Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
25830 | 2kch RC | 16074 | cing | 1-original | 2 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 H1 CYS 1 H1 CYS 1 3.075 0.736 4.478
2 HA CYS 1 HA CYS 1 2.540 3.505 4.498
3 HB2 CYS 1 HB3 CYS 1 1.076 1.511 2.776
4 HB3 CYS 1 HB2 CYS 1 1.505 3.176 2.394
5 H GLY 2 H GLY 2 0.574 0.673 5.207
6 HA2 GLY 2 HA3 GLY 2 -1.280 0.469 6.559
7 HA3 GLY 2 HA2 GLY 2 -1.159 2.182 6.912
8 H GLU 3 H GLU 3 -1.309 3.040 4.174
9 HA GLU 3 HA GLU 3 -4.051 3.399 3.920
10 HB2 GLU 3 HB3 GLU 3 -3.584 4.334 1.720
11 HB3 GLU 3 HB2 GLU 3 -2.406 4.891 2.900
12 HG2 GLU 3 HG3 GLU 3 -0.707 3.587 2.006
13 HG3 GLU 3 HG2 GLU 3 -1.836 2.529 1.159
14 H THR 4 H THR 4 -5.612 2.560 2.652
15 HA THR 4 HA THR 4 -5.194 -0.171 1.719
16 HB THR 4 HB THR 4 -7.693 1.469 2.224
17 HG1 THR 4 HG1 THR 4 -6.286 -0.517 3.630
18 HG21 THR 4 HG21 THR 4 -7.655 -0.438 0.351
19 HG22 THR 4 HG22 THR 4 -9.044 -0.170 1.406
20 HG23 THR 4 HG23 THR 4 -7.892 -1.455 1.773
21 H CYS 5 H CYS 5 -4.891 -0.550 -0.399
22 HA CYS 5 HA CYS 5 -5.476 1.549 -2.320
23 HB2 CYS 5 HB3 CYS 5 -4.352 0.014 -3.954
24 HB3 CYS 5 HB2 CYS 5 -3.336 0.509 -2.606
25 H PHE 6 H PHE 6 -7.791 1.057 -1.537
26 HA PHE 6 HA PHE 6 -9.241 -1.168 -2.299
27 HB2 PHE 6 HB3 PHE 6 -10.123 0.682 -0.910
28 HB3 PHE 6 HB2 PHE 6 -10.180 1.711 -2.336
29 HD1 PHE 6 HD1 PHE 6 -11.255 -1.800 -1.644
30 HD2 PHE 6 HD2 PHE 6 -12.346 2.092 -2.975
31 HE1 PHE 6 HE1 PHE 6 -13.527 -2.608 -2.130
32 HE2 PHE 6 HE2 PHE 6 -14.621 1.292 -3.463
33 HZ PHE 6 HZ PHE 6 -15.214 -1.061 -3.040
34 H GLY 7 H GLY 7 -8.473 1.726 -4.194
35 HA2 GLY 7 HA3 GLY 7 -9.717 0.538 -6.558
36 HA3 GLY 7 HA2 GLY 7 -9.105 2.181 -6.423
37 H GLY 8 H GLY 8 -7.159 -0.479 -5.323
38 HA2 GLY 8 HA3 GLY 8 -5.313 -1.524 -6.215
39 HA3 GLY 8 HA2 GLY 8 -5.765 -0.900 -7.788
40 H THR 9 H THR 9 -5.739 1.901 -6.825
41 HA THR 9 HA THR 9 -2.880 2.318 -7.121
42 HB THR 9 HB THR 9 -4.874 4.536 -6.856
43 HG1 THR 9 HG1 THR 9 -5.042 2.544 -8.639
44 HG21 THR 9 HG21 THR 9 -2.293 4.753 -7.148
45 HG22 THR 9 HG22 THR 9 -3.364 5.781 -8.099
46 HG23 THR 9 HG23 THR 9 -2.632 4.353 -8.831
47 H CYS 10 H CYS 10 -1.624 3.552 -5.718
48 HA CYS 10 HA CYS 10 -2.667 3.807 -2.980
49 HB2 CYS 10 HB3 CYS 10 0.200 3.396 -3.876
50 HB3 CYS 10 HB2 CYS 10 -0.334 3.567 -2.208
51 H ASN 11 H ASN 11 -2.046 5.650 -1.776
52 HA ASN 11 HA ASN 11 -1.731 8.023 -3.432
53 HB2 ASN 11 HB3 ASN 11 -3.429 7.738 -1.526
54 HB3 ASN 11 HB2 ASN 11 -2.067 7.941 -0.433
55 HD21 ASN 11 HD22 ASN 11 -1.408 9.781 -3.096
56 HD22 ASN 11 HD21 ASN 11 -2.048 11.288 -2.553
57 H THR 12 H THR 12 0.164 6.029 -1.357
58 HA THR 12 HA THR 12 2.211 8.111 -1.060
59 HB THR 12 HB THR 12 2.303 5.340 0.121
60 HG1 THR 12 HG1 THR 12 0.382 6.180 0.859
61 HG21 THR 12 HG21 THR 12 4.363 6.659 0.204
62 HG22 THR 12 HG22 THR 12 3.691 6.426 1.817
63 HG23 THR 12 HG23 THR 12 3.494 7.974 0.996
64 HA PRO 13 HA PRO 13 4.395 6.338 -4.535
65 HB2 PRO 13 HB2 PRO 13 6.706 7.763 -4.140
66 HB3 PRO 13 HB3 PRO 13 5.280 8.406 -4.960
67 HG2 PRO 13 HG3 PRO 13 6.176 8.793 -2.134
68 HG3 PRO 13 HG2 PRO 13 5.480 9.970 -3.262
69 HD2 PRO 13 HD3 PRO 13 4.021 8.821 -1.309
70 HD3 PRO 13 HD2 PRO 13 3.320 9.244 -2.884
71 H GLY 14 H GLY 14 5.645 4.560 -4.687
72 HA2 GLY 14 HA3 GLY 14 7.517 3.221 -4.123
73 HA3 GLY 14 HA2 GLY 14 7.534 3.964 -2.529
74 H CYS 15 H CYS 15 4.503 3.599 -2.501
75 HA CYS 15 HA CYS 15 4.601 0.947 -1.332
76 HB2 CYS 15 HB3 CYS 15 2.367 2.987 -1.431
77 HB3 CYS 15 HB2 CYS 15 2.295 1.452 -0.574
78 H SER 16 H SER 16 3.940 -0.815 -2.286
79 HA SER 16 HA SER 16 2.611 -0.640 -4.884
80 HB2 SER 16 HB3 SER 16 3.836 -3.059 -3.530
81 HB3 SER 16 HB2 SER 16 3.368 -2.913 -5.224
82 HG SER 16 HG SER 16 5.171 -1.034 -4.240
83 H CYS 17 H CYS 17 0.595 -1.572 -5.232
84 HA CYS 17 HA CYS 17 -1.051 -1.813 -2.943
85 HB2 CYS 17 HB3 CYS 17 -1.956 -0.995 -5.050
86 HB3 CYS 17 HB2 CYS 17 -1.646 -2.553 -5.807
87 H THR 18 H THR 18 -1.421 -3.423 -1.712
88 HA THR 18 HA THR 18 -1.164 -6.175 -2.701
89 HB THR 18 HB THR 18 -0.370 -5.347 0.104
90 HG1 THR 18 HG1 THR 18 1.019 -5.064 -2.240
91 HG21 THR 18 HG21 THR 18 0.343 -7.806 -1.502
92 HG22 THR 18 HG22 THR 18 -0.992 -7.728 -0.350
93 HG23 THR 18 HG23 THR 18 0.667 -7.518 0.208
94 H TRP 19 H TRP 19 -3.404 -5.229 -3.000
95 HA TRP 19 HA TRP 19 -5.308 -4.429 -1.459
96 HB2 TRP 19 HB3 TRP 19 -5.328 -5.796 -3.786
97 HB3 TRP 19 HB2 TRP 19 -6.136 -6.959 -2.739
98 HD1 TRP 19 HD1 TRP 19 -6.702 -3.716 -4.570
99 HE1 TRP 19 HE1 TRP 19 -9.131 -2.934 -4.210
100 HE3 TRP 19 HE3 TRP 19 -8.056 -6.974 -0.876
101 HZ2 TRP 19 HZ2 TRP 19 -11.326 -3.611 -2.560
102 HZ3 TRP 19 HZ3 TRP 19 -10.321 -6.833 0.054
103 HH2 TRP 19 HH2 TRP 19 -11.930 -5.189 -0.775
104 HA PRO 20 HA PRO 20 -6.612 -3.981 -0.433
105 HB2 PRO 20 HB2 PRO 20 -7.906 -3.508 1.837
106 HB3 PRO 20 HB3 PRO 20 -8.509 -4.702 0.684
107 HG2 PRO 20 HG3 PRO 20 -7.176 -5.111 3.301
108 HG3 PRO 20 HG2 PRO 20 -8.350 -6.138 2.463
109 HD2 PRO 20 HD3 PRO 20 -5.492 -6.396 2.507
110 HD3 PRO 20 HD2 PRO 20 -6.665 -7.405 1.638
111 H ILE 21 H ILE 21 -3.799 -4.320 0.605
112 HA ILE 21 HA ILE 21 -3.687 -1.758 2.008
113 HB ILE 21 HB ILE 21 -2.043 -2.601 3.640
114 HG12 ILE 21 HG13 ILE 21 -2.805 -5.347 2.614
115 HG13 ILE 21 HG12 ILE 21 -1.261 -4.553 2.322
116 HG21 ILE 21 HG21 ILE 21 -4.786 -3.828 3.607
117 HG22 ILE 21 HG22 ILE 21 -4.214 -2.417 4.501
118 HG23 ILE 21 HG23 ILE 21 -3.686 -4.031 4.975
119 HD11 ILE 21 HD11 ILE 21 -0.567 -4.819 4.507
120 HD12 ILE 21 HD12 ILE 21 -1.452 -6.313 4.197
121 HD13 ILE 21 HD13 ILE 21 -2.210 -5.012 5.115
122 H CYS 22 H CYS 22 -1.995 -0.507 1.462
123 HA CYS 22 HA CYS 22 -0.291 -1.426 -0.701
124 HB2 CYS 22 HB3 CYS 22 -0.381 1.243 0.705
125 HB3 CYS 22 HB2 CYS 22 0.587 0.880 -0.713
126 H THR 23 H THR 23 1.808 -1.894 -0.600
127 HA THR 23 HA THR 23 3.179 -1.668 1.998
128 HB THR 23 HB THR 23 4.319 -3.815 1.480
129 HG1 THR 23 HG1 THR 23 2.410 -4.579 -0.384
130 HG21 THR 23 HG21 THR 23 2.212 -5.281 1.723
131 HG22 THR 23 HG22 THR 23 1.327 -3.756 1.742
132 HG23 THR 23 HG23 THR 23 2.540 -4.086 2.980
133 H ARG 24 H ARG 24 5.054 -0.519 1.845
134 HA ARG 24 HA ARG 24 6.153 -0.089 -0.817
135 HB2 ARG 24 HB3 ARG 24 7.456 1.684 0.143
136 HB3 ARG 24 HB2 ARG 24 5.796 1.881 0.658
137 HG2 ARG 24 HG3 ARG 24 6.294 1.552 2.833
138 HG3 ARG 24 HG2 ARG 24 7.567 0.380 2.478
139 HD2 ARG 24 HD3 ARG 24 7.757 3.373 2.137
140 HD3 ARG 24 HD2 ARG 24 8.502 2.426 3.425
141 HE ARG 24 HE ARG 24 9.337 1.393 0.941
142 HH11 ARG 24 HH11 ARG 24 9.778 4.266 2.905
143 HH12 ARG 24 HH12 ARG 24 11.357 4.597 2.277
144 HH21 ARG 24 HH22 ARG 24 11.376 1.803 0.120
