Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
654299 | 7ald RC | 34564 | cing | 1-original | 7 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 H1 SER 1 H SER 1 1.807 0.001 0.856
2 HA SER 1 HA SER 1 1.392 -0.017 -2.063
3 HB2 SER 1 HB2 SER 1 2.869 1.673 -2.339
4 HB3 SER 1 HB3 SER 1 2.580 1.999 -0.631
5 HG SER 1 HG SER 1 4.511 1.282 -0.166
6 HA PRO 2 HA PRO 2 3.869 -3.621 -2.398
7 HB2 PRO 2 HB2 PRO 2 5.299 -3.143 -4.656
8 HB3 PRO 2 HB3 PRO 2 3.568 -3.502 -4.673
9 HG2 PRO 2 HG2 PRO 2 4.956 -0.855 -4.850
10 HG3 PRO 2 HG3 PRO 2 3.569 -1.455 -5.778
11 HD2 PRO 2 HD2 PRO 2 3.297 0.231 -3.676
12 HD3 PRO 2 HD3 PRO 2 2.076 -0.991 -4.084
13 H ARG 3 H ARG 3 5.736 -4.398 -1.588
14 HA ARG 3 HA ARG 3 7.593 -2.718 -0.338
15 HB2 ARG 3 HB2 ARG 3 8.918 -4.746 0.037
16 HB3 ARG 3 HB3 ARG 3 7.214 -5.025 0.373
17 HG2 ARG 3 HG2 ARG 3 7.198 -5.852 -2.124
18 HG3 ARG 3 HG3 ARG 3 8.919 -6.091 -1.814
19 HD2 ARG 3 HD2 ARG 3 7.751 -8.133 -1.326
20 HD3 ARG 3 HD3 ARG 3 8.322 -7.428 0.186
21 HE ARG 3 HE ARG 3 5.644 -6.652 -0.440
22 HH11 ARG 3 HH11 ARG 3 7.600 -9.189 0.922
23 HH12 ARG 3 HH12 ARG 3 6.325 -9.818 1.914
24 HH21 ARG 3 HH21 ARG 3 3.958 -7.471 0.860
25 HH22 ARG 3 HH22 ARG 3 4.254 -8.840 1.877
26 H VAL 4 H VAL 4 9.890 -2.500 -0.765
27 HA VAL 4 HA VAL 4 10.656 -2.811 -3.581
28 HB VAL 4 HB VAL 4 10.982 -0.260 -1.993
29 HG11 VAL 4 HG11 VAL 4 12.076 -1.137 -4.647
30 HG12 VAL 4 HG12 VAL 4 11.857 0.568 -4.252
31 HG13 VAL 4 HG13 VAL 4 12.932 -0.432 -3.275
32 HG21 VAL 4 HG21 VAL 4 9.395 -0.816 -4.499
33 HG22 VAL 4 HG22 VAL 4 8.718 -0.616 -2.883
34 HG23 VAL 4 HG23 VAL 4 9.533 0.735 -3.671
35 H CYS 5 H CYS 5 12.746 -3.378 -3.905
36 HA CYS 5 HA CYS 5 14.620 -3.209 -1.658
37 HB2 CYS 5 HB2 CYS 5 13.888 -5.711 -3.177
38 HB3 CYS 5 HB3 CYS 5 15.390 -5.562 -2.270
39 H ILE 6 H ILE 6 16.819 -3.193 -2.249
40 HA ILE 6 HA ILE 6 17.474 -3.186 -5.090
41 HB ILE 6 HB ILE 6 18.579 -1.037 -5.031
42 HG12 ILE 6 HG12 ILE 6 17.555 -0.833 -2.191
43 HG13 ILE 6 HG13 ILE 6 19.238 -1.025 -2.670
44 HG21 ILE 6 HG21 ILE 6 16.647 0.417 -4.925
45 HG22 ILE 6 HG22 ILE 6 16.194 -1.130 -5.641
46 HG23 ILE 6 HG23 ILE 6 15.771 -0.776 -3.966
47 HD11 ILE 6 HD11 ILE 6 18.269 1.228 -4.038
48 HD12 ILE 6 HD12 ILE 6 17.710 1.361 -2.370
49 HD13 ILE 6 HD13 ILE 6 19.430 1.172 -2.711
50 H ARG 7 H ARG 7 19.954 -2.637 -5.283
51 HA ARG 7 HA ARG 7 21.297 -4.450 -3.425
52 HB2 ARG 7 HB2 ARG 7 21.653 -4.995 -5.724
53 HB3 ARG 7 HB3 ARG 7 22.072 -3.333 -6.117
54 HG2 ARG 7 HG2 ARG 7 24.124 -3.510 -4.860
55 HG3 ARG 7 HG3 ARG 7 23.690 -5.137 -4.331
56 HD2 ARG 7 HD2 ARG 7 25.082 -5.622 -6.087
57 HD3 ARG 7 HD3 ARG 7 23.522 -5.589 -6.909
58 HE ARG 7 HE ARG 7 24.881 -3.055 -6.898
59 HH11 ARG 7 HH11 ARG 7 24.512 -6.103 -8.539
60 HH12 ARG 7 HH12 ARG 7 25.053 -5.494 -10.068
61 HH21 ARG 7 HH21 ARG 7 25.595 -2.241 -8.905
62 HH22 ARG 7 HH22 ARG 7 25.670 -3.297 -10.275
63 H VAL 8 H VAL 8 23.113 -3.895 -2.246
64 HA VAL 8 HA VAL 8 24.085 -1.147 -2.362
65 HB VAL 8 HB VAL 8 22.986 -2.369 0.173
66 HG11 VAL 8 HG11 VAL 8 24.361 -1.036 1.294
67 HG12 VAL 8 HG12 VAL 8 25.036 -0.424 -0.216
68 HG13 VAL 8 HG13 VAL 8 23.630 0.361 0.504
69 HG21 VAL 8 HG21 VAL 8 21.121 -1.553 -0.914
70 HG22 VAL 8 HG22 VAL 8 21.627 -0.147 0.023
71 HG23 VAL 8 HG23 VAL 8 22.016 -0.249 -1.694
72 H CYS 9 H CYS 9 25.977 -2.210 -3.166
73 HA CYS 9 HA CYS 9 27.462 -3.763 -1.157
74 HB2 CYS 9 HB2 CYS 9 28.124 -3.521 -4.092
75 HB3 CYS 9 HB3 CYS 9 28.746 -4.698 -2.940
76 H ARG 10 H ARG 10 29.230 -2.934 -0.238
77 HA ARG 10 HA ARG 10 30.153 -0.310 -1.162
78 HB2 ARG 10 HB2 ARG 10 29.417 -0.731 1.248
79 HB3 ARG 10 HB3 ARG 10 30.897 -1.663 1.426
80 HG2 ARG 10 HG2 ARG 10 31.973 0.554 0.457
81 HG3 ARG 10 HG3 ARG 10 30.514 1.262 1.153
82 HD2 ARG 10 HD2 ARG 10 32.271 -0.599 2.720
83 HD3 ARG 10 HD3 ARG 10 32.604 1.130 2.628
84 HE ARG 10 HE ARG 10 29.947 0.861 3.370
85 HH11 ARG 10 HH11 ARG 10 33.080 0.030 4.641
86 HH12 ARG 10 HH12 ARG 10 32.583 0.143 6.297
87 HH21 ARG 10 HH21 ARG 10 29.280 1.013 5.546
88 HH22 ARG 10 HH22 ARG 10 30.421 0.701 6.811
89 H ASN 11 H ASN 11 31.016 -2.187 -2.846
90 HA ASN 11 HA ASN 11 32.837 -3.186 -3.783
91 HB2 ASN 11 HB2 ASN 11 34.448 -1.251 -2.115
92 HB3 ASN 11 HB3 ASN 11 34.882 -1.951 -3.672
93 HD21 ASN 11 HD21 ASN 11 34.932 0.774 -3.182
94 HD22 ASN 11 HD22 ASN 11 33.711 1.538 -4.136
95 H GLY 12 H GLY 12 32.159 -5.023 -2.280
96 HA2 GLY 12 HA2 GLY 12 34.049 -6.666 -1.519
97 HA3 GLY 12 HA3 GLY 12 34.133 -5.538 -0.174
98 H VAL 13 H VAL 13 31.531 -4.985 0.356
99 HA VAL 13 HA VAL 13 30.379 -7.629 0.972
100 HB VAL 13 HB VAL 13 30.201 -5.167 2.712
101 HG11 VAL 13 HG11 VAL 13 29.673 -7.544 4.133
102 HG12 VAL 13 HG12 VAL 13 28.550 -6.243 3.735
103 HG13 VAL 13 HG13 VAL 13 28.732 -7.617 2.643
104 HG21 VAL 13 HG21 VAL 13 31.621 -6.752 4.237
105 HG22 VAL 13 HG22 VAL 13 32.096 -7.472 2.699
106 HG23 VAL 13 HG23 VAL 13 32.405 -5.763 3.005
107 H CYS 14 H CYS 14 28.478 -7.950 0.042
108 HA CYS 14 HA CYS 14 26.958 -5.688 -0.978
109 HB2 CYS 14 HB2 CYS 14 27.006 -8.622 -1.471
110 HB3 CYS 14 HB3 CYS 14 25.480 -7.785 -1.739
111 H TYR 15 H TYR 15 24.862 -5.184 -0.393
112 HA TYR 15 HA TYR 15 23.608 -6.696 1.766
113 HB2 TYR 15 HB2 TYR 15 24.765 -5.121 3.084
114 HB3 TYR 15 HB3 TYR 15 24.461 -3.814 1.945
115 HD1 TYR 15 HD1 TYR 15 22.349 -6.263 3.835
116 HD2 TYR 15 HD2 TYR 15 23.038 -2.204 2.762
117 HE1 TYR 15 HE1 TYR 15 20.381 -5.589 5.146
118 HE2 TYR 15 HE2 TYR 15 21.072 -1.519 4.071
119 HH TYR 15 HH TYR 15 19.020 -3.913 5.695
120 H ARG 16 H ARG 16 21.395 -6.581 1.790
121 HA ARG 16 HA ARG 16 20.174 -5.401 -0.574
122 HB2 ARG 16 HB2 ARG 16 19.420 -7.502 1.389
123 HB3 ARG 16 HB3 ARG 16 18.111 -6.616 0.619
124 HG2 ARG 16 HG2 ARG 16 20.276 -7.769 -1.072
125 HG3 ARG 16 HG3 ARG 16 19.019 -8.827 -0.425
126 HD2 ARG 16 HD2 ARG 16 18.202 -6.293 -1.756
127 HD3 ARG 16 HD3 ARG 16 18.753 -7.631 -2.764
128 HE ARG 16 HE ARG 16 16.285 -7.466 -1.291
129 HH11 ARG 16 HH11 ARG 16 18.615 -9.586 -2.774
130 HH12 ARG 16 HH12 ARG 16 17.491 -10.889 -2.981
131 HH21 ARG 16 HH21 ARG 16 14.797 -9.174 -1.558
132 HH22 ARG 16 HH22 ARG 16 15.320 -10.653 -2.290
133 H ARG 17 H ARG 17 19.135 -3.525 -0.550
134 HA ARG 17 HA ARG 17 18.349 -2.394 2.051
135 HB2 ARG 17 HB2 ARG 17 19.957 -0.984 1.002
136 HB3 ARG 17 HB3 ARG 17 19.134 -1.085 -0.549
137 HG2 ARG 17 HG2 ARG 17 18.749 1.074 0.447
138 HG3 ARG 17 HG3 ARG 17 17.239 0.163 0.399
139 HD2 ARG 17 HD2 ARG 17 17.450 1.278 2.532
140 HD3 ARG 17 HD3 ARG 17 17.575 -0.466 2.758
141 HE ARG 17 HE ARG 17 19.678 -0.150 3.574
142 HH11 ARG 17 HH11 ARG 17 18.795 2.633 1.678
143 HH12 ARG 17 HH12 ARG 17 20.227 3.523 2.077
144 HH21 ARG 17 HH21 ARG 17 21.568 1.011 4.107
145 HH22 ARG 17 HH22 ARG 17 21.804 2.599 3.458
146 H CYS 18 H CYS 18 16.252 -2.419 2.476
147 HA CYS 18 HA CYS 18 14.351 -1.987 0.278
148 HB2 CYS 18 HB2 CYS 18 13.867 -3.986 2.489
149 HB3 CYS 18 HB3 CYS 18 12.909 -3.736 1.033
150 H TRP 19 H TRP 19 12.313 -1.104 0.924
151 HA TRP 19 HA TRP 19 12.044 -0.161 3.659
152 HB2 TRP 19 HB2 TRP 19 11.699 2.199 2.909
153 HB3 TRP 19 HB3 TRP 19 13.354 1.628 2.717
154 HD1 TRP 19 HD1 TRP 19 10.461 3.036 0.778
155 HE1 TRP 19 HE1 TRP 19 11.116 3.275 -1.700
156 HE3 TRP 19 HE3 TRP 19 14.849 0.412 0.841
157 HZ2 TRP 19 HZ2 TRP 19 13.214 2.458 -3.403
158 HZ3 TRP 19 HZ3 TRP 19 16.119 0.187 -1.254
159 HH2 TRP 19 HH2 TRP 19 15.317 1.190 -3.331
160 H GLY 20 H GLY 20 9.990 1.573 3.439
161 HA2 GLY 20 HA2 GLY 20 7.880 -0.132 2.300
162 HA3 GLY 20 HA3 GLY 20 7.661 1.032 3.598
Start of MODEL 2
1 H1 SER 1 H SER 1 2.102 -1.010 2.226
2 HA SER 1 HA SER 1 1.701 0.225 -0.374
3 HB2 SER 1 HB2 SER 1 4.274 0.838 0.344
4 HB3 SER 1 HB3 SER 1 2.858 1.801 0.763
5 HG SER 1 HG SER 1 3.201 1.313 2.766
6 HA PRO 2 HA PRO 2 3.986 -2.624 -2.804
7 HB2 PRO 2 HB2 PRO 2 5.380 -0.992 -4.466
8 HB3 PRO 2 HB3 PRO 2 3.633 -1.232 -4.597
9 HG2 PRO 2 HG2 PRO 2 5.147 1.013 -3.320
10 HG3 PRO 2 HG3 PRO 2 3.708 1.080 -4.355
11 HD2 PRO 2 HD2 PRO 2 3.574 1.290 -1.659
12 HD3 PRO 2 HD3 PRO 2 2.283 0.545 -2.624
13 H ARG 3 H ARG 3 5.542 -3.789 -1.841
14 HA ARG 3 HA ARG 3 7.779 -2.672 -0.504
15 HB2 ARG 3 HB2 ARG 3 7.084 -5.466 -1.385
16 HB3 ARG 3 HB3 ARG 3 8.609 -5.098 -0.590
17 HG2 ARG 3 HG2 ARG 3 6.003 -4.309 0.651
18 HG3 ARG 3 HG3 ARG 3 6.643 -5.944 0.830
19 HD2 ARG 3 HD2 ARG 3 8.158 -3.436 1.536
20 HD3 ARG 3 HD3 ARG 3 7.240 -4.399 2.693
21 HE ARG 3 HE ARG 3 9.134 -5.980 1.271
22 HH11 ARG 3 HH11 ARG 3 8.796 -3.705 3.884
23 HH12 ARG 3 HH12 ARG 3 10.187 -4.283 4.741
24 HH21 ARG 3 HH21 ARG 3 10.968 -6.750 2.389
25 HH22 ARG 3 HH22 ARG 3 11.422 -6.014 3.889
26 H VAL 4 H VAL 4 9.835 -2.309 -1.158
27 HA VAL 4 HA VAL 4 10.586 -3.095 -3.890
28 HB VAL 4 HB VAL 4 11.012 -0.354 -2.692
29 HG11 VAL 4 HG11 VAL 4 12.002 -1.623 -5.228
30 HG12 VAL 4 HG12 VAL 4 11.881 0.126 -5.038
31 HG13 VAL 4 HG13 VAL 4 12.931 -0.807 -3.971
32 HG21 VAL 4 HG21 VAL 4 9.293 -1.292 -4.987
33 HG22 VAL 4 HG22 VAL 4 8.738 -0.636 -3.447
34 HG23 VAL 4 HG23 VAL 4 9.602 0.397 -4.586
35 H CYS 5 H CYS 5 12.698 -3.669 -4.175
36 HA CYS 5 HA CYS 5 14.510 -3.385 -1.878
37 HB2 CYS 5 HB2 CYS 5 13.830 -5.889 -3.403
38 HB3 CYS 5 HB3 CYS 5 15.363 -5.728 -2.552
39 H ILE 6 H ILE 6 16.723 -3.286 -2.376
40 HA ILE 6 HA ILE 6 17.480 -3.224 -5.197
41 HB ILE 6 HB ILE 6 18.615 -1.071 -4.982
42 HG12 ILE 6 HG12 ILE 6 17.232 -0.802 -2.308
43 HG13 ILE 6 HG13 ILE 6 18.929 -1.232 -2.492
44 HG21 ILE 6 HG21 ILE 6 16.298 -1.187 -5.829
45 HG22 ILE 6 HG22 ILE 6 15.713 -0.854 -4.199
46 HG23 ILE 6 HG23 ILE 6 16.669 0.354 -5.056
47 HD11 ILE 6 HD11 ILE 6 17.945 1.242 -3.805
48 HD12 ILE 6 HD12 ILE 6 18.183 1.242 -2.058
49 HD13 ILE 6 HD13 ILE 6 19.532 0.870 -3.132
50 H ARG 7 H ARG 7 19.955 -2.684 -5.308
51 HA ARG 7 HA ARG 7 21.251 -4.507 -3.423
52 HB2 ARG 7 HB2 ARG 7 21.643 -5.075 -5.709
53 HB3 ARG 7 HB3 ARG 7 22.078 -3.419 -6.111
54 HG2 ARG 7 HG2 ARG 7 24.110 -3.592 -4.829
55 HG3 ARG 7 HG3 ARG 7 23.657 -5.205 -4.273
56 HD2 ARG 7 HD2 ARG 7 24.017 -4.496 -7.177
57 HD3 ARG 7 HD3 ARG 7 25.320 -5.122 -6.167
58 HE ARG 7 HE ARG 7 23.102 -6.835 -5.978
59 HH11 ARG 7 HH11 ARG 7 25.546 -5.844 -8.250
60 HH12 ARG 7 HH12 ARG 7 25.540 -7.347 -9.112
61 HH21 ARG 7 HH21 ARG 7 23.085 -8.819 -7.104
62 HH22 ARG 7 HH22 ARG 7 24.139 -9.038 -8.460
63 H VAL 8 H VAL 8 23.055 -3.952 -2.223
64 HA VAL 8 HA VAL 8 24.012 -1.195 -2.332
65 HB VAL 8 HB VAL 8 22.969 -2.455 0.208
66 HG11 VAL 8 HG11 VAL 8 23.557 -0.341 1.276
67 HG12 VAL 8 HG12 VAL 8 24.982 -1.121 0.589
68 HG13 VAL 8 HG13 VAL 8 24.237 0.245 -0.242
69 HG21 VAL 8 HG21 VAL 8 21.438 -0.436 0.147
70 HG22 VAL 8 HG22 VAL 8 21.941 -0.226 -1.531
71 HG23 VAL 8 HG23 VAL 8 21.109 -1.700 -1.038
72 H CYS 9 H CYS 9 25.939 -2.148 -3.127
73 HA CYS 9 HA CYS 9 27.453 -3.711 -1.142
74 HB2 CYS 9 HB2 CYS 9 28.054 -3.492 -4.094
75 HB3 CYS 9 HB3 CYS 9 28.736 -4.635 -2.940
76 H ARG 10 H ARG 10 29.146 -2.786 -0.196
77 HA ARG 10 HA ARG 10 30.074 -0.201 -1.218
78 HB2 ARG 10 HB2 ARG 10 31.118 0.045 1.028
79 HB3 ARG 10 HB3 ARG 10 29.372 -0.154 1.085
80 HG2 ARG 10 HG2 ARG 10 29.619 -2.471 1.727
81 HG3 ARG 10 HG3 ARG 10 31.373 -2.349 1.573
82 HD2 ARG 10 HD2 ARG 10 30.742 -2.190 3.901
83 HD3 ARG 10 HD3 ARG 10 31.384 -0.643 3.350
84 HE ARG 10 HE ARG 10 29.356 0.301 3.799
85 HH11 ARG 10 HH11 ARG 10 28.954 -3.148 3.549
86 HH12 ARG 10 HH12 ARG 10 27.294 -3.122 4.045
87 HH21 ARG 10 HH21 ARG 10 27.171 0.349 4.453
88 HH22 ARG 10 HH22 ARG 10 26.281 -1.132 4.559
89 H ASN 11 H ASN 11 30.963 -2.254 -2.747
90 HA ASN 11 HA ASN 11 32.812 -3.299 -3.574
91 HB2 ASN 11 HB2 ASN 11 34.556 -1.326 -2.153
92 HB3 ASN 11 HB3 ASN 11 34.673 -1.939 -3.800
93 HD21 ASN 11 HD21 ASN 11 32.750 -1.321 -5.204
94 HD22 ASN 11 HD22 ASN 11 32.221 0.319 -5.084
95 H GLY 12 H GLY 12 32.374 -5.114 -2.116
96 HA2 GLY 12 HA2 GLY 12 34.275 -6.538 -1.115
97 HA3 GLY 12 HA3 GLY 12 34.264 -5.302 0.134
98 H VAL 13 H VAL 13 31.428 -4.930 0.210
99 HA VAL 13 HA VAL 13 30.432 -7.555 1.059
100 HB VAL 13 HB VAL 13 30.201 -5.086 2.782
101 HG11 VAL 13 HG11 VAL 13 29.050 -7.801 2.868
102 HG12 VAL 13 HG12 VAL 13 29.650 -7.163 4.399
103 HG13 VAL 13 HG13 VAL 13 28.420 -6.278 3.496
104 HG21 VAL 13 HG21 VAL 13 32.116 -7.391 2.855
105 HG22 VAL 13 HG22 VAL 13 32.447 -5.664 2.992
106 HG23 VAL 13 HG23 VAL 13 31.682 -6.524 4.329
107 H CYS 14 H CYS 14 28.544 -7.907 0.114
108 HA CYS 14 HA CYS 14 26.991 -5.672 -0.915
109 HB2 CYS 14 HB2 CYS 14 27.089 -8.605 -1.405
110 HB3 CYS 14 HB3 CYS 14 25.551 -7.793 -1.680
111 H TYR 15 H TYR 15 24.844 -5.254 -0.385
112 HA TYR 15 HA TYR 15 23.616 -6.768 1.780
113 HB2 TYR 15 HB2 TYR 15 24.763 -5.171 3.096
114 HB3 TYR 15 HB3 TYR 15 24.397 -3.865 1.975
115 HD1 TYR 15 HD1 TYR 15 22.959 -2.309 2.869
116 HD2 TYR 15 HD2 TYR 15 22.371 -6.413 3.826
117 HE1 TYR 15 HE1 TYR 15 20.986 -1.708 4.209
118 HE2 TYR 15 HE2 TYR 15 20.396 -5.823 5.167
119 HH TYR 15 HH TYR 15 19.196 -4.154 6.043
120 H ARG 16 H ARG 16 21.399 -6.677 1.794
121 HA ARG 16 HA ARG 16 20.180 -5.513 -0.579
122 HB2 ARG 16 HB2 ARG 16 19.440 -7.622 1.380
123 HB3 ARG 16 HB3 ARG 16 18.123 -6.750 0.607
124 HG2 ARG 16 HG2 ARG 16 18.381 -8.500 -0.836
125 HG3 ARG 16 HG3 ARG 16 19.449 -7.310 -1.582
126 HD2 ARG 16 HD2 ARG 16 21.355 -8.331 -0.374
127 HD3 ARG 16 HD3 ARG 16 20.260 -9.567 0.246
128 HE ARG 16 HE ARG 16 20.009 -9.579 -2.515
129 HH11 ARG 16 HH11 ARG 16 22.485 -10.180 -0.143
130 HH12 ARG 16 HH12 ARG 16 23.332 -11.328 -1.127
131 HH21 ARG 16 HH21 ARG 16 21.115 -11.088 -3.820
132 HH22 ARG 16 HH22 ARG 16 22.553 -11.843 -3.219
133 H ARG 17 H ARG 17 18.989 -3.717 -0.581
134 HA ARG 17 HA ARG 17 18.161 -2.602 2.019
135 HB2 ARG 17 HB2 ARG 17 19.841 -1.182 1.090
136 HB3 ARG 17 HB3 ARG 17 19.084 -1.218 -0.497
137 HG2 ARG 17 HG2 ARG 17 18.709 0.909 0.619
138 HG3 ARG 17 HG3 ARG 17 17.190 0.047 0.364
139 HD2 ARG 17 HD2 ARG 17 17.172 0.976 2.573
140 HD3 ARG 17 HD3 ARG 17 17.334 -0.775 2.705
141 HE ARG 17 HE ARG 17 19.336 -0.446 3.739
142 HH11 ARG 17 HH11 ARG 17 18.561 2.406 1.900
143 HH12 ARG 17 HH12 ARG 17 19.927 3.305 2.472
144 HH21 ARG 17 HH21 ARG 17 21.139 0.726 4.499
145 HH22 ARG 17 HH22 ARG 17 21.394 2.348 3.949
146 H CYS 18 H CYS 18 16.043 -2.639 2.320
147 HA CYS 18 HA CYS 18 14.276 -2.172 0.016
148 HB2 CYS 18 HB2 CYS 18 13.645 -4.135 2.222
149 HB3 CYS 18 HB3 CYS 18 12.767 -3.889 0.716
150 H TRP 19 H TRP 19 12.450 -0.964 0.409
151 HA TRP 19 HA TRP 19 12.062 0.016 3.155
152 HB2 TRP 19 HB2 TRP 19 11.673 2.283 2.282
153 HB3 TRP 19 HB3 TRP 19 13.301 1.722 1.911
154 HD1 TRP 19 HD1 TRP 19 10.020 2.702 0.251
155 HE1 TRP 19 HE1 TRP 19 10.394 2.894 -2.288
156 HE3 TRP 19 HE3 TRP 19 14.748 0.777 -0.021
157 HZ2 TRP 19 HZ2 TRP 19 12.425 2.306 -4.159
158 HZ3 TRP 19 HZ3 TRP 19 15.835 0.626 -2.223
159 HH2 TRP 19 HH2 TRP 19 14.696 1.374 -4.248
160 H GLY 20 H GLY 20 9.940 1.691 2.750
161 HA2 GLY 20 HA2 GLY 20 7.865 -0.219 1.906
162 HA3 GLY 20 HA3 GLY 20 7.634 1.095 3.051
Start of MODEL 3
1 H1 SER 1 H SER 1 2.219 0.857 0.682
2 HA SER 1 HA SER 1 1.767 0.649 -2.197
3 HB2 SER 1 HB2 SER 1 3.767 2.392 -0.901
4 HB3 SER 1 HB3 SER 1 4.386 1.388 -2.211
5 HG SER 1 HG SER 1 3.221 3.626 -2.534
6 HA PRO 2 HA PRO 2 3.754 -3.246 -1.851
7 HB2 PRO 2 HB2 PRO 2 5.120 -3.418 -4.191
8 HB3 PRO 2 HB3 PRO 2 3.359 -3.541 -4.095
9 HG2 PRO 2 HG2 PRO 2 5.056 -1.189 -4.837
10 HG3 PRO 2 HG3 PRO 2 3.561 -1.772 -5.592
11 HD2 PRO 2 HD2 PRO 2 3.606 0.318 -3.870
12 HD3 PRO 2 HD3 PRO 2 2.223 -0.788 -3.994
13 H ARG 3 H ARG 3 5.636 -4.217 -1.184
14 HA ARG 3 HA ARG 3 7.706 -2.581 -0.199
15 HB2 ARG 3 HB2 ARG 3 8.815 -4.653 0.427
16 HB3 ARG 3 HB3 ARG 3 7.098 -4.754 0.793
17 HG2 ARG 3 HG2 ARG 3 6.939 -5.894 -1.538
18 HG3 ARG 3 HG3 ARG 3 8.670 -6.161 -1.316
19 HD2 ARG 3 HD2 ARG 3 7.422 -8.082 -0.526
20 HD3 ARG 3 HD3 ARG 3 8.205 -7.269 0.828
21 HE ARG 3 HE ARG 3 6.141 -6.850 1.707
22 HH11 ARG 3 HH11 ARG 3 5.788 -7.603 -1.674
23 HH12 ARG 3 HH12 ARG 3 4.056 -7.618 -1.624
24 HH21 ARG 3 HH21 ARG 3 3.861 -6.867 1.786
25 HH22 ARG 3 HH22 ARG 3 2.961 -7.199 0.344
26 H VAL 4 H VAL 4 9.835 -2.304 -0.856
27 HA VAL 4 HA VAL 4 10.503 -3.236 -3.567
28 HB VAL 4 HB VAL 4 10.975 -0.450 -2.494
29 HG11 VAL 4 HG11 VAL 4 11.862 -1.807 -5.027
30 HG12 VAL 4 HG12 VAL 4 11.784 -0.053 -4.865
31 HG13 VAL 4 HG13 VAL 4 12.852 -0.988 -3.819
32 HG21 VAL 4 HG21 VAL 4 9.359 -1.196 -4.912
33 HG22 VAL 4 HG22 VAL 4 8.640 -1.125 -3.303
34 HG23 VAL 4 HG23 VAL 4 9.365 0.319 -4.008
35 H CYS 5 H CYS 5 12.629 -3.764 -3.930
36 HA CYS 5 HA CYS 5 14.495 -3.455 -1.677
37 HB2 CYS 5 HB2 CYS 5 13.820 -5.962 -3.201
38 HB3 CYS 5 HB3 CYS 5 15.365 -5.780 -2.377
39 H ILE 6 H ILE 6 16.708 -3.375 -2.234
40 HA ILE 6 HA ILE 6 17.398 -3.283 -5.065
41 HB ILE 6 HB ILE 6 18.541 -1.106 -4.829
42 HG12 ILE 6 HG12 ILE 6 17.032 -0.883 -2.217
43 HG13 ILE 6 HG13 ILE 6 18.758 -1.203 -2.342
44 HG21 ILE 6 HG21 ILE 6 15.599 -0.942 -4.192
45 HG22 ILE 6 HG22 ILE 6 16.571 0.268 -5.030
46 HG23 ILE 6 HG23 ILE 6 16.267 -1.296 -5.785
47 HD11 ILE 6 HD11 ILE 6 19.145 0.940 -3.323
48 HD12 ILE 6 HD12 ILE 6 17.413 1.253 -3.436
49 HD13 ILE 6 HD13 ILE 6 18.190 1.158 -1.856
50 H ARG 7 H ARG 7 19.845 -2.760 -5.265
51 HA ARG 7 HA ARG 7 21.217 -4.534 -3.396
52 HB2 ARG 7 HB2 ARG 7 21.327 -4.534 -6.046
53 HB3 ARG 7 HB3 ARG 7 22.585 -3.338 -5.762
54 HG2 ARG 7 HG2 ARG 7 23.919 -4.875 -4.574
55 HG3 ARG 7 HG3 ARG 7 22.594 -6.032 -4.438
56 HD2 ARG 7 HD2 ARG 7 22.629 -6.303 -6.895
57 HD3 ARG 7 HD3 ARG 7 24.017 -5.218 -6.969
58 HE ARG 7 HE ARG 7 24.721 -7.212 -5.208
59 HH11 ARG 7 HH11 ARG 7 23.748 -7.016 -8.545
60 HH12 ARG 7 HH12 ARG 7 24.657 -8.410 -9.027
61 HH21 ARG 7 HH21 ARG 7 25.923 -9.048 -5.831
62 HH22 ARG 7 HH22 ARG 7 25.893 -9.565 -7.483
63 H VAL 8 H VAL 8 23.030 -3.952 -2.223
64 HA VAL 8 HA VAL 8 23.948 -1.184 -2.334
65 HB VAL 8 HB VAL 8 22.915 -2.448 0.209
66 HG11 VAL 8 HG11 VAL 8 23.500 -0.325 1.275
67 HG12 VAL 8 HG12 VAL 8 24.924 -1.123 0.607
68 HG13 VAL 8 HG13 VAL 8 24.200 0.244 -0.241
69 HG21 VAL 8 HG21 VAL 8 21.020 -1.696 -0.901
70 HG22 VAL 8 HG22 VAL 8 21.454 -0.315 0.106
71 HG23 VAL 8 HG23 VAL 8 21.860 -0.317 -1.610
72 H CYS 9 H CYS 9 25.891 -2.087 -3.118
73 HA CYS 9 HA CYS 9 27.418 -3.667 -1.158
74 HB2 CYS 9 HB2 CYS 9 28.054 -3.358 -4.093
75 HB3 CYS 9 HB3 CYS 9 28.724 -4.531 -2.964
76 H ARG 10 H ARG 10 29.155 -2.794 -0.225
77 HA ARG 10 HA ARG 10 30.011 -0.139 -1.129
78 HB2 ARG 10 HB2 ARG 10 31.142 -0.058 1.130
79 HB3 ARG 10 HB3 ARG 10 29.385 -0.120 1.162
80 HG2 ARG 10 HG2 ARG 10 30.847 -2.693 1.316
