0.084 3.798
151 HB3 CYS 24 HB3 CYS 24 9.058 -1.211 2.602
152 H VAL 25 H VAL 25 7.845 -3.235 3.704
153 HA VAL 25 HA VAL 25 8.016 -3.347 6.696
154 HB VAL 25 HB VAL 25 6.925 -5.581 6.598
155 HG11 VAL 25 HG11 VAL 25 5.591 -3.593 7.157
156 HG12 VAL 25 HG12 VAL 25 5.202 -3.347 5.431
157 HG13 VAL 25 HG13 VAL 25 4.609 -4.781 6.322
158 HG21 VAL 25 HG21 VAL 25 6.332 -4.910 3.677
159 HG22 VAL 25 HG22 VAL 25 7.386 -6.220 4.241
160 HG23 VAL 25 HG23 VAL 25 5.651 -6.279 4.584
161 H CYS 26 H CYS 26 9.215 -5.333 7.460
162 HA CYS 26 HA CYS 26 11.297 -6.135 5.484
163 HB2 CYS 26 HB2 CYS 26 12.000 -5.014 7.588
164 HB3 CYS 26 HB3 CYS 26 11.302 -6.349 8.501
165 H GLY 27 H GLY 27 11.089 -8.108 4.612
166 HA2 GLY 27 HA2 GLY 27 9.038 -9.906 5.727
167 HA3 GLY 27 HA3 GLY 27 9.799 -10.009 4.147
168 HA PRO 28 HA PRO 28 11.380 -13.128 7.403
169 HB2 PRO 28 HB2 PRO 28 10.349 -15.032 5.257
170 HB3 PRO 28 HB3 PRO 28 10.238 -15.198 7.060
171 HG2 PRO 28 HG2 PRO 28 8.135 -14.498 5.682
172 HG3 PRO 28 HG3 PRO 28 8.514 -13.667 7.180
173 HD2 PRO 28 HD2 PRO 28 8.930 -12.737 4.369
174 HD3 PRO 28 HD3 PRO 28 8.291 -11.854 5.791
175 H ASN 29 H ASN 29 11.855 -12.449 4.073
176 HA ASN 29 HA ASN 29 14.034 -14.371 3.706
177 HB2 ASN 29 HB2 ASN 29 12.958 -12.164 1.916
178 HB3 ASN 29 HB3 ASN 29 14.248 -13.273 1.474
179 HD21 ASN 29 HD21 ASN 29 12.293 -13.281 -0.221
180 HD22 ASN 29 HD22 ASN 29 11.250 -14.675 -0.046
181 H GLY 30 H GLY 30 13.827 -11.417 5.285
182 HA2 GLY 30 HA2 GLY 30 15.525 -10.025 6.043
183 HA3 GLY 30 HA3 GLY 30 16.711 -10.962 5.092
184 H PHE 31 H PHE 31 13.841 -9.894 3.469
185 HA PHE 31 HA PHE 31 15.313 -7.564 2.319
186 HB2 PHE 31 HB2 PHE 31 13.668 -9.687 0.882
187 HB3 PHE 31 HB3 PHE 31 14.082 -8.106 0.175
188 HD1 PHE 31 HD1 PHE 31 15.375 -11.467 0.940
189 HD2 PHE 31 HD2 PHE 31 16.443 -7.493 -0.261
190 HE1 PHE 31 HE1 PHE 31 17.558 -12.316 0.177
191 HE2 PHE 31 HE2 PHE 31 18.635 -8.326 -1.073
192 HZ PHE 31 HZ PHE 31 19.216 -10.745 -0.836
193 H CYS 32 H CYS 32 14.149 -5.809 1.815
194 HA CYS 32 HA CYS 32 11.738 -5.460 3.389
195 HB2 CYS 32 HB2 CYS 32 13.673 -3.797 2.851
196 HB3 CYS 32 HB3 CYS 32 12.908 -3.598 1.274
197 H GLY 33 H GLY 33 9.697 -4.721 2.561
198 HA2 GLY 33 HA2 GLY 33 9.176 -5.367 -0.293