145 HH22 ARG 24 HH21 ARG 24 12.279 3.184 0.676
146 H ASP 25 H ASP 25 7.866 -1.166 -1.502
147 HA ASP 25 HA ASP 25 9.614 -2.623 -1.574
148 HB2 ASP 25 HB3 ASP 25 10.209 -1.657 1.238
149 HB3 ASP 25 HB2 ASP 25 11.335 -2.450 0.146
150 H GLY 26 H GLY 26 6.984 -3.407 -0.474
151 HA2 GLY 26 HA3 GLY 26 6.150 -5.503 0.088
152 HA3 GLY 26 HA2 GLY 26 7.771 -6.002 0.542
153 H LEU 27 H LEU 27 7.190 -3.076 2.004
154 HA LEU 27 HA LEU 27 6.486 -4.433 4.513
155 HB2 LEU 27 HB3 LEU 27 7.724 -1.716 4.059
156 HB3 LEU 27 HB2 LEU 27 7.405 -2.439 5.624
157 HG LEU 27 HG LEU 27 9.334 -3.524 3.569
158 HD11 LEU 27 HD11 LEU 27 10.621 -1.854 4.331
159 HD12 LEU 27 HD12 LEU 27 10.797 -2.871 5.761
160 HD13 LEU 27 HD13 LEU 27 9.600 -1.575 5.742
161 HD21 LEU 27 HD21 LEU 27 9.021 -4.365 6.440
162 HD22 LEU 27 HD22 LEU 27 9.954 -5.148 5.165
163 HD23 LEU 27 HD23 LEU 27 8.192 -5.177 5.111
164 HA PRO 28 HA PRO 28 2.525 -2.393 4.139
165 HB2 PRO 28 HB2 PRO 28 1.784 -3.687 6.617
166 HB3 PRO 28 HB3 PRO 28 1.236 -4.053 4.981
167 HG2 PRO 28 HG3 PRO 28 2.821 -5.721 6.462
168 HG3 PRO 28 HG2 PRO 28 2.795 -5.697 4.690
169 HD2 PRO 28 HD3 PRO 28 4.761 -4.454 6.576
170 HD3 PRO 28 HD2 PRO 28 5.049 -5.287 5.032
171 H VAL 29 H VAL 29 4.551 -0.826 5.138
172 HA VAL 29 HA VAL 29 3.728 0.155 7.735
173 HB VAL 29 HB VAL 29 6.143 -0.037 7.143
174 HG11 VAL 29 HG11 VAL 29 5.650 2.338 5.360
175 HG12 VAL 29 HG12 VAL 29 5.896 0.689 4.785
176 HG13 VAL 29 HG13 VAL 29 7.185 1.521 5.655
177 HG21 VAL 29 HG21 VAL 29 6.035 1.341 8.926
178 HG22 VAL 29 HG22 VAL 29 4.856 2.411 8.168
179 HG23 VAL 29 HG23 VAL 29 6.563 2.545 7.750
Start of MODEL 2
1 H1 CYS 1 H CYS 1 2.814 1.080 4.256
2 HA CYS 1 HA CYS 1 2.135 3.808 4.280
3 HB2 CYS 1 HB3 CYS 1 0.675 1.848 2.547
4 HB3 CYS 1 HB2 CYS 1 1.282 3.453 2.147
5 H GLY 2 H GLY 2 0.282 0.892 4.976
6 HA2 GLY 2 HA3 GLY 2 -1.577 0.624 6.316
7 HA3 GLY 2 HA2 GLY 2 -1.553 2.351 6.630
8 H GLU 3 H GLU 3 -1.675 3.159 3.894
9 HA GLU 3 HA GLU 3 -4.424 3.351 3.539
10 HB2 GLU 3 HB3 GLU 3 -3.889 4.232 1.289
11 HB3 GLU 3 HB2 GLU 3 -2.922 4.964 2.562
12 HG2 GLU 3 HG3 GLU 3 -1.009 3.693 1.951
13 HG3 GLU 3 HG2 GLU 3 -1.954 2.697 0.844
14 H THR 4 H THR 4 -5.917 2.283 2.410
15 HA THR 4 HA THR 4 -5.219 -0.356 1.413
16 HB THR 4 HB THR 4 -7.782 -0.519 1.216
17 HG1 THR 4 HG1 THR 4 -8.559 1.146 2.973
18 HG21 THR 4 HG21 THR 4 -6.852 -1.713 2.986
19 HG22 THR 4 HG22 THR 4 -7.980 -0.628 3.800
20 HG23 THR 4 HG23 THR 4 -6.255 -0.256 3.783
21 H CYS 5 H CYS 5 -4.776 -0.594 -0.699
22 HA CYS 5 HA CYS 5 -5.581 1.480 -2.552
23 HB2 CYS 5 HB3 CYS 5 -4.109 0.347 -4.159
24 HB3 CYS 5 HB2 CYS 5 -3.281 0.704 -2.649
25 H PHE 6 H PHE 6 -7.871 0.524 -1.924
26 HA PHE 6 HA PHE 6 -8.813 -1.813 -3.136
27 HB2 PHE 6 HB3 PHE 6 -10.121 0.736 -2.267
28 HB3 PHE 6 HB2 PHE 6 -11.049 -0.429 -3.203
29 HD1 PHE 6 HD1 PHE 6 -8.564 -0.792 -0.432
30 HD2 PHE 6 HD2 PHE 6 -12.508 -1.538 -1.843
31 HE1 PHE 6 HE1 PHE 6 -9.055 -2.060 1.617
32 HE2 PHE 6 HE2 PHE 6 -13.005 -2.807 0.204
33 HZ PHE 6 HZ PHE 6 -11.278 -3.068 1.938
34 H GLY 7 H GLY 7 -8.414 1.440 -4.439
35 HA2 GLY 7 HA3 GLY 7 -9.581 0.648 -6.988
36 HA3 GLY 7 HA2 GLY 7 -9.015 2.253 -6.558
37 H GLY 8 H GLY 8 -6.869 -0.333 -5.855
38 HA2 GLY 8 HA3 GLY 8 -4.864 -0.979 -6.760
39 HA3 GLY 8 HA2 GLY 8 -5.574 -0.640 -8.330
40 H THR 9 H THR 9 -4.985 1.649 -5.701
41 HA THR 9 HA THR 9 -2.729 2.815 -7.117
42 HB THR 9 HB THR 9 -5.010 4.630 -6.359
43 HG1 THR 9 HG1 THR 9 -4.872 2.920 -8.502
44 HG21 THR 9 HG21 THR 9 -2.886 5.023 -8.453
45 HG22 THR 9 HG22 THR 9 -2.644 5.468 -6.764
46 HG23 THR 9 HG23 THR 9 -3.922 6.239 -7.704
47 H CYS 10 H CYS 10 -1.504 4.243 -5.780
48 HA CYS 10 HA CYS 10 -2.254 4.250 -2.942
49 HB2 CYS 10 HB3 CYS 10 0.540 3.745 -3.989
50 HB3 CYS 10 HB2 CYS 10 0.045 3.774 -2.299
51 H ASN 11 H ASN 11 -1.707 6.049 -1.795
52 HA ASN 11 HA ASN 11 -1.120 8.422 -3.377
53 HB2 ASN 11 HB3 ASN 11 -3.001 8.425 -1.781
54 HB3 ASN 11 HB2 ASN 11 -1.878 8.119 -0.461
55 HD21 ASN 11 HD22 ASN 11 -1.244 9.823 0.631
56 HD22 ASN 11 HD21 ASN 11 -1.239 11.454 0.064
57 H THR 12 H THR 12 0.517 6.265 -1.291
58 HA THR 12 HA THR 12 2.595 8.236 -0.671
59 HB THR 12 HB THR 12 2.442 5.390 0.318
60 HG1 THR 12 HG1 THR 12 0.543 6.315 0.994
61 HG21 THR 12 HG21 THR 12 4.130 5.919 1.719
62 HG22 THR 12 HG22 THR 12 3.532 7.556 1.989
63 HG23 THR 12 HG23 THR 12 4.461 7.185 0.537
64 HA PRO 13 HA PRO 13 5.067 6.640 -4.032
65 HB2 PRO 13 HB2 PRO 13 7.378 7.915 -3.299
66 HB3 PRO 13 HB3 PRO 13 6.065 8.695 -4.185
67 HG2 PRO 13 HG3 PRO 13 6.699 8.788 -1.264
68 HG3 PRO 13 HG2 PRO 13 6.169 10.095 -2.340
69 HD2 PRO 13 HD3 PRO 13 4.476 8.855 -0.645
70 HD3 PRO 13 HD2 PRO 13 3.953 9.454 -2.233
71 H GLY 14 H GLY 14 6.327 4.860 -4.235
72 HA2 GLY 14 HA3 GLY 14 8.024 3.347 -3.621
73 HA3 GLY 14 HA2 GLY 14 7.974 3.990 -1.984
74 H CYS 15 H CYS 15 4.906 3.788 -2.371
75 HA CYS 15 HA CYS 15 4.712 1.133 -1.223
76 HB2 CYS 15 HB3 CYS 15 2.692 3.357 -1.577
77 HB3 CYS 15 HB2 CYS 15 2.322 1.806 -0.834
78 H SER 16 H SER 16 3.877 -0.594 -2.195
79 HA SER 16 HA SER 16 2.894 -0.298 -4.949
80 HB2 SER 16 HB3 SER 16 4.093 -2.761 -3.655
81 HB3 SER 16 HB2 SER 16 3.731 -2.527 -5.366
82 HG SER 16 HG SER 16 5.423 -0.678 -4.152
83 H CYS 17 H CYS 17 0.903 -1.121 -5.444
84 HA CYS 17 HA CYS 17 -0.879 -1.596 -3.314
85 HB2 CYS 17 HB3 CYS 17 -1.591 -0.606 -5.453
86 HB3 CYS 17 HB2 CYS 17 -1.304 -2.150 -6.251
87 H THR 18 H THR 18 -1.400 -3.325 -2.281
88 HA THR 18 HA THR 18 -0.977 -5.981 -3.459
89 HB THR 18 HB THR 18 -0.468 -5.411 -0.532
90 HG1 THR 18 HG1 THR 18 1.105 -4.763 -2.663
91 HG21 THR 18 HG21 THR 18 -0.849 -7.727 -1.012
92 HG22 THR 18 HG22 THR 18 0.885 -7.518 -0.765
93 HG23 THR 18 HG23 THR 18 0.240 -7.676 -2.398
94 H TRP 19 H TRP 19 -3.241 -5.205 -3.886
95 HA TRP 19 HA TRP 19 -5.299 -4.564 -2.461
96 HB2 TRP 19 HB3 TRP 19 -5.081 -5.860 -4.821
97 HB3 TRP 19 HB2 TRP 19 -5.895 -7.092 -3.862
98 HD1 TRP 19 HD1 TRP 19 -6.485 -3.794 -5.596
99 HE1 TRP 19 HE1 TRP 19 -8.968 -3.141 -5.392
100 HE3 TRP 19 HE3 TRP 19 -7.964 -7.310 -2.197
101 HZ2 TRP 19 HZ2 TRP 19 -11.250 -4.007 -3.966
102 HZ3 TRP 19 HZ3 TRP 19 -10.301 -7.321 -1.450
103 HH2 TRP 19 HH2 TRP 19 -11.917 -5.706 -2.322
104 HA PRO 20 HA PRO 20 -6.737 -4.251 -1.550
105 HB2 PRO 20 HB2 PRO 20 -8.239 -3.929 0.609
106 HB3 PRO 20 HB3 PRO 20 -8.649 -5.152 -0.598
107 HG2 PRO 20 HG3 PRO 20 -7.465 -5.486 2.104
108 HG3 PRO 20 HG2 PRO 20 -8.519 -6.580 1.196
109 HD2 PRO 20 HD3 PRO 20 -5.671 -6.679 1.413
110 HD3 PRO 20 HD2 PRO 20 -6.718 -7.718 0.428
111 H ILE 21 H ILE 21 -4.019 -4.547 -0.105
112 HA ILE 21 HA ILE 21 -4.162 -1.947 1.235
113 HB ILE 21 HB ILE 21 -2.690 -2.705 3.042