81 HG3 ARG 10 HG3 ARG 10 30.887 -1.635 2.728
82 HD2 ARG 10 HD2 ARG 10 28.271 -2.164 1.408
83 HD3 ARG 10 HD3 ARG 10 28.982 -3.428 2.409
84 HE ARG 10 HE ARG 10 27.792 -0.981 3.305
85 HH11 ARG 10 HH11 ARG 10 30.136 -3.441 4.062
86 HH12 ARG 10 HH12 ARG 10 30.067 -3.166 5.771
87 HH21 ARG 10 HH21 ARG 10 27.692 -0.609 5.553
88 HH22 ARG 10 HH22 ARG 10 28.675 -1.555 6.618
89 H ASN 11 H ASN 11 30.923 -2.064 -2.779
90 HA ASN 11 HA ASN 11 32.779 -3.027 -3.686
91 HB2 ASN 11 HB2 ASN 11 34.504 -1.134 -2.136
92 HB3 ASN 11 HB3 ASN 11 34.632 -1.638 -3.818
93 HD21 ASN 11 HD21 ASN 11 32.242 -1.115 -4.869
94 HD22 ASN 11 HD22 ASN 11 31.871 0.570 -4.768
95 H GLY 12 H GLY 12 32.331 -4.927 -2.315
96 HA2 GLY 12 HA2 GLY 12 34.256 -6.410 -1.437
97 HA3 GLY 12 HA3 GLY 12 34.253 -5.256 -0.111
98 H VAL 13 H VAL 13 31.502 -4.871 0.182
99 HA VAL 13 HA VAL 13 30.502 -7.560 0.832
100 HB VAL 13 HB VAL 13 30.293 -5.174 2.672
101 HG11 VAL 13 HG11 VAL 13 29.410 -8.042 2.938
102 HG12 VAL 13 HG12 VAL 13 29.489 -6.909 4.288
103 HG13 VAL 13 HG13 VAL 13 28.397 -6.598 2.938
104 HG21 VAL 13 HG21 VAL 13 31.731 -6.830 4.119
105 HG22 VAL 13 HG22 VAL 13 32.219 -7.444 2.539
106 HG23 VAL 13 HG23 VAL 13 32.497 -5.752 2.953
107 H CYS 14 H CYS 14 28.589 -7.895 -0.069
108 HA CYS 14 HA CYS 14 27.012 -5.637 -1.006
109 HB2 CYS 14 HB2 CYS 14 27.109 -8.555 -1.582
110 HB3 CYS 14 HB3 CYS 14 25.566 -7.737 -1.811
111 H TYR 15 H TYR 15 24.886 -5.226 -0.413
112 HA TYR 15 HA TYR 15 23.706 -6.810 1.733
113 HB2 TYR 15 HB2 TYR 15 24.851 -5.226 3.062
114 HB3 TYR 15 HB3 TYR 15 24.463 -3.903 1.968
115 HD1 TYR 15 HD1 TYR 15 23.018 -2.373 2.893
116 HD2 TYR 15 HD2 TYR 15 22.485 -6.493 3.814
117 HE1 TYR 15 HE1 TYR 15 21.059 -1.806 4.268
118 HE2 TYR 15 HE2 TYR 15 20.524 -5.938 5.190
119 HH TYR 15 HH TYR 15 18.790 -3.520 5.032
120 H ARG 16 H ARG 16 21.490 -6.753 1.783
121 HA ARG 16 HA ARG 16 20.212 -5.562 -0.544
122 HB2 ARG 16 HB2 ARG 16 19.533 -7.709 1.396
123 HB3 ARG 16 HB3 ARG 16 18.192 -6.841 0.661
124 HG2 ARG 16 HG2 ARG 16 18.505 -8.662 -0.740
125 HG3 ARG 16 HG3 ARG 16 19.347 -7.353 -1.573
126 HD2 ARG 16 HD2 ARG 16 20.732 -9.308 -1.637
127 HD3 ARG 16 HD3 ARG 16 21.465 -8.140 -0.538
128 HE ARG 16 HE ARG 16 19.858 -9.826 0.984
129 HH11 ARG 16 HH11 ARG 16 22.720 -10.026 -0.989
130 HH12 ARG 16 HH12 ARG 16 23.397 -11.351 -0.102
131 HH21 ARG 16 HH21 ARG 16 20.740 -11.570 2.160
132 HH22 ARG 16 HH22 ARG 16 22.270 -12.229 1.689
133 H ARG 17 H ARG 17 19.030 -3.764 -0.493
134 HA ARG 17 HA ARG 17 18.232 -2.702 2.137
135 HB2 ARG 17 HB2 ARG 17 19.875 -1.249 1.197
136 HB3 ARG 17 HB3 ARG 17 19.090 -1.275 -0.377
137 HG2 ARG 17 HG2 ARG 17 18.730 0.834 0.817
138 HG3 ARG 17 HG3 ARG 17 17.219 -0.019 0.493
139 HD2 ARG 17 HD2 ARG 17 17.221 0.877 2.750
140 HD3 ARG 17 HD3 ARG 17 17.230 -0.886 2.787
141 HE ARG 17 HE ARG 17 19.846 -0.288 2.967
142 HH11 ARG 17 HH11 ARG 17 17.048 0.856 4.694
143 HH12 ARG 17 HH12 ARG 17 17.917 1.160 6.162
144 HH21 ARG 17 HH21 ARG 17 21.001 0.108 4.894
145 HH22 ARG 17 HH22 ARG 17 20.165 0.734 6.274
146 H CYS 18 H CYS 18 16.122 -2.734 2.487
147 HA CYS 18 HA CYS 18 14.301 -2.280 0.222
148 HB2 CYS 18 HB2 CYS 18 13.730 -4.244 2.443
149 HB3 CYS 18 HB3 CYS 18 12.818 -4.005 0.956
150 H TRP 19 H TRP 19 12.508 -1.048 0.642
151 HA TRP 19 HA TRP 19 12.185 -0.060 3.396
152 HB2 TRP 19 HB2 TRP 19 11.736 2.185 2.517
153 HB3 TRP 19 HB3 TRP 19 13.347 1.640 2.059
154 HD1 TRP 19 HD1 TRP 19 9.953 2.532 0.577
155 HE1 TRP 19 HE1 TRP 19 10.182 2.709 -1.981
156 HE3 TRP 19 HE3 TRP 19 14.709 0.728 0.062
157 HZ2 TRP 19 HZ2 TRP 19 12.122 2.157 -3.955
158 HZ3 TRP 19 HZ3 TRP 19 15.678 0.585 -2.195
159 HH2 TRP 19 HH2 TRP 19 14.409 1.284 -4.161
160 H GLY 20 H GLY 20 10.019 1.578 3.037
161 HA2 GLY 20 HA2 GLY 20 7.932 -0.398 2.513
162 HA3 GLY 20 HA3 GLY 20 7.729 1.129 3.359
Start of MODEL 4
1 H1 SER 1 H SER 1 1.329 -1.458 0.640
2 HA SER 1 HA SER 1 0.970 -0.855 -2.210
3 HB2 SER 1 HB2 SER 1 2.079 1.113 -2.144
4 HB3 SER 1 HB3 SER 1 1.697 1.096 -0.423
5 HG SER 1 HG SER 1 3.795 1.184 -0.235
6 HA PRO 2 HA PRO 2 4.129 -3.803 -2.961
7 HB2 PRO 2 HB2 PRO 2 5.482 -2.698 -5.039
8 HB3 PRO 2 HB3 PRO 2 3.860 -3.381 -5.203
9 HG2 PRO 2 HG2 PRO 2 4.690 -0.521 -4.898
10 HG3 PRO 2 HG3 PRO 2 3.473 -1.223 -5.979
11 HD2 PRO 2 HD2 PRO 2 2.820 0.017 -3.662
12 HD3 PRO 2 HD3 PRO 2 1.880 -1.339 -4.318
13 H ARG 3 H ARG 3 5.866 -4.228 -1.765
14 HA ARG 3 HA ARG 3 7.419 -2.306 -0.461
15 HB2 ARG 3 HB2 ARG 3 7.727 -5.236 -0.985
16 HB3 ARG 3 HB3 ARG 3 9.075 -4.343 -0.293
17 HG2 ARG 3 HG2 ARG 3 8.041 -5.060 1.607
18 HG3 ARG 3 HG3 ARG 3 7.236 -3.505 1.386
19 HD2 ARG 3 HD2 ARG 3 5.618 -5.243 1.907
20 HD3 ARG 3 HD3 ARG 3 5.372 -4.635 0.271
21 HE ARG 3 HE ARG 3 7.053 -6.931 0.293
22 HH11 ARG 3 HH11 ARG 3 3.733 -5.906 0.512
23 HH12 ARG 3 HH12 ARG 3 3.096 -7.396 -0.102
24 HH21 ARG 3 HH21 ARG 3 6.227 -8.897 -0.517
25 HH22 ARG 3 HH22 ARG 3 4.516 -9.097 -0.686
26 H VAL 4 H VAL 4 9.876 -2.205 -0.677
27 HA VAL 4 HA VAL 4 10.714 -2.220 -3.493
28 HB VAL 4 HB VAL 4 11.086 0.091 -1.582
29 HG11 VAL 4 HG11 VAL 4 12.251 -0.469 -4.294
30 HG12 VAL 4 HG12 VAL 4 12.117 1.166 -3.648
31 HG13 VAL 4 HG13 VAL 4 13.091 -0.039 -2.804
32 HG21 VAL 4 HG21 VAL 4 9.939 1.191 -3.713
33 HG22 VAL 4 HG22 VAL 4 9.280 -0.437 -3.876
34 HG23 VAL 4 HG23 VAL 4 8.997 0.484 -2.399
35 H CYS 5 H CYS 5 12.786 -2.836 -3.843
36 HA CYS 5 HA CYS 5 14.640 -2.982 -1.589
37 HB2 CYS 5 HB2 CYS 5 13.762 -5.339 -3.257
38 HB3 CYS 5 HB3 CYS 5 15.254 -5.339 -2.323
39 H ILE 6 H ILE 6 16.837 -3.090 -2.190
40 HA ILE 6 HA ILE 6 17.508 -2.990 -5.018
41 HB ILE 6 HB ILE 6 18.712 -0.891 -4.878
42 HG12 ILE 6 HG12 ILE 6 17.594 -0.663 -2.075
43 HG13 ILE 6 HG13 ILE 6 19.274 -1.011 -2.471
44 HG21 ILE 6 HG21 ILE 6 16.269 -0.960 -5.474
45 HG22 ILE 6 HG22 ILE 6 15.931 -0.428 -3.826
46 HG23 ILE 6 HG23 ILE 6 16.866 0.601 -4.911
47 HD11 ILE 6 HD11 ILE 6 18.339 1.383 -3.789
48 HD12 ILE 6 HD12 ILE 6 18.153 1.475 -2.038
49 HD13 ILE 6 HD13 ILE 6 19.736 1.139 -2.740
50 H ARG 7 H ARG 7 20.000 -2.571 -5.198
51 HA ARG 7 HA ARG 7 21.260 -4.441 -3.333
52 HB2 ARG 7 HB2 ARG 7 21.533 -5.031 -5.644
53 HB3 ARG 7 HB3 ARG 7 22.090 -3.413 -6.047
54 HG2 ARG 7 HG2 ARG 7 24.115 -3.760 -4.761
55 HG3 ARG 7 HG3 ARG 7 23.550 -5.359 -4.273
56 HD2 ARG 7 HD2 ARG 7 23.806 -4.639 -7.169
57 HD3 ARG 7 HD3 ARG 7 25.214 -5.159 -6.244
58 HE ARG 7 HE ARG 7 23.030 -6.960 -5.940
59 HH11 ARG 7 HH11 ARG 7 25.593 -6.021 -8.100
60 HH12 ARG 7 HH12 ARG 7 25.703 -7.577 -8.855
61 HH21 ARG 7 HH21 ARG 7 23.165 -9.012 -6.926
62 HH22 ARG 7 HH22 ARG 7 24.321 -9.277 -8.187
63 H VAL 8 H VAL 8 22.972 -3.920 -2.057
64 HA VAL 8 HA VAL 8 24.091 -1.214 -2.260
65 HB VAL 8 HB VAL 8 23.086 -2.464 0.301
66 HG11 VAL 8 HG11 VAL 8 25.165 -1.253 0.666
67 HG12 VAL 8 HG12 VAL 8 24.504 0.159 -0.157
68 HG13 VAL 8 HG13 VAL 8 23.806 -0.379 1.371
69 HG21 VAL 8 HG21 VAL 8 22.116 -0.172 -1.386
70 HG22 VAL 8 HG22 VAL 8 21.223 -1.593 -0.845
71 HG23 VAL 8 HG23 VAL 8 21.678 -0.343 0.314
72 H CYS 9 H CYS 9 25.974 -2.168 -3.113
73 HA CYS 9 HA CYS 9 27.507 -3.819 -1.214
74 HB2 CYS 9 HB2 CYS 9 27.963 -3.567 -4.191
75 HB3 CYS 9 HB3 CYS 9 28.733 -4.706 -3.092
76 H ARG 10 H ARG 10 29.312 -3.007 -0.360
77 HA ARG 10 HA ARG 10 30.238 -0.399 -1.324
78 HB2 ARG 10 HB2 ARG 10 31.443 -0.302 0.867
79 HB3 ARG 10 HB3 ARG 10 29.693 -0.404 1.010
80 HG2 ARG 10 HG2 ARG 10 29.798 -2.700 1.627
81 HG3 ARG 10 HG3 ARG 10 31.518 -2.783 1.239
82 HD2 ARG 10 HD2 ARG 10 31.873 -1.029 3.022
83 HD3 ARG 10 HD3 ARG 10 30.195 -1.293 3.495
84 HE ARG 10 HE ARG 10 31.750 -3.705 3.391
85 HH11 ARG 10 HH11 ARG 10 30.842 -0.974 5.350
86 HH12 ARG 10 HH12 ARG 10 31.148 -1.783 6.851
87 HH21 ARG 10 HH21 ARG 10 32.158 -4.781 5.360
88 HH22 ARG 10 HH22 ARG 10 31.898 -3.948 6.856
89 H ASN 11 H ASN 11 30.998 -2.332 -3.019
90 HA ASN 11 HA ASN 11 32.766 -3.370 -4.014
91 HB2 ASN 11 HB2 ASN 11 34.362 -1.312 -2.473
92 HB3 ASN 11 HB3 ASN 11 34.888 -2.174 -3.915
93 HD21 ASN 11 HD21 ASN 11 33.602 -1.830 -5.877
94 HD22 ASN 11 HD22 ASN 11 32.915 -0.268 -6.145
95 H GLY 12 H GLY 12 32.058 -5.069 -2.264
96 HA2 GLY 12 HA2 GLY 12 33.993 -6.751 -1.604
97 HA3 GLY 12 HA3 GLY 12 34.169 -5.574 -0.311
98 H VAL 13 H VAL 13 31.521 -4.960 0.211
99 HA VAL 13 HA VAL 13 30.415 -7.556 1.066
100 HB VAL 13 HB VAL 13 30.303 -4.980 2.640
101 HG11 VAL 13 HG11 VAL 13 28.949 -7.558 2.857
102 HG12 VAL 13 HG12 VAL 13 29.747 -7.050 4.345
103 HG13 VAL 13 HG13 VAL 13 28.550 -6.002 3.585
104 HG21 VAL 13 HG21 VAL 13 31.726 -6.576 4.215
105 HG22 VAL 13 HG22 VAL 13 32.206 -7.257 2.661
106 HG23 VAL 13 HG23 VAL 13 32.480 -5.547 2.997
107 H CYS 14 H CYS 14 28.535 -7.931 0.113
108 HA CYS 14 HA CYS 14 26.947 -5.725 -0.922
109 HB2 CYS 14 HB2 CYS 14 27.054 -8.666 -1.362
110 HB3 CYS 14 HB3 CYS 14 25.507 -7.867 -1.623
111 H TYR 15 H TYR 15 24.801 -5.322 -0.365
112 HA TYR 15 HA TYR 15 23.596 -6.815 1.816
113 HB2 TYR 15 HB2 TYR 15 24.783 -5.280 3.156
114 HB3 TYR 15 HB3 TYR 15 24.472 -3.944 2.053
115 HD1 TYR 15 HD1 TYR 15 22.370 -6.427 3.909
116 HD2 TYR 15 HD2 TYR 15 23.070 -2.347 2.928
117 HE1 TYR 15 HE1 TYR 15 20.421 -5.775 5.260
118 HE2 TYR 15 HE2 TYR 15 21.124 -1.683 4.278
119 HH TYR 15 HH TYR 15 18.968 -4.067 5.690
120 H ARG 16 H ARG 16 21.384 -6.685 1.857
121 HA ARG 16 HA ARG 16 20.155 -5.442 -0.469
122 HB2 ARG 16 HB2 ARG 16 19.396 -7.572 1.461
123 HB3 ARG 16 HB3 ARG 16 18.089 -6.657 0.723
124 HG2 ARG 16 HG2 ARG 16 18.291 -8.393 -0.750
125 HG3 ARG 16 HG3 ARG 16 19.360 -7.204 -1.496
126 HD2 ARG 16 HD2 ARG 16 20.638 -9.137 -1.538
127 HD3 ARG 16 HD3 ARG 16 21.208 -8.326 -0.079
128 HE ARG 16 HE ARG 16 19.081 -10.116 0.504
129 HH11 ARG 16 HH11 ARG 16 22.481 -9.999 -0.236
130 HH12 ARG 16 HH12 ARG 16 22.846 -11.475 0.596
131 HH21 ARG 16 HH21 ARG 16 19.549 -12.060 1.602
132 HH22 ARG 16 HH22 ARG 16 21.177 -12.646 1.640
133 H ARG 17 H ARG 17 19.064 -3.591 -0.411
134 HA ARG 17 HA ARG 17 18.313 -2.502 2.221
135 HB2 ARG 17 HB2 ARG 17 20.029 -1.181 1.074
136 HB3 ARG 17 HB3 ARG 17 18.984 -1.030 -0.333
137 HG2 ARG 17 HG2 ARG 17 18.546 0.963 0.646
138 HG3 ARG 17 HG3 ARG 17 17.333 -0.013 1.476
139 HD2 ARG 17 HD2 ARG 17 20.087 0.310 2.610
140 HD3 ARG 17 HD3 ARG 17 18.857 1.546 2.866
141 HE ARG 17 HE ARG 17 18.014 -1.126 3.539
142 HH11 ARG 17 HH11 ARG 17 19.544 1.789 4.671
143 HH12 ARG 17 HH12 ARG 17 19.193 1.480 6.340
144 HH21 ARG 17 HH21 ARG 17 17.546 -1.544 5.732
145 HH22 ARG 17 HH22 ARG 17 18.057 -0.416 6.942
146 H CYS 18 H CYS 18 16.213 -2.411 2.623
147 HA CYS 18 HA CYS 18 14.352 -1.895 0.416
148 HB2 CYS 18 HB2 CYS 18 13.835 -3.991 2.530
149 HB3 CYS 18 HB3 CYS 18 12.847 -3.633 1.117
150 H TRP 19 H TRP 19 12.440 -0.836 0.999
151 HA TRP 19 HA TRP 19 12.098 -0.060 3.791
152 HB2 TRP 19 HB2 TRP 19 11.797 2.352 3.048
153 HB3 TRP 19 HB3 TRP 19 13.451 1.746 3.052
154 HD1 TRP 19 HD1 TRP 19 10.858 3.255 0.800
155 HE1 TRP 19 HE1 TRP 19 11.807 3.490 -1.582
156 HE3 TRP 19 HE3 TRP 19 15.117 0.480 1.346
157 HZ2 TRP 19 HZ2 TRP 19 14.062 2.613 -3.036
158 HZ3 TRP 19 HZ3 TRP 19 16.616 0.227 -0.589
159 HH2 TRP 19 HH2 TRP 19 16.097 1.271 -2.734
160 H GLY 20 H GLY 20 10.103 1.710 3.660
161 HA2 GLY 20 HA2 GLY 20 7.904 0.089 2.724
162 HA3 GLY 20 HA3 GLY 20 7.785 1.597 3.618
Start of MODEL 5
1 H1 SER 1 H SER 1 1.933 -0.537 1.513
2 HA SER 1 HA SER 1 1.588 0.182 -1.285
3 HB2 SER 1 HB2 SER 1 4.198 0.843 -0.422
4 HB3 SER 1 HB3 SER 1 2.832 1.934 -0.653
5 HG SER 1 HG SER 1 3.904 0.903 1.673
6 HA PRO 2 HA PRO 2 3.968 -3.051 -3.053
7 HB2 PRO 2 HB2 PRO 2 5.395 -1.753 -4.963
8 HB3 PRO 2 HB3 PRO 2 3.656 -2.039 -5.092
9 HG2 PRO 2 HG2 PRO 2 5.111 0.433 -4.235
10 HG3 PRO 2 HG3 PRO 2 3.703 0.277 -5.301
11 HD2 PRO 2 HD2 PRO 2 3.488 1.004 -2.702
12 HD3 PRO 2 HD3 PRO 2 2.233 0.068 -3.538
13 H ARG 3 H ARG 3 5.552 -4.031 -1.961
14 HA ARG 3 HA ARG 3 7.591 -2.853 -0.523
15 HB2 ARG 3 HB2 ARG 3 7.224 -5.573 -1.714
16 HB3 ARG 3 HB3 ARG 3 8.769 -5.159 -0.983
17 HG2 ARG 3 HG2 ARG 3 7.857 -4.948 1.137
18 HG3 ARG 3 HG3 ARG 3 6.219 -4.734 0.517
19 HD2 ARG 3 HD2 ARG 3 6.063 -6.896 1.213
20 HD3 ARG 3 HD3 ARG 3 6.657 -7.171 -0.424
21 HE ARG 3 HE ARG 3 8.118 -7.555 2.056
22 HH11 ARG 3 HH11 ARG 3 8.213 -7.359 -1.418
23 HH12 ARG 3 HH12 ARG 3 9.720 -8.203 -1.555
24 HH21 ARG 3 HH21 ARG 3 10.103 -8.667 1.889
25 HH22 ARG 3 HH22 ARG 3 10.794 -8.948 0.327
26 H VAL 4 H VAL 4 9.806 -2.521 -0.892
27 HA VAL 4 HA VAL 4 10.686 -2.563 -3.695
28 HB VAL 4 HB VAL 4 10.998 -0.220 -1.813
29 HG11 VAL 4 HG11 VAL 4 12.030 0.842 -3.885
30 HG12 VAL 4 HG12 VAL 4 13.015 -0.332 -3.013
31 HG13 VAL 4 HG13 VAL 4 12.199 -0.801 -4.505
32 HG21 VAL 4 HG21 VAL 4 8.887 0.065 -2.662
33 HG22 VAL 4 HG22 VAL 4 9.840 0.865 -3.912
34 HG23 VAL 4 HG23 VAL 4 9.258 -0.781 -4.164
35 H CYS 5 H CYS 5 12.773 -3.148 -4.007
36 HA CYS 5 HA CYS 5 14.597 -3.231 -1.726
37 HB2 CYS 5 HB2 CYS 5 13.768 -5.626 -3.363
38 HB3 CYS 5 HB3 CYS 5 15.260 -5.590 -2.429
39 H ILE 6 H ILE 6 16.802 -3.299 -2.293
40 HA ILE 6 HA ILE 6 17.516 -3.244 -5.112
41 HB ILE 6 HB ILE 6 18.677 -1.115 -4.992
42 HG12 ILE 6 HG12 ILE 6 17.467 -0.822 -2.234
43 HG13 ILE 6 HG13 ILE 6 19.159 -1.187 -2.553
44 HG21 ILE 6 HG21 ILE 6 15.868 -0.669 -4.016
45 HG22 ILE 6 HG22 ILE 6 16.805 0.322 -5.134
46 HG23 ILE 6 HG23 ILE 6 16.237 -1.273 -5.631
47 HD11 ILE 6 HD11 ILE 6 19.565 0.935 -3.434
48 HD12 ILE 6 HD12 ILE 6 17.847 1.275 -3.641
49 HD13 ILE 6 HD13 ILE 6 18.547 1.222 -2.023
50 H ARG 7 H ARG 7 20.004 -2.757 -5.253
51 HA ARG 7 HA ARG 7 21.274 -4.560 -3.329
52 HB2 ARG 7 HB2 ARG 7 21.619 -5.220 -5.598
53 HB3 ARG 7 HB3 ARG 7 22.091 -3.592 -6.065
54 HG2 ARG 7 HG2 ARG 7 24.167 -3.767 -4.975
55 HG3 ARG 7 HG3 ARG 7 23.667 -5.209 -4.089
56 HD2 ARG 7 HD2 ARG 7 23.719 -5.236 -7.077
57 HD3 ARG 7 HD3 ARG 7 25.220 -5.426 -6.172
58 HE ARG 7 HE ARG 7 23.430 -7.219 -5.079
59 HH11 ARG 7 HH11 ARG 7 24.888 -6.646 -8.188
60 HH12 ARG 7 HH12 ARG 7 24.846 -8.313 -8.660
61 HH21 ARG 7 HH21 ARG 7 23.369 -9.416 -5.690
62 HH22 ARG 7 HH22 ARG 7 23.980 -9.887 -7.239
63 H VAL 8 H VAL 8 22.988 -3.980 -2.067
64 HA VAL 8 HA VAL 8 24.033 -1.250 -2.308
65 HB VAL 8 HB VAL 8 23.040 -2.464 0.275
66 HG11 VAL 8 HG11 VAL 8 24.352 0.203 -0.242
67 HG12 VAL 8 HG12 VAL 8 23.682 -0.337 1.297
68 HG13 VAL 8 HG13 VAL 8 25.078 -1.163 0.605
69 HG21 VAL 8 HG21 VAL 8 21.155 -1.695 -0.906
70 HG22 VAL 8 HG22 VAL 8 21.557 -0.396 0.217
71 HG23 VAL 8 HG23 VAL 8 22.001 -0.259 -1.484
72 H CYS 9 H CYS 9 25.937 -2.210 -3.131
73 HA CYS 9 HA CYS 9 27.490 -3.765 -1.169
74 HB2 CYS 9 HB2 CYS 9 27.967 -3.588 -4.149
75 HB3 CYS 9 HB3 CYS 9 28.751 -4.679 -3.011
76 H ARG 10 H ARG 10 29.269 -2.891 -0.323
77 HA ARG 10 HA ARG 10 30.150 -0.293 -1.355
78 HB2 ARG 10 HB2 ARG 10 29.484 -0.639 1.087
79 HB3 ARG 10 HB3 ARG 10 30.973 -1.559 1.253
80 HG2 ARG 10 HG2 ARG 10 32.025 0.619 0.197
81 HG3 ARG 10 HG3 ARG 10 30.572 1.356 0.877
82 HD2 ARG 10 HD2 ARG 10 31.130 0.508 3.074
83 HD3 ARG 10 HD3 ARG 10 32.526 -0.346 2.418
84 HE ARG 10 HE ARG 10 32.789 2.365 1.795
85 HH11 ARG 10 HH11 ARG 10 32.785 0.280 4.583
86 HH12 ARG 10 HH12 ARG 10 33.834 1.300 5.510
87 HH21 ARG 10 HH21 ARG 10 34.171 3.717 3.006
88 HH22 ARG 10 HH22 ARG 10 34.622 3.255 4.612
89 H ASN 11 H ASN 11 30.979 -2.211 -3.005
90 HA ASN 11 HA ASN 11 32.779 -3.232 -3.960
91 HB2 ASN 11 HB2 ASN 11 34.357 -1.180 -2.394
92 HB3 ASN 11 HB3 ASN 11 34.863 -2.003 -3.867
93 HD21 ASN 11 HD21 ASN 11 33.143 -1.748 -5.682
94 HD22 ASN 11 HD22 ASN 11 32.606 -0.126 -5.944
95 H GLY 12 H GLY 12 32.075 -4.952 -2.254
96 HA2 GLY 12 HA2 GLY 12 33.995 -6.608 -1.538
97 HA3 GLY 12 HA3 GLY 12 34.156 -5.421 -0.253
98 H VAL 13 H VAL 13 31.606 -4.805 0.393
99 HA VAL 13 HA VAL 13 30.479 -7.400 1.225
100 HB VAL 13 HB VAL 13 30.312 -4.787 2.733
101 HG11 VAL 13 HG11 VAL 13 28.553 -5.826 3.658
102 HG12 VAL 13 HG12 VAL 13 29.024 -7.401 3.021
103 HG13 VAL 13 HG13 VAL 13 29.766 -6.790 4.500
104 HG21 VAL 13 HG21 VAL 13 32.202 -7.093 2.913
105 HG22 VAL 13 HG22 VAL 13 32.527 -5.363 3.021
106 HG23 VAL 13 HG23 VAL 13 31.767 -6.204 4.373
107 H CYS 14 H CYS 14 28.608 -7.829 0.277
108 HA CYS 14 HA CYS 14 26.998 -5.676 -0.834
109 HB2 CYS 14 HB2 CYS 14 27.150 -8.626 -1.188
110 HB3 CYS 14 HB3 CYS 14 25.593 -7.858 -1.483
111 H TYR 15 H TYR 15 24.834 -5.299 -0.312
112 HA TYR 15 HA TYR 15 23.644 -6.739 1.913
113 HB2 TYR 15 HB2 TYR 15 24.800 -5.125 3.195
114 HB3 TYR 15 HB3 TYR 15 24.442 -3.837 2.050
115 HD1 TYR 15 HD1 TYR 15 23.015 -2.253 2.908
116 HD2 TYR 15 HD2 TYR 15 22.406 -6.329 3.965
117 HE1 TYR 15 HE1 TYR 15 21.052 -1.607 4.242
118 HE2 TYR 15 HE2 TYR 15 20.440 -5.695 5.300
119 HH TYR 15 HH TYR 15 19.194 -4.026 6.064
120 H ARG 16 H ARG 16 21.430 -6.655 1.934
121 HA ARG 16 HA ARG 16 20.192 -5.519 -0.443
122 HB2 ARG 16 HB2 ARG 16 19.467 -7.604 1.549
123 HB3 ARG 16 HB3 ARG 16 18.145 -6.744 0.770
124 HG2 ARG 16 HG2 ARG 16 20.338 -7.954 -0.862
125 HG3 ARG 16 HG3 ARG 16 19.002 -8.941 -0.267
126 HD2 ARG 16 HD2 ARG 16 17.401 -7.551 -1.405
127 HD3 ARG 16 HD3 ARG 16 18.666 -6.418 -1.881
128 HE ARG 16 HE ARG 16 19.277 -8.989 -2.859
129 HH11 ARG 16 HH11 ARG 16 17.067 -6.349 -3.374
130 HH12 ARG 16 HH12 ARG 16 16.832 -6.702 -5.054
131 HH21 ARG 16 HH21 ARG 16 18.977 -9.464 -5.070
132 HH22 ARG 16 HH22 ARG 16 17.919 -8.474 -6.017
133 H ARG 17 H ARG 17 18.984 -3.734 -0.460
134 HA ARG 17 HA ARG 17 18.202 -2.571 2.133
135 HB2 ARG 17 HB2 ARG 17 19.908 -1.246 0.968
136 HB3 ARG 17 HB3 ARG 17 18.871 -1.149 -0.450
137 HG2 ARG 17 HG2 ARG 17 18.385 0.857 0.480
138 HG3 ARG 17 HG3 ARG 17 17.185 -0.125 1.321
139 HD2 ARG 17 HD2 ARG 17 19.920 0.275 2.473
140 HD3 ARG 17 HD3 ARG 17 18.667 1.497 2.686
141 HE ARG 17 HE ARG 17 17.861 -1.172 3.416
142 HH11 ARG 17 HH11 ARG 17 19.332 1.794 4.493
143 HH12 ARG 17 HH12 ARG 17 18.968 1.520 6.164
144 HH21 ARG 17 HH21 ARG 17 17.377 -1.545 5.614
145 HH22 ARG 17 HH22 ARG 17 17.858 -0.380 6.801
146 H CYS 18 H CYS 18 16.094 -2.511 2.499
147 HA CYS 18 HA CYS 18 14.258 -2.094 0.253
148 HB2 CYS 18 HB2 CYS 18 13.763 -4.167 2.395
149 HB3 CYS 18 HB3 CYS 18 12.784 -3.856 0.964
150 H TRP 19 H TRP 19 12.316 -1.066 0.783
151 HA TRP 19 HA TRP 19 11.908 -0.252 3.556
152 HB2 TRP 19 HB2 TRP 19 11.555 2.137 2.759
153 HB3 TRP 19 HB3 TRP 19 13.224 1.575 2.808
154 HD1 TRP 19 HD1 TRP 19 10.640 2.975 0.475
155 HE1 TRP 19 HE1 TRP 19 11.630 3.185 -1.891
156 HE3 TRP 19 HE3 TRP 19 14.953 0.316 1.160
157 HZ2 TRP 19 HZ2 TRP 19 13.934 2.335 -3.284
158 HZ3 TRP 19 HZ3 TRP 19 16.496 0.061 -0.740
159 HH2 TRP 19 HH2 TRP 19 15.995 1.050 -2.915
160 H GLY 20 H GLY 20 9.870 1.463 3.362