199 HA3 GLY 33 HA3 GLY 33 8.120 -6.021 0.968
Start of MODEL 20
1 H1 GLY 1 H1 GLY 1 3.677 -3.584 2.738
2 H2 GLY 1 H2 GLY 1 4.654 -2.376 3.297
3 H3 GLY 1 H3 GLY 1 3.154 -2.018 2.718
4 HA2 GLY 1 HA2 GLY 1 5.361 -3.121 1.148
5 HA3 GLY 1 HA3 GLY 1 3.761 -2.698 0.522
6 H CYS 2 H CYS 2 6.732 -1.686 0.221
7 HA CYS 2 HA CYS 2 6.886 0.903 1.292
8 HB2 CYS 2 HB2 CYS 2 8.036 -0.264 -1.257
9 HB3 CYS 2 HB3 CYS 2 8.476 1.330 -0.626
10 HA PRO 3 HA PRO 3 3.970 3.079 -1.043
11 HB2 PRO 3 HB2 PRO 3 4.630 5.683 -0.601
12 HB3 PRO 3 HB3 PRO 3 4.004 4.625 0.704
13 HG2 PRO 3 HG2 PRO 3 6.841 5.389 0.075
14 HG3 PRO 3 HG3 PRO 3 6.002 5.361 1.656
15 HD2 PRO 3 HD2 PRO 3 7.638 3.347 0.740
16 HD3 PRO 3 HD3 PRO 3 6.289 3.072 1.882
17 H ARG 4 H ARG 4 3.675 3.693 -3.094
18 HA ARG 4 HA ARG 4 4.191 3.949 -5.338
19 HB2 ARG 4 HB2 ARG 4 5.870 6.212 -4.207
20 HB3 ARG 4 HB3 ARG 4 5.292 6.058 -5.871
21 HG2 ARG 4 HG2 ARG 4 2.934 6.125 -5.003
22 HG3 ARG 4 HG3 ARG 4 3.587 6.423 -3.382
23 HD2 ARG 4 HD2 ARG 4 2.986 8.546 -4.287
24 HD3 ARG 4 HD3 ARG 4 4.758 8.458 -4.313
25 HE ARG 4 HE ARG 4 3.804 7.527 -6.809
26 HH11 ARG 4 HH11 ARG 4 3.910 10.576 -5.030
27 HH12 ARG 4 HH12 ARG 4 3.891 11.533 -6.487
28 HH21 ARG 4 HH21 ARG 4 3.790 8.815 -8.625
29 HH22 ARG 4 HH22 ARG 4 3.817 10.551 -8.482
30 HA PRO 5 HA PRO 5 8.454 2.132 -4.942
31 HB2 PRO 5 HB2 PRO 5 8.025 -0.378 -5.935
32 HB3 PRO 5 HB3 PRO 5 7.693 0.048 -4.225
33 HG2 PRO 5 HG2 PRO 5 5.784 -0.065 -6.545
34 HG3 PRO 5 HG3 PRO 5 5.636 -0.818 -4.924
35 HD2 PRO 5 HD2 PRO 5 4.437 1.530 -5.516
36 HD3 PRO 5 HD3 PRO 5 5.150 1.237 -3.897
37 H ARG 6 H ARG 6 9.994 1.842 -6.586
38 HA ARG 6 HA ARG 6 9.324 3.085 -9.088
39 HB2 ARG 6 HB2 ARG 6 11.550 3.234 -7.978
40 HB3 ARG 6 HB3 ARG 6 11.801 1.514 -8.271
41 HG2 ARG 6 HG2 ARG 6 13.045 2.593 -9.959
42 HG3 ARG 6 HG3 ARG 6 11.583 2.028 -10.763
43 HD2 ARG 6 HD2 ARG 6 11.955 4.218 -11.573
44 HD3 ARG 6 HD3 ARG 6 10.609 4.347 -10.431
45 HE ARG 6 HE ARG 6 11.955 5.581 -8.976
46 HH11 ARG 6 HH11 ARG 6 13.978 4.340 -11.606
47 HH12 ARG 6 HH12 ARG 6 15.322 5.360 -11.169
48 HH21 ARG 6 HH21 ARG 6 13.718 6.841 -8.484
49 HH22 ARG 6 HH22 ARG 6 15.172 6.746 -9.436
50 H GLY 7 H GLY 7 9.944 -0.327 -8.196
51 HA2 GLY 7 HA2 GLY 7 9.209 -2.233 -9.338
52 HA3 GLY 7 HA3 GLY 7 8.609 -1.207 -10.648