114 HG12 ILE 21 HG13 ILE 21 -3.116 -5.488 1.927
115 HG13 ILE 21 HG12 ILE 21 -1.618 -4.574 1.796
116 HG21 ILE 21 HG21 ILE 21 -4.948 -2.706 3.656
117 HG22 ILE 21 HG22 ILE 21 -4.368 -4.296 4.151
118 HG23 ILE 21 HG23 ILE 21 -5.312 -4.122 2.668
119 HD11 ILE 21 HD11 ILE 21 -1.524 -4.530 4.288
120 HD12 ILE 21 HD12 ILE 21 -1.380 -6.135 3.570
121 HD13 ILE 21 HD13 ILE 21 -2.904 -5.629 4.299
122 H CYS 22 H CYS 22 -2.366 -0.673 1.005
123 HA CYS 22 HA CYS 22 -0.484 -1.526 -1.046
124 HB2 CYS 22 HB3 CYS 22 -1.641 0.764 -0.947
125 HB3 CYS 22 HB2 CYS 22 -0.458 1.160 0.289
126 H THR 23 H THR 23 1.678 -1.668 -0.790
127 HA THR 23 HA THR 23 2.764 -1.480 1.939
128 HB THR 23 HB THR 23 4.012 -3.602 1.541
129 HG1 THR 23 HG1 THR 23 2.201 -4.359 -0.455
130 HG21 THR 23 HG21 THR 23 2.232 -4.000 2.949
131 HG22 THR 23 HG22 THR 23 1.843 -5.088 1.616
132 HG23 THR 23 HG23 THR 23 1.036 -3.525 1.744
133 H ARG 24 H ARG 24 4.670 -0.408 1.991
134 HA ARG 24 HA ARG 24 6.017 0.104 -0.537
135 HB2 ARG 24 HB3 ARG 24 7.326 1.748 0.696
136 HB3 ARG 24 HB2 ARG 24 5.613 2.036 0.913
137 HG2 ARG 24 HG3 ARG 24 5.666 1.469 3.135
138 HG3 ARG 24 HG2 ARG 24 7.088 0.435 2.948
139 HD2 ARG 24 HD3 ARG 24 7.063 3.447 2.760
140 HD3 ARG 24 HD2 ARG 24 7.622 2.510 4.147
141 HE ARG 24 HE ARG 24 9.077 1.545 2.032
142 HH11 ARG 24 HH11 ARG 24 8.611 4.724 3.439
143 HH12 ARG 24 HH12 ARG 24 10.188 5.280 2.997
144 HH21 ARG 24 HH22 ARG 24 11.107 2.238 1.453
145 HH22 ARG 24 HH21 ARG 24 11.631 3.853 1.850
146 H ASP 25 H ASP 25 7.789 -0.955 -1.109
147 HA ASP 25 HA ASP 25 9.513 -2.444 -1.089
148 HB2 ASP 25 HB3 ASP 25 9.835 -1.667 1.823
149 HB3 ASP 25 HB2 ASP 25 11.060 -2.380 0.781
150 H GLY 26 H GLY 26 6.773 -3.244 -0.298
151 HA2 GLY 26 HA3 GLY 26 5.823 -5.317 0.100
152 HA3 GLY 26 HA2 GLY 26 7.403 -5.920 0.576
153 H LEU 27 H LEU 27 6.659 -3.045 2.167
154 HA LEU 27 HA LEU 27 5.804 -4.556 4.548
155 HB2 LEU 27 HB3 LEU 27 7.344 -1.962 4.388
156 HB3 LEU 27 HB2 LEU 27 6.842 -2.753 5.870
157 HG LEU 27 HG LEU 27 8.780 -3.904 3.860
158 HD11 LEU 27 HD11 LEU 27 9.347 -2.833 6.615
159 HD12 LEU 27 HD12 LEU 27 9.589 -1.908 5.132
160 HD13 LEU 27 HD13 LEU 27 10.510 -3.387 5.409
161 HD21 LEU 27 HD21 LEU 27 8.284 -4.894 6.647
162 HD22 LEU 27 HD22 LEU 27 9.073 -5.716 5.301
163 HD23 LEU 27 HD23 LEU 27 7.326 -5.473 5.284
164 HA PRO 28 HA PRO 28 2.054 -2.181 4.226
165 HB2 PRO 28 HB2 PRO 28 1.344 -3.262 6.835
166 HB3 PRO 28 HB3 PRO 28 0.636 -3.616 5.258
167 HG2 PRO 28 HG3 PRO 28 2.110 -5.419 6.651
168 HG3 PRO 28 HG2 PRO 28 2.039 -5.391 4.880
169 HD2 PRO 28 HD3 PRO 28 4.160 -4.326 6.710
170 HD3 PRO 28 HD2 PRO 28 4.334 -5.216 5.180
171 H VAL 29 H VAL 29 4.098 -0.584 4.954
172 HA VAL 29 HA VAL 29 3.565 0.576 7.552
173 HB VAL 29 HB VAL 29 5.489 1.531 5.427
174 HG11 VAL 29 HG11 VAL 29 6.578 2.754 7.195
175 HG12 VAL 29 HG12 VAL 29 5.458 2.098 8.388
176 HG13 VAL 29 HG13 VAL 29 4.874 3.204 7.145
177 HG21 VAL 29 HG21 VAL 29 6.006 -0.760 6.101
178 HG22 VAL 29 HG22 VAL 29 6.020 -0.263 7.793
179 HG23 VAL 29 HG23 VAL 29 7.232 0.369 6.678
Start of MODEL 3
1 H1 CYS 1 H CYS 1 3.341 0.705 4.216
2 HA CYS 1 HA CYS 1 2.724 3.439 4.498
3 HB2 CYS 1 HB3 CYS 1 1.100 1.628 2.746
4 HB3 CYS 1 HB2 CYS 1 1.686 3.258 2.422
5 H GLY 2 H GLY 2 0.901 0.491 5.116
6 HA2 GLY 2 HA3 GLY 2 -0.842 0.117 6.579
7 HA3 GLY 2 HA2 GLY 2 -0.758 1.806 7.047
8 H GLU 3 H GLU 3 -1.112 2.866 4.420
9 HA GLU 3 HA GLU 3 -3.875 3.131 4.339
10 HB2 GLU 3 HB3 GLU 3 -3.538 4.210 2.153
11 HB3 GLU 3 HB2 GLU 3 -2.399 4.784 3.363
12 HG2 GLU 3 HG3 GLU 3 -0.617 3.598 2.406
13 HG3 GLU 3 HG2 GLU 3 -1.696 2.608 1.425
14 H THR 4 H THR 4 -5.489 2.218 3.233
15 HA THR 4 HA THR 4 -4.983 -0.358 1.989
16 HB THR 4 HB THR 4 -7.510 -0.469 1.944
17 HG1 THR 4 HG1 THR 4 -7.619 1.955 2.096
18 HG21 THR 4 HG21 THR 4 -5.786 -0.382 4.325
19 HG22 THR 4 HG22 THR 4 -6.903 -1.633 3.780
20 HG23 THR 4 HG23 THR 4 -7.511 -0.230 4.657
21 H CYS 5 H CYS 5 -4.723 -0.487 -0.177
22 HA CYS 5 HA CYS 5 -5.497 1.776 -1.818
23 HB2 CYS 5 HB3 CYS 5 -4.295 0.595 -3.635
24 HB3 CYS 5 HB2 CYS 5 -3.294 0.855 -2.212
25 H PHE 6 H PHE 6 -7.758 1.053 -1.055
26 HA PHE 6 HA PHE 6 -9.109 -1.129 -2.109
27 HB2 PHE 6 HB3 PHE 6 -10.027 0.416 -0.406
28 HB3 PHE 6 HB2 PHE 6 -10.190 1.662 -1.636
29 HD1 PHE 6 HD1 PHE 6 -11.106 -1.955 -1.401
30 HD2 PHE 6 HD2 PHE 6 -12.363 2.025 -2.232
31 HE1 PHE 6 HE1 PHE 6 -13.362 -2.782 -1.934
32 HE2 PHE 6 HE2 PHE 6 -14.620 1.205 -2.766
33 HZ PHE 6 HZ PHE 6 -15.122 -1.201 -2.617
34 H GLY 7 H GLY 7 -8.485 2.044 -3.542
35 HA2 GLY 7 HA3 GLY 7 -9.825 1.233 -6.009
36 HA3 GLY 7 HA2 GLY 7 -9.235 2.844 -5.633
37 H GLY 8 H GLY 8 -7.150 0.136 -5.052
38 HA2 GLY 8 HA3 GLY 8 -5.325 -0.693 -6.190
39 HA3 GLY 8 HA2 GLY 8 -5.912 0.112 -7.633
40 H THR 9 H THR 9 -5.918 2.753 -6.254
41 HA THR 9 HA THR 9 -3.126 3.364 -6.751
42 HB THR 9 HB THR 9 -5.186 5.392 -5.947
43 HG1 THR 9 HG1 THR 9 -5.418 3.701 -8.013
44 HG21 THR 9 HG21 THR 9 -2.518 5.479 -6.866
45 HG22 THR 9 HG22 THR 9 -3.610 6.836 -6.584
46 HG23 THR 9 HG23 THR 9 -3.528 6.085 -8.178
47 H CYS 10 H CYS 10 -1.797 4.509 -5.311
48 HA CYS 10 HA CYS 10 -2.571 4.363 -2.477
49 HB2 CYS 10 HB3 CYS 10 0.203 3.961 -3.624
50 HB3 CYS 10 HB2 CYS 10 -0.233 3.888 -1.920
51 H ASN 11 H ASN 11 -1.814 6.021 -1.134
52 HA ASN 11 HA ASN 11 -1.443 8.557 -2.515
53 HB2 ASN 11 HB3 ASN 11 -3.104 8.377 -0.712
54 HB3 ASN 11 HB2 ASN 11 -1.834 7.926 0.420
55 HD21 ASN 11 HD22 ASN 11 -1.048 9.494 1.614
56 HD22 ASN 11 HD21 ASN 11 -1.100 11.180 1.245
57 H THR 12 H THR 12 0.438 6.253 -0.785
58 HA THR 12 HA THR 12 2.581 8.196 -0.315
59 HB THR 12 HB THR 12 2.538 5.302 0.533
60 HG1 THR 12 HG1 THR 12 0.721 6.204 1.450
61 HG21 THR 12 HG21 THR 12 4.162 5.947 2.143
62 HG22 THR 12 HG22 THR 12 3.909 7.661 1.813
63 HG23 THR 12 HG23 THR 12 4.680 6.635 0.603
64 HA PRO 13 HA PRO 13 4.632 6.765 -4.021
65 HB2 PRO 13 HB2 PRO 13 6.993 8.063 -3.538
66 HB3 PRO 13 HB3 PRO 13 5.564 8.849 -4.217
67 HG2 PRO 13 HG3 PRO 13 6.568 8.844 -1.400
68 HG3 PRO 13 HG2 PRO 13 5.886 10.181 -2.345
69 HD2 PRO 13 HD3 PRO 13 4.442 8.842 -0.501
70 HD3 PRO 13 HD2 PRO 13 3.711 9.498 -1.980
71 H GLY 14 H GLY 14 5.880 5.015 -4.436
72 HA2 GLY 14 HA3 GLY 14 7.685 3.536 -4.077
73 HA3 GLY 14 HA2 GLY 14 7.793 4.106 -2.417
74 H CYS 15 H CYS 15 4.711 3.839 -2.472
75 HA CYS 15 HA CYS 15 4.704 1.115 -1.470
76 HB2 CYS 15 HB3 CYS 15 2.602 3.293 -1.442
77 HB3 CYS 15 HB2 CYS 15 2.381 1.697 -0.736
78 H SER 16 H SER 16 3.767 -0.568 -2.445
79 HA SER 16 HA SER 16 2.508 -0.114 -5.062
80 HB2 SER 16 HB3 SER 16 3.792 -2.652 -4.015
81 HB3 SER 16 HB2 SER 16 3.261 -2.335 -5.667