161 HA2 GLY 20 HA2 GLY 20 7.798 -0.164 2.053
162 HA3 GLY 20 HA3 GLY 20 7.536 0.927 3.405
Start of MODEL 6
1 H1 SER 1 H SER 1 1.251 0.258 -0.385
2 HA SER 1 HA SER 1 1.178 -0.593 -3.202
3 HB2 SER 1 HB2 SER 1 3.588 0.775 -2.723
4 HB3 SER 1 HB3 SER 1 2.183 1.370 -3.606
5 HG SER 1 HG SER 1 2.941 1.823 -0.944
6 HA PRO 2 HA PRO 2 3.970 -3.902 -2.504
7 HB2 PRO 2 HB2 PRO 2 5.585 -3.778 -4.682
8 HB3 PRO 2 HB3 PRO 2 3.902 -4.312 -4.763
9 HG2 PRO 2 HG2 PRO 2 5.073 -1.636 -5.417
10 HG3 PRO 2 HG3 PRO 2 3.848 -2.566 -6.298
11 HD2 PRO 2 HD2 PRO 2 3.214 -0.502 -4.664
12 HD3 PRO 2 HD3 PRO 2 2.150 -1.906 -4.886
13 H ARG 3 H ARG 3 5.843 -4.321 -1.450
14 HA ARG 3 HA ARG 3 7.362 -2.295 -0.323
15 HB2 ARG 3 HB2 ARG 3 8.776 -3.979 0.537
16 HB3 ARG 3 HB3 ARG 3 7.192 -4.730 0.398
17 HG2 ARG 3 HG2 ARG 3 9.345 -5.012 -1.682
18 HG3 ARG 3 HG3 ARG 3 9.122 -6.141 -0.343
19 HD2 ARG 3 HD2 ARG 3 7.178 -5.507 -2.556
20 HD3 ARG 3 HD3 ARG 3 8.012 -7.033 -2.266
21 HE ARG 3 HE ARG 3 5.595 -6.157 -1.054
22 HH11 ARG 3 HH11 ARG 3 8.499 -7.983 -0.461
23 HH12 ARG 3 HH12 ARG 3 7.777 -8.985 0.755
24 HH21 ARG 3 HH21 ARG 3 4.633 -7.469 0.545
25 HH22 ARG 3 HH22 ARG 3 5.577 -8.692 1.325
26 H VAL 4 H VAL 4 9.869 -2.254 -0.558
27 HA VAL 4 HA VAL 4 10.651 -2.322 -3.385
28 HB VAL 4 HB VAL 4 11.032 0.055 -1.560
29 HG11 VAL 4 HG11 VAL 4 13.010 -0.077 -2.812
30 HG12 VAL 4 HG12 VAL 4 12.158 -0.595 -4.266
31 HG13 VAL 4 HG13 VAL 4 11.999 1.066 -3.696
32 HG21 VAL 4 HG21 VAL 4 8.958 0.487 -2.344
33 HG22 VAL 4 HG22 VAL 4 9.840 1.016 -3.776
34 HG23 VAL 4 HG23 VAL 4 9.137 -0.600 -3.722
35 H CYS 5 H CYS 5 12.703 -2.976 -3.740
36 HA CYS 5 HA CYS 5 14.596 -3.018 -1.509
37 HB2 CYS 5 HB2 CYS 5 13.704 -5.423 -3.096
38 HB3 CYS 5 HB3 CYS 5 15.228 -5.389 -2.215
39 H ILE 6 H ILE 6 16.783 -3.086 -2.129
40 HA ILE 6 HA ILE 6 17.421 -3.059 -4.968
41 HB ILE 6 HB ILE 6 18.594 -0.944 -4.901
42 HG12 ILE 6 HG12 ILE 6 17.560 -0.698 -2.067
43 HG13 ILE 6 HG13 ILE 6 19.236 -0.982 -2.524
44 HG21 ILE 6 HG21 ILE 6 15.791 -0.611 -3.840
45 HG22 ILE 6 HG22 ILE 6 16.704 0.566 -4.785
46 HG23 ILE 6 HG23 ILE 6 16.211 -0.961 -5.516
47 HD11 ILE 6 HD11 ILE 6 18.378 1.318 -3.907
48 HD12 ILE 6 HD12 ILE 6 17.851 1.481 -2.232
49 HD13 ILE 6 HD13 ILE 6 19.553 1.200 -2.597
50 H ARG 7 H ARG 7 19.906 -2.617 -5.188
51 HA ARG 7 HA ARG 7 21.207 -4.440 -3.307
52 HB2 ARG 7 HB2 ARG 7 21.470 -5.048 -5.616
53 HB3 ARG 7 HB3 ARG 7 22.008 -3.427 -6.035
54 HG2 ARG 7 HG2 ARG 7 24.039 -3.748 -4.734
55 HG3 ARG 7 HG3 ARG 7 23.495 -5.361 -4.270
56 HD2 ARG 7 HD2 ARG 7 24.127 -4.400 -7.057
57 HD3 ARG 7 HD3 ARG 7 25.084 -5.519 -6.087
58 HE ARG 7 HE ARG 7 22.761 -6.136 -7.635
59 HH11 ARG 7 HH11 ARG 7 24.600 -7.039 -4.820
60 HH12 ARG 7 HH12 ARG 7 24.050 -8.682 -4.827
61 HH21 ARG 7 HH21 ARG 7 22.030 -8.297 -7.655
62 HH22 ARG 7 HH22 ARG 7 22.589 -9.397 -6.440
63 H VAL 8 H VAL 8 23.021 -3.910 -2.137
64 HA VAL 8 HA VAL 8 24.079 -1.190 -2.356
65 HB VAL 8 HB VAL 8 23.096 -2.386 0.239
66 HG11 VAL 8 HG11 VAL 8 23.801 -0.278 1.258
67 HG12 VAL 8 HG12 VAL 8 25.168 -1.133 0.543
68 HG13 VAL 8 HG13 VAL 8 24.461 0.251 -0.290
69 HG21 VAL 8 HG21 VAL 8 21.196 -1.575 -0.840
70 HG22 VAL 8 HG22 VAL 8 21.698 -0.224 0.177
71 HG23 VAL 8 HG23 VAL 8 22.063 -0.212 -1.548
72 H CYS 9 H CYS 9 25.959 -2.166 -3.197
73 HA CYS 9 HA CYS 9 27.509 -3.752 -1.257
74 HB2 CYS 9 HB2 CYS 9 27.972 -3.609 -4.239
75 HB3 CYS 9 HB3 CYS 9 28.697 -4.735 -3.096
76 H ARG 10 H ARG 10 29.297 -2.885 -0.430
77 HA ARG 10 HA ARG 10 30.229 -0.330 -1.524
78 HB2 ARG 10 HB2 ARG 10 30.888 -1.609 1.134
79 HB3 ARG 10 HB3 ARG 10 31.295 0.026 0.629
80 HG2 ARG 10 HG2 ARG 10 29.184 0.806 0.962
81 HG3 ARG 10 HG3 ARG 10 28.434 -0.752 0.609
82 HD2 ARG 10 HD2 ARG 10 28.160 -0.266 2.947
83 HD3 ARG 10 HD3 ARG 10 29.295 -1.603 2.769
84 HE ARG 10 HE ARG 10 30.647 0.893 2.912
85 HH11 ARG 10 HH11 ARG 10 29.024 -1.502 4.848
86 HH12 ARG 10 HH12 ARG 10 29.907 -1.124 6.290
87 HH21 ARG 10 HH21 ARG 10 31.816 1.401 4.804
88 HH22 ARG 10 HH22 ARG 10 31.494 0.528 6.264
89 H ASN 11 H ASN 11 30.955 -2.513 -3.028
90 HA ASN 11 HA ASN 11 32.737 -3.565 -3.975
91 HB2 ASN 11 HB2 ASN 11 34.600 -1.654 -2.613
92 HB3 ASN 11 HB3 ASN 11 34.656 -2.286 -4.256
93 HD21 ASN 11 HD21 ASN 11 32.693 -1.628 -5.604
94 HD22 ASN 11 HD22 ASN 11 32.230 0.033 -5.493
95 H GLY 12 H GLY 12 32.256 -5.350 -2.463
96 HA2 GLY 12 HA2 GLY 12 34.101 -6.900 -1.578
97 HA3 GLY 12 HA3 GLY 12 34.299 -5.649 -0.360
98 H VAL 13 H VAL 13 31.527 -5.041 -0.038
99 HA VAL 13 HA VAL 13 30.450 -7.567 1.016
100 HB VAL 13 HB VAL 13 30.418 -4.956 2.534
101 HG11 VAL 13 HG11 VAL 13 28.851 -5.889 3.798
102 HG12 VAL 13 HG12 VAL 13 28.847 -7.304 2.745
103 HG13 VAL 13 HG13 VAL 13 29.921 -7.249 4.143
104 HG21 VAL 13 HG21 VAL 13 32.596 -5.531 2.858
105 HG22 VAL 13 HG22 VAL 13 31.866 -6.542 4.105
106 HG23 VAL 13 HG23 VAL 13 32.306 -7.243 2.548
107 H CYS 14 H CYS 14 28.550 -7.912 0.088
108 HA CYS 14 HA CYS 14 26.992 -5.684 -0.947
109 HB2 CYS 14 HB2 CYS 14 27.031 -8.631 -1.353
110 HB3 CYS 14 HB3 CYS 14 25.495 -7.805 -1.596
111 H TYR 15 H TYR 15 24.837 -5.268 -0.385
112 HA TYR 15 HA TYR 15 23.668 -6.689 1.862
113 HB2 TYR 15 HB2 TYR 15 24.892 -5.106 3.121
114 HB3 TYR 15 HB3 TYR 15 24.532 -3.806 1.991
115 HD1 TYR 15 HD1 TYR 15 22.489 -6.266 3.941
116 HD2 TYR 15 HD2 TYR 15 23.161 -2.197 2.895
117 HE1 TYR 15 HE1 TYR 15 20.572 -5.598 5.330
118 HE2 TYR 15 HE2 TYR 15 21.247 -1.518 4.282
119 HH TYR 15 HH TYR 15 19.200 -3.915 5.888
120 H ARG 16 H ARG 16 21.457 -6.552 1.939
121 HA ARG 16 HA ARG 16 20.189 -5.376 -0.403
122 HB2 ARG 16 HB2 ARG 16 19.466 -7.461 1.589
123 HB3 ARG 16 HB3 ARG 16 18.146 -6.567 0.848
124 HG2 ARG 16 HG2 ARG 16 18.817 -7.263 -1.341
125 HG3 ARG 16 HG3 ARG 16 20.288 -8.000 -0.703
126 HD2 ARG 16 HD2 ARG 16 17.576 -8.872 0.234
127 HD3 ARG 16 HD3 ARG 16 18.282 -9.521 -1.245
128 HE ARG 16 HE ARG 16 20.183 -9.778 0.770
129 HH11 ARG 16 HH11 ARG 16 17.013 -10.996 0.001
130 HH12 ARG 16 HH12 ARG 16 17.249 -12.501 0.825
131 HH21 ARG 16 HH21 ARG 16 20.505 -11.756 1.858
132 HH22 ARG 16 HH22 ARG 16 19.235 -12.932 1.882
133 H ARG 17 H ARG 17 19.031 -3.560 -0.378
134 HA ARG 17 HA ARG 17 18.334 -2.401 2.240
135 HB2 ARG 17 HB2 ARG 17 20.033 -1.102 1.037
136 HB3 ARG 17 HB3 ARG 17 18.962 -0.978 -0.352
137 HG2 ARG 17 HG2 ARG 17 18.582 1.042 0.621
138 HG3 ARG 17 HG3 ARG 17 17.334 0.085 1.422
139 HD2 ARG 17 HD2 ARG 17 20.074 0.397 2.605
140 HD3 ARG 17 HD3 ARG 17 18.818 1.607 2.866
141 HE ARG 17 HE ARG 17 18.963 -1.028 4.024
142 HH11 ARG 17 HH11 ARG 17 16.898 1.654 3.208
143 HH12 ARG 17 HH12 ARG 17 15.692 1.252 4.385
144 HH21 ARG 17 HH21 ARG 17 17.383 -1.567 5.577
145 HH22 ARG 17 HH22 ARG 17 15.969 -0.580 5.733
146 H CYS 18 H CYS 18 16.239 -2.284 2.664
147 HA CYS 18 HA CYS 18 14.351 -1.830 0.468
148 HB2 CYS 18 HB2 CYS 18 13.850 -3.881 2.628
149 HB3 CYS 18 HB3 CYS 18 12.867 -3.564 1.202
150 H TRP 19 H TRP 19 12.418 -0.798 1.065
151 HA TRP 19 HA TRP 19 12.118 0.043 3.842
152 HB2 TRP 19 HB2 TRP 19 11.792 2.434 3.066
153 HB3 TRP 19 HB3 TRP 19 13.450 1.840 3.028
154 HD1 TRP 19 HD1 TRP 19 10.775 3.291 0.832
155 HE1 TRP 19 HE1 TRP 19 11.649 3.495 -1.580
156 HE3 TRP 19 HE3 TRP 19 15.075 0.566 1.294
157 HZ2 TRP 19 HZ2 TRP 19 13.868 2.617 -3.087
158 HZ3 TRP 19 HZ3 TRP 19 16.518 0.295 -0.681
159 HH2 TRP 19 HH2 TRP 19 15.925 1.300 -2.825
160 H GLY 20 H GLY 20 10.105 1.797 3.697
161 HA2 GLY 20 HA2 GLY 20 7.822 1.914 3.493
162 HA3 GLY 20 HA3 GLY 20 8.079 1.394 1.834
Start of MODEL 7
1 H1 SER 1 H SER 1 -0.037 -0.675 -1.792
2 HA SER 1 HA SER 1 2.036 0.184 -1.390
3 HB2 SER 1 HB2 SER 1 1.255 -0.984 1.269
4 HB3 SER 1 HB3 SER 1 2.816 -0.190 1.059
5 HG SER 1 HG SER 1 1.706 1.684 0.412
6 HA PRO 2 HA PRO 2 4.084 -3.900 -2.231
7 HB2 PRO 2 HB2 PRO 2 5.141 -3.143 -4.614
8 HB3 PRO 2 HB3 PRO 2 3.513 -3.814 -4.455
9 HG2 PRO 2 HG2 PRO 2 4.369 -0.955 -4.698
10 HG3 PRO 2 HG3 PRO 2 3.019 -1.790 -5.489
11 HD2 PRO 2 HD2 PRO 2 2.682 -0.206 -3.319
12 HD3 PRO 2 HD3 PRO 2 1.665 -1.627 -3.630
13 H ARG 3 H ARG 3 5.804 -3.950 -0.905
14 HA ARG 3 HA ARG 3 7.571 -1.895 -0.343
15 HB2 ARG 3 HB2 ARG 3 8.841 -3.455 0.827
16 HB3 ARG 3 HB3 ARG 3 7.247 -4.198 0.803
17 HG2 ARG 3 HG2 ARG 3 9.533 -4.867 -1.040
18 HG3 ARG 3 HG3 ARG 3 8.995 -5.825 0.341
19 HD2 ARG 3 HD2 ARG 3 7.395 -5.195 -2.137
20 HD3 ARG 3 HD3 ARG 3 8.125 -6.748 -1.732
21 HE ARG 3 HE ARG 3 6.360 -5.885 0.316
22 HH11 ARG 3 HH11 ARG 3 6.427 -7.274 -2.876
23 HH12 ARG 3 HH12 ARG 3 4.905 -8.083 -2.697
24 HH21 ARG 3 HH21 ARG 3 4.355 -6.944 0.563
25 HH22 ARG 3 HH22 ARG 3 3.727 -7.894 -0.741
26 H VAL 4 H VAL 4 10.012 -2.039 -0.780
27 HA VAL 4 HA VAL 4 10.608 -2.877 -3.520
28 HB VAL 4 HB VAL 4 11.096 -0.076 -2.497
29 HG11 VAL 4 HG11 VAL 4 11.942 -1.456 -5.036
30 HG12 VAL 4 HG12 VAL 4 11.926 0.297 -4.845
31 HG13 VAL 4 HG13 VAL 4 12.968 -0.692 -3.822
32 HG21 VAL 4 HG21 VAL 4 9.591 0.618 -4.282
33 HG22 VAL 4 HG22 VAL 4 9.343 -1.065 -4.745
34 HG23 VAL 4 HG23 VAL 4 8.777 -0.489 -3.177
35 H CYS 5 H CYS 5 12.733 -3.416 -3.880
36 HA CYS 5 HA CYS 5 14.602 -3.084 -1.633
37 HB2 CYS 5 HB2 CYS 5 13.985 -5.608 -3.167
38 HB3 CYS 5 HB3 CYS 5 15.468 -5.407 -2.239
39 H ILE 6 H ILE 6 16.837 -3.102 -2.204
40 HA ILE 6 HA ILE 6 17.494 -2.972 -5.042
41 HB ILE 6 HB ILE 6 18.704 -0.839 -4.785
42 HG12 ILE 6 HG12 ILE 6 17.262 -0.601 -2.138
43 HG13 ILE 6 HG13 ILE 6 18.964 -1.020 -2.296
44 HG21 ILE 6 HG21 ILE 6 15.759 -0.732 -4.151
45 HG22 ILE 6 HG22 ILE 6 16.714 0.625 -4.749
46 HG23 ILE 6 HG23 ILE 6 16.493 -0.808 -5.753
47 HD11 ILE 6 HD11 ILE 6 19.560 1.100 -2.593
48 HD12 ILE 6 HD12 ILE 6 18.251 1.403 -3.735
49 HD13 ILE 6 HD13 ILE 6 17.949 1.502 -2.000
50 H ARG 7 H ARG 7 19.961 -2.506 -5.251
51 HA ARG 7 HA ARG 7 21.292 -4.392 -3.469
52 HB2 ARG 7 HB2 ARG 7 21.401 -4.260 -6.115
53 HB3 ARG 7 HB3 ARG 7 22.686 -3.109 -5.773
54 HG2 ARG 7 HG2 ARG 7 23.996 -4.730 -4.689
55 HG3 ARG 7 HG3 ARG 7 22.643 -5.856 -4.567
56 HD2 ARG 7 HD2 ARG 7 24.194 -6.548 -6.312
57 HD3 ARG 7 HD3 ARG 7 22.632 -6.105 -6.999
58 HE ARG 7 HE ARG 7 24.431 -3.904 -7.007
59 HH11 ARG 7 HH11 ARG 7 23.660 -6.871 -8.658
60 HH12 ARG 7 HH12 ARG 7 24.320 -6.351 -10.174
61 HH21 ARG 7 HH21 ARG 7 25.302 -3.209 -8.997
62 HH22 ARG 7 HH22 ARG 7 25.254 -4.268 -10.365
63 H VAL 8 H VAL 8 23.129 -3.918 -2.279
64 HA VAL 8 HA VAL 8 24.121 -1.176 -2.250
65 HB VAL 8 HB VAL 8 23.030 -2.521 0.226
66 HG11 VAL 8 HG11 VAL 8 25.074 -1.294 0.712
67 HG12 VAL 8 HG12 VAL 8 24.425 0.134 -0.094
68 HG13 VAL 8 HG13 VAL 8 23.674 -0.459 1.387
69 HG21 VAL 8 HG21 VAL 8 21.593 -0.418 0.249
70 HG22 VAL 8 HG22 VAL 8 22.089 -0.196 -1.429
71 HG23 VAL 8 HG23 VAL 8 21.198 -1.643 -0.957
72 H CYS 9 H CYS 9 26.041 -2.100 -3.066
73 HA CYS 9 HA CYS 9 27.508 -3.810 -1.169
74 HB2 CYS 9 HB2 CYS 9 28.168 -3.403 -4.087
75 HB3 CYS 9 HB3 CYS 9 28.791 -4.643 -3.004
76 H ARG 10 H ARG 10 29.305 -3.060 -0.230
77 HA ARG 10 HA ARG 10 30.215 -0.376 -0.981
78 HB2 ARG 10 HB2 ARG 10 31.338 -0.388 1.237
79 HB3 ARG 10 HB3 ARG 10 29.595 -0.594 1.339
80 HG2 ARG 10 HG2 ARG 10 29.910 -3.010 1.626
81 HG3 ARG 10 HG3 ARG 10 31.658 -2.776 1.565
82 HD2 ARG 10 HD2 ARG 10 31.290 -1.126 3.505
83 HD3 ARG 10 HD3 ARG 10 29.708 -1.889 3.665
84 HE ARG 10 HE ARG 10 31.738 -3.853 3.602
85 HH11 ARG 10 HH11 ARG 10 30.373 -1.402 5.662
86 HH12 ARG 10 HH12 ARG 10 30.817 -2.205 7.132
87 HH21 ARG 10 HH21 ARG 10 32.329 -4.920 5.529
88 HH22 ARG 10 HH22 ARG 10 31.931 -4.206 7.055
89 H ASN 11 H ASN 11 31.034 -2.213 -2.777
90 HA ASN 11 HA ASN 11 32.842 -3.157 -3.793
91 HB2 ASN 11 HB2 ASN 11 34.215 -1.035 -2.133
92 HB3 ASN 11 HB3 ASN 11 35.013 -1.958 -3.403
93 HD21 ASN 11 HD21 ASN 11 33.174 -2.053 -5.364
94 HD22 ASN 11 HD22 ASN 11 32.810 -0.463 -5.934
95 H GLY 12 H GLY 12 32.028 -4.824 -1.910
96 HA2 GLY 12 HA2 GLY 12 34.070 -6.529 -1.371
97 HA3 GLY 12 HA3 GLY 12 34.098 -5.436 0.005
98 H VAL 13 H VAL 13 31.320 -5.001 0.249
99 HA VAL 13 HA VAL 13 30.288 -7.692 0.837
100 HB VAL 13 HB VAL 13 30.054 -5.333 2.709
101 HG11 VAL 13 HG11 VAL 13 28.892 -8.058 2.641
102 HG12 VAL 13 HG12 VAL 13 29.412 -7.438 4.209
103 HG13 VAL 13 HG13 VAL 13 28.217 -6.551 3.261
104 HG21 VAL 13 HG21 VAL 13 31.460 -7.009 4.160
105 HG22 VAL 13 HG22 VAL 13 31.973 -7.611 2.584
106 HG23 VAL 13 HG23 VAL 13 32.252 -5.925 3.017
107 H CYS 14 H CYS 14 28.412 -7.992 -0.148
108 HA CYS 14 HA CYS 14 26.859 -5.705 -1.054
109 HB2 CYS 14 HB2 CYS 14 26.935 -8.617 -1.695
110 HB3 CYS 14 HB3 CYS 14 25.431 -7.748 -1.981
111 H TYR 15 H TYR 15 24.748 -5.271 -0.470
112 HA TYR 15 HA TYR 15 23.474 -6.936 1.556
113 HB2 TYR 15 HB2 TYR 15 24.591 -5.490 3.031
114 HB3 TYR 15 HB3 TYR 15 24.357 -4.093 1.985
115 HD1 TYR 15 HD1 TYR 15 22.917 -2.515 2.831
116 HD2 TYR 15 HD2 TYR 15 22.154 -6.618 3.659
117 HE1 TYR 15 HE1 TYR 15 20.922 -1.878 4.122
118 HE2 TYR 15 HE2 TYR 15 20.157 -5.992 4.950
119 HH TYR 15 HH TYR 15 19.227 -4.113 6.106
120 H ARG 16 H ARG 16 21.257 -6.798 1.575
121 HA ARG 16 HA ARG 16 20.073 -5.440 -0.712
122 HB2 ARG 16 HB2 ARG 16 19.282 -7.674 1.083
123 HB3 ARG 16 HB3 ARG 16 17.987 -6.725 0.365
124 HG2 ARG 16 HG2 ARG 16 18.221 -8.360 -1.205
125 HG3 ARG 16 HG3 ARG 16 19.332 -7.148 -1.847
126 HD2 ARG 16 HD2 ARG 16 20.334 -9.374 -1.884
127 HD3 ARG 16 HD3 ARG 16 21.208 -8.299 -0.794
128 HE ARG 16 HE ARG 16 19.368 -9.617 0.772
129 HH11 ARG 16 HH11 ARG 16 22.027 -10.503 -1.293
130 HH12 ARG 16 HH12 ARG 16 22.420 -11.931 -0.394
131 HH21 ARG 16 HH21 ARG 16 19.876 -11.494 1.964
132 HH22 ARG 16 HH22 ARG 16 21.196 -12.494 1.458
133 H ARG 17 H ARG 17 19.248 -3.476 -0.508
134 HA ARG 17 HA ARG 17 18.355 -2.575 2.140
135 HB2 ARG 17 HB2 ARG 17 20.021 -1.123 1.257
136 HB3 ARG 17 HB3 ARG 17 19.243 -1.077 -0.320
137 HG2 ARG 17 HG2 ARG 17 18.908 1.002 0.893
138 HG3 ARG 17 HG3 ARG 17 17.376 0.169 0.624
139 HD2 ARG 17 HD2 ARG 17 17.389 0.991 2.869
140 HD3 ARG 17 HD3 ARG 17 17.559 -0.763 2.928
141 HE ARG 17 HE ARG 17 19.584 -0.472 3.932
142 HH11 ARG 17 HH11 ARG 17 18.745 2.463 2.259
143 HH12 ARG 17 HH12 ARG 17 20.112 3.347 2.853
144 HH21 ARG 17 HH21 ARG 17 21.387 0.681 4.721
145 HH22 ARG 17 HH22 ARG 17 21.614 2.332 4.253
146 H CYS 18 H CYS 18 16.248 -2.563 2.515
147 HA CYS 18 HA CYS 18 14.417 -2.005 0.279
148 HB2 CYS 18 HB2 CYS 18 13.798 -3.934 2.517
149 HB3 CYS 18 HB3 CYS 18 12.879 -3.669 1.038
150 H TRP 19 H TRP 19 12.688 -0.694 0.714
151 HA TRP 19 HA TRP 19 12.445 0.320 3.468
152 HB2 TRP 19 HB2 TRP 19 12.070 2.573 2.585
153 HB3 TRP 19 HB3 TRP 19 13.645 1.961 2.086
154 HD1 TRP 19 HD1 TRP 19 10.256 2.997 0.694
155 HE1 TRP 19 HE1 TRP 19 10.419 3.146 -1.870
156 HE3 TRP 19 HE3 TRP 19 14.903 0.964 0.056
157 HZ2 TRP 19 HZ2 TRP 19 12.271 2.488 -3.896
158 HZ3 TRP 19 HZ3 TRP 19 15.797 0.759 -2.227
159 HH2 TRP 19 HH2 TRP 19 14.507 1.505 -4.161
160 H GLY 20 H GLY 20 10.335 2.040 3.121
161 HA2 GLY 20 HA2 GLY 20 8.166 0.136 2.657
162 HA3 GLY 20 HA3 GLY 20 8.035 1.678 3.490
Start of MODEL 8
1 H1 SER 1 H SER 1 1.400 0.897 -1.330
2 HA SER 1 HA SER 1 1.492 -0.524 -3.901
3 HB2 SER 1 HB2 SER 1 3.120 1.802 -3.029
4 HB3 SER 1 HB3 SER 1 3.976 0.508 -3.867
5 HG SER 1 HG SER 1 3.179 2.044 -5.339
6 HA PRO 2 HA PRO 2 3.669 -3.705 -1.810
7 HB2 PRO 2 HB2 PRO 2 5.478 -4.501 -3.671
8 HB3 PRO 2 HB3 PRO 2 3.748 -4.836 -3.808
9 HG2 PRO 2 HG2 PRO 2 5.370 -2.684 -5.112
10 HG3 PRO 2 HG3 PRO 2 4.103 -3.709 -5.811
11 HD2 PRO 2 HD2 PRO 2 3.645 -1.159 -5.021
12 HD3 PRO 2 HD3 PRO 2 2.403 -2.425 -4.929
13 H ARG 3 H ARG 3 6.013 -4.535 -1.402
14 HA ARG 3 HA ARG 3 7.443 -2.399 -0.159
15 HB2 ARG 3 HB2 ARG 3 7.744 -5.356 -0.351
16 HB3 ARG 3 HB3 ARG 3 9.162 -4.417 0.098
17 HG2 ARG 3 HG2 ARG 3 8.181 -5.036 2.124
18 HG3 ARG 3 HG3 ARG 3 7.695 -3.356 1.885
19 HD2 ARG 3 HD2 ARG 3 5.509 -3.925 1.380
20 HD3 ARG 3 HD3 ARG 3 5.939 -5.570 0.914
21 HE ARG 3 HE ARG 3 5.593 -6.200 3.074
22 HH11 ARG 3 HH11 ARG 3 6.206 -2.774 3.010
23 HH12 ARG 3 HH12 ARG 3 5.914 -2.558 4.704
24 HH21 ARG 3 HH21 ARG 3 5.205 -5.928 5.306
25 HH22 ARG 3 HH22 ARG 3 5.345 -4.353 6.009
26 H VAL 4 H VAL 4 9.881 -2.237 -0.450
27 HA VAL 4 HA VAL 4 10.638 -2.492 -3.280
28 HB VAL 4 HB VAL 4 11.078 -0.045 -1.563
29 HG11 VAL 4 HG11 VAL 4 11.937 0.843 -3.834
30 HG12 VAL 4 HG12 VAL 4 13.004 -0.162 -2.853
31 HG13 VAL 4 HG13 VAL 4 12.157 -0.860 -4.234
32 HG21 VAL 4 HG21 VAL 4 9.671 1.092 -3.205
33 HG22 VAL 4 HG22 VAL 4 9.434 -0.430 -4.064
34 HG23 VAL 4 HG23 VAL 4 8.800 -0.231 -2.430
35 H CYS 5 H CYS 5 12.719 -3.082 -3.661
36 HA CYS 5 HA CYS 5 14.604 -3.129 -1.420
37 HB2 CYS 5 HB2 CYS 5 13.722 -5.500 -3.053
38 HB3 CYS 5 HB3 CYS 5 15.287 -5.472 -2.247
39 H ILE 6 H ILE 6 16.771 -3.021 -2.002
40 HA ILE 6 HA ILE 6 17.445 -2.937 -4.841
41 HB ILE 6 HB ILE 6 18.543 -0.796 -4.715
42 HG12 ILE 6 HG12 ILE 6 17.568 -0.695 -1.853
43 HG13 ILE 6 HG13 ILE 6 19.241 -0.875 -2.367
44 HG21 ILE 6 HG21 ILE 6 16.629 0.658 -4.551
45 HG22 ILE 6 HG22 ILE 6 16.134 -0.872 -5.274
46 HG23 ILE 6 HG23 ILE 6 15.762 -0.535 -3.583
47 HD11 ILE 6 HD11 ILE 6 18.281 1.430 -3.636
48 HD12 ILE 6 HD12 ILE 6 17.713 1.504 -1.968
49 HD13 ILE 6 HD13 ILE 6 19.434 1.323 -2.306
50 H ARG 7 H ARG 7 19.869 -2.617 -5.120
51 HA ARG 7 HA ARG 7 21.212 -4.390 -3.239
52 HB2 ARG 7 HB2 ARG 7 21.667 -3.524 -6.044
53 HB3 ARG 7 HB3 ARG 7 23.090 -3.943 -5.099
54 HG2 ARG 7 HG2 ARG 7 22.134 -6.142 -4.630
55 HG3 ARG 7 HG3 ARG 7 20.708 -5.721 -5.581
56 HD2 ARG 7 HD2 ARG 7 22.131 -7.022 -6.976
57 HD3 ARG 7 HD3 ARG 7 22.232 -5.352 -7.534
58 HE ARG 7 HE ARG 7 24.284 -5.952 -5.658
59 HH11 ARG 7 HH11 ARG 7 23.344 -6.366 -8.984
60 HH12 ARG 7 HH12 ARG 7 24.971 -6.505 -9.563
61 HH21 ARG 7 HH21 ARG 7 26.431 -6.134 -6.407
62 HH22 ARG 7 HH22 ARG 7 26.726 -6.374 -8.096
63 H VAL 8 H VAL 8 23.033 -3.864 -2.071
64 HA VAL 8 HA VAL 8 24.041 -1.120 -2.229
65 HB VAL 8 HB VAL 8 23.157 -2.396 0.364
66 HG11 VAL 8 HG11 VAL 8 23.777 -0.295 1.400
67 HG12 VAL 8 HG12 VAL 8 25.167 -0.986 0.563
68 HG13 VAL 8 HG13 VAL 8 24.279 0.355 -0.161
69 HG21 VAL 8 HG21 VAL 8 21.923 -0.323 -1.408
70 HG22 VAL 8 HG22 VAL 8 21.172 -1.711 -0.621
71 HG23 VAL 8 HG23 VAL 8 21.633 -0.300 0.332
72 H CYS 9 H CYS 9 25.864 -2.215 -3.184
73 HA CYS 9 HA CYS 9 27.479 -3.766 -1.277
74 HB2 CYS 9 HB2 CYS 9 27.933 -3.534 -4.254
75 HB3 CYS 9 HB3 CYS 9 28.638 -4.706 -3.145
76 H ARG 10 H ARG 10 29.255 -2.892 -0.436
77 HA ARG 10 HA ARG 10 30.160 -0.307 -1.481
78 HB2 ARG 10 HB2 ARG 10 29.512 -0.642 0.967
79 HB3 ARG 10 HB3 ARG 10 30.992 -1.578 1.121
80 HG2 ARG 10 HG2 ARG 10 32.051 0.591 0.045
81 HG3 ARG 10 HG3 ARG 10 30.618 1.340 0.753