53 H ASP 8 H ASP 8 11.262 0.173 -10.759
54 HA ASP 8 HA ASP 8 12.619 -1.741 -12.556
55 HB2 ASP 8 HB2 ASP 8 11.793 0.585 -13.262
56 HB3 ASP 8 HB3 ASP 8 13.080 1.243 -12.242
57 H ASN 9 H ASN 9 12.859 -1.691 -9.513
58 HA ASN 9 HA ASN 9 15.782 -1.275 -9.394
59 HB2 ASN 9 HB2 ASN 9 15.475 0.619 -8.249
60 HB3 ASN 9 HB3 ASN 9 13.748 0.323 -8.106
61 HD21 ASN 9 HD21 ASN 9 13.095 -1.295 -6.393
62 HD22 ASN 9 HD22 ASN 9 13.985 -1.209 -4.897
63 HA PRO 10 HA PRO 10 15.521 -5.186 -7.405
64 HB2 PRO 10 HB2 PRO 10 17.944 -5.392 -6.190
65 HB3 PRO 10 HB3 PRO 10 17.794 -5.303 -7.976
66 HG2 PRO 10 HG2 PRO 10 18.417 -3.118 -6.012
67 HG3 PRO 10 HG3 PRO 10 19.264 -3.547 -7.532
68 HD2 PRO 10 HD2 PRO 10 17.402 -1.547 -7.359
69 HD3 PRO 10 HD3 PRO 10 17.634 -2.505 -8.855
70 HA PRO 11 HA PRO 11 14.247 -4.503 -3.258
71 HB2 PRO 11 HB2 PRO 11 14.514 -6.893 -1.989
72 HB3 PRO 11 HB3 PRO 11 13.313 -6.647 -3.295
73 HG2 PRO 11 HG2 PRO 11 16.081 -7.834 -3.479
74 HG3 PRO 11 HG3 PRO 11 14.526 -8.507 -4.070
75 HD2 PRO 11 HD2 PRO 11 16.210 -7.158 -5.709
76 HD3 PRO 11 HD3 PRO 11 14.425 -6.999 -5.867
77 H LEU 12 H LEU 12 15.015 -4.038 -1.147
78 HA LEU 12 HA LEU 12 17.981 -4.147 -0.874
79 HB2 LEU 12 HB2 LEU 12 17.823 -2.326 0.634
80 HB3 LEU 12 HB3 LEU 12 16.912 -1.900 -0.801
81 HG LEU 12 HG LEU 12 15.430 -2.940 1.593
82 HD11 LEU 12 HD11 LEU 12 16.495 -0.116 1.255
83 HD12 LEU 12 HD12 LEU 12 16.967 -1.288 2.511
84 HD13 LEU 12 HD13 LEU 12 15.317 -0.642 2.482
85 HD21 LEU 12 HD21 LEU 12 14.809 -0.885 -0.579
86 HD22 LEU 12 HD22 LEU 12 13.728 -1.295 0.774
87 HD23 LEU 12 HD23 LEU 12 14.124 -2.520 -0.441
88 H THR 13 H THR 13 18.853 -4.709 1.240
89 HA THR 13 HA THR 13 17.361 -6.902 2.470
90 HB THR 13 HB THR 13 19.429 -6.986 3.957
91 HG1 THR 13 HG1 THR 13 19.964 -4.742 3.644
92 HG21 THR 13 HG21 THR 13 20.924 -7.806 2.202
93 HG22 THR 13 HG22 THR 13 19.948 -6.998 0.956
94 HG23 THR 13 HG23 THR 13 19.259 -8.347 1.894
95 H CYS 14 H CYS 14 16.916 -7.020 4.769
96 HA CYS 14 HA CYS 14 17.097 -4.570 6.373
97 HB2 CYS 14 HB2 CYS 14 14.689 -4.527 6.875
98 HB3 CYS 14 HB3 CYS 14 14.951 -4.258 5.145
99 H SER 15 H SER 15 16.447 -5.084 8.591
100 HA SER 15 HA SER 15 16.233 -8.009 9.191
101 HB2 SER 15 HB2 SER 15 18.385 -7.808 9.902