82 HG SER 16 HG SER 16 5.083 -0.546 -4.569
83 H CYS 17 H CYS 17 0.467 -0.887 -5.405
84 HA CYS 17 HA CYS 17 -1.112 -1.446 -3.144
85 HB2 CYS 17 HB3 CYS 17 -2.014 -0.359 -5.156
86 HB3 CYS 17 HB2 CYS 17 -1.820 -1.866 -6.047
87 H THR 18 H THR 18 -1.548 -3.198 -2.140
88 HA THR 18 HA THR 18 -1.269 -5.812 -3.450
89 HB THR 18 HB THR 18 -0.570 -5.363 -0.540
90 HG1 THR 18 HG1 THR 18 0.845 -4.547 -2.674
91 HG21 THR 18 HG21 THR 18 0.602 -7.494 -2.263
92 HG22 THR 18 HG22 THR 18 -1.078 -7.664 -1.753
93 HG23 THR 18 HG23 THR 18 0.201 -7.526 -0.546
94 H TRP 19 H TRP 19 -3.520 -4.869 -3.680
95 HA TRP 19 HA TRP 19 -5.466 -4.255 -2.117
96 HB2 TRP 19 HB3 TRP 19 -5.441 -5.386 -4.554
97 HB3 TRP 19 HB2 TRP 19 -6.209 -6.680 -3.640
98 HD1 TRP 19 HD1 TRP 19 -6.881 -3.282 -5.121
99 HE1 TRP 19 HE1 TRP 19 -9.338 -2.628 -4.709
100 HE3 TRP 19 HE3 TRP 19 -8.153 -6.966 -1.817
101 HZ2 TRP 19 HZ2 TRP 19 -11.523 -3.560 -3.180
102 HZ3 TRP 19 HZ3 TRP 19 -10.434 -7.008 -0.914
103 HH2 TRP 19 HH2 TRP 19 -12.090 -5.341 -1.585
104 HA PRO 20 HA PRO 20 -6.829 -3.931 -1.111
105 HB2 PRO 20 HB2 PRO 20 -8.191 -3.661 1.142
106 HB3 PRO 20 HB3 PRO 20 -8.723 -4.801 -0.096
107 HG2 PRO 20 HG3 PRO 20 -7.394 -5.322 2.510
108 HG3 PRO 20 HG2 PRO 20 -8.559 -6.318 1.623
109 HD2 PRO 20 HD3 PRO 20 -5.715 -6.570 1.650
110 HD3 PRO 20 HD2 PRO 20 -6.873 -7.497 0.676
111 H ILE 21 H ILE 21 -4.046 -4.416 0.121
112 HA ILE 21 HA ILE 21 -3.983 -1.901 1.623
113 HB ILE 21 HB ILE 21 -2.408 -2.825 3.258
114 HG12 ILE 21 HG13 ILE 21 -3.031 -5.515 2.012
115 HG13 ILE 21 HG12 ILE 21 -1.510 -4.649 1.824
116 HG21 ILE 21 HG21 ILE 21 -4.623 -2.779 4.028
117 HG22 ILE 21 HG22 ILE 21 -4.055 -4.404 4.410
118 HG23 ILE 21 HG23 ILE 21 -5.100 -4.141 3.011
119 HD11 ILE 21 HD11 ILE 21 -2.245 -4.994 4.606
120 HD12 ILE 21 HD12 ILE 21 -0.745 -5.394 3.769
121 HD13 ILE 21 HD13 ILE 21 -2.098 -6.526 3.745
122 H CYS 22 H CYS 22 -2.204 -0.653 1.272
123 HA CYS 22 HA CYS 22 -0.505 -1.448 -0.951
124 HB2 CYS 22 HB3 CYS 22 -1.607 0.869 -0.576
125 HB3 CYS 22 HB2 CYS 22 -0.242 1.162 0.489
126 H THR 23 H THR 23 1.665 -1.648 -0.883
127 HA THR 23 HA THR 23 2.983 -1.618 1.749
128 HB THR 23 HB THR 23 4.133 -3.744 1.160
129 HG1 THR 23 HG1 THR 23 2.189 -4.414 -0.719
130 HG21 THR 23 HG21 THR 23 2.449 -4.189 2.666
131 HG22 THR 23 HG22 THR 23 1.932 -5.185 1.304
132 HG23 THR 23 HG23 THR 23 1.183 -3.613 1.582
133 H ARG 24 H ARG 24 4.931 -0.617 1.693
134 HA ARG 24 HA ARG 24 6.040 0.058 -0.906
135 HB2 ARG 24 HB3 ARG 24 7.517 1.552 0.303
136 HB3 ARG 24 HB2 ARG 24 5.857 1.839 0.783
137 HG2 ARG 24 HG3 ARG 24 6.186 0.842 2.886
138 HG3 ARG 24 HG2 ARG 24 7.711 0.105 2.386
139 HD2 ARG 24 HD3 ARG 24 7.124 2.983 3.009
140 HD3 ARG 24 HD2 ARG 24 8.350 1.931 3.713
141 HE ARG 24 HE ARG 24 8.708 3.616 1.516
142 HH11 ARG 24 HH11 ARG 24 9.494 0.329 2.474
143 HH12 ARG 24 HH12 ARG 24 10.769 0.167 1.301
144 HH21 ARG 24 HH22 ARG 24 10.437 3.381 0.011
145 HH22 ARG 24 HH21 ARG 24 11.295 1.868 -0.070
146 H ASP 25 H ASP 25 7.604 -1.095 -1.788
147 HA ASP 25 HA ASP 25 9.181 -2.694 -2.127
148 HB2 ASP 25 HB3 ASP 25 10.016 -1.847 0.656
149 HB3 ASP 25 HB2 ASP 25 10.924 -2.999 -0.314
150 H GLY 26 H GLY 26 6.585 -3.419 -1.069
151 HA2 GLY 26 HA3 GLY 26 5.571 -5.446 -0.622
152 HA3 GLY 26 HA2 GLY 26 7.161 -6.152 -0.381
153 H LEU 27 H LEU 27 6.794 -3.345 1.444
154 HA LEU 27 HA LEU 27 6.183 -4.960 3.829
155 HB2 LEU 27 HB3 LEU 27 7.741 -2.382 3.607
156 HB3 LEU 27 HB2 LEU 27 7.413 -3.241 5.099
157 HG LEU 27 HG LEU 27 9.058 -4.315 2.805
158 HD11 LEU 27 HD11 LEU 27 10.229 -2.511 3.870
159 HD12 LEU 27 HD12 LEU 27 10.945 -4.036 4.391
160 HD13 LEU 27 HD13 LEU 27 9.860 -3.157 5.469
161 HD21 LEU 27 HD21 LEU 27 9.629 -5.741 5.102
162 HD22 LEU 27 HD22 LEU 27 8.640 -6.291 3.750
163 HD23 LEU 27 HD23 LEU 27 7.877 -5.547 5.154
164 HA PRO 28 HA PRO 28 2.463 -2.521 4.075
165 HB2 PRO 28 HB2 PRO 28 1.533 -3.553 6.392
166 HB3 PRO 28 HB3 PRO 28 1.489 -4.451 4.870
167 HG2 PRO 28 HG3 PRO 28 3.436 -4.654 7.133
168 HG3 PRO 28 HG2 PRO 28 2.682 -5.950 6.185
169 HD2 PRO 28 HD3 PRO 28 5.216 -5.053 5.739
170 HD3 PRO 28 HD2 PRO 28 4.187 -5.734 4.465
171 H VAL 29 H VAL 29 4.625 -1.023 4.682
172 HA VAL 29 HA VAL 29 4.392 -0.019 7.387
173 HB VAL 29 HB VAL 29 6.121 1.022 5.138
174 HG11 VAL 29 HG11 VAL 29 7.156 1.405 7.795
175 HG12 VAL 29 HG12 VAL 29 5.550 2.119 7.645
176 HG13 VAL 29 HG13 VAL 29 6.835 2.596 6.534
177 HG21 VAL 29 HG21 VAL 29 7.537 -0.662 5.441
178 HG22 VAL 29 HG22 VAL 29 6.324 -1.434 6.463
179 HG23 VAL 29 HG23 VAL 29 7.556 -0.398 7.184
Start of MODEL 4
1 H1 CYS 1 H CYS 1 2.935 0.825 4.260
2 HA CYS 1 HA CYS 1 2.282 3.563 4.438
3 HB2 CYS 1 HB3 CYS 1 0.778 1.734 2.612
4 HB3 CYS 1 HB2 CYS 1 1.451 3.332 2.291
5 H GLY 2 H GLY 2 0.409 0.614 4.932
6 HA2 GLY 2 HA3 GLY 2 -1.437 0.254 6.267
7 HA3 GLY 2 HA2 GLY 2 -1.381 1.944 6.732
8 H GLU 3 H GLU 3 -1.536 2.986 4.069
9 HA GLU 3 HA GLU 3 -4.276 3.285 3.793
10 HB2 GLU 3 HB3 GLU 3 -3.775 4.284 1.585
11 HB3 GLU 3 HB2 GLU 3 -2.747 4.901 2.871
12 HG2 GLU 3 HG3 GLU 3 -0.895 3.624 2.119
13 HG3 GLU 3 HG2 GLU 3 -1.903 2.706 1.001
14 H THR 4 H THR 4 -5.846 2.327 2.681
15 HA THR 4 HA THR 4 -5.300 -0.274 1.506
16 HB THR 4 HB THR 4 -7.830 -0.376 1.383
17 HG1 THR 4 HG1 THR 4 -7.974 2.027 1.490
18 HG21 THR 4 HG21 THR 4 -7.903 -0.121 4.089
19 HG22 THR 4 HG22 THR 4 -6.168 -0.268 3.810
20 HG23 THR 4 HG23 THR 4 -7.262 -1.528 3.240
21 H CYS 5 H CYS 5 -4.841 -0.365 -0.616
22 HA CYS 5 HA CYS 5 -5.674 1.798 -2.356
23 HB2 CYS 5 HB3 CYS 5 -4.222 0.749 -4.034
24 HB3 CYS 5 HB2 CYS 5 -3.372 1.030 -2.520
25 H PHE 6 H PHE 6 -7.954 0.811 -1.746
26 HA PHE 6 HA PHE 6 -8.913 -1.473 -3.034
27 HB2 PHE 6 HB3 PHE 6 -10.209 1.043 -2.062
28 HB3 PHE 6 HB2 PHE 6 -11.148 -0.088 -3.029
29 HD1 PHE 6 HD2 PHE 6 -8.625 -0.568 -0.312
30 HD2 PHE 6 HD1 PHE 6 -12.599 -1.225 -1.683
31 HE1 PHE 6 HE2 PHE 6 -9.096 -1.907 1.698
32 HE2 PHE 6 HE1 PHE 6 -13.076 -2.563 0.325
33 HZ PHE 6 HZ PHE 6 -11.322 -2.907 2.018
34 H GLY 7 H GLY 7 -8.526 1.822 -4.230
35 HA2 GLY 7 HA3 GLY 7 -9.725 1.122 -6.791
36 HA3 GLY 7 HA2 GLY 7 -9.139 2.708 -6.314
37 H GLY 8 H GLY 8 -7.000 0.096 -5.711
38 HA2 GLY 8 HA3 GLY 8 -5.013 -0.540 -6.659
39 HA3 GLY 8 HA2 GLY 8 -5.739 -0.153 -8.209
40 H THR 9 H THR 9 -5.089 2.041 -5.514
41 HA THR 9 HA THR 9 -2.858 3.249 -6.938
42 HB THR 9 HB THR 9 -5.077 5.060 -6.022
43 HG1 THR 9 HG1 THR 9 -5.075 3.426 -8.229
44 HG21 THR 9 HG21 THR 9 -2.605 5.304 -7.671
45 HG22 THR 9 HG22 THR 9 -3.222 6.363 -6.403
46 HG23 THR 9 HG23 THR 9 -3.961 6.382 -8.004
47 H CYS 10 H CYS 10 -1.558 4.555 -5.570
48 HA CYS 10 HA CYS 10 -2.239 4.446 -2.714