82 HD2 ARG 10 HD2 ARG 10 32.456 -0.455 2.317
83 HD3 ARG 10 HD3 ARG 10 32.708 1.286 2.193
84 HE ARG 10 HE ARG 10 30.727 -0.071 3.769
85 HH11 ARG 10 HH11 ARG 10 31.546 2.899 2.149
86 HH12 ARG 10 HH12 ARG 10 30.524 3.878 3.147
87 HH21 ARG 10 HH21 ARG 10 29.377 1.207 5.091
88 HH22 ARG 10 HH22 ARG 10 29.291 2.915 4.821
89 H ASN 11 H ASN 11 30.939 -2.279 -3.118
90 HA ASN 11 HA ASN 11 32.717 -3.329 -4.082
91 HB2 ASN 11 HB2 ASN 11 34.496 -1.406 -2.604
92 HB3 ASN 11 HB3 ASN 11 34.689 -2.059 -4.228
93 HD21 ASN 11 HD21 ASN 11 32.327 -1.599 -5.403
94 HD22 ASN 11 HD22 ASN 11 31.998 0.096 -5.478
95 H GLY 12 H GLY 12 32.149 -5.122 -2.526
96 HA2 GLY 12 HA2 GLY 12 34.099 -6.685 -1.739
97 HA3 GLY 12 HA3 GLY 12 34.159 -5.515 -0.429
98 H VAL 13 H VAL 13 31.539 -5.028 0.099
99 HA VAL 13 HA VAL 13 30.443 -7.684 0.756
100 HB VAL 13 HB VAL 13 30.333 -5.249 2.540
101 HG11 VAL 13 HG11 VAL 13 29.243 -8.026 2.736
102 HG12 VAL 13 HG12 VAL 13 29.654 -7.128 4.197
103 HG13 VAL 13 HG13 VAL 13 28.452 -6.487 3.076
104 HG21 VAL 13 HG21 VAL 13 32.535 -5.873 2.762
105 HG22 VAL 13 HG22 VAL 13 31.777 -6.880 3.995
106 HG23 VAL 13 HG23 VAL 13 32.200 -7.572 2.429
107 H CYS 14 H CYS 14 28.506 -7.995 -0.100
108 HA CYS 14 HA CYS 14 26.953 -5.722 -1.044
109 HB2 CYS 14 HB2 CYS 14 26.981 -8.650 -1.570
110 HB3 CYS 14 HB3 CYS 14 25.448 -7.809 -1.775
111 H TYR 15 H TYR 15 24.940 -5.155 -0.321
112 HA TYR 15 HA TYR 15 23.741 -6.711 1.848
113 HB2 TYR 15 HB2 TYR 15 24.977 -5.137 3.112
114 HB3 TYR 15 HB3 TYR 15 24.577 -3.820 2.015
115 HD1 TYR 15 HD1 TYR 15 22.592 -6.348 3.937
116 HD2 TYR 15 HD2 TYR 15 23.219 -2.246 2.997
117 HE1 TYR 15 HE1 TYR 15 20.694 -5.734 5.375
118 HE2 TYR 15 HE2 TYR 15 21.323 -1.621 4.434
119 HH TYR 15 HH TYR 15 20.159 -2.853 6.584
120 H ARG 16 H ARG 16 21.532 -6.599 1.951
121 HA ARG 16 HA ARG 16 20.223 -5.399 -0.353
122 HB2 ARG 16 HB2 ARG 16 19.540 -7.505 1.630
123 HB3 ARG 16 HB3 ARG 16 18.203 -6.610 0.920
124 HG2 ARG 16 HG2 ARG 16 19.458 -7.184 -1.324
125 HG3 ARG 16 HG3 ARG 16 20.111 -8.500 -0.346
126 HD2 ARG 16 HD2 ARG 16 17.774 -9.112 0.265
127 HD3 ARG 16 HD3 ARG 16 17.206 -7.889 -0.871
128 HE ARG 16 HE ARG 16 17.703 -9.309 -2.600
129 HH11 ARG 16 HH11 ARG 16 19.221 -10.465 0.312
130 HH12 ARG 16 HH12 ARG 16 19.712 -11.972 -0.387
131 HH21 ARG 16 HH21 ARG 16 18.345 -11.289 -3.532
132 HH22 ARG 16 HH22 ARG 16 19.215 -12.439 -2.574
133 H ARG 17 H ARG 17 19.012 -3.612 -0.296
134 HA ARG 17 HA ARG 17 18.349 -2.481 2.344
135 HB2 ARG 17 HB2 ARG 17 20.011 -1.106 1.271
136 HB3 ARG 17 HB3 ARG 17 19.087 -1.077 -0.225
137 HG2 ARG 17 HG2 ARG 17 18.876 1.024 0.963
138 HG3 ARG 17 HG3 ARG 17 17.321 0.193 0.888
139 HD2 ARG 17 HD2 ARG 17 17.609 1.086 3.097
140 HD3 ARG 17 HD3 ARG 17 17.735 -0.670 3.178
141 HE ARG 17 HE ARG 17 19.862 -0.418 3.952
142 HH11 ARG 17 HH11 ARG 17 18.939 2.496 2.287
143 HH12 ARG 17 HH12 ARG 17 20.391 3.347 2.699
144 HH21 ARG 17 HH21 ARG 17 21.778 0.691 4.501
145 HH22 ARG 17 HH22 ARG 17 22.005 2.319 3.958
146 H CYS 18 H CYS 18 16.250 -2.512 2.761
147 HA CYS 18 HA CYS 18 14.360 -1.957 0.584
148 HB2 CYS 18 HB2 CYS 18 13.862 -4.078 2.674
149 HB3 CYS 18 HB3 CYS 18 12.898 -3.732 1.241
150 H TRP 19 H TRP 19 12.340 -1.076 1.262
151 HA TRP 19 HA TRP 19 12.064 -0.294 4.049
152 HB2 TRP 19 HB2 TRP 19 11.732 2.109 3.419
153 HB3 TRP 19 HB3 TRP 19 13.387 1.537 3.226
154 HD1 TRP 19 HD1 TRP 19 10.536 3.063 1.314
155 HE1 TRP 19 HE1 TRP 19 11.234 3.424 -1.137
156 HE3 TRP 19 HE3 TRP 19 14.905 0.409 1.315
157 HZ2 TRP 19 HZ2 TRP 19 13.356 2.682 -2.845
158 HZ3 TRP 19 HZ3 TRP 19 16.209 0.283 -0.768
159 HH2 TRP 19 HH2 TRP 19 15.449 1.396 -2.804
160 H GLY 20 H GLY 20 10.023 1.459 3.930
161 HA2 GLY 20 HA2 GLY 20 7.795 -0.168 3.387
162 HA3 GLY 20 HA3 GLY 20 7.740 1.556 3.722
Start of MODEL 9
1 H1 SER 1 H SER 1 -0.293 -0.419 -2.671
2 HA SER 1 HA SER 1 2.277 0.668 -2.951
3 HB2 SER 1 HB2 SER 1 0.460 0.112 -0.648
4 HB3 SER 1 HB3 SER 1 2.144 0.507 -0.305
5 HG SER 1 HG SER 1 0.664 2.334 -0.419
6 HA PRO 2 HA PRO 2 3.857 -3.697 -2.488
7 HB2 PRO 2 HB2 PRO 2 5.584 -3.559 -4.578
8 HB3 PRO 2 HB3 PRO 2 3.894 -4.041 -4.760
9 HG2 PRO 2 HG2 PRO 2 5.171 -1.383 -5.273
10 HG3 PRO 2 HG3 PRO 2 3.966 -2.251 -6.242
11 HD2 PRO 2 HD2 PRO 2 3.308 -0.217 -4.581
12 HD3 PRO 2 HD3 PRO 2 2.218 -1.582 -4.898
13 H ARG 3 H ARG 3 5.914 -4.339 -1.748
14 HA ARG 3 HA ARG 3 7.355 -2.372 -0.320
15 HB2 ARG 3 HB2 ARG 3 7.971 -5.259 -0.953
16 HB3 ARG 3 HB3 ARG 3 8.987 -4.263 0.082
17 HG2 ARG 3 HG2 ARG 3 7.043 -3.904 1.571
18 HG3 ARG 3 HG3 ARG 3 6.113 -5.017 0.565
19 HD2 ARG 3 HD2 ARG 3 6.981 -6.178 2.505
20 HD3 ARG 3 HD3 ARG 3 7.752 -6.787 1.040
21 HE ARG 3 HE ARG 3 9.226 -4.699 2.364
22 HH11 ARG 3 HH11 ARG 3 8.639 -8.124 2.165
23 HH12 ARG 3 HH12 ARG 3 10.174 -8.559 2.843
24 HH21 ARG 3 HH21 ARG 3 11.250 -5.258 3.257
25 HH22 ARG 3 HH22 ARG 3 11.657 -6.927 3.464
26 H VAL 4 H VAL 4 9.859 -2.341 -0.500
27 HA VAL 4 HA VAL 4 10.703 -2.245 -3.310
28 HB VAL 4 HB VAL 4 11.090 -0.002 -1.324
29 HG11 VAL 4 HG11 VAL 4 12.099 1.127 -3.389
30 HG12 VAL 4 HG12 VAL 4 13.084 -0.069 -2.546
31 HG13 VAL 4 HG13 VAL 4 12.258 -0.504 -4.042
32 HG21 VAL 4 HG21 VAL 4 9.208 -0.484 -3.536
33 HG22 VAL 4 HG22 VAL 4 9.045 0.536 -2.107
34 HG23 VAL 4 HG23 VAL 4 9.952 1.115 -3.504
35 H CYS 5 H CYS 5 12.750 -2.911 -3.667
36 HA CYS 5 HA CYS 5 14.599 -3.129 -1.411
37 HB2 CYS 5 HB2 CYS 5 13.647 -5.412 -3.128
38 HB3 CYS 5 HB3 CYS 5 15.199 -5.468 -2.300
39 H ILE 6 H ILE 6 16.785 -3.143 -1.984
40 HA ILE 6 HA ILE 6 17.503 -3.021 -4.799
41 HB ILE 6 HB ILE 6 18.674 -0.893 -4.611
42 HG12 ILE 6 HG12 ILE 6 17.380 -0.632 -1.889
43 HG13 ILE 6 HG13 ILE 6 19.074 -1.034 -2.147
44 HG21 ILE 6 HG21 ILE 6 15.800 -0.601 -3.748
45 HG22 ILE 6 HG22 ILE 6 16.762 0.574 -4.646
46 HG23 ILE 6 HG23 ILE 6 16.327 -0.965 -5.391
47 HD11 ILE 6 HD11 ILE 6 19.545 1.091 -3.032
48 HD12 ILE 6 HD12 ILE 6 17.834 1.480 -3.213
49 HD13 ILE 6 HD13 ILE 6 18.548 1.371 -1.604
50 H ARG 7 H ARG 7 19.935 -2.733 -5.032
51 HA ARG 7 HA ARG 7 21.222 -4.487 -3.090
52 HB2 ARG 7 HB2 ARG 7 21.718 -3.721 -5.917
53 HB3 ARG 7 HB3 ARG 7 23.126 -4.129 -4.945
54 HG2 ARG 7 HG2 ARG 7 22.462 -6.321 -4.661
55 HG3 ARG 7 HG3 ARG 7 20.766 -5.956 -4.985
56 HD2 ARG 7 HD2 ARG 7 21.368 -5.492 -7.344
57 HD3 ARG 7 HD3 ARG 7 23.022 -5.988 -6.987
58 HE ARG 7 HE ARG 7 21.168 -8.010 -6.257
59 HH11 ARG 7 HH11 ARG 7 22.749 -6.565 -9.002
60 HH12 ARG 7 HH12 ARG 7 22.660 -7.998 -9.972
61 HH21 ARG 7 HH21 ARG 7 21.044 -9.902 -7.524
62 HH22 ARG 7 HH22 ARG 7 21.689 -9.895 -9.131
63 H VAL 8 H VAL 8 23.101 -3.970 -1.979
64 HA VAL 8 HA VAL 8 24.101 -1.226 -2.175
65 HB VAL 8 HB VAL 8 23.281 -2.490 0.444
66 HG11 VAL 8 HG11 VAL 8 23.917 -0.386 1.456
67 HG12 VAL 8 HG12 VAL 8 25.290 -1.065 0.581
68 HG13 VAL 8 HG13 VAL 8 24.369 0.266 -0.119
69 HG21 VAL 8 HG21 VAL 8 21.993 -0.443 -1.317
70 HG22 VAL 8 HG22 VAL 8 21.268 -1.821 -0.487
71 HG23 VAL 8 HG23 VAL 8 21.750 -0.393 0.430
72 H CYS 9 H CYS 9 25.901 -2.329 -3.168
73 HA CYS 9 HA CYS 9 27.570 -3.846 -1.280
74 HB2 CYS 9 HB2 CYS 9 27.933 -3.683 -4.273
75 HB3 CYS 9 HB3 CYS 9 28.673 -4.829 -3.160
76 H ARG 10 H ARG 10 29.289 -2.876 -0.445
77 HA ARG 10 HA ARG 10 30.175 -0.335 -1.583
78 HB2 ARG 10 HB2 ARG 10 29.634 -0.545 0.860
79 HB3 ARG 10 HB3 ARG 10 31.017 -1.620 1.017
80 HG2 ARG 10 HG2 ARG 10 31.998 0.329 1.631
81 HG3 ARG 10 HG3 ARG 10 32.268 0.419 -0.111
82 HD2 ARG 10 HD2 ARG 10 30.704 2.060 -0.408
83 HD3 ARG 10 HD3 ARG 10 29.735 1.534 0.968
84 HE ARG 10 HE ARG 10 32.294 2.641 1.685
85 HH11 ARG 10 HH11 ARG 10 28.951 3.329 0.999
86 HH12 ARG 10 HH12 ARG 10 28.939 4.815 1.890
87 HH21 ARG 10 HH21 ARG 10 32.290 4.595 2.861
88 HH22 ARG 10 HH22 ARG 10 30.839 5.535 2.948
89 H ASN 11 H ASN 11 30.917 -2.256 -3.259
90 HA ASN 11 HA ASN 11 32.664 -3.293 -4.292
91 HB2 ASN 11 HB2 ASN 11 34.400 -1.314 -2.812
92 HB3 ASN 11 HB3 ASN 11 34.708 -2.058 -4.378
93 HD21 ASN 11 HD21 ASN 11 34.091 0.765 -3.120
94 HD22 ASN 11 HD22 ASN 11 33.076 1.474 -4.325
95 H GLY 12 H GLY 12 32.057 -5.038 -2.610
96 HA2 GLY 12 HA2 GLY 12 34.013 -6.675 -1.958
97 HA3 GLY 12 HA3 GLY 12 34.190 -5.501 -0.662
98 H VAL 13 H VAL 13 31.664 -4.926 0.072
99 HA VAL 13 HA VAL 13 30.561 -7.545 0.861
100 HB VAL 13 HB VAL 13 30.513 -4.991 2.473
101 HG11 VAL 13 HG11 VAL 13 29.306 -7.690 2.840
102 HG12 VAL 13 HG12 VAL 13 29.856 -6.799 4.260
103 HG13 VAL 13 HG13 VAL 13 28.637 -6.097 3.196
104 HG21 VAL 13 HG21 VAL 13 32.724 -5.708 2.606
105 HG22 VAL 13 HG22 VAL 13 31.973 -6.452 4.018
106 HG23 VAL 13 HG23 VAL 13 32.275 -7.413 2.571
107 H CYS 14 H CYS 14 28.619 -7.930 0.048
108 HA CYS 14 HA CYS 14 27.004 -5.734 -0.968
109 HB2 CYS 14 HB2 CYS 14 27.074 -8.684 -1.351
110 HB3 CYS 14 HB3 CYS 14 25.521 -7.881 -1.559
111 H TYR 15 H TYR 15 24.942 -5.232 -0.277
112 HA TYR 15 HA TYR 15 23.834 -6.681 2.001
113 HB2 TYR 15 HB2 TYR 15 25.086 -5.038 3.167
114 HB3 TYR 15 HB3 TYR 15 24.619 -3.770 2.039
115 HD1 TYR 15 HD1 TYR 15 23.283 -2.190 3.045
116 HD2 TYR 15 HD2 TYR 15 22.732 -6.281 4.075
117 HE1 TYR 15 HE1 TYR 15 21.417 -1.561 4.519
118 HE2 TYR 15 HE2 TYR 15 20.864 -5.664 5.552
119 HH TYR 15 HH TYR 15 19.630 -4.015 6.368
120 H ARG 16 H ARG 16 21.626 -6.599 2.136
121 HA ARG 16 HA ARG 16 20.259 -5.498 -0.184
122 HB2 ARG 16 HB2 ARG 16 19.644 -7.545 1.881
123 HB3 ARG 16 HB3 ARG 16 18.281 -6.692 1.168
124 HG2 ARG 16 HG2 ARG 16 18.417 -8.437 -0.273
125 HG3 ARG 16 HG3 ARG 16 19.526 -7.325 -1.077
126 HD2 ARG 16 HD2 ARG 16 20.610 -9.431 -1.011
127 HD3 ARG 16 HD3 ARG 16 21.387 -8.426 0.213
128 HE ARG 16 HE ARG 16 20.613 -9.854 1.830
129 HH11 ARG 16 HH11 ARG 16 18.922 -10.468 -1.151
130 HH12 ARG 16 HH12 ARG 16 18.141 -11.899 -0.565
131 HH21 ARG 16 HH21 ARG 16 19.591 -11.736 2.613
132 HH22 ARG 16 HH22 ARG 16 18.522 -12.619 1.577
133 H ARG 17 H ARG 17 18.912 -3.793 -0.162
134 HA ARG 17 HA ARG 17 18.277 -2.581 2.448
135 HB2 ARG 17 HB2 ARG 17 19.997 -1.282 1.260
136 HB3 ARG 17 HB3 ARG 17 18.927 -1.138 -0.128
137 HG2 ARG 17 HG2 ARG 17 18.574 0.876 0.884
138 HG3 ARG 17 HG3 ARG 17 17.298 -0.083 1.636
139 HD2 ARG 17 HD2 ARG 17 20.023 0.224 2.868
140 HD3 ARG 17 HD3 ARG 17 18.718 1.370 3.172
141 HE ARG 17 HE ARG 17 18.959 -1.308 4.208
142 HH11 ARG 17 HH11 ARG 17 16.796 1.326 3.498
143 HH12 ARG 17 HH12 ARG 17 15.598 0.823 4.645
144 HH21 ARG 17 HH21 ARG 17 17.390 -1.980 5.721
145 HH22 ARG 17 HH22 ARG 17 15.937 -1.057 5.909
146 H CYS 18 H CYS 18 16.173 -2.519 2.835
147 HA CYS 18 HA CYS 18 14.319 -1.997 0.630
148 HB2 CYS 18 HB2 CYS 18 13.827 -4.183 2.657
149 HB3 CYS 18 HB3 CYS 18 12.845 -3.790 1.250
150 H TRP 19 H TRP 19 12.381 -1.001 1.237
151 HA TRP 19 HA TRP 19 12.003 -0.339 4.054
152 HB2 TRP 19 HB2 TRP 19 11.659 2.092 3.404
153 HB3 TRP 19 HB3 TRP 19 13.325 1.520 3.391
154 HD1 TRP 19 HD1 TRP 19 10.711 3.067 1.190
155 HE1 TRP 19 HE1 TRP 19 11.663 3.413 -1.176
156 HE3 TRP 19 HE3 TRP 19 15.020 0.353 1.643
157 HZ2 TRP 19 HZ2 TRP 19 13.938 2.637 -2.656
158 HZ3 TRP 19 HZ3 TRP 19 16.529 0.205 -0.295
159 HH2 TRP 19 HH2 TRP 19 15.998 1.323 -2.399
160 H GLY 20 H GLY 20 9.972 1.397 3.971
161 HA2 GLY 20 HA2 GLY 20 7.887 -0.133 2.563
162 HA3 GLY 20 HA3 GLY 20 7.636 0.837 4.007
Start of MODEL 10
1 H1 SER 1 H SER 1 1.872 -1.848 1.486
2 HA SER 1 HA SER 1 1.543 0.098 -0.685
3 HB2 SER 1 HB2 SER 1 4.127 0.513 0.395
4 HB3 SER 1 HB3 SER 1 2.770 1.640 0.379
5 HG SER 1 HG SER 1 2.430 1.253 2.422
6 HA PRO 2 HA PRO 2 3.982 -2.618 -3.115
7 HB2 PRO 2 HB2 PRO 2 5.458 -0.901 -4.614
8 HB3 PRO 2 HB3 PRO 2 3.723 -1.141 -4.856
9 HG2 PRO 2 HG2 PRO 2 5.145 1.044 -3.386
10 HG3 PRO 2 HG3 PRO 2 3.768 1.156 -4.497
11 HD2 PRO 2 HD2 PRO 2 3.479 1.233 -1.806
12 HD3 PRO 2 HD3 PRO 2 2.251 0.531 -2.879
13 H ARG 3 H ARG 3 5.587 -3.846 -2.370
14 HA ARG 3 HA ARG 3 7.648 -2.893 -0.681
15 HB2 ARG 3 HB2 ARG 3 8.597 -5.168 -0.925
16 HB3 ARG 3 HB3 ARG 3 6.886 -5.185 -0.520
17 HG2 ARG 3 HG2 ARG 3 6.294 -5.721 -2.780
18 HG3 ARG 3 HG3 ARG 3 7.967 -5.524 -3.308
19 HD2 ARG 3 HD2 ARG 3 7.369 -7.885 -3.053
20 HD3 ARG 3 HD3 ARG 3 8.643 -7.410 -1.931
21 HE ARG 3 HE ARG 3 6.336 -7.102 -0.509
22 HH11 ARG 3 HH11 ARG 3 7.814 -9.723 -2.261
23 HH12 ARG 3 HH12 ARG 3 7.134 -10.954 -1.250
24 HH21 ARG 3 HH21 ARG 3 5.435 -8.715 0.829
25 HH22 ARG 3 HH22 ARG 3 5.780 -10.380 0.507
26 H VAL 4 H VAL 4 9.803 -2.499 -1.061
27 HA VAL 4 HA VAL 4 10.724 -2.568 -3.850
28 HB VAL 4 HB VAL 4 11.037 -0.218 -1.977
29 HG11 VAL 4 HG11 VAL 4 12.078 0.816 -4.073
30 HG12 VAL 4 HG12 VAL 4 13.058 -0.326 -3.153
31 HG13 VAL 4 HG13 VAL 4 12.267 -0.843 -4.642
32 HG21 VAL 4 HG21 VAL 4 8.819 -0.438 -3.066
33 HG22 VAL 4 HG22 VAL 4 9.701 1.005 -3.565
34 HG23 VAL 4 HG23 VAL 4 9.623 -0.395 -4.635
35 H CYS 5 H CYS 5 12.809 -3.176 -4.128
36 HA CYS 5 HA CYS 5 14.595 -3.268 -1.816
37 HB2 CYS 5 HB2 CYS 5 13.753 -5.650 -3.460
38 HB3 CYS 5 HB3 CYS 5 15.258 -5.633 -2.547
39 H ILE 6 H ILE 6 16.793 -3.261 -2.331
40 HA ILE 6 HA ILE 6 17.579 -3.254 -5.133
41 HB ILE 6 HB ILE 6 18.691 -1.106 -5.037
42 HG12 ILE 6 HG12 ILE 6 17.475 -0.811 -2.281
43 HG13 ILE 6 HG13 ILE 6 19.177 -1.118 -2.608
44 HG21 ILE 6 HG21 ILE 6 15.864 -0.705 -4.087
45 HG22 ILE 6 HG22 ILE 6 16.795 0.311 -5.187
46 HG23 ILE 6 HG23 ILE 6 16.270 -1.292 -5.700
47 HD11 ILE 6 HD11 ILE 6 19.583 1.031 -2.975
48 HD12 ILE 6 HD12 ILE 6 18.187 1.195 -4.041
49 HD13 ILE 6 HD13 ILE 6 17.986 1.342 -2.295
50 H ARG 7 H ARG 7 20.030 -2.876 -5.291
51 HA ARG 7 HA ARG 7 21.286 -4.574 -3.278
52 HB2 ARG 7 HB2 ARG 7 21.858 -3.856 -6.103
53 HB3 ARG 7 HB3 ARG 7 23.241 -4.217 -5.077
54 HG2 ARG 7 HG2 ARG 7 22.430 -6.407 -4.619
55 HG3 ARG 7 HG3 ARG 7 20.880 -6.053 -5.384
56 HD2 ARG 7 HD2 ARG 7 21.836 -6.004 -7.535
57 HD3 ARG 7 HD3 ARG 7 23.474 -5.907 -6.891
58 HE ARG 7 HE ARG 7 22.187 -8.309 -6.085
59 HH11 ARG 7 HH11 ARG 7 23.764 -6.775 -8.783
60 HH12 ARG 7 HH12 ARG 7 24.278 -8.267 -9.499
61 HH21 ARG 7 HH21 ARG 7 22.857 -10.280 -7.018
62 HH22 ARG 7 HH22 ARG 7 23.760 -10.260 -8.495
63 H VAL 8 H VAL 8 23.075 -3.985 -2.081
64 HA VAL 8 HA VAL 8 24.058 -1.238 -2.325
65 HB VAL 8 HB VAL 8 23.108 -2.425 0.286
66 HG11 VAL 8 HG11 VAL 8 25.104 -1.009 0.512
67 HG12 VAL 8 HG12 VAL 8 24.253 0.303 -0.303
68 HG13 VAL 8 HG13 VAL 8 23.686 -0.278 1.263
69 HG21 VAL 8 HG21 VAL 8 21.536 -0.421 0.181
70 HG22 VAL 8 HG22 VAL 8 21.950 -0.332 -1.531
71 HG23 VAL 8 HG23 VAL 8 21.176 -1.779 -0.885
72 H CYS 9 H CYS 9 25.933 -2.303 -3.176
73 HA CYS 9 HA CYS 9 27.514 -3.765 -1.169
74 HB2 CYS 9 HB2 CYS 9 28.043 -3.657 -4.139
75 HB3 CYS 9 HB3 CYS 9 28.732 -4.770 -2.962
76 H ARG 10 H ARG 10 29.260 -2.832 -0.326
77 HA ARG 10 HA ARG 10 30.151 -0.279 -1.458
78 HB2 ARG 10 HB2 ARG 10 29.450 -0.519 0.986
79 HB3 ARG 10 HB3 ARG 10 30.938 -1.429 1.214
80 HG2 ARG 10 HG2 ARG 10 32.005 0.701 0.081
81 HG3 ARG 10 HG3 ARG 10 30.540 1.467 0.702
82 HD2 ARG 10 HD2 ARG 10 31.226 0.165 2.899
83 HD3 ARG 10 HD3 ARG 10 32.828 0.255 2.167
84 HE ARG 10 HE ARG 10 31.745 2.804 2.051
85 HH11 ARG 10 HH11 ARG 10 32.675 0.501 4.491
86 HH12 ARG 10 HH12 ARG 10 33.069 1.710 5.668
87 HH21 ARG 10 HH21 ARG 10 32.260 4.405 3.592
88 HH22 ARG 10 HH22 ARG 10 32.832 3.930 5.156
89 H ASN 11 H ASN 11 30.991 -2.324 -2.983
90 HA ASN 11 HA ASN 11 32.807 -3.388 -3.858
91 HB2 ASN 11 HB2 ASN 11 34.476 -1.316 -2.441
92 HB3 ASN 11 HB3 ASN 11 34.795 -2.106 -3.982
93 HD21 ASN 11 HD21 ASN 11 32.571 -1.828 -5.392
94 HD22 ASN 11 HD22 ASN 11 32.171 -0.163 -5.623
95 H GLY 12 H GLY 12 32.208 -5.083 -2.179
96 HA2 GLY 12 HA2 GLY 12 34.173 -6.583 -1.291
97 HA3 GLY 12 HA3 GLY 12 34.201 -5.341 -0.048
98 H VAL 13 H VAL 13 31.504 -4.870 0.309
99 HA VAL 13 HA VAL 13 30.454 -7.494 1.140
100 HB VAL 13 HB VAL 13 30.280 -4.955 2.768
101 HG11 VAL 13 HG11 VAL 13 29.225 -7.736 3.144
102 HG12 VAL 13 HG12 VAL 13 29.534 -6.683 4.525
103 HG13 VAL 13 HG13 VAL 13 28.377 -6.196 3.286
104 HG21 VAL 13 HG21 VAL 13 32.448 -5.517 3.175
105 HG22 VAL 13 HG22 VAL 13 31.670 -6.590 4.340
106 HG23 VAL 13 HG23 VAL 13 32.198 -7.217 2.778
107 H CYS 14 H CYS 14 28.553 -7.886 0.240
108 HA CYS 14 HA CYS 14 26.984 -5.696 -0.860
109 HB2 CYS 14 HB2 CYS 14 27.081 -8.646 -1.232
110 HB3 CYS 14 HB3 CYS 14 25.538 -7.848 -1.520
111 H TYR 15 H TYR 15 24.916 -5.164 -0.246
112 HA TYR 15 HA TYR 15 23.701 -6.617 1.980
113 HB2 TYR 15 HB2 TYR 15 24.870 -4.944 3.184
114 HB3 TYR 15 HB3 TYR 15 24.457 -3.699 2.010
115 HD1 TYR 15 HD1 TYR 15 23.045 -2.114 2.894
116 HD2 TYR 15 HD2 TYR 15 22.491 -6.183 4.006
117 HE1 TYR 15 HE1 TYR 15 21.099 -1.471 4.255
118 HE2 TYR 15 HE2 TYR 15 20.543 -5.552 5.369
119 HH TYR 15 HH TYR 15 19.663 -3.558 6.508
120 H ARG 16 H ARG 16 21.488 -6.558 2.013
121 HA ARG 16 HA ARG 16 20.218 -5.515 -0.387
122 HB2 ARG 16 HB2 ARG 16 19.529 -7.530 1.687
123 HB3 ARG 16 HB3 ARG 16 18.192 -6.707 0.894
124 HG2 ARG 16 HG2 ARG 16 19.109 -7.406 -1.292
125 HG3 ARG 16 HG3 ARG 16 20.360 -8.313 -0.439
126 HD2 ARG 16 HD2 ARG 16 17.403 -8.750 -0.063
127 HD3 ARG 16 HD3 ARG 16 18.401 -9.679 -1.180
128 HE ARG 16 HE ARG 16 19.643 -9.853 1.275
129 HH11 ARG 16 HH11 ARG 16 16.548 -10.704 -0.073
130 HH12 ARG 16 HH12 ARG 16 16.306 -12.046 0.996
131 HH21 ARG 16 HH21 ARG 16 19.336 -11.617 2.688
132 HH22 ARG 16 HH22 ARG 16 17.891 -12.564 2.567
133 H ARG 17 H ARG 17 18.917 -3.787 -0.460
134 HA ARG 17 HA ARG 17 18.152 -2.533 2.096
135 HB2 ARG 17 HB2 ARG 17 19.872 -1.231 0.928
136 HB3 ARG 17 HB3 ARG 17 18.861 -1.172 -0.509
137 HG2 ARG 17 HG2 ARG 17 18.355 0.855 0.362
138 HG3 ARG 17 HG3 ARG 17 17.141 -0.108 1.206
139 HD2 ARG 17 HD2 ARG 17 19.856 0.327 2.395
140 HD3 ARG 17 HD3 ARG 17 18.595 1.550 2.557
141 HE ARG 17 HE ARG 17 17.785 -1.104 3.336
142 HH11 ARG 17 HH11 ARG 17 19.230 1.891 4.367
143 HH12 ARG 17 HH12 ARG 17 18.839 1.655 6.039
144 HH21 ARG 17 HH21 ARG 17 17.265 -1.426 5.534
145 HH22 ARG 17 HH22 ARG 17 17.722 -0.232 6.701
146 H CYS 18 H CYS 18 16.038 -2.482 2.430
147 HA CYS 18 HA CYS 18 14.232 -2.087 0.157
148 HB2 CYS 18 HB2 CYS 18 13.720 -4.171 2.285
149 HB3 CYS 18 HB3 CYS 18 12.762 -3.863 0.840
150 H TRP 19 H TRP 19 12.272 -1.081 0.663
151 HA TRP 19 HA TRP 19 11.812 -0.280 3.431
152 HB2 TRP 19 HB2 TRP 19 11.470 2.111 2.655
153 HB3 TRP 19 HB3 TRP 19 13.140 1.554 2.708
154 HD1 TRP 19 HD1 TRP 19 10.566 2.969 0.375
155 HE1 TRP 19 HE1 TRP 19 11.569 3.209 -1.983
156 HE3 TRP 19 HE3 TRP 19 14.884 0.319 1.058
157 HZ2 TRP 19 HZ2 TRP 19 13.885 2.383 -3.370
158 HZ3 TRP 19 HZ3 TRP 19 16.440 0.091 -0.835
159 HH2 TRP 19 HH2 TRP 19 15.948 1.102 -3.003
160 H GLY 20 H GLY 20 9.771 1.427 3.208
161 HA2 GLY 20 HA2 GLY 20 7.741 -0.181 1.804