102 HB3 SER 15 HB3 SER 15 18.282 -6.045 10.031
103 HG SER 15 HG SER 15 16.746 -7.462 11.859
104 H GLN 16 H GLN 16 15.225 -4.745 9.566
105 HA GLN 16 HA GLN 16 12.971 -5.631 11.260
106 HB2 GLN 16 HB2 GLN 16 13.186 -3.596 12.680
107 HB3 GLN 16 HB3 GLN 16 14.542 -4.707 12.915
108 HG2 GLN 16 HG2 GLN 16 15.926 -3.332 11.403
109 HG3 GLN 16 HG3 GLN 16 14.588 -2.200 11.210
110 HE21 GLN 16 HE21 GLN 16 17.224 -1.665 12.135
111 HE22 GLN 16 HE22 GLN 16 17.072 -1.072 13.781
112 H ASP 17 H ASP 17 11.214 -3.875 11.045
113 HA ASP 17 HA ASP 17 11.076 -3.080 8.247
114 HB2 ASP 17 HB2 ASP 17 8.896 -2.138 8.858
115 HB3 ASP 17 HB3 ASP 17 9.066 -3.787 9.478
116 H SER 18 H SER 18 12.028 -1.632 11.247
117 HA SER 18 HA SER 18 11.851 1.116 10.624
118 HB2 SER 18 HB2 SER 18 14.206 0.338 12.188
119 HB3 SER 18 HB3 SER 18 12.786 1.297 12.667
120 HG SER 18 HG SER 18 13.236 -0.993 13.582
121 H ASP 19 H ASP 19 13.889 -1.211 9.138
122 HA ASP 19 HA ASP 19 16.154 0.575 8.620
123 HB2 ASP 19 HB2 ASP 19 15.300 -2.067 7.366
124 HB3 ASP 19 HB3 ASP 19 16.824 -1.238 7.024
125 H CYS 20 H CYS 20 12.987 0.330 7.458
126 HA CYS 20 HA CYS 20 13.735 1.415 4.773
127 HB2 CYS 20 HB2 CYS 20 11.373 -0.301 5.584
128 HB3 CYS 20 HB3 CYS 20 11.723 0.292 3.959
129 H LEU 21 H LEU 21 11.533 2.355 3.767
130 HA LEU 21 HA LEU 21 10.899 4.713 5.303
131 HB2 LEU 21 HB2 LEU 21 9.333 3.537 2.982
132 HB3 LEU 21 HB3 LEU 21 9.283 5.195 3.546
133 HG LEU 21 HG LEU 21 11.570 3.831 2.112
134 HD11 LEU 21 HD11 LEU 21 9.655 4.346 0.687
135 HD12 LEU 21 HD12 LEU 21 11.016 5.418 0.305
136 HD13 LEU 21 HD13 LEU 21 9.648 6.029 1.266
137 HD21 LEU 21 HD21 LEU 21 12.497 5.475 3.683
138 HD22 LEU 21 HD22 LEU 21 11.344 6.705 3.110
139 HD23 LEU 21 HD23 LEU 21 12.615 6.092 2.025
140 H ALA 22 H ALA 22 8.896 5.249 6.312
141 HA ALA 22 HA ALA 22 7.504 3.159 7.646
142 HB1 ALA 22 HB1 ALA 22 6.575 6.003 7.002
143 HB2 ALA 22 HB2 ALA 22 5.845 4.917 8.209
144 HB3 ALA 22 HB3 ALA 22 7.503 5.516 8.444
145 H GLY 23 H GLY 23 5.890 1.853 6.985
146 HA2 GLY 23 HA2 GLY 23 3.871 1.469 5.665
147 HA3 GLY 23 HA3 GLY 23 4.567 2.460 4.369
148 H CYS 24 H CYS 24 7.284 1.281 4.751
149 HA CYS 24 HA CYS 24 6.987 -1.118 3.100
150 HB2 CYS 24 HB2 CYS 24 9.332 0.003 4.675