49 HB2 CYS 10 HB3 CYS 10 0.517 3.967 -3.867
50 HB3 CYS 10 HB2 CYS 10 0.071 3.914 -2.165
51 H ASN 11 H ASN 11 -1.630 6.169 -1.489
52 HA ASN 11 HA ASN 11 -1.046 8.618 -2.953
53 HB2 ASN 11 HB3 ASN 11 -2.882 8.572 -1.312
54 HB3 ASN 11 HB2 ASN 11 -1.740 8.154 -0.041
55 HD21 ASN 11 HD22 ASN 11 -1.057 9.768 1.150
56 HD22 ASN 11 HD21 ASN 11 -1.014 11.431 0.689
57 H THR 12 H THR 12 0.586 6.318 -1.013
58 HA THR 12 HA THR 12 2.739 8.201 -0.366
59 HB THR 12 HB THR 12 2.532 5.323 0.510
60 HG1 THR 12 HG1 THR 12 0.664 6.255 1.257
61 HG21 THR 12 HG21 THR 12 3.833 7.663 1.892
62 HG22 THR 12 HG22 THR 12 4.692 6.610 0.769
63 HG23 THR 12 HG23 THR 12 4.016 5.947 2.256
64 HA PRO 13 HA PRO 13 5.064 6.643 -3.854
65 HB2 PRO 13 HB2 PRO 13 7.413 7.879 -3.191
66 HB3 PRO 13 HB3 PRO 13 6.070 8.699 -3.994
67 HG2 PRO 13 HG3 PRO 13 6.835 8.699 -1.104
68 HG3 PRO 13 HG2 PRO 13 6.279 10.045 -2.117
69 HD2 PRO 13 HD3 PRO 13 4.644 8.774 -0.385
70 HD3 PRO 13 HD2 PRO 13 4.061 9.438 -1.925
71 H GLY 14 H GLY 14 6.351 4.884 -4.152
72 HA2 GLY 14 HA3 GLY 14 8.055 3.352 -3.608
73 HA3 GLY 14 HA2 GLY 14 8.022 3.937 -1.949
74 H CYS 15 H CYS 15 4.962 3.756 -2.264
75 HA CYS 15 HA CYS 15 4.777 1.051 -1.240
76 HB2 CYS 15 HB3 CYS 15 2.766 3.300 -1.444
77 HB3 CYS 15 HB2 CYS 15 2.405 1.721 -0.759
78 H SER 16 H SER 16 3.865 -0.619 -2.252
79 HA SER 16 HA SER 16 2.877 -0.197 -4.988
80 HB2 SER 16 HB3 SER 16 3.948 -2.754 -3.763
81 HB3 SER 16 HB2 SER 16 3.608 -2.450 -5.467
82 HG SER 16 HG SER 16 5.356 -0.679 -4.263
83 H CYS 17 H CYS 17 0.841 -0.896 -5.495
84 HA CYS 17 HA CYS 17 -0.921 -1.402 -3.335
85 HB2 CYS 17 HB3 CYS 17 -1.651 -0.176 -5.323
86 HB3 CYS 17 HB2 CYS 17 -1.445 -1.629 -6.296
87 H THR 18 H THR 18 -1.366 -3.179 -2.388
88 HA THR 18 HA THR 18 -1.262 -5.721 -3.843
89 HB THR 18 HB THR 18 -0.596 -6.697 -1.504
90 HG1 THR 18 HG1 THR 18 -0.722 -4.434 -0.610
91 HG21 THR 18 HG21 THR 18 1.041 -5.578 -3.672
92 HG22 THR 18 HG22 THR 18 1.062 -7.185 -2.948
93 HG23 THR 18 HG23 THR 18 1.909 -5.853 -2.160
94 H TRP 19 H TRP 19 -3.474 -5.031 -4.085
95 HA TRP 19 HA TRP 19 -5.432 -4.337 -2.526
96 HB2 TRP 19 HB3 TRP 19 -5.358 -5.648 -4.905
97 HB3 TRP 19 HB2 TRP 19 -6.187 -6.830 -3.896
98 HD1 TRP 19 HD1 TRP 19 -6.664 -3.437 -5.534
99 HE1 TRP 19 HE1 TRP 19 -9.116 -2.701 -5.260
100 HE3 TRP 19 HE3 TRP 19 -8.228 -7.054 -2.281
101 HZ2 TRP 19 HZ2 TRP 19 -11.408 -3.545 -3.837
102 HZ3 TRP 19 HZ3 TRP 19 -10.554 -7.010 -1.496
103 HH2 TRP 19 HH2 TRP 19 -12.117 -5.295 -2.264
104 HA PRO 20 HA PRO 20 -6.893 -4.067 -1.596
105 HB2 PRO 20 HB2 PRO 20 -8.324 -3.764 0.619
106 HB3 PRO 20 HB3 PRO 20 -8.760 -4.986 -0.581
107 HG2 PRO 20 HG3 PRO 20 -7.495 -5.319 2.083
108 HG3 PRO 20 HG2 PRO 20 -8.551 -6.428 1.191
109 HD2 PRO 20 HD3 PRO 20 -5.694 -6.465 1.338
110 HD3 PRO 20 HD2 PRO 20 -6.746 -7.529 0.383
111 H ILE 21 H ILE 21 -4.131 -4.355 -0.144
112 HA ILE 21 HA ILE 21 -4.273 -1.698 1.069
113 HB ILE 21 HB ILE 21 -2.948 -2.280 2.980
114 HG12 ILE 21 HG13 ILE 21 -1.662 -4.137 1.801
115 HG13 ILE 21 HG12 ILE 21 -2.076 -4.424 3.485
116 HG21 ILE 21 HG21 ILE 21 -5.422 -3.880 2.521
117 HG22 ILE 21 HG22 ILE 21 -5.143 -2.510 3.600
118 HG23 ILE 21 HG23 ILE 21 -4.508 -4.103 4.016
119 HD11 ILE 21 HD11 ILE 21 -3.449 -5.583 1.072
120 HD12 ILE 21 HD12 ILE 21 -3.970 -5.819 2.740
121 HD13 ILE 21 HD13 ILE 21 -2.403 -6.431 2.211
122 H CYS 22 H CYS 22 -2.368 -0.516 0.991
123 HA CYS 22 HA CYS 22 -0.542 -1.379 -1.108
124 HB2 CYS 22 HB3 CYS 22 -1.599 0.970 -0.871
125 HB3 CYS 22 HB2 CYS 22 -0.337 1.246 0.319
126 H THR 23 H THR 23 1.610 -1.627 -0.868
127 HA THR 23 HA THR 23 2.724 -1.577 1.853
128 HB THR 23 HB THR 23 3.870 -3.777 1.301
129 HG1 THR 23 HG1 THR 23 1.757 -4.329 -0.468
130 HG21 THR 23 HG21 THR 23 1.693 -5.122 1.706
131 HG22 THR 23 HG22 THR 23 0.922 -3.538 1.799
132 HG23 THR 23 HG23 THR 23 2.210 -3.960 2.927
133 H ARG 24 H ARG 24 4.687 -0.619 1.902
134 HA ARG 24 HA ARG 24 6.023 -0.109 -0.630
135 HB2 ARG 24 HB3 ARG 24 7.428 1.429 0.605
136 HB3 ARG 24 HB2 ARG 24 5.746 1.771 0.945
137 HG2 ARG 24 HG3 ARG 24 5.937 1.218 3.128
138 HG3 ARG 24 HG2 ARG 24 7.139 -0.039 2.820
139 HD2 ARG 24 HD3 ARG 24 7.616 2.940 2.783
140 HD3 ARG 24 HD2 ARG 24 8.140 1.815 4.036
141 HE ARG 24 HE ARG 24 9.143 0.955 1.540
142 HH11 ARG 24 HH11 ARG 24 9.624 3.528 3.875
143 HH12 ARG 24 HH12 ARG 24 11.282 3.771 3.444
144 HH21 ARG 24 HH22 ARG 24 11.286 1.252 0.972
145 HH22 ARG 24 HH21 ARG 24 12.243 2.464 1.776
146 H ASP 25 H ASP 25 7.733 -1.237 -1.281
147 HA ASP 25 HA ASP 25 9.369 -2.822 -1.359
148 HB2 ASP 25 HB3 ASP 25 9.788 -2.180 1.575
149 HB3 ASP 25 HB2 ASP 25 10.947 -2.934 0.491
150 H GLY 26 H GLY 26 6.611 -3.507 -0.553
151 HA2 GLY 26 HA3 GLY 26 5.536 -5.522 -0.188
152 HA3 GLY 26 HA2 GLY 26 7.092 -6.246 0.190
153 H LEU 27 H LEU 27 6.493 -3.384 1.910
154 HA LEU 27 HA LEU 27 5.709 -4.952 4.278
155 HB2 LEU 27 HB3 LEU 27 7.334 -2.409 4.137
156 HB3 LEU 27 HB2 LEU 27 6.868 -3.232 5.614
157 HG LEU 27 HG LEU 27 8.673 -4.384 3.484
158 HD11 LEU 27 HD11 LEU 27 10.046 -4.107 5.893
159 HD12 LEU 27 HD12 LEU 27 9.181 -2.585 5.674
160 HD13 LEU 27 HD13 LEU 27 10.276 -3.166 4.419
161 HD21 LEU 27 HD21 LEU 27 8.389 -6.348 4.474
162 HD22 LEU 27 HD22 LEU 27 7.185 -5.631 5.545
163 HD23 LEU 27 HD23 LEU 27 8.883 -5.658 6.020
164 HA PRO 28 HA PRO 28 2.041 -2.439 4.231
165 HB2 PRO 28 HB2 PRO 28 0.965 -3.340 6.537
166 HB3 PRO 28 HB3 PRO 28 1.003 -4.319 5.065
167 HG2 PRO 28 HG3 PRO 28 2.808 -4.414 7.451
168 HG3 PRO 28 HG2 PRO 28 2.099 -5.753 6.529
169 HD2 PRO 28 HD3 PRO 28 4.665 -4.894 6.192
170 HD3 PRO 28 HD2 PRO 28 3.711 -5.648 4.900
171 H VAL 29 H VAL 29 4.163 -0.911 4.867
172 HA VAL 29 HA VAL 29 3.813 0.209 7.513
173 HB VAL 29 HB VAL 29 5.635 1.158 5.298
174 HG11 VAL 29 HG11 VAL 29 6.286 2.793 6.654
175 HG12 VAL 29 HG12 VAL 29 6.555 1.659 7.978
176 HG13 VAL 29 HG13 VAL 29 4.956 2.360 7.729
177 HG21 VAL 29 HG21 VAL 29 6.715 -0.338 7.610
178 HG22 VAL 29 HG22 VAL 29 7.244 -0.309 5.928
179 HG23 VAL 29 HG23 VAL 29 5.840 -1.269 6.395
Start of MODEL 5
1 H1 CYS 1 H CYS 1 3.452 1.099 4.043
2 HA CYS 1 HA CYS 1 2.782 3.836 4.237
3 HB2 CYS 1 HB3 CYS 1 1.000 2.059 2.672
4 HB3 CYS 1 HB2 CYS 1 1.820 3.542 2.187
5 H GLY 2 H GLY 2 1.067 0.863 5.035
6 HA2 GLY 2 HA3 GLY 2 -0.752 0.437 6.360
7 HA3 GLY 2 HA2 GLY 2 -0.389 1.960 7.157
8 H GLU 3 H GLU 3 -1.290 1.490 3.775
9 HA GLU 3 HA GLU 3 -3.819 2.870 4.346
10 HB2 GLU 3 HB3 GLU 3 -3.595 4.131 2.271
11 HB3 GLU 3 HB2 GLU 3 -2.233 4.448 3.335
12 HG2 GLU 3 HG3 GLU 3 -0.791 3.083 2.031
13 HG3 GLU 3 HG2 GLU 3 -2.141 2.462 1.082
14 H THR 4 H THR 4 -5.591 2.234 3.200
15 HA THR 4 HA THR 4 -5.386 -0.351 1.891