162 HA3 GLY 20 HA3 GLY 20 7.439 0.830 3.210
Start of MODEL 11
1 H1 SER 1 H SER 1 2.772 2.177 -1.112
2 HA SER 1 HA SER 1 2.126 0.505 -3.451
3 HB2 SER 1 HB2 SER 1 3.935 1.240 -4.594
4 HB3 SER 1 HB3 SER 1 3.864 2.620 -3.498
5 HG SER 1 HG SER 1 5.946 1.477 -3.679
6 HA PRO 2 HA PRO 2 3.653 -2.993 -1.291
7 HB2 PRO 2 HB2 PRO 2 4.952 -4.366 -3.240
8 HB3 PRO 2 HB3 PRO 2 3.190 -4.236 -3.168
9 HG2 PRO 2 HG2 PRO 2 5.138 -2.688 -4.833
10 HG3 PRO 2 HG3 PRO 2 3.573 -3.382 -5.296
11 HD2 PRO 2 HD2 PRO 2 3.887 -0.756 -4.717
12 HD3 PRO 2 HD3 PRO 2 2.383 -1.635 -4.376
13 H ARG 3 H ARG 3 5.662 -4.294 -0.824
14 HA ARG 3 HA ARG 3 7.737 -2.592 0.021
15 HB2 ARG 3 HB2 ARG 3 8.931 -4.676 0.610
16 HB3 ARG 3 HB3 ARG 3 7.267 -4.669 1.179
17 HG2 ARG 3 HG2 ARG 3 7.358 -6.770 0.331
18 HG3 ARG 3 HG3 ARG 3 6.857 -5.904 -1.123
19 HD2 ARG 3 HD2 ARG 3 8.976 -6.009 -2.068
20 HD3 ARG 3 HD3 ARG 3 9.761 -6.288 -0.514
21 HE ARG 3 HE ARG 3 8.114 -8.466 -0.983
22 HH11 ARG 3 HH11 ARG 3 10.888 -6.966 -2.457
23 HH12 ARG 3 HH12 ARG 3 11.502 -8.447 -3.116
24 HH21 ARG 3 HH21 ARG 3 8.911 -10.422 -1.845
25 HH22 ARG 3 HH22 ARG 3 10.376 -10.411 -2.768
26 H VAL 4 H VAL 4 9.911 -2.448 -0.657
27 HA VAL 4 HA VAL 4 10.514 -3.467 -3.342
28 HB VAL 4 HB VAL 4 10.910 -0.598 -2.481
29 HG11 VAL 4 HG11 VAL 4 12.778 -1.227 -3.812
30 HG12 VAL 4 HG12 VAL 4 11.750 -2.073 -4.968
31 HG13 VAL 4 HG13 VAL 4 11.687 -0.314 -4.854
32 HG21 VAL 4 HG21 VAL 4 8.911 -1.982 -4.189
33 HG22 VAL 4 HG22 VAL 4 8.715 -0.601 -3.109
34 HG23 VAL 4 HG23 VAL 4 9.465 -0.384 -4.691
35 H CYS 5 H CYS 5 12.648 -3.952 -3.713
36 HA CYS 5 HA CYS 5 14.540 -3.432 -1.520
37 HB2 CYS 5 HB2 CYS 5 14.003 -6.044 -2.931
38 HB3 CYS 5 HB3 CYS 5 15.494 -5.742 -2.043
39 H ILE 6 H ILE 6 16.757 -3.355 -2.125
40 HA ILE 6 HA ILE 6 17.362 -3.323 -4.981
41 HB ILE 6 HB ILE 6 18.510 -1.139 -4.805
42 HG12 ILE 6 HG12 ILE 6 17.042 -0.842 -2.180
43 HG13 ILE 6 HG13 ILE 6 18.755 -1.225 -2.304
44 HG21 ILE 6 HG21 ILE 6 15.577 -1.006 -4.121
45 HG22 ILE 6 HG22 ILE 6 16.518 0.231 -4.954
46 HG23 ILE 6 HG23 ILE 6 16.234 -1.330 -5.725
47 HD11 ILE 6 HD11 ILE 6 18.093 1.201 -1.897
48 HD12 ILE 6 HD12 ILE 6 19.279 0.876 -3.161
49 HD13 ILE 6 HD13 ILE 6 17.603 1.219 -3.591
50 H ARG 7 H ARG 7 19.795 -2.819 -5.276
51 HA ARG 7 HA ARG 7 21.232 -4.556 -3.425
52 HB2 ARG 7 HB2 ARG 7 21.262 -4.581 -6.077
53 HB3 ARG 7 HB3 ARG 7 22.524 -3.379 -5.842
54 HG2 ARG 7 HG2 ARG 7 23.939 -4.886 -4.783
55 HG3 ARG 7 HG3 ARG 7 22.624 -6.002 -4.409
56 HD2 ARG 7 HD2 ARG 7 22.381 -6.418 -6.858
57 HD3 ARG 7 HD3 ARG 7 23.826 -5.439 -7.115
58 HE ARG 7 HE ARG 7 24.308 -7.520 -5.241
59 HH11 ARG 7 HH11 ARG 7 23.950 -6.878 -8.644
60 HH12 ARG 7 HH12 ARG 7 24.932 -8.219 -9.133
61 HH21 ARG 7 HH21 ARG 7 25.603 -9.288 -5.873
62 HH22 ARG 7 HH22 ARG 7 25.871 -9.590 -7.556
63 H VAL 8 H VAL 8 22.968 -3.936 -2.209
64 HA VAL 8 HA VAL 8 23.932 -1.183 -2.418
65 HB VAL 8 HB VAL 8 22.901 -2.380 0.158
66 HG11 VAL 8 HG11 VAL 8 23.512 -0.237 1.172
67 HG12 VAL 8 HG12 VAL 8 24.924 -1.072 0.525
68 HG13 VAL 8 HG13 VAL 8 24.220 0.284 -0.357
69 HG21 VAL 8 HG21 VAL 8 21.442 -0.268 0.033
70 HG22 VAL 8 HG22 VAL 8 21.874 -0.241 -1.677
71 HG23 VAL 8 HG23 VAL 8 21.020 -1.630 -1.004
72 H CYS 9 H CYS 9 25.866 -2.112 -3.190
73 HA CYS 9 HA CYS 9 27.385 -3.685 -1.220
74 HB2 CYS 9 HB2 CYS 9 28.050 -3.358 -4.146
75 HB3 CYS 9 HB3 CYS 9 28.696 -4.547 -3.020
76 H ARG 10 H ARG 10 29.147 -2.844 -0.294
77 HA ARG 10 HA ARG 10 29.985 -0.166 -1.139
78 HB2 ARG 10 HB2 ARG 10 31.103 -0.075 1.086
79 HB3 ARG 10 HB3 ARG 10 29.362 -0.303 1.180
80 HG2 ARG 10 HG2 ARG 10 29.629 -2.627 1.687
81 HG3 ARG 10 HG3 ARG 10 31.367 -2.535 1.396
82 HD2 ARG 10 HD2 ARG 10 31.548 -0.926 3.272
83 HD3 ARG 10 HD3 ARG 10 29.829 -1.156 3.592
84 HE ARG 10 HE ARG 10 30.798 -3.672 3.681
85 HH11 ARG 10 HH11 ARG 10 31.766 -0.701 5.217
86 HH12 ARG 10 HH12 ARG 10 32.392 -1.483 6.630
87 HH21 ARG 10 HH21 ARG 10 31.619 -4.713 5.537
88 HH22 ARG 10 HH22 ARG 10 32.309 -3.766 6.811
89 H ASN 11 H ASN 11 30.872 -2.031 -2.866
90 HA ASN 11 HA ASN 11 32.713 -2.962 -3.836
91 HB2 ASN 11 HB2 ASN 11 34.150 -0.847 -2.217
92 HB3 ASN 11 HB3 ASN 11 34.781 -1.671 -3.640
93 HD21 ASN 11 HD21 ASN 11 33.997 1.193 -2.890
94 HD22 ASN 11 HD22 ASN 11 33.070 1.721 -4.249
95 H GLY 12 H GLY 12 32.045 -4.727 -2.134
96 HA2 GLY 12 HA2 GLY 12 34.088 -6.296 -1.451
97 HA3 GLY 12 HA3 GLY 12 34.087 -5.165 -0.106
98 H VAL 13 H VAL 13 31.313 -4.799 0.160
99 HA VAL 13 HA VAL 13 30.345 -7.502 0.801
100 HB VAL 13 HB VAL 13 30.021 -5.133 2.643
101 HG11 VAL 13 HG11 VAL 13 29.666 -7.444 4.087
102 HG12 VAL 13 HG12 VAL 13 28.380 -6.418 3.450
103 HG13 VAL 13 HG13 VAL 13 28.916 -7.828 2.537
104 HG21 VAL 13 HG21 VAL 13 32.266 -5.541 2.911
105 HG22 VAL 13 HG22 VAL 13 31.586 -6.667 4.087
106 HG23 VAL 13 HG23 VAL 13 32.114 -7.252 2.509
107 H CYS 14 H CYS 14 28.453 -7.861 -0.134
108 HA CYS 14 HA CYS 14 26.850 -5.624 -1.075
109 HB2 CYS 14 HB2 CYS 14 26.974 -8.547 -1.648
110 HB3 CYS 14 HB3 CYS 14 25.445 -7.719 -1.925
111 H TYR 15 H TYR 15 24.822 -5.115 -0.378
112 HA TYR 15 HA TYR 15 23.594 -6.774 1.698
113 HB2 TYR 15 HB2 TYR 15 24.691 -5.229 3.082
114 HB3 TYR 15 HB3 TYR 15 24.401 -3.891 1.976
115 HD1 TYR 15 HD1 TYR 15 22.275 -6.395 3.775
116 HD2 TYR 15 HD2 TYR 15 22.953 -2.309 2.802
117 HE1 TYR 15 HE1 TYR 15 20.283 -5.762 5.072
118 HE2 TYR 15 HE2 TYR 15 20.965 -1.665 4.098
119 HH TYR 15 HH TYR 15 19.523 -3.544 6.311
120 H ARG 16 H ARG 16 21.388 -6.764 1.700
121 HA ARG 16 HA ARG 16 20.116 -5.521 -0.599
122 HB2 ARG 16 HB2 ARG 16 19.797 -7.965 0.406
123 HB3 ARG 16 HB3 ARG 16 18.574 -7.143 1.365
124 HG2 ARG 16 HG2 ARG 16 17.536 -6.332 -0.728
125 HG3 ARG 16 HG3 ARG 16 18.715 -7.279 -1.638
126 HD2 ARG 16 HD2 ARG 16 17.895 -9.311 -0.452
127 HD3 ARG 16 HD3 ARG 16 16.633 -8.319 0.279
128 HE ARG 16 HE ARG 16 15.489 -8.378 -1.702
129 HH11 ARG 16 HH11 ARG 16 18.774 -9.393 -2.251
130 HH12 ARG 16 HH12 ARG 16 18.487 -9.884 -3.887
131 HH21 ARG 16 HH21 ARG 16 15.099 -9.021 -3.856
132 HH22 ARG 16 HH22 ARG 16 16.396 -9.671 -4.800
133 H ARG 17 H ARG 17 19.214 -3.585 -0.456
134 HA ARG 17 HA ARG 17 18.320 -2.623 2.172
135 HB2 ARG 17 HB2 ARG 17 19.925 -1.143 1.227
136 HB3 ARG 17 HB3 ARG 17 19.137 -1.180 -0.345
137 HG2 ARG 17 HG2 ARG 17 18.734 0.927 0.796
138 HG3 ARG 17 HG3 ARG 17 17.231 0.030 0.571
139 HD2 ARG 17 HD2 ARG 17 17.242 0.940 2.786
140 HD3 ARG 17 HD3 ARG 17 17.454 -0.807 2.902
141 HE ARG 17 HE ARG 17 19.470 -0.431 3.891
142 HH11 ARG 17 HH11 ARG 17 18.581 2.409 2.084
143 HH12 ARG 17 HH12 ARG 17 19.938 3.339 2.627
144 HH21 ARG 17 HH21 ARG 17 21.261 0.783 4.613
145 HH22 ARG 17 HH22 ARG 17 21.462 2.413 4.065
146 H CYS 18 H CYS 18 16.217 -2.638 2.570
147 HA CYS 18 HA CYS 18 14.350 -2.245 0.328
148 HB2 CYS 18 HB2 CYS 18 13.808 -4.084 2.660
149 HB3 CYS 18 HB3 CYS 18 12.872 -3.918 1.178
150 H TRP 19 H TRP 19 12.571 -0.982 0.726
151 HA TRP 19 HA TRP 19 12.340 0.169 3.427
152 HB2 TRP 19 HB2 TRP 19 11.857 2.352 2.434
153 HB3 TRP 19 HB3 TRP 19 13.441 1.776 1.924
154 HD1 TRP 19 HD1 TRP 19 9.967 2.574 0.575
155 HE1 TRP 19 HE1 TRP 19 10.060 2.599 -1.997
156 HE3 TRP 19 HE3 TRP 19 14.699 0.754 -0.085
157 HZ2 TRP 19 HZ2 TRP 19 11.895 1.933 -4.036
158 HZ3 TRP 19 HZ3 TRP 19 15.547 0.477 -2.378
159 HH2 TRP 19 HH2 TRP 19 14.172 1.055 -4.311
160 H GLY 20 H GLY 20 10.153 1.780 3.034
161 HA2 GLY 20 HA2 GLY 20 7.859 1.703 3.054
162 HA3 GLY 20 HA3 GLY 20 8.007 0.709 1.612
Start of MODEL 12
1 H1 SER 1 H SER 1 3.271 2.909 -1.313
2 HA SER 1 HA SER 1 2.626 0.975 -3.294
3 HB2 SER 1 HB2 SER 1 5.481 1.319 -2.885
4 HB3 SER 1 HB3 SER 1 4.490 1.747 -4.279
5 HG SER 1 HG SER 1 5.217 3.657 -3.521
6 HA PRO 2 HA PRO 2 3.676 -2.845 -1.410
7 HB2 PRO 2 HB2 PRO 2 4.950 -4.158 -3.415
8 HB3 PRO 2 HB3 PRO 2 3.209 -3.856 -3.420
9 HG2 PRO 2 HG2 PRO 2 5.392 -2.367 -4.826
10 HG3 PRO 2 HG3 PRO 2 3.799 -2.853 -5.433
11 HD2 PRO 2 HD2 PRO 2 4.329 -0.337 -4.585
12 HD3 PRO 2 HD3 PRO 2 2.730 -1.087 -4.408
13 H ARG 3 H ARG 3 5.665 -4.506 -1.396
14 HA ARG 3 HA ARG 3 7.734 -3.215 0.013
15 HB2 ARG 3 HB2 ARG 3 7.288 -5.991 -1.005
16 HB3 ARG 3 HB3 ARG 3 8.882 -5.548 -0.410
17 HG2 ARG 3 HG2 ARG 3 7.723 -6.540 1.394
18 HG3 ARG 3 HG3 ARG 3 7.772 -4.806 1.715
19 HD2 ARG 3 HD2 ARG 3 5.508 -4.532 1.077
20 HD3 ARG 3 HD3 ARG 3 5.437 -6.149 0.379
21 HE ARG 3 HE ARG 3 5.040 -7.001 2.469
22 HH11 ARG 3 HH11 ARG 3 6.181 -3.725 2.759
23 HH12 ARG 3 HH12 ARG 3 5.855 -3.624 4.457
24 HH21 ARG 3 HH21 ARG 3 4.607 -6.880 4.705
25 HH22 ARG 3 HH22 ARG 3 4.961 -5.419 5.563
26 H VAL 4 H VAL 4 9.850 -2.748 -0.522
27 HA VAL 4 HA VAL 4 10.611 -3.031 -3.348
28 HB VAL 4 HB VAL 4 10.907 -0.520 -1.695
29 HG11 VAL 4 HG11 VAL 4 11.979 -1.249 -4.411
30 HG12 VAL 4 HG12 VAL 4 11.840 0.415 -3.843
31 HG13 VAL 4 HG13 VAL 4 12.882 -0.724 -2.990
32 HG21 VAL 4 HG21 VAL 4 9.219 -1.225 -4.083
33 HG22 VAL 4 HG22 VAL 4 8.691 -0.630 -2.509
34 HG23 VAL 4 HG23 VAL 4 9.556 0.440 -3.612
35 H CYS 5 H CYS 5 12.706 -3.556 -3.714
36 HA CYS 5 HA CYS 5 14.653 -3.337 -1.556
37 HB2 CYS 5 HB2 CYS 5 13.945 -5.961 -2.885
38 HB3 CYS 5 HB3 CYS 5 15.340 -5.713 -1.840
39 H ILE 6 H ILE 6 16.821 -3.429 -2.252
40 HA ILE 6 HA ILE 6 17.357 -3.718 -5.095
41 HB ILE 6 HB ILE 6 18.452 -1.567 -5.326
42 HG12 ILE 6 HG12 ILE 6 17.436 -0.961 -2.541
43 HG13 ILE 6 HG13 ILE 6 19.112 -1.313 -2.946
44 HG21 ILE 6 HG21 ILE 6 16.520 -0.167 -5.442
45 HG22 ILE 6 HG22 ILE 6 16.015 -1.816 -5.813
46 HG23 ILE 6 HG23 ILE 6 15.684 -1.129 -4.223
47 HD11 ILE 6 HD11 ILE 6 19.353 0.692 -4.135
48 HD12 ILE 6 HD12 ILE 6 17.612 0.964 -4.191
49 HD13 ILE 6 HD13 ILE 6 18.480 1.119 -2.664
50 H ARG 7 H ARG 7 19.816 -3.197 -5.459
51 HA ARG 7 HA ARG 7 21.250 -4.810 -3.505
52 HB2 ARG 7 HB2 ARG 7 21.470 -5.339 -5.898
53 HB3 ARG 7 HB3 ARG 7 22.133 -3.736 -6.190
54 HG2 ARG 7 HG2 ARG 7 24.031 -5.024 -6.097
55 HG3 ARG 7 HG3 ARG 7 23.913 -4.443 -4.434
56 HD2 ARG 7 HD2 ARG 7 24.427 -6.835 -4.522
57 HD3 ARG 7 HD3 ARG 7 22.866 -6.531 -3.760
58 HE ARG 7 HE ARG 7 22.402 -6.997 -6.464
59 HH11 ARG 7 HH11 ARG 7 23.606 -8.713 -3.684
60 HH12 ARG 7 HH12 ARG 7 23.073 -10.262 -4.247
61 HH21 ARG 7 HH21 ARG 7 21.695 -9.031 -7.216
62 HH22 ARG 7 HH22 ARG 7 21.987 -10.442 -6.257
63 H VAL 8 H VAL 8 22.802 -4.081 -2.165
64 HA VAL 8 HA VAL 8 23.778 -1.331 -2.498
65 HB VAL 8 HB VAL 8 22.735 -2.496 0.087
66 HG11 VAL 8 HG11 VAL 8 24.064 0.159 -0.449
67 HG12 VAL 8 HG12 VAL 8 23.310 -0.320 1.072
68 HG13 VAL 8 HG13 VAL 8 24.736 -1.176 0.487
69 HG21 VAL 8 HG21 VAL 8 20.852 -1.770 -1.048
70 HG22 VAL 8 HG22 VAL 8 21.300 -0.340 -0.117
71 HG23 VAL 8 HG23 VAL 8 21.709 -0.441 -1.829
72 H CYS 9 H CYS 9 25.767 -2.140 -3.195
73 HA CYS 9 HA CYS 9 27.295 -3.685 -1.210
74 HB2 CYS 9 HB2 CYS 9 28.012 -3.303 -4.117
75 HB3 CYS 9 HB3 CYS 9 28.679 -4.477 -2.988
76 H ARG 10 H ARG 10 29.035 -2.812 -0.261
77 HA ARG 10 HA ARG 10 29.770 -0.081 -1.032
78 HB2 ARG 10 HB2 ARG 10 30.849 0.024 1.195
79 HB3 ARG 10 HB3 ARG 10 29.131 -0.340 1.287
80 HG2 ARG 10 HG2 ARG 10 29.476 -2.460 2.048
81 HG3 ARG 10 HG3 ARG 10 31.038 -2.614 1.241
82 HD2 ARG 10 HD2 ARG 10 32.161 -1.483 2.915
83 HD3 ARG 10 HD3 ARG 10 30.706 -0.659 3.474
84 HE ARG 10 HE ARG 10 30.614 -3.501 3.848
85 HH11 ARG 10 HH11 ARG 10 31.706 -0.484 5.199
86 HH12 ARG 10 HH12 ARG 10 31.730 -1.073 6.828
87 HH21 ARG 10 HH21 ARG 10 30.641 -4.288 5.989
88 HH22 ARG 10 HH22 ARG 10 31.125 -3.236 7.276
89 H ASN 11 H ASN 11 30.733 -1.887 -2.795
90 HA ASN 11 HA ASN 11 32.614 -2.710 -3.782
91 HB2 ASN 11 HB2 ASN 11 33.974 -0.591 -2.102
92 HB3 ASN 11 HB3 ASN 11 34.622 -1.341 -3.558
93 HD21 ASN 11 HD21 ASN 11 33.015 1.284 -2.354
94 HD22 ASN 11 HD22 ASN 11 32.339 1.894 -3.822
95 H GLY 12 H GLY 12 32.008 -4.541 -2.126
96 HA2 GLY 12 HA2 GLY 12 34.084 -6.066 -1.480
97 HA3 GLY 12 HA3 GLY 12 34.087 -4.951 -0.121
98 H VAL 13 H VAL 13 31.267 -4.657 0.118
99 HA VAL 13 HA VAL 13 30.398 -7.383 0.799
100 HB VAL 13 HB VAL 13 30.070 -4.989 2.612
101 HG11 VAL 13 HG11 VAL 13 29.063 -7.789 2.664
102 HG12 VAL 13 HG12 VAL 13 29.492 -7.020 4.192
103 HG13 VAL 13 HG13 VAL 13 28.268 -6.292 3.152
104 HG21 VAL 13 HG21 VAL 13 31.554 -6.549 4.098
105 HG22 VAL 13 HG22 VAL 13 32.066 -7.207 2.544
106 HG23 VAL 13 HG23 VAL 13 32.298 -5.494 2.897
107 H CYS 14 H CYS 14 28.532 -7.811 -0.157
108 HA CYS 14 HA CYS 14 26.842 -5.635 -1.094
109 HB2 CYS 14 HB2 CYS 14 27.086 -8.548 -1.685
110 HB3 CYS 14 HB3 CYS 14 25.529 -7.777 -1.968
111 H TYR 15 H TYR 15 24.780 -5.230 -0.418
112 HA TYR 15 HA TYR 15 23.586 -6.962 1.609
113 HB2 TYR 15 HB2 TYR 15 24.639 -5.479 3.079
114 HB3 TYR 15 HB3 TYR 15 24.387 -4.096 2.020
115 HD1 TYR 15 HD1 TYR 15 22.852 -2.547 2.750
116 HD2 TYR 15 HD2 TYR 15 22.284 -6.631 3.801
117 HE1 TYR 15 HE1 TYR 15 20.841 -1.933 4.026
118 HE2 TYR 15 HE2 TYR 15 20.270 -6.028 5.078
119 HH TYR 15 HH TYR 15 19.545 -2.982 6.037
120 H ARG 16 H ARG 16 21.360 -6.893 1.682
121 HA ARG 16 HA ARG 16 20.090 -5.605 -0.601
122 HB2 ARG 16 HB2 ARG 16 19.414 -7.854 1.223
123 HB3 ARG 16 HB3 ARG 16 18.073 -6.959 0.520
124 HG2 ARG 16 HG2 ARG 16 18.599 -7.604 -1.637
125 HG3 ARG 16 HG3 ARG 16 20.273 -7.980 -1.223
126 HD2 ARG 16 HD2 ARG 16 18.098 -9.537 0.082
127 HD3 ARG 16 HD3 ARG 16 18.485 -9.883 -1.603
128 HE ARG 16 HE ARG 16 20.795 -9.822 0.093
129 HH11 ARG 16 HH11 ARG 16 18.161 -11.789 -1.055
130 HH12 ARG 16 HH12 ARG 16 18.989 -13.286 -0.781
131 HH21 ARG 16 HH21 ARG 16 21.895 -11.787 0.458
132 HH22 ARG 16 HH22 ARG 16 21.112 -13.284 0.080
133 H ARG 17 H ARG 17 19.197 -3.671 -0.397
134 HA ARG 17 HA ARG 17 18.307 -2.787 2.259
135 HB2 ARG 17 HB2 ARG 17 19.951 -1.325 1.266
136 HB3 ARG 17 HB3 ARG 17 19.022 -1.225 -0.225
137 HG2 ARG 17 HG2 ARG 17 17.556 0.279 0.624
138 HG3 ARG 17 HG3 ARG 17 17.670 -0.368 2.262
139 HD2 ARG 17 HD2 ARG 17 19.744 1.316 0.862
140 HD3 ARG 17 HD3 ARG 17 18.648 1.861 2.130
141 HE ARG 17 HE ARG 17 20.132 -0.346 3.053
142 HH11 ARG 17 HH11 ARG 17 20.510 3.020 2.245
143 HH12 ARG 17 HH12 ARG 17 21.823 3.271 3.346
144 HH21 ARG 17 HH21 ARG 17 21.861 -0.027 4.506
145 HH22 ARG 17 HH22 ARG 17 22.592 1.537 4.631
146 H CYS 18 H CYS 18 16.210 -2.590 2.679
147 HA CYS 18 HA CYS 18 14.336 -2.237 0.442
148 HB2 CYS 18 HB2 CYS 18 13.824 -4.083 2.779
149 HB3 CYS 18 HB3 CYS 18 12.816 -3.865 1.352
150 H TRP 19 H TRP 19 12.400 -1.148 0.949
151 HA TRP 19 HA TRP 19 12.113 -0.044 3.631
152 HB2 TRP 19 HB2 TRP 19 11.834 2.272 2.656
153 HB3 TRP 19 HB3 TRP 19 13.480 1.646 2.647
154 HD1 TRP 19 HD1 TRP 19 10.797 2.952 0.371
155 HE1 TRP 19 HE1 TRP 19 11.639 2.937 -2.061
156 HE3 TRP 19 HE3 TRP 19 15.060 0.203 1.006
157 HZ2 TRP 19 HZ2 TRP 19 13.822 1.897 -3.518
158 HZ3 TRP 19 HZ3 TRP 19 16.470 -0.258 -0.957
159 HH2 TRP 19 HH2 TRP 19 15.862 0.572 -3.171
160 H GLY 20 H GLY 20 10.127 1.723 3.312
161 HA2 GLY 20 HA2 GLY 20 7.843 1.839 3.109
162 HA3 GLY 20 HA3 GLY 20 8.099 1.201 1.492
Start of MODEL 13
1 H1 SER 1 H SER 1 1.235 0.261 -0.207
2 HA SER 1 HA SER 1 1.039 -1.245 -2.694
3 HB2 SER 1 HB2 SER 1 3.392 0.342 -2.656
4 HB3 SER 1 HB3 SER 1 1.904 0.631 -3.557
5 HG SER 1 HG SER 1 1.423 2.166 -2.211
6 HA PRO 2 HA PRO 2 4.124 -4.234 -1.809
7 HB2 PRO 2 HB2 PRO 2 5.483 -4.388 -4.154
8 HB3 PRO 2 HB3 PRO 2 3.845 -5.019 -3.950
9 HG2 PRO 2 HG2 PRO 2 4.740 -2.430 -5.157
10 HG3 PRO 2 HG3 PRO 2 3.498 -3.560 -5.727
11 HD2 PRO 2 HD2 PRO 2 2.895 -1.289 -4.381
12 HD3 PRO 2 HD3 PRO 2 1.918 -2.766 -4.248
13 H ARG 3 H ARG 3 5.949 -4.146 -0.665
14 HA ARG 3 HA ARG 3 7.489 -1.887 -0.291
15 HB2 ARG 3 HB2 ARG 3 8.904 -3.195 1.015
16 HB3 ARG 3 HB3 ARG 3 7.397 -4.098 1.055
17 HG2 ARG 3 HG2 ARG 3 9.756 -4.688 -0.722
18 HG3 ARG 3 HG3 ARG 3 9.314 -5.565 0.745
19 HD2 ARG 3 HD2 ARG 3 7.680 -5.347 -1.780
20 HD3 ARG 3 HD3 ARG 3 8.556 -6.770 -1.219
21 HE ARG 3 HE ARG 3 6.832 -6.120 0.818
22 HH11 ARG 3 HH11 ARG 3 6.544 -6.942 -2.552
23 HH12 ARG 3 HH12 ARG 3 4.982 -7.671 -2.375
24 HH21 ARG 3 HH21 ARG 3 4.776 -7.076 1.064
25 HH22 ARG 3 HH22 ARG 3 3.977 -7.746 -0.318
26 H VAL 4 H VAL 4 9.918 -1.763 -0.712
27 HA VAL 4 HA VAL 4 10.544 -2.650 -3.449
28 HB VAL 4 HB VAL 4 11.094 0.093 -2.306
29 HG11 VAL 4 HG11 VAL 4 11.890 0.534 -4.674
30 HG12 VAL 4 HG12 VAL 4 12.946 -0.450 -3.660
31 HG13 VAL 4 HG13 VAL 4 11.928 -1.217 -4.880
32 HG21 VAL 4 HG21 VAL 4 8.931 0.322 -2.966
33 HG22 VAL 4 HG22 VAL 4 9.706 0.573 -4.531
34 HG23 VAL 4 HG23 VAL 4 9.029 -1.004 -4.125
35 H CYS 5 H CYS 5 12.635 -3.262 -3.832
36 HA CYS 5 HA CYS 5 14.534 -3.048 -1.595
37 HB2 CYS 5 HB2 CYS 5 13.764 -5.491 -3.172
38 HB3 CYS 5 HB3 CYS 5 15.336 -5.377 -2.386
39 H ILE 6 H ILE 6 16.748 -3.025 -2.171
40 HA ILE 6 HA ILE 6 17.407 -2.853 -5.008
41 HB ILE 6 HB ILE 6 18.613 -0.730 -4.728
42 HG12 ILE 6 HG12 ILE 6 17.227 -0.546 -2.046
43 HG13 ILE 6 HG13 ILE 6 18.927 -0.954 -2.253
44 HG21 ILE 6 HG21 ILE 6 16.265 -0.823 -5.561
45 HG22 ILE 6 HG22 ILE 6 15.723 -0.441 -3.927
46 HG23 ILE 6 HG23 ILE 6 16.707 0.716 -4.823
47 HD11 ILE 6 HD11 ILE 6 19.506 1.176 -2.834
48 HD12 ILE 6 HD12 ILE 6 17.903 1.560 -3.463
49 HD13 ILE 6 HD13 ILE 6 18.175 1.493 -1.722
50 H ARG 7 H ARG 7 19.884 -2.357 -5.188
51 HA ARG 7 HA ARG 7 21.209 -4.265 -3.409
52 HB2 ARG 7 HB2 ARG 7 21.516 -4.756 -5.727
53 HB3 ARG 7 HB3 ARG 7 21.969 -3.094 -6.083
54 HG2 ARG 7 HG2 ARG 7 24.032 -3.357 -4.846
55 HG3 ARG 7 HG3 ARG 7 23.569 -4.996 -4.383
56 HD2 ARG 7 HD2 ARG 7 24.972 -5.379 -6.178
57 HD3 ARG 7 HD3 ARG 7 23.383 -5.388 -6.942
58 HE ARG 7 HE ARG 7 24.361 -2.780 -7.043
59 HH11 ARG 7 HH11 ARG 7 25.127 -5.923 -8.331
60 HH12 ARG 7 HH12 ARG 7 25.850 -5.298 -9.777
61 HH21 ARG 7 HH21 ARG 7 25.311 -1.946 -8.942
62 HH22 ARG 7 HH22 ARG 7 25.955 -3.036 -10.122
63 H VAL 8 H VAL 8 23.022 -3.776 -2.214
64 HA VAL 8 HA VAL 8 24.065 -1.050 -2.282
65 HB VAL 8 HB VAL 8 23.011 -2.319 0.249
66 HG11 VAL 8 HG11 VAL 8 23.673 -0.242 1.343
67 HG12 VAL 8 HG12 VAL 8 25.067 -1.045 0.621
68 HG13 VAL 8 HG13 VAL 8 24.345 0.354 -0.175
69 HG21 VAL 8 HG21 VAL 8 21.993 -0.137 -1.531
70 HG22 VAL 8 HG22 VAL 8 21.124 -1.503 -0.831
71 HG23 VAL 8 HG23 VAL 8 21.605 -0.147 0.189
72 H CYS 9 H CYS 9 25.944 -2.069 -3.122
73 HA CYS 9 HA CYS 9 27.410 -3.759 -1.212
74 HB2 CYS 9 HB2 CYS 9 28.075 -3.342 -4.127
75 HB3 CYS 9 HB3 CYS 9 28.687 -4.594 -3.051
76 H ARG 10 H ARG 10 29.160 -2.990 -0.218
77 HA ARG 10 HA ARG 10 30.137 -0.340 -1.003
78 HB2 ARG 10 HB2 ARG 10 30.665 -1.876 1.546
79 HB3 ARG 10 HB3 ARG 10 31.088 -0.199 1.227
80 HG2 ARG 10 HG2 ARG 10 28.236 -0.981 0.990
81 HG3 ARG 10 HG3 ARG 10 28.939 -0.862 2.604
82 HD2 ARG 10 HD2 ARG 10 29.322 1.343 0.619