151 HB3 CYS 24 HB3 CYS 24 9.430 -1.353 3.550
152 H VAL 25 H VAL 25 7.804 -3.245 3.853
153 HA VAL 25 HA VAL 25 7.801 -3.553 6.825
154 HB VAL 25 HB VAL 25 6.601 -5.745 6.582
155 HG11 VAL 25 HG11 VAL 25 4.333 -4.820 6.365
156 HG12 VAL 25 HG12 VAL 25 5.373 -3.710 7.283
157 HG13 VAL 25 HG13 VAL 25 4.982 -3.356 5.587
158 HG21 VAL 25 HG21 VAL 25 7.038 -6.192 4.190
159 HG22 VAL 25 HG22 VAL 25 5.296 -6.217 4.520
160 HG23 VAL 25 HG23 VAL 25 6.032 -4.805 3.726
161 H CYS 26 H CYS 26 9.170 -5.281 7.520
162 HA CYS 26 HA CYS 26 11.197 -6.001 5.473
163 HB2 CYS 26 HB2 CYS 26 11.960 -5.014 7.611
164 HB3 CYS 26 HB3 CYS 26 11.215 -6.346 8.500
165 H GLY 27 H GLY 27 11.138 -7.998 4.548
166 HA2 GLY 27 HA2 GLY 27 9.032 -9.790 5.526
167 HA3 GLY 27 HA3 GLY 27 9.891 -9.911 3.992
168 HA PRO 28 HA PRO 28 11.369 -12.984 7.369
169 HB2 PRO 28 HB2 PRO 28 10.280 -14.919 5.336
170 HB3 PRO 28 HB3 PRO 28 10.174 -14.971 7.124
171 HG2 PRO 28 HG2 PRO 28 8.052 -14.307 5.702
172 HG3 PRO 28 HG3 PRO 28 8.467 -13.378 7.177
173 HD2 PRO 28 HD2 PRO 28 8.991 -12.681 4.294
174 HD3 PRO 28 HD3 PRO 28 8.303 -11.672 5.613
175 H ASN 29 H ASN 29 11.863 -12.496 3.964
176 HA ASN 29 HA ASN 29 14.043 -14.457 3.778
177 HB2 ASN 29 HB2 ASN 29 12.380 -13.747 1.908
178 HB3 ASN 29 HB3 ASN 29 13.391 -12.302 1.753
179 HD21 ASN 29 HD21 ASN 29 14.749 -12.490 0.095
180 HD22 ASN 29 HD22 ASN 29 15.564 -13.957 -0.380
181 H GLY 30 H GLY 30 13.842 -11.503 5.276
182 HA2 GLY 30 HA2 GLY 30 15.572 -10.152 6.050
183 HA3 GLY 30 HA3 GLY 30 16.727 -11.092 5.085
184 H PHE 31 H PHE 31 13.903 -9.900 3.488
185 HA PHE 31 HA PHE 31 15.421 -7.597 2.364
186 HB2 PHE 31 HB2 PHE 31 13.960 -9.788 0.887
187 HB3 PHE 31 HB3 PHE 31 14.122 -8.167 0.200
188 HD1 PHE 31 HD1 PHE 31 16.032 -11.160 1.291
189 HD2 PHE 31 HD2 PHE 31 16.200 -7.347 -0.673
190 HE1 PHE 31 HE1 PHE 31 18.298 -11.715 0.437
191 HE2 PHE 31 HE2 PHE 31 18.458 -7.885 -1.555
192 HZ PHE 31 HZ PHE 31 19.518 -10.077 -1.003
193 H CYS 32 H CYS 32 14.231 -5.833 1.817
194 HA CYS 32 HA CYS 32 11.769 -5.591 3.384
195 HB2 CYS 32 HB2 CYS 32 13.833 -3.992 3.188
196 HB3 CYS 32 HB3 CYS 32 13.039 -3.418 1.720
197 H GLY 33 H GLY 33 9.768 -4.652 2.518
198 HA2 GLY 33 HA2 GLY 33 9.535 -4.499 -0.416
199 HA3 GLY 33 HA3 GLY 33 8.602 -5.782 0.359