16 HB THR 4 HB THR 4 -7.923 -0.162 1.888
17 HG1 THR 4 HG1 THR 4 -7.851 2.200 2.135
18 HG21 THR 4 HG21 THR 4 -6.114 -0.502 4.154
19 HG22 THR 4 HG22 THR 4 -7.491 -1.483 3.650
20 HG23 THR 4 HG23 THR 4 -7.747 -0.043 4.636
21 H CYS 5 H CYS 5 -4.950 -0.332 -0.237
22 HA CYS 5 HA CYS 5 -5.720 1.948 -1.854
23 HB2 CYS 5 HB3 CYS 5 -4.414 0.816 -3.644
24 HB3 CYS 5 HB2 CYS 5 -3.484 1.117 -2.180
25 H PHE 6 H PHE 6 -8.029 1.077 -1.215
26 HA PHE 6 HA PHE 6 -9.150 -1.109 -2.545
27 HB2 PHE 6 HB3 PHE 6 -10.280 1.444 -1.457
28 HB3 PHE 6 HB2 PHE 6 -11.306 0.387 -2.421
29 HD1 PHE 6 HD2 PHE 6 -8.709 -0.358 0.158
30 HD2 PHE 6 HD1 PHE 6 -12.788 -0.646 -1.015
31 HE1 PHE 6 HE2 PHE 6 -9.183 -1.724 2.149
32 HE2 PHE 6 HE1 PHE 6 -13.269 -2.011 0.974
33 HZ PHE 6 HZ PHE 6 -11.465 -2.553 2.558
34 H GLY 7 H GLY 7 -8.552 2.179 -3.629
35 HA2 GLY 7 HA3 GLY 7 -9.881 1.700 -6.172
36 HA3 GLY 7 HA2 GLY 7 -9.125 3.200 -5.657
37 H GLY 8 H GLY 8 -7.223 0.384 -5.208
38 HA2 GLY 8 HA3 GLY 8 -5.475 -0.538 -6.399
39 HA3 GLY 8 HA2 GLY 8 -6.033 0.328 -7.818
40 H THR 9 H THR 9 -5.889 2.931 -6.410
41 HA THR 9 HA THR 9 -3.070 3.406 -6.898
42 HB THR 9 HB THR 9 -5.028 5.527 -6.078
43 HG1 THR 9 HG1 THR 9 -5.323 3.877 -8.174
44 HG21 THR 9 HG21 THR 9 -3.539 6.985 -6.964
45 HG22 THR 9 HG22 THR 9 -3.109 5.902 -8.289
46 HG23 THR 9 HG23 THR 9 -2.400 5.666 -6.692
47 H CYS 10 H CYS 10 -1.689 4.458 -5.437
48 HA CYS 10 HA CYS 10 -2.473 4.255 -2.609
49 HB2 CYS 10 HB3 CYS 10 0.283 3.875 -3.804
50 HB3 CYS 10 HB2 CYS 10 -0.114 3.786 -2.092
51 H ASN 11 H ASN 11 -1.759 5.865 -1.216
52 HA ASN 11 HA ASN 11 -1.339 8.445 -2.495
53 HB2 ASN 11 HB3 ASN 11 -1.841 7.674 0.389
54 HB3 ASN 11 HB2 ASN 11 -1.716 9.330 -0.198
55 HD21 ASN 11 HD22 ASN 11 -3.700 6.575 0.151
56 HD22 ASN 11 HD21 ASN 11 -5.130 7.242 -0.560
57 H THR 12 H THR 12 0.480 6.034 -0.898
58 HA THR 12 HA THR 12 2.643 7.911 -0.262
59 HB THR 12 HB THR 12 2.623 4.971 0.388
60 HG1 THR 12 HG1 THR 12 0.701 5.794 1.249
61 HG21 THR 12 HG21 THR 12 4.344 5.430 1.795
62 HG22 THR 12 HG22 THR 12 3.725 7.030 2.206
63 HG23 THR 12 HG23 THR 12 4.584 6.779 0.686
64 HA PRO 13 HA PRO 13 4.681 6.672 -4.044
65 HB2 PRO 13 HB2 PRO 13 7.071 7.881 -3.491
66 HB3 PRO 13 HB3 PRO 13 5.655 8.744 -4.101
67 HG2 PRO 13 HG3 PRO 13 6.676 8.518 -1.299
68 HG3 PRO 13 HG2 PRO 13 6.025 9.935 -2.144
69 HD2 PRO 13 HD3 PRO 13 4.556 8.506 -0.388
70 HD3 PRO 13 HD2 PRO 13 3.835 9.286 -1.809
71 H GLY 14 H GLY 14 5.886 4.929 -4.584
72 HA2 GLY 14 HA3 GLY 14 7.613 3.355 -4.371
73 HA3 GLY 14 HA2 GLY 14 7.843 3.864 -2.703
74 H CYS 15 H CYS 15 4.716 3.655 -2.671
75 HA CYS 15 HA CYS 15 4.718 0.941 -1.651
76 HB2 CYS 15 HB3 CYS 15 2.631 3.128 -1.614
77 HB3 CYS 15 HB2 CYS 15 2.407 1.537 -0.893
78 H SER 16 H SER 16 3.703 -0.746 -2.529
79 HA SER 16 HA SER 16 2.469 -0.375 -5.166
80 HB2 SER 16 HB3 SER 16 3.593 -2.929 -3.992
81 HB3 SER 16 HB2 SER 16 3.154 -2.624 -5.674
82 HG SER 16 HG SER 16 4.940 -0.798 -4.781
83 H CYS 17 H CYS 17 0.392 -1.053 -5.472
84 HA CYS 17 HA CYS 17 -1.172 -1.511 -3.152
85 HB2 CYS 17 HB3 CYS 17 -2.037 -0.271 -5.087
86 HB3 CYS 17 HB2 CYS 17 -1.983 -1.746 -6.047
87 H THR 18 H THR 18 -1.541 -3.272 -2.163
88 HA THR 18 HA THR 18 -1.533 -5.841 -3.592
89 HB THR 18 HB THR 18 -0.786 -5.507 -0.674
90 HG1 THR 18 HG1 THR 18 1.248 -5.149 -1.236
91 HG21 THR 18 HG21 THR 18 -0.903 -7.736 -0.708
92 HG22 THR 18 HG22 THR 18 0.458 -7.740 -1.830
93 HG23 THR 18 HG23 THR 18 -1.195 -7.743 -2.447
94 H TRP 19 H TRP 19 -3.727 -4.842 -3.827
95 HA TRP 19 HA TRP 19 -5.650 -4.134 -2.257
96 HB2 TRP 19 HB3 TRP 19 -5.665 -5.260 -4.708
97 HB3 TRP 19 HB2 TRP 19 -6.527 -6.498 -3.798
98 HD1 TRP 19 HD1 TRP 19 -6.947 -3.050 -5.266
99 HE1 TRP 19 HE1 TRP 19 -9.357 -2.229 -4.873
100 HE3 TRP 19 HE3 TRP 19 -8.513 -6.671 -2.020
101 HZ2 TRP 19 HZ2 TRP 19 -11.617 -3.016 -3.374
102 HZ3 TRP 19 HZ3 TRP 19 -10.799 -6.558 -1.138
103 HH2 TRP 19 HH2 TRP 19 -12.326 -4.770 -1.806
104 HA PRO 20 HA PRO 20 -7.023 -3.767 -1.260
105 HB2 PRO 20 HB2 PRO 20 -8.378 -3.463 0.998
106 HB3 PRO 20 HB3 PRO 20 -8.958 -4.560 -0.258
107 HG2 PRO 20 HG3 PRO 20 -7.669 -5.180 2.345
108 HG3 PRO 20 HG2 PRO 20 -8.868 -6.111 1.432
109 HD2 PRO 20 HD3 PRO 20 -6.037 -6.484 1.476
110 HD3 PRO 20 HD2 PRO 20 -7.226 -7.347 0.482
111 H ILE 21 H ILE 21 -4.275 -4.395 -0.008
112 HA ILE 21 HA ILE 21 -4.124 -1.900 1.524
113 HB ILE 21 HB ILE 21 -2.583 -2.920 3.147
114 HG12 ILE 21 HG13 ILE 21 -3.365 -5.554 1.872
115 HG13 ILE 21 HG12 ILE 21 -1.793 -4.782 1.702
116 HG21 ILE 21 HG21 ILE 21 -4.327 -4.413 4.277
117 HG22 ILE 21 HG22 ILE 21 -5.352 -4.057 2.885
118 HG23 ILE 21 HG23 ILE 21 -4.787 -2.747 3.924
119 HD11 ILE 21 HD11 ILE 21 -2.781 -5.314 4.444
120 HD12 ILE 21 HD12 ILE 21 -1.139 -5.344 3.802
121 HD13 ILE 21 HD13 ILE 21 -2.239 -6.683 3.473
122 H CYS 22 H CYS 22 -2.392 -0.671 1.109
123 HA CYS 22 HA CYS 22 -0.624 -1.523 -1.038
124 HB2 CYS 22 HB3 CYS 22 -1.739 0.784 -0.824
125 HB3 CYS 22 HB2 CYS 22 -0.478 1.133 0.349
126 H THR 23 H THR 23 1.539 -1.671 -0.913
127 HA THR 23 HA THR 23 2.853 -1.485 1.704
128 HB THR 23 HB THR 23 3.949 -3.752 1.151
129 HG1 THR 23 HG1 THR 23 2.587 -3.575 -1.002
130 HG21 THR 23 HG21 THR 23 2.494 -4.834 2.559
131 HG22 THR 23 HG22 THR 23 1.064 -4.175 1.762
132 HG23 THR 23 HG23 THR 23 2.010 -3.164 2.854
133 H ARG 24 H ARG 24 4.861 -0.607 1.506
134 HA ARG 24 HA ARG 24 5.936 -0.298 -1.183
135 HB2 ARG 24 HB3 ARG 24 7.473 1.299 -0.217
136 HB3 ARG 24 HB2 ARG 24 5.840 1.694 0.273
137 HG2 ARG 24 HG3 ARG 24 6.252 1.275 2.460
138 HG3 ARG 24 HG2 ARG 24 7.432 0.007 2.110
139 HD2 ARG 24 HD3 ARG 24 7.862 2.979 1.814
140 HD3 ARG 24 HD2 ARG 24 8.529 1.951 3.084
141 HE ARG 24 HE ARG 24 9.286 0.895 0.588
142 HH11 ARG 24 HH11 ARG 24 9.934 3.717 2.569
143 HH12 ARG 24 HH12 ARG 24 11.526 3.944 1.933
144 HH21 ARG 24 HH22 ARG 24 11.342 1.168 -0.242
145 HH22 ARG 24 HH21 ARG 24 12.341 2.480 0.316
146 H ASP 25 H ASP 25 7.581 -1.476 -1.918
147 HA ASP 25 HA ASP 25 9.185 -3.092 -2.042
148 HB2 ASP 25 HB3 ASP 25 9.893 -2.259 0.787
149 HB3 ASP 25 HB2 ASP 25 10.937 -3.093 -0.355
150 H GLY 26 H GLY 26 6.519 -3.682 -0.943
151 HA2 GLY 26 HA3 GLY 26 5.448 -5.626 -0.306
152 HA3 GLY 26 HA2 GLY 26 7.023 -6.371 -0.069
153 H LEU 27 H LEU 27 6.665 -3.388 1.516
154 HA LEU 27 HA LEU 27 6.173 -4.781 4.063
155 HB2 LEU 27 HB3 LEU 27 7.771 -2.271 3.548
156 HB3 LEU 27 HB2 LEU 27 7.494 -2.990 5.123
157 HG LEU 27 HG LEU 27 9.013 -4.302 2.866
158 HD11 LEU 27 HD11 LEU 27 10.924 -3.453 3.673
159 HD12 LEU 27 HD12 LEU 27 10.397 -3.590 5.350
160 HD13 LEU 27 HD13 LEU 27 9.879 -2.217 4.372
161 HD21 LEU 27 HD21 LEU 27 9.273 -6.142 4.164