83 HD3 ARG 10 HD3 ARG 10 27.821 1.223 1.536
84 HE ARG 10 HE ARG 10 30.072 1.075 3.254
85 HH11 ARG 10 HH11 ARG 10 28.175 3.311 1.377
86 HH12 ARG 10 HH12 ARG 10 28.546 4.672 2.383
87 HH21 ARG 10 HH21 ARG 10 30.567 2.859 4.586
88 HH22 ARG 10 HH22 ARG 10 29.908 4.414 4.207
89 H ASN 11 H ASN 11 30.939 -2.400 -2.661
90 HA ASN 11 HA ASN 11 32.771 -3.356 -3.613
91 HB2 ASN 11 HB2 ASN 11 34.569 -1.581 -2.007
92 HB3 ASN 11 HB3 ASN 11 34.683 -2.047 -3.701
93 HD21 ASN 11 HD21 ASN 11 32.608 -1.310 -4.956
94 HD22 ASN 11 HD22 ASN 11 32.200 0.353 -4.732
95 H GLY 12 H GLY 12 32.374 -5.329 -2.448
96 HA2 GLY 12 HA2 GLY 12 34.134 -6.921 -1.567
97 HA3 GLY 12 HA3 GLY 12 34.268 -5.789 -0.229
98 H VAL 13 H VAL 13 31.396 -5.264 -0.132
99 HA VAL 13 HA VAL 13 30.305 -7.868 0.648
100 HB VAL 13 HB VAL 13 30.226 -5.477 2.490
101 HG11 VAL 13 HG11 VAL 13 28.326 -6.758 2.928
102 HG12 VAL 13 HG12 VAL 13 29.174 -8.280 2.653
103 HG13 VAL 13 HG13 VAL 13 29.503 -7.338 4.107
104 HG21 VAL 13 HG21 VAL 13 31.644 -7.221 3.893
105 HG22 VAL 13 HG22 VAL 13 32.122 -7.754 2.281
106 HG23 VAL 13 HG23 VAL 13 32.406 -6.086 2.779
107 H CYS 14 H CYS 14 28.406 -8.074 -0.319
108 HA CYS 14 HA CYS 14 26.929 -5.713 -1.161
109 HB2 CYS 14 HB2 CYS 14 26.912 -8.603 -1.865
110 HB3 CYS 14 HB3 CYS 14 25.400 -7.719 -2.055
111 H TYR 15 H TYR 15 24.993 -5.069 -0.367
112 HA TYR 15 HA TYR 15 23.694 -6.742 1.666
113 HB2 TYR 15 HB2 TYR 15 24.906 -5.222 3.014
114 HB3 TYR 15 HB3 TYR 15 24.544 -3.865 1.952
115 HD1 TYR 15 HD1 TYR 15 22.505 -6.436 3.757
116 HD2 TYR 15 HD2 TYR 15 23.162 -2.314 2.936
117 HE1 TYR 15 HE1 TYR 15 20.577 -5.854 5.169
118 HE2 TYR 15 HE2 TYR 15 21.237 -1.720 4.347
119 HH TYR 15 HH TYR 15 19.055 -4.120 5.583
120 H ARG 16 H ARG 16 21.483 -6.619 1.734
121 HA ARG 16 HA ARG 16 20.225 -5.335 -0.554
122 HB2 ARG 16 HB2 ARG 16 19.494 -7.505 1.341
123 HB3 ARG 16 HB3 ARG 16 18.175 -6.579 0.637
124 HG2 ARG 16 HG2 ARG 16 19.157 -7.088 -1.618
125 HG3 ARG 16 HG3 ARG 16 20.256 -8.202 -0.801
126 HD2 ARG 16 HD2 ARG 16 17.304 -8.400 -0.359
127 HD3 ARG 16 HD3 ARG 16 18.031 -9.092 -1.809
128 HE ARG 16 HE ARG 16 19.532 -10.047 0.279
129 HH11 ARG 16 HH11 ARG 16 16.176 -10.142 -0.642
130 HH12 ARG 16 HH12 ARG 16 15.878 -11.674 0.111
131 HH21 ARG 16 HH21 ARG 16 19.153 -12.065 1.273
132 HH22 ARG 16 HH22 ARG 16 17.572 -12.766 1.201
133 H ARG 17 H ARG 17 19.063 -3.522 -0.455
134 HA ARG 17 HA ARG 17 18.332 -2.492 2.208
135 HB2 ARG 17 HB2 ARG 17 20.007 -1.064 1.289
136 HB3 ARG 17 HB3 ARG 17 19.212 -1.032 -0.279
137 HG2 ARG 17 HG2 ARG 17 17.702 0.533 0.360
138 HG3 ARG 17 HG3 ARG 17 17.669 -0.023 2.034
139 HD2 ARG 17 HD2 ARG 17 19.877 1.558 0.721
140 HD3 ARG 17 HD3 ARG 17 18.691 2.182 1.867
141 HE ARG 17 HE ARG 17 20.071 0.007 3.013
142 HH11 ARG 17 HH11 ARG 17 20.536 3.332 2.089
143 HH12 ARG 17 HH12 ARG 17 21.756 3.629 3.283
144 HH21 ARG 17 HH21 ARG 17 21.676 0.387 4.590
145 HH22 ARG 17 HH22 ARG 17 22.404 1.953 4.704
146 H CYS 18 H CYS 18 16.225 -2.441 2.579
147 HA CYS 18 HA CYS 18 14.400 -1.885 0.342
148 HB2 CYS 18 HB2 CYS 18 13.785 -3.896 2.508
149 HB3 CYS 18 HB3 CYS 18 12.876 -3.590 1.031
150 H TRP 19 H TRP 19 12.636 -0.628 0.818
151 HA TRP 19 HA TRP 19 12.363 0.286 3.602
152 HB2 TRP 19 HB2 TRP 19 11.973 2.572 2.794
153 HB3 TRP 19 HB3 TRP 19 13.569 1.995 2.321
154 HD1 TRP 19 HD1 TRP 19 10.229 3.089 0.873
155 HE1 TRP 19 HE1 TRP 19 10.457 3.315 -1.681
156 HE3 TRP 19 HE3 TRP 19 14.870 1.024 0.286
157 HZ2 TRP 19 HZ2 TRP 19 12.353 2.700 -3.680
158 HZ3 TRP 19 HZ3 TRP 19 15.818 0.880 -1.980
159 HH2 TRP 19 HH2 TRP 19 14.584 1.701 -3.920
160 H GLY 20 H GLY 20 10.246 1.996 3.315
161 HA2 GLY 20 HA2 GLY 20 8.079 0.126 2.953
162 HA3 GLY 20 HA3 GLY 20 7.944 1.788 3.509
Start of MODEL 14
1 H1 SER 1 H SER 1 1.061 -0.328 -1.808
2 HA SER 1 HA SER 1 1.425 -2.054 -4.141
3 HB2 SER 1 HB2 SER 1 2.818 -0.677 -5.274
4 HB3 SER 1 HB3 SER 1 2.069 0.603 -4.319
5 HG SER 1 HG SER 1 3.789 0.638 -2.987
6 HA PRO 2 HA PRO 2 4.138 -4.358 -1.578
7 HB2 PRO 2 HB2 PRO 2 6.061 -5.153 -3.323
8 HB3 PRO 2 HB3 PRO 2 4.419 -5.807 -3.339
9 HG2 PRO 2 HG2 PRO 2 5.629 -3.682 -5.066
10 HG3 PRO 2 HG3 PRO 2 4.566 -5.025 -5.524
11 HD2 PRO 2 HD2 PRO 2 3.657 -2.496 -5.197
12 HD3 PRO 2 HD3 PRO 2 2.664 -3.922 -4.835
13 H ARG 3 H ARG 3 6.278 -4.470 -0.640
14 HA ARG 3 HA ARG 3 7.387 -1.980 -0.044
15 HB2 ARG 3 HB2 ARG 3 8.960 -3.124 1.250
16 HB3 ARG 3 HB3 ARG 3 7.581 -4.215 1.224
17 HG2 ARG 3 HG2 ARG 3 10.012 -4.440 -0.539
18 HG3 ARG 3 HG3 ARG 3 9.709 -5.387 0.918
19 HD2 ARG 3 HD2 ARG 3 7.553 -6.132 -0.193
20 HD3 ARG 3 HD3 ARG 3 8.191 -5.425 -1.677
21 HE ARG 3 HE ARG 3 10.042 -7.233 -0.485
22 HH11 ARG 3 HH11 ARG 3 7.155 -7.063 -2.424
23 HH12 ARG 3 HH12 ARG 3 7.437 -8.581 -3.210
24 HH21 ARG 3 HH21 ARG 3 10.424 -9.233 -1.513
25 HH22 ARG 3 HH22 ARG 3 9.296 -9.815 -2.690
26 H VAL 4 H VAL 4 9.983 -1.825 -0.258
27 HA VAL 4 HA VAL 4 10.666 -2.223 -3.093
28 HB VAL 4 HB VAL 4 11.161 0.298 -1.502
29 HG11 VAL 4 HG11 VAL 4 13.037 0.035 -2.890
30 HG12 VAL 4 HG12 VAL 4 12.066 -0.580 -4.228
31 HG13 VAL 4 HG13 VAL 4 11.967 1.122 -3.776
32 HG21 VAL 4 HG21 VAL 4 9.722 0.506 -4.027
33 HG22 VAL 4 HG22 VAL 4 8.872 -0.462 -2.823
34 HG23 VAL 4 HG23 VAL 4 9.345 1.195 -2.448
35 H CYS 5 H CYS 5 12.782 -2.715 -3.532
36 HA CYS 5 HA CYS 5 14.720 -2.686 -1.345
37 HB2 CYS 5 HB2 CYS 5 13.972 -5.161 -2.915
38 HB3 CYS 5 HB3 CYS 5 15.391 -5.036 -1.881
39 H ILE 6 H ILE 6 16.906 -2.796 -2.032
40 HA ILE 6 HA ILE 6 17.427 -2.722 -4.900
41 HB ILE 6 HB ILE 6 18.668 -0.643 -4.810
42 HG12 ILE 6 HG12 ILE 6 17.751 -0.483 -1.930
43 HG13 ILE 6 HG13 ILE 6 19.403 -0.757 -2.472
44 HG21 ILE 6 HG21 ILE 6 16.252 -0.593 -5.327
45 HG22 ILE 6 HG22 ILE 6 15.922 -0.249 -3.629
46 HG23 ILE 6 HG23 ILE 6 16.830 0.907 -4.603
47 HD11 ILE 6 HD11 ILE 6 18.997 1.553 -1.749
48 HD12 ILE 6 HD12 ILE 6 19.491 1.447 -3.439
49 HD13 ILE 6 HD13 ILE 6 17.798 1.724 -3.032
50 H ARG 7 H ARG 7 19.897 -2.386 -5.239
51 HA ARG 7 HA ARG 7 21.226 -4.304 -3.487
52 HB2 ARG 7 HB2 ARG 7 21.413 -4.813 -5.815
53 HB3 ARG 7 HB3 ARG 7 21.927 -3.174 -6.194
54 HG2 ARG 7 HG2 ARG 7 24.057 -3.507 -5.314
55 HG3 ARG 7 HG3 ARG 7 23.554 -4.925 -4.391
56 HD2 ARG 7 HD2 ARG 7 24.618 -5.971 -6.111
57 HD3 ARG 7 HD3 ARG 7 23.006 -5.845 -6.814
58 HE ARG 7 HE ARG 7 25.379 -4.367 -7.600
59 HH11 ARG 7 HH11 ARG 7 21.926 -4.740 -7.845
60 HH12 ARG 7 HH12 ARG 7 21.804 -3.853 -9.328
61 HH21 ARG 7 HH21 ARG 7 25.231 -3.197 -9.553
62 HH22 ARG 7 HH22 ARG 7 23.685 -2.976 -10.299
63 H VAL 8 H VAL 8 22.810 -3.791 -2.104
64 HA VAL 8 HA VAL 8 24.057 -1.135 -2.309
65 HB VAL 8 HB VAL 8 22.982 -2.385 0.222
66 HG11 VAL 8 HG11 VAL 8 23.796 -0.341 1.334
67 HG12 VAL 8 HG12 VAL 8 25.108 -1.315 0.669
68 HG13 VAL 8 HG13 VAL 8 24.579 0.143 -0.170
69 HG21 VAL 8 HG21 VAL 8 21.204 -1.372 -0.986
70 HG22 VAL 8 HG22 VAL 8 21.658 -0.245 0.292
71 HG23 VAL 8 HG23 VAL 8 22.183 0.045 -1.366
72 H CYS 9 H CYS 9 25.943 -2.061 -3.132
73 HA CYS 9 HA CYS 9 27.385 -3.872 -1.313
74 HB2 CYS 9 HB2 CYS 9 27.994 -3.374 -4.230
75 HB3 CYS 9 HB3 CYS 9 28.647 -4.646 -3.202
76 H ARG 10 H ARG 10 29.244 -3.232 -0.399
77 HA ARG 10 HA ARG 10 30.197 -0.532 -1.027
78 HB2 ARG 10 HB2 ARG 10 29.546 -1.289 1.347
79 HB3 ARG 10 HB3 ARG 10 31.056 -2.189 1.332
80 HG2 ARG 10 HG2 ARG 10 32.067 0.127 0.636
81 HG3 ARG 10 HG3 ARG 10 30.599 0.748 1.392
82 HD2 ARG 10 HD2 ARG 10 32.448 -1.199 2.751
83 HD3 ARG 10 HD3 ARG 10 32.628 0.550 2.888
84 HE ARG 10 HE ARG 10 30.704 -1.090 4.220
85 HH11 ARG 10 HH11 ARG 10 31.288 2.091 2.930
86 HH12 ARG 10 HH12 ARG 10 30.159 2.870 3.989
87 HH21 ARG 10 HH21 ARG 10 29.215 -0.076 5.619
88 HH22 ARG 10 HH22 ARG 10 28.981 1.637 5.519
89 H ASN 11 H ASN 11 30.915 -2.304 -2.940
90 HA ASN 11 HA ASN 11 32.669 -3.239 -4.056
91 HB2 ASN 11 HB2 ASN 11 33.911 -1.034 -2.451
92 HB3 ASN 11 HB3 ASN 11 34.943 -2.099 -3.400
93 HD21 ASN 11 HD21 ASN 11 35.181 -1.702 -5.497
94 HD22 ASN 11 HD22 ASN 11 34.265 -0.554 -6.406
95 H GLY 12 H GLY 12 31.821 -4.647 -1.720
96 HA2 GLY 12 HA2 GLY 12 33.925 -6.500 -1.464
97 HA3 GLY 12 HA3 GLY 12 33.916 -5.462 -0.046
98 H VAL 13 H VAL 13 31.103 -5.084 0.121
99 HA VAL 13 HA VAL 13 30.105 -7.808 0.589
100 HB VAL 13 HB VAL 13 29.857 -5.552 2.583
101 HG11 VAL 13 HG11 VAL 13 27.997 -6.776 3.044
102 HG12 VAL 13 HG12 VAL 13 28.666 -8.257 2.359
103 HG13 VAL 13 HG13 VAL 13 29.169 -7.721 3.962
104 HG21 VAL 13 HG21 VAL 13 32.038 -6.182 2.901
105 HG22 VAL 13 HG22 VAL 13 31.221 -7.339 3.952
106 HG23 VAL 13 HG23 VAL 13 31.758 -7.832 2.346
107 H CYS 14 H CYS 14 28.220 -8.078 -0.390
108 HA CYS 14 HA CYS 14 26.670 -5.761 -1.219
109 HB2 CYS 14 HB2 CYS 14 26.727 -8.656 -1.948
110 HB3 CYS 14 HB3 CYS 14 25.242 -7.753 -2.229
111 H TYR 15 H TYR 15 24.713 -5.190 -0.439
112 HA TYR 15 HA TYR 15 23.364 -6.974 1.453
113 HB2 TYR 15 HB2 TYR 15 24.477 -5.651 3.015
114 HB3 TYR 15 HB3 TYR 15 24.374 -4.207 2.015
115 HD1 TYR 15 HD1 TYR 15 22.022 -6.617 3.652
116 HD2 TYR 15 HD2 TYR 15 22.952 -2.561 2.764
117 HE1 TYR 15 HE1 TYR 15 20.040 -5.893 4.914
118 HE2 TYR 15 HE2 TYR 15 20.972 -1.826 4.025
119 HH TYR 15 HH TYR 15 19.146 -3.987 6.005
120 H ARG 16 H ARG 16 21.150 -6.784 1.507
121 HA ARG 16 HA ARG 16 19.975 -5.307 -0.707
122 HB2 ARG 16 HB2 ARG 16 19.142 -7.576 1.022
123 HB3 ARG 16 HB3 ARG 16 17.867 -6.566 0.355
124 HG2 ARG 16 HG2 ARG 16 18.652 -7.007 -1.893
125 HG3 ARG 16 HG3 ARG 16 19.999 -7.953 -1.257
126 HD2 ARG 16 HD2 ARG 16 17.097 -8.611 -0.776
127 HD3 ARG 16 HD3 ARG 16 18.062 -9.308 -2.077
128 HE ARG 16 HE ARG 16 19.366 -9.681 0.398
129 HH11 ARG 16 HH11 ARG 16 16.633 -10.815 -1.436
130 HH12 ARG 16 HH12 ARG 16 16.624 -12.383 -0.700
131 HH21 ARG 16 HH21 ARG 16 19.365 -11.743 1.374
132 HH22 ARG 16 HH22 ARG 16 18.178 -12.909 0.899
133 H ARG 17 H ARG 17 19.359 -3.280 -0.374
134 HA ARG 17 HA ARG 17 18.536 -2.434 2.301
135 HB2 ARG 17 HB2 ARG 17 20.140 -0.970 1.360
136 HB3 ARG 17 HB3 ARG 17 19.317 -0.939 -0.193
137 HG2 ARG 17 HG2 ARG 17 19.020 1.152 1.015
138 HG3 ARG 17 HG3 ARG 17 17.480 0.320 0.789
139 HD2 ARG 17 HD2 ARG 17 17.551 1.157 3.028
140 HD3 ARG 17 HD3 ARG 17 17.718 -0.597 3.094
141 HE ARG 17 HE ARG 17 19.759 -0.302 4.058
142 HH11 ARG 17 HH11 ARG 17 18.917 2.608 2.344
143 HH12 ARG 17 HH12 ARG 17 20.307 3.487 2.889
144 HH21 ARG 17 HH21 ARG 17 21.594 0.844 4.782
145 HH22 ARG 17 HH22 ARG 17 21.830 2.482 4.275
146 H CYS 18 H CYS 18 16.457 -2.415 2.807
147 HA CYS 18 HA CYS 18 14.493 -1.796 0.705
148 HB2 CYS 18 HB2 CYS 18 14.043 -3.810 2.912
149 HB3 CYS 18 HB3 CYS 18 12.982 -3.464 1.550
150 H TRP 19 H TRP 19 12.566 -0.769 1.418
151 HA TRP 19 HA TRP 19 12.422 0.124 4.178
152 HB2 TRP 19 HB2 TRP 19 12.278 2.512 3.541
153 HB3 TRP 19 HB3 TRP 19 13.859 1.819 3.189
154 HD1 TRP 19 HD1 TRP 19 10.919 3.505 1.544
155 HE1 TRP 19 HE1 TRP 19 11.407 3.829 -0.962
156 HE3 TRP 19 HE3 TRP 19 15.138 0.643 1.163
157 HZ2 TRP 19 HZ2 TRP 19 13.326 2.982 -2.851
158 HZ3 TRP 19 HZ3 TRP 19 16.239 0.452 -1.029
159 HH2 TRP 19 HH2 TRP 19 15.350 1.598 -2.993
160 H GLY 20 H GLY 20 10.505 2.047 3.989
161 HA2 GLY 20 HA2 GLY 20 8.160 0.529 3.560
162 HA3 GLY 20 HA3 GLY 20 8.222 2.258 3.868
Start of MODEL 15
1 H1 SER 1 H SER 1 1.724 -3.574 1.370
2 HA SER 1 HA SER 1 0.812 -2.163 -1.048
3 HB2 SER 1 HB2 SER 1 2.879 -0.628 0.106
4 HB3 SER 1 HB3 SER 1 1.172 -0.204 -0.022
5 HG SER 1 HG SER 1 2.380 -1.654 2.100
6 HA PRO 2 HA PRO 2 4.351 -3.704 -3.130
7 HB2 PRO 2 HB2 PRO 2 5.088 -1.597 -4.676
8 HB3 PRO 2 HB3 PRO 2 3.639 -2.560 -4.991
9 HG2 PRO 2 HG2 PRO 2 3.892 0.089 -3.620
10 HG3 PRO 2 HG3 PRO 2 2.689 -0.446 -4.808
11 HD2 PRO 2 HD2 PRO 2 2.178 -0.370 -2.150
12 HD3 PRO 2 HD3 PRO 2 1.447 -1.576 -3.229
13 H ARG 3 H ARG 3 6.145 -4.110 -1.982
14 HA ARG 3 HA ARG 3 7.561 -2.044 -0.567
15 HB2 ARG 3 HB2 ARG 3 7.904 -5.001 -0.910
16 HB3 ARG 3 HB3 ARG 3 9.218 -4.041 -0.242
17 HG2 ARG 3 HG2 ARG 3 7.567 -3.184 1.459
18 HG3 ARG 3 HG3 ARG 3 6.457 -4.425 0.874
19 HD2 ARG 3 HD2 ARG 3 7.757 -6.154 1.678
20 HD3 ARG 3 HD3 ARG 3 9.232 -5.188 1.665
21 HE ARG 3 HE ARG 3 7.361 -4.165 3.538
22 HH11 ARG 3 HH11 ARG 3 9.651 -6.741 3.041
23 HH12 ARG 3 HH12 ARG 3 9.958 -6.969 4.731
24 HH21 ARG 3 HH21 ARG 3 7.758 -4.456 5.765
25 HH22 ARG 3 HH22 ARG 3 8.880 -5.669 6.279
26 H VAL 4 H VAL 4 9.991 -1.892 -0.811
27 HA VAL 4 HA VAL 4 10.813 -2.104 -3.627
28 HB VAL 4 HB VAL 4 11.217 0.311 -1.858
29 HG11 VAL 4 HG11 VAL 4 13.201 0.057 -3.124
30 HG12 VAL 4 HG12 VAL 4 12.302 -0.372 -4.580
31 HG13 VAL 4 HG13 VAL 4 12.238 1.277 -3.958
32 HG21 VAL 4 HG21 VAL 4 8.981 0.218 -2.775
33 HG22 VAL 4 HG22 VAL 4 9.907 1.473 -3.600
34 HG23 VAL 4 HG23 VAL 4 9.625 -0.079 -4.390
35 H CYS 5 H CYS 5 12.882 -2.742 -3.963
36 HA CYS 5 HA CYS 5 14.777 -2.732 -1.746
37 HB2 CYS 5 HB2 CYS 5 13.951 -5.243 -3.216
38 HB3 CYS 5 HB3 CYS 5 15.339 -5.129 -2.139
39 H ILE 6 H ILE 6 16.954 -2.902 -2.388
40 HA ILE 6 HA ILE 6 17.554 -3.088 -5.228
41 HB ILE 6 HB ILE 6 18.778 -0.998 -5.321
42 HG12 ILE 6 HG12 ILE 6 17.737 -0.491 -2.525
43 HG13 ILE 6 HG13 ILE 6 19.402 -0.894 -2.928
44 HG21 ILE 6 HG21 ILE 6 16.343 -1.073 -5.874
45 HG22 ILE 6 HG22 ILE 6 16.014 -0.448 -4.258
46 HG23 ILE 6 HG23 ILE 6 16.936 0.521 -5.407
47 HD11 ILE 6 HD11 ILE 6 18.925 1.533 -2.513
48 HD12 ILE 6 HD12 ILE 6 19.722 1.163 -4.042
49 HD13 ILE 6 HD13 ILE 6 17.996 1.527 -4.012
50 H ARG 7 H ARG 7 20.047 -2.706 -5.506
51 HA ARG 7 HA ARG 7 21.327 -4.495 -3.600
52 HB2 ARG 7 HB2 ARG 7 21.644 -5.008 -5.938
53 HB3 ARG 7 HB3 ARG 7 22.232 -3.382 -6.259
54 HG2 ARG 7 HG2 ARG 7 24.149 -3.866 -4.725
55 HG3 ARG 7 HG3 ARG 7 23.594 -5.540 -4.669
56 HD2 ARG 7 HD2 ARG 7 23.975 -4.280 -7.333
57 HD3 ARG 7 HD3 ARG 7 25.414 -4.717 -6.412
58 HE ARG 7 HE ARG 7 24.887 -6.959 -6.678
59 HH11 ARG 7 HH11 ARG 7 22.342 -4.934 -7.920
60 HH12 ARG 7 HH12 ARG 7 21.543 -6.226 -8.754
61 HH21 ARG 7 HH21 ARG 7 23.844 -8.668 -7.772
62 HH22 ARG 7 HH22 ARG 7 22.398 -8.349 -8.668
63 H VAL 8 H VAL 8 22.915 -3.938 -2.210
64 HA VAL 8 HA VAL 8 24.058 -1.241 -2.378
65 HB VAL 8 HB VAL 8 22.872 -2.444 0.127
66 HG11 VAL 8 HG11 VAL 8 23.544 -0.351 1.217
67 HG12 VAL 8 HG12 VAL 8 24.936 -1.256 0.621
68 HG13 VAL 8 HG13 VAL 8 24.356 0.154 -0.266
69 HG21 VAL 8 HG21 VAL 8 21.083 -1.568 -1.089
70 HG22 VAL 8 HG22 VAL 8 21.531 -0.254 -0.002
71 HG23 VAL 8 HG23 VAL 8 22.034 -0.210 -1.692
72 H CYS 9 H CYS 9 25.999 -2.184 -3.073
73 HA CYS 9 HA CYS 9 27.365 -3.898 -1.109
74 HB2 CYS 9 HB2 CYS 9 28.180 -3.446 -3.981
75 HB3 CYS 9 HB3 CYS 9 28.752 -4.700 -2.886
76 H ARG 10 H ARG 10 29.157 -3.205 -0.100
77 HA ARG 10 HA ARG 10 30.079 -0.491 -0.711
78 HB2 ARG 10 HB2 ARG 10 31.154 -0.613 1.538
79 HB3 ARG 10 HB3 ARG 10 29.404 -0.785 1.576
80 HG2 ARG 10 HG2 ARG 10 29.551 -3.117 1.963
81 HG3 ARG 10 HG3 ARG 10 31.280 -3.132 1.608
82 HD2 ARG 10 HD2 ARG 10 30.905 -3.261 4.003
83 HD3 ARG 10 HD3 ARG 10 31.686 -1.737 3.584
84 HE ARG 10 HE ARG 10 28.957 -1.259 3.616
85 HH11 ARG 10 HH11 ARG 10 31.432 -2.246 5.856
86 HH12 ARG 10 HH12 ARG 10 30.648 -1.546 7.233
87 HH21 ARG 10 HH21 ARG 10 27.915 -0.332 5.422
88 HH22 ARG 10 HH22 ARG 10 28.647 -0.458 6.985
89 H ASN 11 H ASN 11 30.974 -2.180 -2.577
90 HA ASN 11 HA ASN 11 32.814 -3.065 -3.588
91 HB2 ASN 11 HB2 ASN 11 34.143 -1.092 -1.721
92 HB3 ASN 11 HB3 ASN 11 34.972 -1.916 -3.039
93 HD21 ASN 11 HD21 ASN 11 33.703 -1.729 -5.186
94 HD22 ASN 11 HD22 ASN 11 33.171 -0.134 -5.582
95 H GLY 12 H GLY 12 31.954 -4.907 -1.961
96 HA2 GLY 12 HA2 GLY 12 33.900 -6.675 -1.454
97 HA3 GLY 12 HA3 GLY 12 33.976 -5.666 -0.018
98 H VAL 13 H VAL 13 31.301 -5.140 0.419
99 HA VAL 13 HA VAL 13 30.178 -7.829 0.867
100 HB VAL 13 HB VAL 13 29.918 -5.472 2.738
101 HG11 VAL 13 HG11 VAL 13 29.352 -7.868 4.055
102 HG12 VAL 13 HG12 VAL 13 28.205 -6.619 3.572
103 HG13 VAL 13 HG13 VAL 13 28.525 -7.983 2.501
104 HG21 VAL 13 HG21 VAL 13 31.290 -7.213 4.193
105 HG22 VAL 13 HG22 VAL 13 31.871 -7.706 2.602
106 HG23 VAL 13 HG23 VAL 13 32.090 -6.042 3.144
107 H CYS 14 H CYS 14 28.324 -8.113 -0.163
108 HA CYS 14 HA CYS 14 26.798 -5.812 -1.080
109 HB2 CYS 14 HB2 CYS 14 26.898 -8.711 -1.761
110 HB3 CYS 14 HB3 CYS 14 25.388 -7.854 -2.052
111 H TYR 15 H TYR 15 24.773 -5.272 -0.416
112 HA TYR 15 HA TYR 15 23.400 -6.998 1.503
113 HB2 TYR 15 HB2 TYR 15 24.511 -5.633 3.047
114 HB3 TYR 15 HB3 TYR 15 24.361 -4.201 2.034
115 HD1 TYR 15 HD1 TYR 15 22.910 -2.593 2.802
116 HD2 TYR 15 HD2 TYR 15 22.068 -6.674 3.661
117 HE1 TYR 15 HE1 TYR 15 20.907 -1.910 4.056
118 HE2 TYR 15 HE2 TYR 15 20.062 -6.003 4.916
119 HH TYR 15 HH TYR 15 18.673 -4.299 5.392
120 H ARG 16 H ARG 16 21.181 -6.782 1.522
121 HA ARG 16 HA ARG 16 20.066 -5.337 -0.749
122 HB2 ARG 16 HB2 ARG 16 19.193 -7.602 0.968
123 HB3 ARG 16 HB3 ARG 16 17.934 -6.599 0.261
124 HG2 ARG 16 HG2 ARG 16 18.769 -7.052 -1.961
125 HG3 ARG 16 HG3 ARG 16 20.116 -7.975 -1.291
126 HD2 ARG 16 HD2 ARG 16 18.208 -9.357 -2.145
127 HD3 ARG 16 HD3 ARG 16 18.654 -9.662 -0.467
128 HE ARG 16 HE ARG 16 16.577 -7.725 -0.669
129 HH11 ARG 16 HH11 ARG 16 17.226 -11.143 -0.799
130 HH12 ARG 16 HH12 ARG 16 15.630 -11.597 -0.302
131 HH21 ARG 16 HH21 ARG 16 14.473 -8.310 -0.014
132 HH22 ARG 16 HH22 ARG 16 14.064 -9.985 0.144
133 H ARG 17 H ARG 17 19.260 -3.369 -0.506
134 HA ARG 17 HA ARG 17 18.366 -2.519 2.160
135 HB2 ARG 17 HB2 ARG 17 20.117 -1.128 1.243
136 HB3 ARG 17 HB3 ARG 17 19.219 -0.917 -0.254
137 HG2 ARG 17 HG2 ARG 17 17.830 0.639 0.631
138 HG3 ARG 17 HG3 ARG 17 17.882 -0.072 2.246
139 HD2 ARG 17 HD2 ARG 17 20.072 1.535 0.934
140 HD3 ARG 17 HD3 ARG 17 18.991 2.098 2.209
141 HE ARG 17 HE ARG 17 20.332 -0.227 3.064
142 HH11 ARG 17 HH11 ARG 17 20.913 3.140 2.393
143 HH12 ARG 17 HH12 ARG 17 22.223 3.273 3.519
144 HH21 ARG 17 HH21 ARG 17 22.056 -0.064 4.549
145 HH22 ARG 17 HH22 ARG 17 22.873 1.450 4.744
146 H CYS 18 H CYS 18 16.273 -2.222 2.541
147 HA CYS 18 HA CYS 18 14.477 -1.672 0.282
148 HB2 CYS 18 HB2 CYS 18 13.803 -3.593 2.516
149 HB3 CYS 18 HB3 CYS 18 12.851 -3.257 1.074
150 H TRP 19 H TRP 19 12.582 -0.512 0.802
151 HA TRP 19 HA TRP 19 12.293 0.483 3.526
152 HB2 TRP 19 HB2 TRP 19 12.160 2.852 2.660
153 HB3 TRP 19 HB3 TRP 19 13.771 2.140 2.650
154 HD1 TRP 19 HD1 TRP 19 11.208 3.696 0.392
155 HE1 TRP 19 HE1 TRP 19 12.100 3.751 -2.022
156 HE3 TRP 19 HE3 TRP 19 15.306 0.694 0.971
157 HZ2 TRP 19 HZ2 TRP 19 14.255 2.666 -3.487
158 HZ3 TRP 19 HZ3 TRP 19 16.731 0.253 -0.986
159 HH2 TRP 19 HH2 TRP 19 16.214 1.219 -3.168
160 H GLY 20 H GLY 20 10.411 2.369 3.247
161 HA2 GLY 20 HA2 GLY 20 8.148 0.818 2.266