162 HD22 LEU 27 HD22 LEU 27 7.721 -5.607 4.807
163 HD23 LEU 27 HD23 LEU 27 9.211 -5.225 5.670
164 HA PRO 28 HA PRO 28 2.562 -2.206 4.348
165 HB2 PRO 28 HB2 PRO 28 1.793 -2.937 6.822
166 HB3 PRO 28 HB3 PRO 28 1.651 -4.027 5.438
167 HG2 PRO 28 HG3 PRO 28 3.736 -3.948 7.582
168 HG3 PRO 28 HG2 PRO 28 2.930 -5.350 6.855
169 HD2 PRO 28 HD3 PRO 28 5.432 -4.500 6.147
170 HD3 PRO 28 HD2 PRO 28 4.347 -5.382 5.056
171 H VAL 29 H VAL 29 4.733 -0.649 4.566
172 HA VAL 29 HA VAL 29 4.806 0.620 7.163
173 HB VAL 29 HB VAL 29 6.229 1.437 4.627
174 HG11 VAL 29 HG11 VAL 29 6.309 2.398 7.438
175 HG12 VAL 29 HG12 VAL 29 6.453 3.298 5.927
176 HG13 VAL 29 HG13 VAL 29 7.820 2.359 6.528
177 HG21 VAL 29 HG21 VAL 29 7.813 -0.100 4.983
178 HG22 VAL 29 HG22 VAL 29 6.626 -0.895 6.018
179 HG23 VAL 29 HG23 VAL 29 7.827 0.189 6.723
Start of MODEL 6
1 H1 CYS 1 H CYS 1 3.265 0.681 4.294
2 HA CYS 1 HA CYS 1 2.577 3.409 4.534
3 HB2 CYS 1 HB3 CYS 1 1.042 1.530 2.774
4 HB3 CYS 1 HB2 CYS 1 1.581 3.175 2.443
5 H GLY 2 H GLY 2 0.802 0.414 5.097
6 HA2 GLY 2 HA3 GLY 2 -0.958 -0.009 6.525
7 HA3 GLY 2 HA2 GLY 2 -0.907 1.674 7.021
8 H GLU 3 H GLU 3 -1.242 2.774 4.411
9 HA GLU 3 HA GLU 3 -4.008 2.987 4.292
10 HB2 GLU 3 HB3 GLU 3 -3.649 4.103 2.114
11 HB3 GLU 3 HB2 GLU 3 -2.584 4.702 3.378
12 HG2 GLU 3 HG3 GLU 3 -0.716 3.627 2.474
13 HG3 GLU 3 HG2 GLU 3 -1.704 2.577 1.459
14 H THR 4 H THR 4 -5.589 2.059 3.158
15 HA THR 4 HA THR 4 -5.009 -0.470 1.848
16 HB THR 4 HB THR 4 -7.535 -0.636 1.773
17 HG1 THR 4 HG1 THR 4 -7.716 1.769 1.997
18 HG21 THR 4 HG21 THR 4 -6.007 -1.498 3.648
19 HG22 THR 4 HG22 THR 4 -7.724 -1.326 4.011
20 HG23 THR 4 HG23 THR 4 -6.577 -0.110 4.574
21 H CYS 5 H CYS 5 -4.717 -0.526 -0.311
22 HA CYS 5 HA CYS 5 -5.545 1.748 -1.910
23 HB2 CYS 5 HB3 CYS 5 -4.287 0.623 -3.739
24 HB3 CYS 5 HB2 CYS 5 -3.311 0.938 -2.309
25 H PHE 6 H PHE 6 -7.791 0.963 -1.225
26 HA PHE 6 HA PHE 6 -9.058 -1.248 -2.314
27 HB2 PHE 6 HB3 PHE 6 -10.061 0.264 -0.634
28 HB3 PHE 6 HB2 PHE 6 -10.223 1.511 -1.865
29 HD1 PHE 6 HD1 PHE 6 -11.044 -2.131 -1.694
30 HD2 PHE 6 HD2 PHE 6 -12.396 1.823 -2.492
31 HE1 PHE 6 HE1 PHE 6 -13.262 -3.014 -2.290
32 HE2 PHE 6 HE2 PHE 6 -14.616 0.949 -3.088
33 HZ PHE 6 HZ PHE 6 -15.052 -1.473 -2.988
34 H GLY 7 H GLY 7 -8.509 1.947 -3.741
35 HA2 GLY 7 HA3 GLY 7 -9.778 1.094 -6.229
36 HA3 GLY 7 HA2 GLY 7 -9.222 2.717 -5.851
37 H GLY 8 H GLY 8 -7.073 0.087 -5.200
38 HA2 GLY 8 HA3 GLY 8 -5.223 -0.723 -6.317
39 HA3 GLY 8 HA2 GLY 8 -5.804 0.064 -7.773
40 H THR 9 H THR 9 -5.910 2.702 -6.424
41 HA THR 9 HA THR 9 -3.132 3.392 -6.849
42 HB THR 9 HB THR 9 -4.590 5.690 -6.154
43 HG1 THR 9 HG1 THR 9 -6.073 4.039 -7.952
44 HG21 THR 9 HG21 THR 9 -2.959 4.793 -8.203
45 HG22 THR 9 HG22 THR 9 -3.675 6.399 -8.073
46 HG23 THR 9 HG23 THR 9 -4.487 5.146 -9.009
47 H CYS 10 H CYS 10 -1.787 4.346 -5.374
48 HA CYS 10 HA CYS 10 -2.663 4.268 -2.568
49 HB2 CYS 10 HB3 CYS 10 0.148 4.028 -3.671
50 HB3 CYS 10 HB2 CYS 10 -0.302 3.943 -1.971
51 H ASN 11 H ASN 11 -1.974 5.941 -1.182
52 HA ASN 11 HA ASN 11 -1.763 8.517 -2.521
53 HB2 ASN 11 HB3 ASN 11 -3.388 8.230 -0.704
54 HB3 ASN 11 HB2 ASN 11 -2.090 7.801 0.403
55 HD21 ASN 11 HD22 ASN 11 -1.325 9.365 1.619
56 HD22 ASN 11 HD21 ASN 11 -1.463 11.057 1.304
57 H THR 12 H THR 12 0.229 6.309 -0.763
58 HA THR 12 HA THR 12 2.301 8.344 -0.368
59 HB THR 12 HB THR 12 2.345 5.481 0.582
60 HG1 THR 12 HG1 THR 12 0.532 6.355 1.506
61 HG21 THR 12 HG21 THR 12 3.676 7.897 1.789
62 HG22 THR 12 HG22 THR 12 4.454 6.895 0.563
63 HG23 THR 12 HG23 THR 12 3.997 6.194 2.115
64 HA PRO 13 HA PRO 13 4.381 6.831 -4.030
65 HB2 PRO 13 HB2 PRO 13 6.672 8.274 -3.654
66 HB3 PRO 13 HB3 PRO 13 5.193 8.955 -4.338
67 HG2 PRO 13 HG3 PRO 13 6.245 9.132 -1.545
68 HG3 PRO 13 HG2 PRO 13 5.481 10.388 -2.537
69 HD2 PRO 13 HD3 PRO 13 4.142 9.058 -0.603
70 HD3 PRO 13 HD2 PRO 13 3.351 9.622 -2.088
71 H GLY 14 H GLY 14 5.789 5.172 -4.390
72 HA2 GLY 14 HA3 GLY 14 7.692 3.841 -3.937
73 HA3 GLY 14 HA2 GLY 14 7.686 4.441 -2.283
74 H CYS 15 H CYS 15 4.673 3.985 -2.349
75 HA CYS 15 HA CYS 15 4.796 1.253 -1.380
76 HB2 CYS 15 HB3 CYS 15 2.622 3.354 -1.327
77 HB3 CYS 15 HB2 CYS 15 2.421 1.729 -0.685
78 H SER 16 H SER 16 3.919 -0.463 -2.357
79 HA SER 16 HA SER 16 2.713 -0.060 -5.004
80 HB2 SER 16 HB3 SER 16 3.951 -2.590 -3.892
81 HB3 SER 16 HB2 SER 16 3.529 -2.252 -5.572
82 HG SER 16 HG SER 16 5.198 -0.369 -4.558
83 H CYS 17 H CYS 17 0.689 -0.842 -5.397
84 HA CYS 17 HA CYS 17 -0.925 -1.446 -3.151
85 HB2 CYS 17 HB3 CYS 17 -1.813 -0.241 -5.086
86 HB3 CYS 17 HB2 CYS 17 -1.598 -1.675 -6.084
87 H THR 18 H THR 18 -1.260 -3.237 -2.208
88 HA THR 18 HA THR 18 -1.074 -5.780 -3.664
89 HB THR 18 HB THR 18 -0.298 -5.408 -0.754
90 HG1 THR 18 HG1 THR 18 1.729 -5.074 -1.377
91 HG21 THR 18 HG21 THR 18 -0.200 -7.691 -2.701
92 HG22 THR 18 HG22 THR 18 -0.857 -7.655 -1.064
93 HG23 THR 18 HG23 THR 18 0.888 -7.639 -1.314
94 H TRP 19 H TRP 19 -3.303 -4.962 -3.910
95 HA TRP 19 HA TRP 19 -5.271 -4.343 -2.353
96 HB2 TRP 19 HB3 TRP 19 -5.215 -5.458 -4.795
97 HB3 TRP 19 HB2 TRP 19 -5.973 -6.768 -3.895
98 HD1 TRP 19 HD1 TRP 19 -6.661 -3.338 -5.313
99 HE1 TRP 19 HE1 TRP 19 -9.134 -2.727 -4.930
100 HE3 TRP 19 HE3 TRP 19 -7.949 -7.137 -2.148
101 HZ2 TRP 19 HZ2 TRP 19 -11.336 -3.732 -3.472
102 HZ3 TRP 19 HZ3 TRP 19 -10.245 -7.234 -1.292
103 HH2 TRP 19 HH2 TRP 19 -11.910 -5.569 -1.944
104 HA PRO 20 HA PRO 20 -6.681 -4.059 -1.396
105 HB2 PRO 20 HB2 PRO 20 -8.122 -3.831 0.812
106 HB3 PRO 20 HB3 PRO 20 -8.582 -4.984 -0.441
107 HG2 PRO 20 HG3 PRO 20 -7.327 -5.472 2.206
108 HG3 PRO 20 HG2 PRO 20 -8.430 -6.501 1.277
109 HD2 PRO 20 HD3 PRO 20 -5.577 -6.659 1.400
110 HD3 PRO 20 HD2 PRO 20 -6.673 -7.628 0.396
111 H ILE 21 H ILE 21 -3.928 -4.472 -0.087
112 HA ILE 21 HA ILE 21 -3.981 -1.967 1.431
113 HB ILE 21 HB ILE 21 -2.437 -2.864 3.115
114 HG12 ILE 21 HG13 ILE 21 -2.969 -5.560 1.841
115 HG13 ILE 21 HG12 ILE 21 -1.460 -4.665 1.704
116 HG21 ILE 21 HG21 ILE 21 -4.681 -2.860 3.807
117 HG22 ILE 21 HG22 ILE 21 -4.091 -4.474 4.208
118 HG23 ILE 21 HG23 ILE 21 -5.093 -4.232 2.775
119 HD11 ILE 21 HD11 ILE 21 -1.924 -4.819 4.432
120 HD12 ILE 21 HD12 ILE 21 -0.776 -5.776 3.494
121 HD13 ILE 21 HD13 ILE 21 -2.395 -6.400 3.808
122 H CYS 22 H CYS 22 -2.253 -0.662 1.133
123 HA CYS 22 HA CYS 22 -0.434 -1.373 -1.016
124 HB2 CYS 22 HB3 CYS 22 -1.594 0.922 -0.609
125 HB3 CYS 22 HB2 CYS 22 -0.260 1.201 0.498
126 H THR 23 H THR 23 1.728 -1.526 -0.854
127 HA THR 23 HA THR 23 2.961 -1.516 1.813
128 HB THR 23 HB THR 23 4.101 -3.707 1.167
129 HG1 THR 23 HG1 THR 23 2.715 -3.322 -1.048