162 HA3 GLY 20 HA3 GLY 20 8.069 2.263 3.264
Start of MODEL 16
1 H1 SER 1 H SER 1 0.949 0.035 -0.902
2 HA SER 1 HA SER 1 1.117 -1.561 -3.331
3 HB2 SER 1 HB2 SER 1 3.328 -0.026 -3.438
4 HB3 SER 1 HB3 SER 1 1.741 0.545 -3.953
5 HG SER 1 HG SER 1 3.091 1.822 -2.339
6 HA PRO 2 HA PRO 2 4.160 -4.414 -1.977
7 HB2 PRO 2 HB2 PRO 2 5.798 -4.592 -4.134
8 HB3 PRO 2 HB3 PRO 2 4.167 -5.273 -4.108
9 HG2 PRO 2 HG2 PRO 2 5.124 -2.692 -5.285
10 HG3 PRO 2 HG3 PRO 2 3.996 -3.881 -5.963
11 HD2 PRO 2 HD2 PRO 2 3.164 -1.593 -4.777
12 HD3 PRO 2 HD3 PRO 2 2.224 -3.097 -4.713
13 H ARG 3 H ARG 3 6.143 -4.541 -0.991
14 HA ARG 3 HA ARG 3 7.436 -2.198 -0.214
15 HB2 ARG 3 HB2 ARG 3 8.089 -5.105 -0.054
16 HB3 ARG 3 HB3 ARG 3 9.359 -3.945 0.312
17 HG2 ARG 3 HG2 ARG 3 8.317 -3.188 2.206
18 HG3 ARG 3 HG3 ARG 3 6.710 -3.636 1.631
19 HD2 ARG 3 HD2 ARG 3 8.853 -5.597 2.440
20 HD3 ARG 3 HD3 ARG 3 7.541 -5.059 3.489
21 HE ARG 3 HE ARG 3 7.375 -6.959 1.336
22 HH11 ARG 3 HH11 ARG 3 5.611 -4.696 3.308
23 HH12 ARG 3 HH12 ARG 3 4.083 -5.474 3.063
24 HH21 ARG 3 HH21 ARG 3 5.369 -7.992 1.006
25 HH22 ARG 3 HH22 ARG 3 3.946 -7.350 1.754
26 H VAL 4 H VAL 4 9.986 -2.086 -0.479
27 HA VAL 4 HA VAL 4 10.696 -2.450 -3.304
28 HB VAL 4 HB VAL 4 11.065 0.123 -1.763
29 HG11 VAL 4 HG11 VAL 4 12.005 -0.726 -4.494
30 HG12 VAL 4 HG12 VAL 4 11.931 0.957 -3.974
31 HG13 VAL 4 HG13 VAL 4 12.983 -0.180 -3.132
32 HG21 VAL 4 HG21 VAL 4 9.568 1.096 -3.416
33 HG22 VAL 4 HG22 VAL 4 9.397 -0.471 -4.206
34 HG23 VAL 4 HG23 VAL 4 8.774 -0.234 -2.573
35 H CYS 5 H CYS 5 12.784 -3.009 -3.668
36 HA CYS 5 HA CYS 5 14.694 -2.828 -1.451
37 HB2 CYS 5 HB2 CYS 5 14.001 -5.329 -2.997
38 HB3 CYS 5 HB3 CYS 5 15.470 -5.166 -2.042
39 H ILE 6 H ILE 6 16.891 -2.824 -2.079
40 HA ILE 6 HA ILE 6 17.468 -2.724 -4.941
41 HB ILE 6 HB ILE 6 18.681 -0.626 -4.777
42 HG12 ILE 6 HG12 ILE 6 17.657 -0.531 -1.931
43 HG13 ILE 6 HG13 ILE 6 19.333 -0.767 -2.415
44 HG21 ILE 6 HG21 ILE 6 15.879 -0.331 -3.703
45 HG22 ILE 6 HG22 ILE 6 16.799 0.889 -4.584
46 HG23 ILE 6 HG23 ILE 6 16.300 -0.595 -5.396
47 HD11 ILE 6 HD11 ILE 6 17.870 1.665 -2.036
48 HD12 ILE 6 HD12 ILE 6 19.597 1.423 -2.298
49 HD13 ILE 6 HD13 ILE 6 18.510 1.584 -3.677
50 H ARG 7 H ARG 7 19.936 -2.336 -5.231
51 HA ARG 7 HA ARG 7 21.274 -4.245 -3.470
52 HB2 ARG 7 HB2 ARG 7 21.474 -4.756 -5.801
53 HB3 ARG 7 HB3 ARG 7 21.990 -3.117 -6.175
54 HG2 ARG 7 HG2 ARG 7 24.086 -3.456 -5.068
55 HG3 ARG 7 HG3 ARG 7 23.563 -5.031 -4.468
56 HD2 ARG 7 HD2 ARG 7 23.803 -4.338 -7.390
57 HD3 ARG 7 HD3 ARG 7 25.085 -5.108 -6.456
58 HE ARG 7 HE ARG 7 22.663 -6.554 -6.209
59 HH11 ARG 7 HH11 ARG 7 25.264 -5.909 -8.431
60 HH12 ARG 7 HH12 ARG 7 25.103 -7.420 -9.263
61 HH21 ARG 7 HH21 ARG 7 22.440 -8.546 -7.297
62 HH22 ARG 7 HH22 ARG 7 23.495 -8.919 -8.618
63 H VAL 8 H VAL 8 22.895 -3.721 -2.121
64 HA VAL 8 HA VAL 8 24.099 -1.050 -2.327
65 HB VAL 8 HB VAL 8 23.040 -2.268 0.228
66 HG11 VAL 8 HG11 VAL 8 25.140 -1.085 0.595
67 HG12 VAL 8 HG12 VAL 8 24.496 0.335 -0.229
68 HG13 VAL 8 HG13 VAL 8 23.788 -0.196 1.296
69 HG21 VAL 8 HG21 VAL 8 21.650 -0.150 0.223
70 HG22 VAL 8 HG22 VAL 8 22.131 0.050 -1.462
71 HG23 VAL 8 HG23 VAL 8 21.210 -1.372 -0.970
72 H CYS 9 H CYS 9 25.962 -2.068 -3.162
73 HA CYS 9 HA CYS 9 27.410 -3.798 -1.273
74 HB2 CYS 9 HB2 CYS 9 28.033 -3.391 -4.201
75 HB3 CYS 9 HB3 CYS 9 28.667 -4.640 -3.133
76 H ARG 10 H ARG 10 29.210 -3.084 -0.321
77 HA ARG 10 HA ARG 10 30.209 -0.437 -1.089
78 HB2 ARG 10 HB2 ARG 10 30.776 -2.022 1.422
79 HB3 ARG 10 HB3 ARG 10 31.218 -0.348 1.118
80 HG2 ARG 10 HG2 ARG 10 28.348 -1.078 0.940
81 HG3 ARG 10 HG3 ARG 10 29.092 -1.000 2.538
82 HD2 ARG 10 HD2 ARG 10 30.018 1.292 1.579
83 HD3 ARG 10 HD3 ARG 10 28.582 1.160 0.564
84 HE ARG 10 HE ARG 10 27.910 0.707 3.271
85 HH11 ARG 10 HH11 ARG 10 28.801 3.249 1.066
86 HH12 ARG 10 HH12 ARG 10 27.964 4.484 1.947
87 HH21 ARG 10 HH21 ARG 10 26.804 2.323 4.439
88 HH22 ARG 10 HH22 ARG 10 26.829 3.957 3.865
89 H ASN 11 H ASN 11 30.946 -2.447 -2.814
90 HA ASN 11 HA ASN 11 32.738 -3.416 -3.827
91 HB2 ASN 11 HB2 ASN 11 34.384 -1.505 -2.160
92 HB3 ASN 11 HB3 ASN 11 34.840 -2.245 -3.692
93 HD21 ASN 11 HD21 ASN 11 34.144 0.580 -2.496
94 HD22 ASN 11 HD22 ASN 11 33.253 1.304 -3.787
95 H GLY 12 H GLY 12 32.007 -5.225 -2.265
96 HA2 GLY 12 HA2 GLY 12 33.864 -6.952 -1.598
97 HA3 GLY 12 HA3 GLY 12 34.051 -5.834 -0.256
98 H VAL 13 H VAL 13 31.252 -5.203 -0.012
99 HA VAL 13 HA VAL 13 30.117 -7.793 0.795
100 HB VAL 13 HB VAL 13 30.024 -5.310 2.513
101 HG11 VAL 13 HG11 VAL 13 29.443 -7.519 4.061
102 HG12 VAL 13 HG12 VAL 13 28.277 -6.362 3.419
103 HG13 VAL 13 HG13 VAL 13 28.616 -7.853 2.539
104 HG21 VAL 13 HG21 VAL 13 31.424 -6.952 4.025
105 HG22 VAL 13 HG22 VAL 13 31.890 -7.629 2.465
106 HG23 VAL 13 HG23 VAL 13 32.208 -5.931 2.819
107 H CYS 14 H CYS 14 28.271 -8.042 -0.264
108 HA CYS 14 HA CYS 14 26.764 -5.722 -1.164
109 HB2 CYS 14 HB2 CYS 14 26.815 -8.622 -1.832
110 HB3 CYS 14 HB3 CYS 14 25.299 -7.761 -2.080
111 H TYR 15 H TYR 15 24.876 -5.046 -0.335
112 HA TYR 15 HA TYR 15 23.501 -6.757 1.616
113 HB2 TYR 15 HB2 TYR 15 24.652 -5.327 3.070
114 HB3 TYR 15 HB3 TYR 15 24.463 -3.937 2.007
115 HD1 TYR 15 HD1 TYR 15 23.095 -2.298 2.859
116 HD2 TYR 15 HD2 TYR 15 22.166 -6.365 3.697
117 HE1 TYR 15 HE1 TYR 15 21.128 -1.577 4.146
118 HE2 TYR 15 HE2 TYR 15 20.195 -5.654 4.986
119 HH TYR 15 HH TYR 15 19.276 -3.801 6.071
120 H ARG 16 H ARG 16 21.300 -6.646 1.592
121 HA ARG 16 HA ARG 16 20.111 -5.246 -0.660
122 HB2 ARG 16 HB2 ARG 16 19.667 -7.712 0.237
123 HB3 ARG 16 HB3 ARG 16 18.474 -6.874 1.221
124 HG2 ARG 16 HG2 ARG 16 17.506 -5.921 -0.852
125 HG3 ARG 16 HG3 ARG 16 18.638 -6.903 -1.783
126 HD2 ARG 16 HD2 ARG 16 16.587 -7.968 0.155
127 HD3 ARG 16 HD3 ARG 16 16.412 -7.943 -1.599
128 HE ARG 16 HE ARG 16 18.732 -9.291 -1.212
129 HH11 ARG 16 HH11 ARG 16 15.499 -9.647 0.029
130 HH12 ARG 16 HH12 ARG 16 15.619 -11.366 0.213
131 HH21 ARG 16 HH21 ARG 16 18.903 -11.553 -0.974
132 HH22 ARG 16 HH22 ARG 16 17.556 -12.449 -0.357
133 H ARG 17 H ARG 17 19.325 -3.268 -0.434
134 HA ARG 17 HA ARG 17 18.496 -2.352 2.224
135 HB2 ARG 17 HB2 ARG 17 20.101 -0.894 1.245
136 HB3 ARG 17 HB3 ARG 17 19.256 -0.886 -0.297
137 HG2 ARG 17 HG2 ARG 17 18.949 1.210 0.897
138 HG3 ARG 17 HG3 ARG 17 17.416 0.357 0.702
139 HD2 ARG 17 HD2 ARG 17 17.512 1.215 2.932
140 HD3 ARG 17 HD3 ARG 17 17.699 -0.536 3.010
141 HE ARG 17 HE ARG 17 19.755 -0.212 3.935
142 HH11 ARG 17 HH11 ARG 17 18.841 2.682 2.229
143 HH12 ARG 17 HH12 ARG 17 20.227 3.583 2.750
144 HH21 ARG 17 HH21 ARG 17 21.583 0.964 4.628
145 HH22 ARG 17 HH22 ARG 17 21.786 2.604 4.113
146 H CYS 18 H CYS 18 16.409 -2.328 2.698
147 HA CYS 18 HA CYS 18 14.471 -1.795 0.552
148 HB2 CYS 18 HB2 CYS 18 13.997 -3.799 2.761
149 HB3 CYS 18 HB3 CYS 18 12.992 -3.503 1.346
150 H TRP 19 H TRP 19 12.516 -0.800 1.218
151 HA TRP 19 HA TRP 19 12.325 0.118 3.974
152 HB2 TRP 19 HB2 TRP 19 12.077 2.483 3.289
153 HB3 TRP 19 HB3 TRP 19 13.684 1.850 2.940
154 HD1 TRP 19 HD1 TRP 19 10.650 3.355 1.279
155 HE1 TRP 19 HE1 TRP 19 11.112 3.656 -1.235
156 HE3 TRP 19 HE3 TRP 19 15.016 0.717 0.934
157 HZ2 TRP 19 HZ2 TRP 19 13.067 2.877 -3.116
158 HZ3 TRP 19 HZ3 TRP 19 16.118 0.542 -1.259
159 HH2 TRP 19 HH2 TRP 19 15.162 1.600 -3.241
160 H GLY 20 H GLY 20 10.327 1.952 3.753
161 HA2 GLY 20 HA2 GLY 20 8.098 0.252 2.969
162 HA3 GLY 20 HA3 GLY 20 7.999 1.743 3.894
Start of MODEL 17
1 H1 SER 1 H SER 1 2.189 -0.288 1.366
2 HA SER 1 HA SER 1 1.722 0.358 -1.471
3 HB2 SER 1 HB2 SER 1 3.578 1.448 0.551
4 HB3 SER 1 HB3 SER 1 4.290 1.153 -1.035
5 HG SER 1 HG SER 1 3.264 3.275 -0.666
6 HA PRO 2 HA PRO 2 3.949 -3.184 -2.785
7 HB2 PRO 2 HB2 PRO 2 5.368 -2.236 -4.896
8 HB3 PRO 2 HB3 PRO 2 3.617 -2.476 -4.945
9 HG2 PRO 2 HG2 PRO 2 5.174 0.042 -4.497
10 HG3 PRO 2 HG3 PRO 2 3.734 -0.220 -5.499
11 HD2 PRO 2 HD2 PRO 2 3.610 0.893 -3.033
12 HD3 PRO 2 HD3 PRO 2 2.304 -0.112 -3.694
13 H ARG 3 H ARG 3 5.589 -4.126 -1.758
14 HA ARG 3 HA ARG 3 7.665 -2.846 -0.451
15 HB2 ARG 3 HB2 ARG 3 8.776 -5.073 -0.403
16 HB3 ARG 3 HB3 ARG 3 7.088 -5.121 0.087
17 HG2 ARG 3 HG2 ARG 3 7.104 -6.919 -1.288
18 HG3 ARG 3 HG3 ARG 3 6.752 -5.672 -2.486
19 HD2 ARG 3 HD2 ARG 3 9.403 -5.554 -2.574
20 HD3 ARG 3 HD3 ARG 3 9.243 -7.219 -2.017
21 HE ARG 3 HE ARG 3 7.541 -6.759 -4.225
22 HH11 ARG 3 HH11 ARG 3 10.897 -7.185 -3.404
23 HH12 ARG 3 HH12 ARG 3 11.328 -7.834 -4.951
24 HH21 ARG 3 HH21 ARG 3 8.096 -7.612 -6.267
25 HH22 ARG 3 HH22 ARG 3 9.735 -8.075 -6.579
26 H VAL 4 H VAL 4 9.838 -2.485 -0.907
27 HA VAL 4 HA VAL 4 10.673 -2.811 -3.707
28 HB VAL 4 HB VAL 4 11.020 -0.296 -2.068
29 HG11 VAL 4 HG11 VAL 4 12.174 -1.176 -4.688
30 HG12 VAL 4 HG12 VAL 4 11.929 0.534 -4.334
31 HG13 VAL 4 HG13 VAL 4 12.983 -0.437 -3.306
32 HG21 VAL 4 HG21 VAL 4 9.084 -1.151 -4.099
33 HG22 VAL 4 HG22 VAL 4 8.964 0.114 -2.876
34 HG23 VAL 4 HG23 VAL 4 9.808 0.430 -4.392
35 H CYS 5 H CYS 5 12.771 -3.382 -4.007
36 HA CYS 5 HA CYS 5 14.594 -3.309 -1.715
37 HB2 CYS 5 HB2 CYS 5 13.826 -5.755 -3.300
38 HB3 CYS 5 HB3 CYS 5 15.343 -5.662 -2.411
39 H ILE 6 H ILE 6 16.770 -3.165 -2.240
40 HA ILE 6 HA ILE 6 17.523 -3.172 -5.061
41 HB ILE 6 HB ILE 6 18.578 -1.007 -4.980
42 HG12 ILE 6 HG12 ILE 6 17.525 -0.828 -2.148
43 HG13 ILE 6 HG13 ILE 6 19.215 -0.994 -2.613
44 HG21 ILE 6 HG21 ILE 6 15.756 -0.787 -3.941
45 HG22 ILE 6 HG22 ILE 6 16.626 0.422 -4.886
46 HG23 ILE 6 HG23 ILE 6 16.201 -1.127 -5.614
47 HD11 ILE 6 HD11 ILE 6 17.435 1.349 -3.240
48 HD12 ILE 6 HD12 ILE 6 18.686 1.292 -1.999
49 HD13 ILE 6 HD13 ILE 6 19.129 1.184 -3.702
50 H ARG 7 H ARG 7 19.943 -2.836 -5.293
51 HA ARG 7 HA ARG 7 21.266 -4.510 -3.312
52 HB2 ARG 7 HB2 ARG 7 21.781 -3.738 -6.134
53 HB3 ARG 7 HB3 ARG 7 23.185 -4.097 -5.138
54 HG2 ARG 7 HG2 ARG 7 22.564 -6.093 -6.263
55 HG3 ARG 7 HG3 ARG 7 22.123 -6.282 -4.565
56 HD2 ARG 7 HD2 ARG 7 20.306 -7.113 -5.849
57 HD3 ARG 7 HD3 ARG 7 19.802 -5.556 -5.193
58 HE ARG 7 HE ARG 7 20.934 -5.367 -7.822
59 HH11 ARG 7 HH11 ARG 7 18.032 -6.010 -6.010
60 HH12 ARG 7 HH12 ARG 7 16.970 -5.560 -7.302
61 HH21 ARG 7 HH21 ARG 7 19.546 -4.771 -9.531
62 HH22 ARG 7 HH22 ARG 7 17.832 -4.856 -9.305
63 H VAL 8 H VAL 8 23.059 -3.914 -2.129
64 HA VAL 8 HA VAL 8 24.022 -1.160 -2.356
65 HB VAL 8 HB VAL 8 23.094 -2.353 0.260
66 HG11 VAL 8 HG11 VAL 8 25.075 -0.891 0.440
67 HG12 VAL 8 HG12 VAL 8 24.162 0.403 -0.338
68 HG13 VAL 8 HG13 VAL 8 23.654 -0.212 1.235
69 HG21 VAL 8 HG21 VAL 8 21.868 -0.364 -1.613
70 HG22 VAL 8 HG22 VAL 8 21.124 -1.748 -0.812
71 HG23 VAL 8 HG23 VAL 8 21.525 -0.303 0.116
72 H CYS 9 H CYS 9 25.881 -2.271 -3.227
73 HA CYS 9 HA CYS 9 27.468 -3.732 -1.228
74 HB2 CYS 9 HB2 CYS 9 28.013 -3.564 -4.193
75 HB3 CYS 9 HB3 CYS 9 28.698 -4.699 -3.034
76 H ARG 10 H ARG 10 29.204 -2.810 -0.355
77 HA ARG 10 HA ARG 10 30.098 -0.236 -1.435
78 HB2 ARG 10 HB2 ARG 10 30.720 -1.487 1.245
79 HB3 ARG 10 HB3 ARG 10 31.097 0.156 0.744
80 HG2 ARG 10 HG2 ARG 10 28.958 0.881 1.018
81 HG3 ARG 10 HG3 ARG 10 28.259 -0.698 0.652
82 HD2 ARG 10 HD2 ARG 10 29.159 -1.501 2.849
83 HD3 ARG 10 HD3 ARG 10 29.604 0.168 3.205
84 HE ARG 10 HE ARG 10 26.873 0.011 2.490
85 HH11 ARG 10 HH11 ARG 10 29.069 -0.737 5.086
86 HH12 ARG 10 HH12 ARG 10 27.864 -0.588 6.323
87 HH21 ARG 10 HH21 ARG 10 25.278 0.211 4.109
88 HH22 ARG 10 HH22 ARG 10 25.708 -0.050 5.765
89 H ASN 11 H ASN 11 30.917 -2.419 -2.901
90 HA ASN 11 HA ASN 11 32.751 -3.425 -3.797
91 HB2 ASN 11 HB2 ASN 11 34.529 -1.460 -2.401
92 HB3 ASN 11 HB3 ASN 11 34.641 -2.097 -4.039
93 HD21 ASN 11 HD21 ASN 11 33.192 -1.292 -5.630
94 HD22 ASN 11 HD22 ASN 11 32.492 0.279 -5.463
95 H GLY 12 H GLY 12 32.249 -5.195 -2.253
96 HA2 GLY 12 HA2 GLY 12 34.143 -6.683 -1.318
97 HA3 GLY 12 HA3 GLY 12 34.229 -5.429 -0.089
98 H VAL 13 H VAL 13 31.406 -4.953 0.076
99 HA VAL 13 HA VAL 13 30.377 -7.525 1.050
100 HB VAL 13 HB VAL 13 30.215 -4.970 2.651
101 HG11 VAL 13 HG11 VAL 13 29.671 -6.951 4.382
102 HG12 VAL 13 HG12 VAL 13 28.433 -6.102 3.457
103 HG13 VAL 13 HG13 VAL 13 29.036 -7.663 2.899
104 HG21 VAL 13 HG21 VAL 13 32.398 -5.466 3.038
105 HG22 VAL 13 HG22 VAL 13 31.674 -6.570 4.208
106 HG23 VAL 13 HG23 VAL 13 32.197 -7.171 2.635
107 H CYS 14 H CYS 14 28.496 -7.890 0.096
108 HA CYS 14 HA CYS 14 26.934 -5.674 -0.958
109 HB2 CYS 14 HB2 CYS 14 27.028 -8.615 -1.397
110 HB3 CYS 14 HB3 CYS 14 25.487 -7.808 -1.672
111 H TYR 15 H TYR 15 24.954 -5.053 -0.246
112 HA TYR 15 HA TYR 15 23.700 -6.587 1.916
113 HB2 TYR 15 HB2 TYR 15 24.870 -4.945 3.154
114 HB3 TYR 15 HB3 TYR 15 24.478 -3.677 1.998
115 HD1 TYR 15 HD1 TYR 15 23.061 -2.093 2.876
116 HD2 TYR 15 HD2 TYR 15 22.491 -6.166 3.967
117 HE1 TYR 15 HE1 TYR 15 21.116 -1.450 4.236
118 HE2 TYR 15 HE2 TYR 15 20.543 -5.534 5.329
119 HH TYR 15 HH TYR 15 19.847 -3.167 6.558
120 H ARG 16 H ARG 16 21.486 -6.514 1.962
121 HA ARG 16 HA ARG 16 20.213 -5.428 -0.418
122 HB2 ARG 16 HB2 ARG 16 19.520 -7.470 1.627
123 HB3 ARG 16 HB3 ARG 16 18.185 -6.629 0.852
124 HG2 ARG 16 HG2 ARG 16 20.369 -7.946 -0.728
125 HG3 ARG 16 HG3 ARG 16 18.939 -8.822 -0.180
126 HD2 ARG 16 HD2 ARG 16 17.629 -6.881 -1.288
127 HD3 ARG 16 HD3 ARG 16 19.142 -6.565 -2.136
128 HE ARG 16 HE ARG 16 18.728 -8.385 -3.447
129 HH11 ARG 16 HH11 ARG 16 16.794 -8.623 -0.562
130 HH12 ARG 16 HH12 ARG 16 15.928 -10.023 -1.101
131 HH21 ARG 16 HH21 ARG 16 17.595 -10.229 -4.168
132 HH22 ARG 16 HH22 ARG 16 16.385 -10.937 -3.152
133 H ARG 17 H ARG 17 18.988 -3.653 -0.459
134 HA ARG 17 HA ARG 17 18.229 -2.441 2.118
135 HB2 ARG 17 HB2 ARG 17 19.893 -1.073 1.045
136 HB3 ARG 17 HB3 ARG 17 19.020 -1.124 -0.481
137 HG2 ARG 17 HG2 ARG 17 18.733 1.020 0.616
138 HG3 ARG 17 HG3 ARG 17 17.197 0.158 0.514
139 HD2 ARG 17 HD2 ARG 17 17.377 1.136 2.695
140 HD3 ARG 17 HD3 ARG 17 17.541 -0.613 2.851
141 HE ARG 17 HE ARG 17 19.629 -0.277 3.696
142 HH11 ARG 17 HH11 ARG 17 18.707 2.544 1.876
143 HH12 ARG 17 HH12 ARG 17 20.123 3.445 2.307
144 HH21 ARG 17 HH21 ARG 17 21.497 0.899 4.271
145 HH22 ARG 17 HH22 ARG 17 21.709 2.508 3.669
146 H CYS 18 H CYS 18 16.121 -2.523 2.478
147 HA CYS 18 HA CYS 18 14.281 -2.069 0.234
148 HB2 CYS 18 HB2 CYS 18 13.762 -4.127 2.382
149 HB3 CYS 18 HB3 CYS 18 12.836 -3.850 0.911
150 H TRP 19 H TRP 19 12.225 -1.208 0.829
151 HA TRP 19 HA TRP 19 11.860 -0.336 3.579
152 HB2 TRP 19 HB2 TRP 19 11.500 2.036 2.860
153 HB3 TRP 19 HB3 TRP 19 13.169 1.491 2.723
154 HD1 TRP 19 HD1 TRP 19 10.332 2.892 0.697
155 HE1 TRP 19 HE1 TRP 19 11.079 3.186 -1.748
156 HE3 TRP 19 HE3 TRP 19 14.755 0.335 0.886
157 HZ2 TRP 19 HZ2 TRP 19 13.255 2.433 -3.381
158 HZ3 TRP 19 HZ3 TRP 19 16.109 0.168 -1.161
159 HH2 TRP 19 HH2 TRP 19 15.372 1.195 -3.250
160 H GLY 20 H GLY 20 9.789 1.368 3.349
161 HA2 GLY 20 HA2 GLY 20 7.727 -0.352 2.160
162 HA3 GLY 20 HA3 GLY 20 7.465 0.849 3.416
Start of MODEL 18
1 H1 SER 1 H SER 1 1.062 -0.878 0.809
2 HA SER 1 HA SER 1 0.917 -1.170 -2.062
3 HB2 SER 1 HB2 SER 1 1.931 0.849 -2.139
4 HB3 SER 1 HB3 SER 1 1.586 0.917 -0.411
5 HG SER 1 HG SER 1 3.639 0.732 -0.014
6 HA PRO 2 HA PRO 2 4.197 -4.006 -2.716
7 HB2 PRO 2 HB2 PRO 2 5.449 -2.965 -4.889
8 HB3 PRO 2 HB3 PRO 2 3.858 -3.732 -4.972
9 HG2 PRO 2 HG2 PRO 2 4.554 -0.823 -4.857
10 HG3 PRO 2 HG3 PRO 2 3.349 -1.646 -5.864
11 HD2 PRO 2 HD2 PRO 2 2.689 -0.301 -3.608
12 HD3 PRO 2 HD3 PRO 2 1.801 -1.736 -4.159
13 H ARG 3 H ARG 3 5.989 -4.281 -1.558
14 HA ARG 3 HA ARG 3 7.487 -2.172 -0.453
15 HB2 ARG 3 HB2 ARG 3 8.176 -5.099 -0.769
16 HB3 ARG 3 HB3 ARG 3 9.093 -3.962 0.210
17 HG2 ARG 3 HG2 ARG 3 6.179 -4.236 0.724
18 HG3 ARG 3 HG3 ARG 3 7.260 -5.522 1.265
19 HD2 ARG 3 HD2 ARG 3 7.562 -2.597 1.938
20 HD3 ARG 3 HD3 ARG 3 6.853 -3.813 3.001
21 HE ARG 3 HE ARG 3 9.642 -3.368 2.501
22 HH11 ARG 3 HH11 ARG 3 7.258 -5.727 3.439
23 HH12 ARG 3 HH12 ARG 3 8.389 -6.719 4.299
24 HH21 ARG 3 HH21 ARG 3 11.139 -4.666 3.631
25 HH22 ARG 3 HH22 ARG 3 10.596 -6.114 4.408
26 H VAL 4 H VAL 4 9.934 -2.038 -0.714
27 HA VAL 4 HA VAL 4 10.725 -2.337 -3.530
28 HB VAL 4 HB VAL 4 11.161 0.136 -1.848
29 HG11 VAL 4 HG11 VAL 4 13.100 -0.076 -3.140
30 HG12 VAL 4 HG12 VAL 4 12.212 -0.690 -4.535
31 HG13 VAL 4 HG13 VAL 4 12.071 1.007 -4.077
32 HG21 VAL 4 HG21 VAL 4 9.836 1.210 -3.700
33 HG22 VAL 4 HG22 VAL 4 9.428 -0.416 -4.248
34 HG23 VAL 4 HG23 VAL 4 8.923 0.127 -2.648
35 H CYS 5 H CYS 5 12.817 -2.922 -3.877
36 HA CYS 5 HA CYS 5 14.683 -2.923 -1.625
37 HB2 CYS 5 HB2 CYS 5 13.870 -5.365 -3.205
38 HB3 CYS 5 HB3 CYS 5 15.341 -5.293 -2.239
39 H ILE 6 H ILE 6 16.875 -2.974 -2.218
40 HA ILE 6 HA ILE 6 17.539 -2.977 -5.054
41 HB ILE 6 HB ILE 6 18.694 -0.860 -5.005
42 HG12 ILE 6 HG12 ILE 6 17.706 -0.628 -2.154
43 HG13 ILE 6 HG13 ILE 6 19.377 -0.867 -2.651
44 HG21 ILE 6 HG21 ILE 6 16.817 0.640 -4.920
45 HG22 ILE 6 HG22 ILE 6 16.280 -0.910 -5.567
46 HG23 ILE 6 HG23 ILE 6 15.918 -0.479 -3.895
47 HD11 ILE 6 HD11 ILE 6 18.463 1.412 -4.009
48 HD12 ILE 6 HD12 ILE 6 17.918 1.561 -2.338
49 HD13 ILE 6 HD13 ILE 6 19.630 1.324 -2.689
50 H ARG 7 H ARG 7 19.992 -2.655 -5.316
51 HA ARG 7 HA ARG 7 21.286 -4.437 -3.409
52 HB2 ARG 7 HB2 ARG 7 21.789 -3.593 -6.212
53 HB3 ARG 7 HB3 ARG 7 23.194 -4.024 -5.246
54 HG2 ARG 7 HG2 ARG 7 22.268 -6.214 -4.812
55 HG3 ARG 7 HG3 ARG 7 20.791 -5.786 -5.677
56 HD2 ARG 7 HD2 ARG 7 23.566 -5.994 -6.841
57 HD3 ARG 7 HD3 ARG 7 22.234 -7.121 -7.095
58 HE ARG 7 HE ARG 7 21.273 -4.697 -7.925
59 HH11 ARG 7 HH11 ARG 7 24.001 -6.700 -8.742
60 HH12 ARG 7 HH12 ARG 7 24.069 -6.162 -10.387
61 HH21 ARG 7 HH21 ARG 7 21.353 -3.981 -10.090
62 HH22 ARG 7 HH22 ARG 7 22.563 -4.615 -11.153
63 H VAL 8 H VAL 8 22.987 -3.897 -2.123
64 HA VAL 8 HA VAL 8 24.094 -1.189 -2.324
65 HB VAL 8 HB VAL 8 23.032 -2.393 0.236
66 HG11 VAL 8 HG11 VAL 8 25.095 -1.150 0.610
67 HG12 VAL 8 HG12 VAL 8 24.426 0.239 -0.246
68 HG13 VAL 8 HG13 VAL 8 23.712 -0.285 1.279
69 HG21 VAL 8 HG21 VAL 8 22.049 -0.232 -1.589
70 HG22 VAL 8 HG22 VAL 8 21.159 -1.571 -0.862
71 HG23 VAL 8 HG23 VAL 8 21.659 -0.201 0.130
72 H CYS 9 H CYS 9 25.986 -2.190 -3.125
73 HA CYS 9 HA CYS 9 27.456 -3.834 -1.176
74 HB2 CYS 9 HB2 CYS 9 28.111 -3.520 -4.105
75 HB3 CYS 9 HB3 CYS 9 28.717 -4.739 -2.989
76 H ARG 10 H ARG 10 29.255 -3.065 -0.259
77 HA ARG 10 HA ARG 10 30.192 -0.419 -1.103
78 HB2 ARG 10 HB2 ARG 10 29.485 -0.922 1.302
79 HB3 ARG 10 HB3 ARG 10 30.963 -1.868 1.424
80 HG2 ARG 10 HG2 ARG 10 32.049 0.365 0.529
81 HG3 ARG 10 HG3 ARG 10 30.596 1.070 1.241
82 HD2 ARG 10 HD2 ARG 10 31.226 -0.385 3.302
83 HD3 ARG 10 HD3 ARG 10 32.827 -0.418 2.563
84 HE ARG 10 HE ARG 10 32.185 2.218 2.588
85 HH11 ARG 10 HH11 ARG 10 32.273 -0.274 5.018
86 HH12 ARG 10 HH12 ARG 10 32.657 0.817 6.308
87 HH21 ARG 10 HH21 ARG 10 32.690 3.664 4.279
88 HH22 ARG 10 HH22 ARG 10 32.893 3.056 5.887
89 H ASN 11 H ASN 11 30.999 -2.293 -2.847
90 HA ASN 11 HA ASN 11 32.796 -3.285 -3.838
91 HB2 ASN 11 HB2 ASN 11 34.336 -1.272 -2.183
92 HB3 ASN 11 HB3 ASN 11 34.916 -2.089 -3.632
93 HD21 ASN 11 HD21 ASN 11 33.490 -1.772 -5.586
94 HD22 ASN 11 HD22 ASN 11 32.882 -0.176 -5.847
95 H GLY 12 H GLY 12 32.047 -5.043 -2.159
96 HA2 GLY 12 HA2 GLY 12 33.994 -6.731 -1.514
97 HA3 GLY 12 HA3 GLY 12 34.094 -5.613 -0.162
98 H VAL 13 H VAL 13 31.384 -5.071 0.220
99 HA VAL 13 HA VAL 13 30.281 -7.719 0.891
100 HB VAL 13 HB VAL 13 30.114 -5.273 2.654
101 HG11 VAL 13 HG11 VAL 13 28.375 -6.362 3.526
102 HG12 VAL 13 HG12 VAL 13 28.733 -7.826 2.610
103 HG13 VAL 13 HG13 VAL 13 29.544 -7.527 4.147
104 HG21 VAL 13 HG21 VAL 13 31.511 -6.952 4.147
105 HG22 VAL 13 HG22 VAL 13 32.024 -7.549 2.569
106 HG23 VAL 13 HG23 VAL 13 32.294 -5.861 3.004
107 H CYS 14 H CYS 14 28.395 -8.026 -0.074
108 HA CYS 14 HA CYS 14 26.861 -5.748 -1.036
109 HB2 CYS 14 HB2 CYS 14 26.927 -8.669 -1.610
110 HB3 CYS 14 HB3 CYS 14 25.404 -7.825 -1.872
111 H TYR 15 H TYR 15 24.853 -5.172 -0.342
112 HA TYR 15 HA TYR 15 23.557 -6.796 1.721
113 HB2 TYR 15 HB2 TYR 15 24.716 -5.294 3.110
114 HB3 TYR 15 HB3 TYR 15 24.451 -3.939 2.019
115 HD1 TYR 15 HD1 TYR 15 22.294 -6.407 3.831
116 HD2 TYR 15 HD2 TYR 15 23.029 -2.334 2.845
117 HE1 TYR 15 HE1 TYR 15 20.327 -5.739 5.147
118 HE2 TYR 15 HE2 TYR 15 21.064 -1.655 4.159
119 HH TYR 15 HH TYR 15 18.893 -4.034 5.580
120 H ARG 16 H ARG 16 21.345 -6.665 1.750
121 HA ARG 16 HA ARG 16 20.131 -5.390 -0.566
122 HB2 ARG 16 HB2 ARG 16 19.350 -7.534 1.343
123 HB3 ARG 16 HB3 ARG 16 18.054 -6.611 0.594
124 HG2 ARG 16 HG2 ARG 16 18.631 -8.700 -0.605
125 HG3 ARG 16 HG3 ARG 16 18.776 -7.246 -1.595
126 HD2 ARG 16 HD2 ARG 16 21.120 -7.283 -1.501
127 HD3 ARG 16 HD3 ARG 16 21.131 -8.407 -0.142
128 HE ARG 16 HE ARG 16 19.925 -9.783 -2.174
129 HH11 ARG 16 HH11 ARG 16 22.975 -8.158 -1.753
130 HH12 ARG 16 HH12 ARG 16 23.830 -9.202 -2.839
131 HH21 ARG 16 HH21 ARG 16 21.040 -11.165 -3.606
132 HH22 ARG 16 HH22 ARG 16 22.728 -10.912 -3.893
133 H ARG 17 H ARG 17 19.169 -3.478 -0.473
134 HA ARG 17 HA ARG 17 18.378 -2.429 2.159
135 HB2 ARG 17 HB2 ARG 17 20.050 -1.048 1.127
136 HB3 ARG 17 HB3 ARG 17 19.161 -1.015 -0.390
137 HG2 ARG 17 HG2 ARG 17 18.967 1.084 0.859
138 HG3 ARG 17 HG3 ARG 17 17.405 0.297 0.624
139 HD2 ARG 17 HD2 ARG 17 17.587 1.146 2.889
140 HD3 ARG 17 HD3 ARG 17 17.539 -0.616 2.899
141 HE ARG 17 HE ARG 17 20.179 -0.115 2.913
142 HH11 ARG 17 HH11 ARG 17 17.548 1.116 4.833
143 HH12 ARG 17 HH12 ARG 17 18.524 1.371 6.242
144 HH21 ARG 17 HH21 ARG 17 21.474 0.216 4.762
145 HH22 ARG 17 HH22 ARG 17 20.757 0.860 6.200
146 H CYS 18 H CYS 18 16.282 -2.299 2.576
147 HA CYS 18 HA CYS 18 14.411 -1.804 0.369
148 HB2 CYS 18 HB2 CYS 18 13.869 -3.829 2.545
149 HB3 CYS 18 HB3 CYS 18 12.896 -3.508 1.112
150 H TRP 19 H TRP 19 12.429 -0.820 0.991
151 HA TRP 19 HA TRP 19 12.144 0.067 3.745
152 HB2 TRP 19 HB2 TRP 19 11.922 2.457 3.042
153 HB3 TRP 19 HB3 TRP 19 13.553 1.815 2.873
154 HD1 TRP 19 HD1 TRP 19 10.769 3.392 0.903
155 HE1 TRP 19 HE1 TRP 19 11.490 3.656 -1.554
156 HE3 TRP 19 HE3 TRP 19 15.036 0.578 1.003
157 HZ2 TRP 19 HZ2 TRP 19 13.590 2.785 -3.228
158 HZ3 TRP 19 HZ3 TRP 19 16.343 0.344 -1.068
159 HH2 TRP 19 HH2 TRP 19 15.633 1.425 -3.139
160 H GLY 20 H GLY 20 10.176 1.896 3.530
161 HA2 GLY 20 HA2 GLY 20 7.943 0.267 2.716
162 HA3 GLY 20 HA3 GLY 20 7.860 1.846 3.483
Start of MODEL 19
1 H1 SER 1 H SER 1 1.484 -0.921 0.679
2 HA SER 1 HA SER 1 1.067 -1.038 -2.237
3 HB2 SER 1 HB2 SER 1 3.378 0.454 -1.806
4 HB3 SER 1 HB3 SER 1 1.787 1.090 -2.221
5 HG SER 1 HG SER 1 2.789 1.975 -0.274
6 HA PRO 2 HA PRO 2 4.193 -4.084 -2.665
7 HB2 PRO 2 HB2 PRO 2 5.477 -3.295 -4.922
8 HB3 PRO 2 HB3 PRO 2 3.849 -3.983 -4.934
9 HG2 PRO 2 HG2 PRO 2 4.694 -1.114 -5.066
10 HG3 PRO 2 HG3 PRO 2 3.440 -1.955 -5.996
11 HD2 PRO 2 HD2 PRO 2 2.868 -0.394 -3.859
12 HD3 PRO 2 HD3 PRO 2 1.904 -1.823 -4.283
13 H ARG 3 H ARG 3 5.872 -4.249 -1.322
14 HA ARG 3 HA ARG 3 7.492 -2.212 -0.402
15 HB2 ARG 3 HB2 ARG 3 8.790 -3.849 0.631
16 HB3 ARG 3 HB3 ARG 3 7.236 -4.647 0.429
17 HG2 ARG 3 HG2 ARG 3 9.628 -4.984 -1.368
18 HG3 ARG 3 HG3 ARG 3 9.091 -6.124 -0.133
19 HD2 ARG 3 HD2 ARG 3 6.930 -6.327 -1.337
20 HD3 ARG 3 HD3 ARG 3 7.582 -5.293 -2.607
21 HE ARG 3 HE ARG 3 9.402 -7.294 -2.421
22 HH11 ARG 3 HH11 ARG 3 5.948 -7.206 -2.848
23 HH12 ARG 3 HH12 ARG 3 5.893 -8.674 -3.767
24 HH21 ARG 3 HH21 ARG 3 9.343 -9.227 -3.630
25 HH22 ARG 3 HH22 ARG 3 7.824 -9.823 -4.211
26 H VAL 4 H VAL 4 9.918 -2.074 -0.705
27 HA VAL 4 HA VAL 4 10.688 -2.477 -3.514
28 HB VAL 4 HB VAL 4 11.120 0.064 -1.936
29 HG11 VAL 4 HG11 VAL 4 12.146 -0.851 -4.606
30 HG12 VAL 4 HG12 VAL 4 12.020 0.858 -4.188
31 HG13 VAL 4 HG13 VAL 4 13.054 -0.209 -3.237
32 HG21 VAL 4 HG21 VAL 4 9.693 1.112 -3.592
33 HG22 VAL 4 HG22 VAL 4 9.500 -0.425 -4.434
34 HG23 VAL 4 HG23 VAL 4 8.835 -0.218 -2.814
35 H CYS 5 H CYS 5 12.784 -3.057 -3.855
36 HA CYS 5 HA CYS 5 14.660 -2.968 -1.611
37 HB2 CYS 5 HB2 CYS 5 13.856 -5.460 -3.113
38 HB3 CYS 5 HB3 CYS 5 15.339 -5.349 -2.170
39 H ILE 6 H ILE 6 16.816 -2.864 -2.199
40 HA ILE 6 HA ILE 6 17.479 -2.980 -5.045
41 HB ILE 6 HB ILE 6 18.603 -0.853 -5.050
42 HG12 ILE 6 HG12 ILE 6 17.687 -0.592 -2.177
43 HG13 ILE 6 HG13 ILE 6 19.347 -0.820 -2.716
44 HG21 ILE 6 HG21 ILE 6 15.828 -0.549 -3.909
45 HG22 ILE 6 HG22 ILE 6 16.701 0.656 -4.856
46 HG23 ILE 6 HG23 ILE 6 16.218 -0.868 -5.599
47 HD11 ILE 6 HD11 ILE 6 17.848 1.597 -2.417
48 HD12 ILE 6 HD12 ILE 6 19.565 1.376 -2.757
49 HD13 ILE 6 HD13 ILE 6 18.403 1.429 -4.083
50 H ARG 7 H ARG 7 19.928 -2.641 -5.327
51 HA ARG 7 HA ARG 7 21.248 -4.392 -3.413
52 HB2 ARG 7 HB2 ARG 7 21.739 -3.547 -6.218
53 HB3 ARG 7 HB3 ARG 7 23.149 -3.959 -5.252
54 HG2 ARG 7 HG2 ARG 7 22.400 -5.886 -6.492
55 HG3 ARG 7 HG3 ARG 7 22.155 -6.151 -4.765
56 HD2 ARG 7 HD2 ARG 7 19.803 -5.618 -4.985
57 HD3 ARG 7 HD3 ARG 7 20.025 -5.234 -6.692
58 HE ARG 7 HE ARG 7 20.899 -7.833 -6.363
59 HH11 ARG 7 HH11 ARG 7 17.931 -6.064 -5.934
60 HH12 ARG 7 HH12 ARG 7 16.917 -7.427 -6.272
61 HH21 ARG 7 HH21 ARG 7 19.574 -9.635 -6.810
62 HH22 ARG 7 HH22 ARG 7 17.852 -9.458 -6.769
63 H VAL 8 H VAL 8 23.010 -3.848 -2.186
64 HA VAL 8 HA VAL 8 24.080 -1.134 -2.383
65 HB VAL 8 HB VAL 8 22.953 -2.297 0.167
66 HG11 VAL 8 HG11 VAL 8 24.422 -1.041 1.262
67 HG12 VAL 8 HG12 VAL 8 25.063 -0.401 -0.251
68 HG13 VAL 8 HG13 VAL 8 23.692 0.388 0.529
69 HG21 VAL 8 HG21 VAL 8 22.106 -0.056 -1.641
70 HG22 VAL 8 HG22 VAL 8 21.152 -1.410 -1.034
71 HG23 VAL 8 HG23 VAL 8 21.625 -0.106 0.055
72 H CYS 9 H CYS 9 25.953 -2.217 -3.174
73 HA CYS 9 HA CYS 9 27.407 -3.811 -1.175
74 HB2 CYS 9 HB2 CYS 9 28.097 -3.541 -4.101
75 HB3 CYS 9 HB3 CYS 9 28.680 -4.750 -2.962
76 H ARG 10 H ARG 10 29.191 -3.029 -0.243
77 HA ARG 10 HA ARG 10 30.156 -0.405 -1.123
78 HB2 ARG 10 HB2 ARG 10 29.408 -0.870 1.282
79 HB3 ARG 10 HB3 ARG 10 30.890 -1.803 1.442
80 HG2 ARG 10 HG2 ARG 10 31.958 0.433 0.506
81 HG3 ARG 10 HG3 ARG 10 30.502 1.125 1.222
82 HD2 ARG 10 HD2 ARG 10 32.064 1.218 2.948
83 HD3 ARG 10 HD3 ARG 10 31.128 -0.232 3.309
84 HE ARG 10 HE ARG 10 33.431 -0.819 1.738
85 HH11 ARG 10 HH11 ARG 10 32.357 -0.130 4.977
86 HH12 ARG 10 HH12 ARG 10 33.666 -0.978 5.731
87 HH21 ARG 10 HH21 ARG 10 35.159 -1.939 2.719
88 HH22 ARG 10 HH22 ARG 10 35.259 -2.006 4.446
89 H ASN 11 H ASN 11 30.987 -2.284 -2.830
90 HA ASN 11 HA ASN 11 32.797 -3.287 -3.784
91 HB2 ASN 11 HB2 ASN 11 34.479 -1.453 -2.080
92 HB3 ASN 11 HB3 ASN 11 34.833 -2.073 -3.691
93 HD21 ASN 11 HD21 ASN 11 32.823 -1.532 -5.223
94 HD22 ASN 11 HD22 ASN 11 32.423 0.149 -5.241
95 H GLY 12 H GLY 12 32.102 -5.155 -2.349
96 HA2 GLY 12 HA2 GLY 12 33.940 -6.846 -1.607
97 HA3 GLY 12 HA3 GLY 12 34.063 -5.742 -0.245
98 H VAL 13 H VAL 13 31.471 -5.133 0.301
99 HA VAL 13 HA VAL 13 30.267 -7.758 0.899
100 HB VAL 13 HB VAL 13 30.129 -5.305 2.655
101 HG11 VAL 13 HG11 VAL 13 29.565 -7.591 4.131
102 HG12 VAL 13 HG12 VAL 13 28.410 -6.380 3.575
103 HG13 VAL 13 HG13 VAL 13 28.709 -7.823 2.606
104 HG21 VAL 13 HG21 VAL 13 31.543 -6.887 4.169
105 HG22 VAL 13 HG22 VAL 13 31.986 -7.646 2.641
106 HG23 VAL 13 HG23 VAL 13 32.335 -5.938 2.911
107 H CYS 14 H CYS 14 28.371 -8.034 -0.055
108 HA CYS 14 HA CYS 14 26.885 -5.733 -1.038
109 HB2 CYS 14 HB2 CYS 14 26.895 -8.658 -1.585
110 HB3 CYS 14 HB3 CYS 14 25.382 -7.795 -1.842
111 H TYR 15 H TYR 15 24.918 -5.081 -0.318
112 HA TYR 15 HA TYR 15 23.607 -6.652 1.784
113 HB2 TYR 15 HB2 TYR 15 24.775 -5.088 3.100
114 HB3 TYR 15 HB3 TYR 15 24.488 -3.780 1.959
115 HD1 TYR 15 HD1 TYR 15 22.357 -6.195 3.870
116 HD2 TYR 15 HD2 TYR 15 23.075 -2.152 2.756
117 HE1 TYR 15 HE1 TYR 15 20.397 -5.492 5.180
118 HE2 TYR 15 HE2 TYR 15 21.118 -1.438 4.064
119 HH TYR 15 HH TYR 15 19.579 -3.425 6.304
120 H ARG 16 H ARG 16 21.395 -6.525 1.820
121 HA ARG 16 HA ARG 16 20.166 -5.343 -0.537
122 HB2 ARG 16 HB2 ARG 16 19.410 -7.427 1.443
123 HB3 ARG 16 HB3 ARG 16 18.101 -6.533 0.680
124 HG2 ARG 16 HG2 ARG 16 18.568 -7.370 -1.414
125 HG3 ARG 16 HG3 ARG 16 20.247 -7.733 -1.008
126 HD2 ARG 16 HD2 ARG 16 18.908 -9.771 -1.220
127 HD3 ARG 16 HD3 ARG 16 19.524 -9.565 0.419
128 HE ARG 16 HE ARG 16 16.935 -8.453 0.198
129 HH11 ARG 16 HH11 ARG 16 18.594 -11.510 0.350
130 HH12 ARG 16 HH12 ARG 16 17.252 -12.352 1.052
131 HH21 ARG 16 HH21 ARG 16 15.161 -9.550 1.121
132 HH22 ARG 16 HH22 ARG 16 15.299 -11.236 1.489
133 H ARG 17 H ARG 17 19.177 -3.442 -0.510
134 HA ARG 17 HA ARG 17 18.434 -2.282 2.088
135 HB2 ARG 17 HB2 ARG 17 20.017 -0.901 0.952
136 HB3 ARG 17 HB3 ARG 17 19.124 -1.010 -0.558
137 HG2 ARG 17 HG2 ARG 17 18.829 1.164 0.483
138 HG3 ARG 17 HG3 ARG 17 17.301 0.283 0.416
139 HD2 ARG 17 HD2 ARG 17 17.484 1.319 2.569
140 HD3 ARG 17 HD3 ARG 17 17.674 -0.422 2.770
141 HE ARG 17 HE ARG 17 19.762 -0.034 3.591
142 HH11 ARG 17 HH11 ARG 17 18.792 2.720 1.697
143 HH12 ARG 17 HH12 ARG 17 20.198 3.652 2.091
144 HH21 ARG 17 HH21 ARG 17 21.619 1.182 4.118
145 HH22 ARG 17 HH22 ARG 17 21.806 2.775 3.468
146 H CYS 18 H CYS 18 16.350 -2.356 2.571
147 HA CYS 18 HA CYS 18 14.384 -1.946 0.423
148 HB2 CYS 18 HB2 CYS 18 14.041 -3.930 2.678
149 HB3 CYS 18 HB3 CYS 18 12.945 -3.661 1.327
150 H TRP 19 H TRP 19 12.432 -0.952 1.054
151 HA TRP 19 HA TRP 19 12.159 -0.029 3.795
152 HB2 TRP 19 HB2 TRP 19 11.961 2.347 3.113
153 HB3 TRP 19 HB3 TRP 19 13.577 1.700 2.848
154 HD1 TRP 19 HD1 TRP 19 10.677 3.279 1.042
155 HE1 TRP 19 HE1 TRP 19 11.270 3.573 -1.446
156 HE3 TRP 19 HE3 TRP 19 14.975 0.514 0.899
157 HZ2 TRP 19 HZ2 TRP 19 13.291 2.743 -3.232
158 HZ3 TRP 19 HZ3 TRP 19 16.177 0.313 -1.238
159 HH2 TRP 19 HH2 TRP 19 15.351 1.405 -3.260
160 H GLY 20 H GLY 20 10.192 1.825 3.520
161 HA2 GLY 20 HA2 GLY 20 8.015 0.191 2.418
162 HA3 GLY 20 HA3 GLY 20 7.841 1.451 3.631
Start of MODEL 20
1 H1 SER 1 H SER 1 2.086 -2.177 1.701
2 HA SER 1 HA SER 1 1.641 -0.171 -0.391
3 HB2 SER 1 HB2 SER 1 3.502 0.027 1.923
4 HB3 SER 1 HB3 SER 1 4.094 0.592 0.361
5 HG SER 1 HG SER 1 2.047 1.825 0.291
6 HA PRO 2 HA PRO 2 4.098 -2.732 -2.968
7 HB2 PRO 2 HB2 PRO 2 5.477 -0.922 -4.450
8 HB3 PRO 2 HB3 PRO 2 3.746 -1.212 -4.655
9 HG2 PRO 2 HG2 PRO 2 5.136 0.974 -3.154
10 HG3 PRO 2 HG3 PRO 2 3.727 1.074 -4.225
11 HD2 PRO 2 HD2 PRO 2 3.508 1.059 -1.527
12 HD3 PRO 2 HD3 PRO 2 2.274 0.350 -2.589
13 H ARG 3 H ARG 3 5.668 -3.915 -2.051
14 HA ARG 3 HA ARG 3 7.788 -2.897 -0.508
15 HB2 ARG 3 HB2 ARG 3 8.759 -5.179 -0.739
16 HB3 ARG 3 HB3 ARG 3 7.077 -5.179 -0.225
17 HG2 ARG 3 HG2 ARG 3 6.962 -6.802 -1.798
18 HG3 ARG 3 HG3 ARG 3 6.678 -5.405 -2.838
19 HD2 ARG 3 HD2 ARG 3 8.324 -6.424 -4.039
20 HD3 ARG 3 HD3 ARG 3 9.323 -5.437 -2.973
21 HE ARG 3 HE ARG 3 10.161 -7.363 -2.099
22 HH11 ARG 3 HH11 ARG 3 7.054 -8.058 -3.509
23 HH12 ARG 3 HH12 ARG 3 7.151 -9.760 -3.204
24 HH21 ARG 3 HH21 ARG 3 10.300 -9.604 -1.693
25 HH22 ARG 3 HH22 ARG 3 8.997 -10.639 -2.171
26 H VAL 4 H VAL 4 9.906 -2.447 -0.967
27 HA VAL 4 HA VAL 4 10.769 -2.640 -3.770
28 HB VAL 4 HB VAL 4 11.053 -0.190 -2.025
29 HG11 VAL 4 HG11 VAL 4 12.215 -0.862 -4.719
30 HG12 VAL 4 HG12 VAL 4 12.085 0.789 -4.110
31 HG13 VAL 4 HG13 VAL 4 13.071 -0.394 -3.250
32 HG21 VAL 4 HG21 VAL 4 9.463 -0.758 -4.518
33 HG22 VAL 4 HG22 VAL 4 8.861 -0.258 -2.938
34 HG23 VAL 4 HG23 VAL 4 9.785 0.872 -3.927
35 H CYS 5 H CYS 5 12.860 -3.216 -4.064
36 HA CYS 5 HA CYS 5 14.727 -3.098 -1.828
37 HB2 CYS 5 HB2 CYS 5 14.003 -5.671 -3.244
38 HB3 CYS 5 HB3 CYS 5 15.365 -5.484 -2.144
39 H ILE 6 H ILE 6 16.909 -3.188 -2.441
40 HA ILE 6 HA ILE 6 17.550 -3.439 -5.270
41 HB ILE 6 HB ILE 6 18.712 -1.309 -5.396
42 HG12 ILE 6 HG12 ILE 6 17.559 -0.725 -2.661
43 HG13 ILE 6 HG13 ILE 6 19.242 -1.138 -2.968
44 HG21 ILE 6 HG21 ILE 6 16.335 -1.453 -6.056
45 HG22 ILE 6 HG22 ILE 6 15.881 -0.903 -4.443
46 HG23 ILE 6 HG23 ILE 6 16.800 0.159 -5.511
47 HD11 ILE 6 HD11 ILE 6 19.570 0.869 -4.219
48 HD12 ILE 6 HD12 ILE 6 17.849 1.248 -4.151
49 HD13 ILE 6 HD13 ILE 6 18.819 1.286 -2.679
50 H ARG 7 H ARG 7 20.029 -2.984 -5.533
51 HA ARG 7 HA ARG 7 21.350 -4.674 -3.567
52 HB2 ARG 7 HB2 ARG 7 21.897 -3.824 -6.361
53 HB3 ARG 7 HB3 ARG 7 23.290 -4.187 -5.351
54 HG2 ARG 7 HG2 ARG 7 22.621 -6.136 -6.620
55 HG3 ARG 7 HG3 ARG 7 22.376 -6.409 -4.893
56 HD2 ARG 7 HD2 ARG 7 19.978 -5.754 -5.228
57 HD3 ARG 7 HD3 ARG 7 20.289 -5.751 -6.963
58 HE ARG 7 HE ARG 7 19.987 -8.051 -5.254
59 HH11 ARG 7 HH11 ARG 7 21.244 -6.842 -8.268
60 HH12 ARG 7 HH12 ARG 7 21.241 -8.393 -9.041
61 HH21 ARG 7 HH21 ARG 7 19.979 -10.098 -6.261
62 HH22 ARG 7 HH22 ARG 7 20.521 -10.244 -7.899
63 H VAL 8 H VAL 8 22.885 -4.024 -2.162
64 HA VAL 8 HA VAL 8 23.913 -1.281 -2.373
65 HB VAL 8 HB VAL 8 22.827 -2.518 0.161
66 HG11 VAL 8 HG11 VAL 8 24.082 0.186 -0.302
67 HG12 VAL 8 HG12 VAL 8 23.361 -0.375 1.207
68 HG13 VAL 8 HG13 VAL 8 24.811 -1.157 0.578
69 HG21 VAL 8 HG21 VAL 8 21.296 -0.481 0.022
70 HG22 VAL 8 HG22 VAL 8 21.807 -0.358 -1.662
71 HG23 VAL 8 HG23 VAL 8 20.975 -1.806 -1.097
72 H CYS 9 H CYS 9 25.869 -2.221 -3.110
73 HA CYS 9 HA CYS 9 27.345 -3.780 -1.098
74 HB2 CYS 9 HB2 CYS 9 28.081 -3.441 -4.006
75 HB3 CYS 9 HB3 CYS 9 28.718 -4.620 -2.865
76 H ARG 10 H ARG 10 29.088 -2.939 -0.131
77 HA ARG 10 HA ARG 10 29.922 -0.247 -0.934
78 HB2 ARG 10 HB2 ARG 10 29.172 -0.810 1.449
79 HB3 ARG 10 HB3 ARG 10 30.699 -1.667 1.605
80 HG2 ARG 10 HG2 ARG 10 31.673 0.633 0.749
81 HG3 ARG 10 HG3 ARG 10 30.164 1.245 1.430
82 HD2 ARG 10 HD2 ARG 10 30.867 -0.246 3.478
83 HD3 ARG 10 HD3 ARG 10 32.478 -0.056 2.786
84 HE ARG 10 HE ARG 10 31.118 2.439 3.039
85 HH11 ARG 10 HH11 ARG 10 32.930 0.041 4.796
86 HH12 ARG 10 HH12 ARG 10 33.496 1.158 5.994
87 HH21 ARG 10 HH21 ARG 10 31.856 3.919 4.610
88 HH22 ARG 10 HH22 ARG 10 32.884 3.363 5.888
89 H ASN 11 H ASN 11 30.873 -2.036 -2.676
90 HA ASN 11 HA ASN 11 32.742 -2.927 -3.625
91 HB2 ASN 11 HB2 ASN 11 34.135 -0.892 -1.871
92 HB3 ASN 11 HB3 ASN 11 34.806 -1.655 -3.309
93 HD21 ASN 11 HD21 ASN 11 33.543 1.107 -2.223
94 HD22 ASN 11 HD22 ASN 11 32.841 1.727 -3.675
95 H GLY 12 H GLY 12 32.012 -4.759 -2.023
96 HA2 GLY 12 HA2 GLY 12 33.981 -6.397 -1.352
97 HA3 GLY 12 HA3 GLY 12 34.031 -5.297 0.017
98 H VAL 13 H VAL 13 31.375 -4.826 0.489
99 HA VAL 13 HA VAL 13 30.330 -7.515 1.102
100 HB VAL 13 HB VAL 13 29.969 -5.049 2.806
101 HG11 VAL 13 HG11 VAL 13 28.255 -6.274 3.575
102 HG12 VAL 13 HG12 VAL 13 28.854 -7.756 2.830
103 HG13 VAL 13 HG13 VAL 13 29.503 -7.225 4.382
104 HG21 VAL 13 HG21 VAL 13 31.465 -6.461 4.388
105 HG22 VAL 13 HG22 VAL 13 31.990 -7.252 2.902
106 HG23 VAL 13 HG23 VAL 13 32.218 -5.515 3.105
107 H CYS 14 H CYS 14 28.512 -7.926 0.049
108 HA CYS 14 HA CYS 14 26.885 -5.740 -0.972
109 HB2 CYS 14 HB2 CYS 14 27.145 -8.649 -1.539
110 HB3 CYS 14 HB3 CYS 14 25.581 -7.902 -1.850
111 H TYR 15 H TYR 15 24.809 -5.297 -0.370
112 HA TYR 15 HA TYR 15 23.503 -7.001 1.607
113 HB2 TYR 15 HB2 TYR 15 24.561 -5.554 3.118
114 HB3 TYR 15 HB3 TYR 15 24.349 -4.154 2.072
115 HD1 TYR 15 HD1 TYR 15 22.164 -6.689 3.752
116 HD2 TYR 15 HD2 TYR 15 22.826 -2.595 2.802
117 HE1 TYR 15 HE1 TYR 15 20.129 -6.079 4.992
118 HE2 TYR 15 HE2 TYR 15 20.793 -1.973 4.040
119 HH TYR 15 HH TYR 15 19.028 -4.300 5.962
120 H ARG 16 H ARG 16 21.276 -6.856 1.612
121 HA ARG 16 HA ARG 16 20.129 -5.485 -0.694
122 HB2 ARG 16 HB2 ARG 16 19.424 -7.713 -0.642
123 HB3 ARG 16 HB3 ARG 16 19.205 -7.703 1.102
124 HG2 ARG 16 HG2 ARG 16 17.195 -6.479 0.942
125 HG3 ARG 16 HG3 ARG 16 17.486 -6.084 -0.753
126 HD2 ARG 16 HD2 ARG 16 17.136 -8.905 0.235
127 HD3 ARG 16 HD3 ARG 16 15.785 -7.904 -0.297
128 HE ARG 16 HE ARG 16 17.919 -8.082 -2.214
129 HH11 ARG 16 HH11 ARG 16 15.007 -9.571 -1.021
130 HH12 ARG 16 HH12 ARG 16 14.665 -10.395 -2.507
131 HH21 ARG 16 HH21 ARG 16 17.479 -9.161 -4.175
132 HH22 ARG 16 HH22 ARG 16 16.071 -10.161 -4.300
133 H ARG 17 H ARG 17 19.195 -3.571 -0.474
134 HA ARG 17 HA ARG 17 18.224 -2.768 2.182
135 HB2 ARG 17 HB2 ARG 17 19.927 -1.288 1.339
136 HB3 ARG 17 HB3 ARG 17 19.091 -1.127 -0.200
137 HG2 ARG 17 HG2 ARG 17 17.591 0.367 0.610
138 HG3 ARG 17 HG3 ARG 17 17.602 -0.334 2.230
139 HD2 ARG 17 HD2 ARG 17 19.772 1.369 1.009
140 HD3 ARG 17 HD3 ARG 17 18.610 1.886 2.229
141 HE ARG 17 HE ARG 17 20.017 -0.368 3.161
142 HH11 ARG 17 HH11 ARG 17 20.472 3.018 2.491
143 HH12 ARG 17 HH12 ARG 17 21.722 3.217 3.674
144 HH21 ARG 17 HH21 ARG 17 21.661 -0.118 4.721
145 HH22 ARG 17 HH22 ARG 17 22.398 1.432 4.942
146 H CYS 18 H CYS 18 16.117 -2.468 2.515
147 HA CYS 18 HA CYS 18 14.355 -2.040 0.204
148 HB2 CYS 18 HB2 CYS 18 13.705 -3.935 2.467
149 HB3 CYS 18 HB3 CYS 18 12.756 -3.651 1.012
150 H TRP 19 H TRP 19 12.422 -0.920 0.649
151 HA TRP 19 HA TRP 19 12.035 0.125 3.342
152 HB2 TRP 19 HB2 TRP 19 11.856 2.470 2.418
153 HB3 TRP 19 HB3 TRP 19 13.486 1.805 2.466
154 HD1 TRP 19 HD1 TRP 19 10.941 3.236 0.108
155 HE1 TRP 19 HE1 TRP 19 11.893 3.263 -2.283
156 HE3 TRP 19 HE3 TRP 19 15.104 0.365 0.860
157 HZ2 TRP 19 HZ2 TRP 19 14.115 2.206 -3.667
158 HZ3 TRP 19 HZ3 TRP 19 16.590 -0.080 -1.050
159 HH2 TRP 19 HH2 TRP 19 16.104 0.822 -3.266
160 H GLY 20 H GLY 20 10.108 1.949 2.973
161 HA2 GLY 20 HA2 GLY 20 7.851 0.346 2.282
162 HA3 GLY 20 HA3 GLY 20 7.817 2.037 2.760