130 HG21 THR 23 HG21 THR 23 1.735 -4.960 1.566
131 HG22 THR 23 HG22 THR 23 1.325 -3.326 2.092
132 HG23 THR 23 HG23 THR 23 2.664 -4.187 2.852
133 H ARG 24 H ARG 24 4.976 -0.654 1.788
134 HA ARG 24 HA ARG 24 6.172 -0.091 -0.814
135 HB2 ARG 24 HB3 ARG 24 7.681 1.396 0.429
136 HB3 ARG 24 HB2 ARG 24 6.002 1.811 0.699
137 HG2 ARG 24 HG3 ARG 24 6.055 1.154 2.896
138 HG3 ARG 24 HG2 ARG 24 7.386 0.022 2.637
139 HD2 ARG 24 HD3 ARG 24 7.612 3.030 2.550
140 HD3 ARG 24 HD2 ARG 24 8.076 2.015 3.916
141 HE ARG 24 HE ARG 24 9.430 1.038 1.689
142 HH11 ARG 24 HH11 ARG 24 9.355 4.007 3.555
143 HH12 ARG 24 HH12 ARG 24 11.005 4.402 3.215
144 HH21 ARG 24 HH22 ARG 24 11.552 1.528 1.236
145 HH22 ARG 24 HH21 ARG 24 12.276 2.979 1.877
146 H ASP 25 H ASP 25 7.873 -1.210 -1.536
147 HA ASP 25 HA ASP 25 9.507 -2.793 -1.673
148 HB2 ASP 25 HB3 ASP 25 10.008 -2.198 1.257
149 HB3 ASP 25 HB2 ASP 25 11.141 -2.915 0.116
150 H GLY 26 H GLY 26 6.769 -3.470 -0.793
151 HA2 GLY 26 HA3 GLY 26 5.684 -5.475 -0.410
152 HA3 GLY 26 HA2 GLY 26 7.247 -6.222 -0.110
153 H LEU 27 H LEU 27 6.842 -3.405 1.702
154 HA LEU 27 HA LEU 27 6.144 -5.006 4.069
155 HB2 LEU 27 HB3 LEU 27 7.709 -2.429 3.888
156 HB3 LEU 27 HB2 LEU 27 7.336 -3.288 5.371
157 HG LEU 27 HG LEU 27 9.055 -4.357 3.129
158 HD11 LEU 27 HD11 LEU 27 10.931 -3.946 4.527
159 HD12 LEU 27 HD12 LEU 27 9.901 -3.466 5.876
160 HD13 LEU 27 HD13 LEU 27 10.009 -2.445 4.441
161 HD21 LEU 27 HD21 LEU 27 8.369 -5.471 5.846
162 HD22 LEU 27 HD22 LEU 27 9.632 -6.105 4.791
163 HD23 LEU 27 HD23 LEU 27 7.945 -6.157 4.277
164 HA PRO 28 HA PRO 28 2.433 -2.572 4.272
165 HB2 PRO 28 HB2 PRO 28 2.001 -3.721 6.909
166 HB3 PRO 28 HB3 PRO 28 1.129 -4.035 5.407
167 HG2 PRO 28 HG3 PRO 28 2.735 -5.876 6.594
168 HG3 PRO 28 HG2 PRO 28 2.476 -5.805 4.842
169 HD2 PRO 28 HD3 PRO 28 4.783 -4.779 6.457
170 HD3 PRO 28 HD2 PRO 28 4.792 -5.645 4.905
171 H VAL 29 H VAL 29 4.570 -1.022 4.808
172 HA VAL 29 HA VAL 29 4.349 0.066 7.481
173 HB VAL 29 HB VAL 29 6.031 1.062 5.175
174 HG11 VAL 29 HG11 VAL 29 6.837 2.648 6.522
175 HG12 VAL 29 HG12 VAL 29 7.001 1.532 7.878
176 HG13 VAL 29 HG13 VAL 29 5.451 2.312 7.560
177 HG21 VAL 29 HG21 VAL 29 6.398 -1.181 7.039
178 HG22 VAL 29 HG22 VAL 29 7.788 -0.109 6.872
179 HG23 VAL 29 HG23 VAL 29 7.105 -0.896 5.449
Start of MODEL 7
1 H1 CYS 1 H CYS 1 3.145 0.746 4.253
2 HA CYS 1 HA CYS 1 2.600 3.492 4.517
3 HB2 CYS 1 HB3 CYS 1 0.947 1.771 2.717
4 HB3 CYS 1 HB2 CYS 1 1.690 3.337 2.396
5 H GLY 2 H GLY 2 0.664 0.611 5.093
6 HA2 GLY 2 HA3 GLY 2 -1.129 0.309 6.510
7 HA3 GLY 2 HA2 GLY 2 -1.021 2.006 6.944
8 H GLU 3 H GLU 3 -1.274 3.010 4.266
9 HA GLU 3 HA GLU 3 -4.047 3.275 4.125
10 HB2 GLU 3 HB3 GLU 3 -3.700 4.444 2.035
11 HB3 GLU 3 HB2 GLU 3 -2.467 4.916 3.194
12 HG2 GLU 3 HG3 GLU 3 -0.807 3.659 2.091
13 HG3 GLU 3 HG2 GLU 3 -2.000 2.807 1.112
14 H THR 4 H THR 4 -5.621 2.368 2.948
15 HA THR 4 HA THR 4 -5.044 -0.208 1.734
16 HB THR 4 HB THR 4 -7.612 -0.289 1.631
17 HG1 THR 4 HG1 THR 4 -8.300 1.272 3.501
18 HG21 THR 4 HG21 THR 4 -7.661 -1.288 3.686
19 HG22 THR 4 HG22 THR 4 -6.793 0.032 4.469
20 HG23 THR 4 HG23 THR 4 -5.913 -1.147 3.497
21 H CYS 5 H CYS 5 -4.705 -0.321 -0.409
22 HA CYS 5 HA CYS 5 -5.517 1.903 -2.084
23 HB2 CYS 5 HB3 CYS 5 -4.178 0.802 -3.843
24 HB3 CYS 5 HB2 CYS 5 -3.256 1.084 -2.371
25 H PHE 6 H PHE 6 -7.807 1.006 -1.416
26 HA PHE 6 HA PHE 6 -8.891 -1.227 -2.708
27 HB2 PHE 6 HB3 PHE 6 -10.058 1.315 -1.640
28 HB3 PHE 6 HB2 PHE 6 -11.071 0.249 -2.606
29 HD1 PHE 6 HD1 PHE 6 -8.488 -0.421 0.011
30 HD2 PHE 6 HD2 PHE 6 -12.534 -0.844 -1.234
31 HE1 PHE 6 HE1 PHE 6 -8.954 -1.793 1.999
32 HE2 PHE 6 HE2 PHE 6 -13.008 -2.215 0.752
33 HZ PHE 6 HZ PHE 6 -11.216 -2.691 2.373
34 H GLY 7 H GLY 7 -8.350 2.053 -3.840
35 HA2 GLY 7 HA3 GLY 7 -9.658 1.492 -6.383
36 HA3 GLY 7 HA2 GLY 7 -8.973 3.031 -5.881
37 H GLY 8 H GLY 8 -6.987 0.265 -5.404
38 HA2 GLY 8 HA3 GLY 8 -5.189 -0.595 -6.560
39 HA3 GLY 8 HA2 GLY 8 -5.755 0.247 -7.990
40 H THR 9 H THR 9 -5.706 2.866 -6.617
41 HA THR 9 HA THR 9 -2.890 3.411 -7.054
42 HB THR 9 HB THR 9 -4.930 5.486 -6.318
43 HG1 THR 9 HG1 THR 9 -5.139 3.795 -8.378
44 HG21 THR 9 HG21 THR 9 -3.040 5.971 -8.498
45 HG22 THR 9 HG22 THR 9 -2.263 5.630 -6.951
46 HG23 THR 9 HG23 THR 9 -3.415 6.959 -7.086
47 H CYS 10 H CYS 10 -1.578 4.545 -5.583
48 HA CYS 10 HA CYS 10 -2.421 4.377 -2.771
49 HB2 CYS 10 HB3 CYS 10 0.362 4.003 -3.905
50 HB3 CYS 10 HB2 CYS 10 -0.048 3.993 -2.193
51 H ASN 11 H ASN 11 -1.743 6.037 -1.394
52 HA ASN 11 HA ASN 11 -1.419 8.595 -2.732
53 HB2 ASN 11 HB3 ASN 11 -1.923 7.854 0.154
54 HB3 ASN 11 HB2 ASN 11 -1.816 9.510 -0.438
55 HD21 ASN 11 HD22 ASN 11 -3.751 6.699 -0.154
56 HD22 ASN 11 HD21 ASN 11 -5.184 7.352 -0.875
57 H THR 12 H THR 12 0.482 6.390 -0.823
58 HA THR 12 HA THR 12 2.545 8.447 -0.488
59 HB THR 12 HB THR 12 3.649 6.689 0.986
60 HG1 THR 12 HG1 THR 12 1.071 5.488 0.657
61 HG21 THR 12 HG21 THR 12 1.942 7.071 2.848
62 HG22 THR 12 HG22 THR 12 1.002 7.953 1.645
63 HG23 THR 12 HG23 THR 12 2.621 8.503 2.075
64 HA PRO 13 HA PRO 13 4.824 6.798 -3.913
65 HB2 PRO 13 HB2 PRO 13 7.082 8.294 -2.758
66 HB3 PRO 13 HB3 PRO 13 6.287 8.493 -4.323
67 HG2 PRO 13 HG3 PRO 13 5.988 10.291 -2.352
68 HG3 PRO 13 HG2 PRO 13 4.668 9.901 -3.473
69 HD2 PRO 13 HD3 PRO 13 5.108 8.964 -0.660
70 HD3 PRO 13 HD2 PRO 13 3.603 9.474 -1.456
71 H GLY 14 H GLY 14 6.169 5.092 -4.236
72 HA2 GLY 14 HA3 GLY 14 7.979 3.664 -3.721
73 HA3 GLY 14 HA2 GLY 14 7.917 4.223 -2.055
74 H CYS 15 H CYS 15 4.901 3.905 -2.256
75 HA CYS 15 HA CYS 15 4.870 1.144 -1.375
76 HB2 CYS 15 HB3 CYS 15 2.792 3.339 -1.306
77 HB3 CYS 15 HB2 CYS 15 2.513 1.708 -0.706
78 H SER 16 H SER 16 3.904 -0.497 -2.402
79 HA SER 16 HA SER 16 2.745 0.038 -5.049
80 HB2 SER 16 HB3 SER 16 3.970 -2.539 -4.031
81 HB3 SER 16 HB2 SER 16 3.488 -2.175 -5.689
82 HG SER 16 HG SER 16 5.304 -0.444 -4.486
83 H CYS 17 H CYS 17 0.703 -0.707 -5.472
84 HA CYS 17 HA CYS 17 -0.949 -1.288 -3.273
85 HB2 CYS 17 HB3 CYS 17 -1.768 -0.165 -5.307
86 HB3 CYS 17 HB2 CYS 17 -1.578 -1.671 -6.200
87 H THR 18 H THR 18 -1.480 -3.054 -2.325
88 HA THR 18 HA THR 18 -1.179 -5.651 -3.658
89 HB THR 18 HB THR 18 -0.520 -5.242 -0.732
90 HG1 THR 18 HG1 THR 18 0.954 -4.487 -2.871
91 HG21 THR 18 HG21 THR 18 0.244 -7.417 -0.750
92 HG22 THR 18 HG22 THR 18 0.604 -7.390 -2.477
93 HG23 THR 18 HG23 THR 18 -1.066 -7.526 -1.927
94 H TRP 19 H TRP 19 -3.427 -4.753 -3.932
95 HA TRP 19 HA TRP 19 -5.395 -4.133 -2.386
96 HB2 TRP 19 HB3 TRP 19 -5.325 -5.292 -4.827
97 HB3 TRP 19 HB2 TRP 19 -6.154 -6.545 -3.906
98 HD1 TRP 19 HD1 TRP 19 -6.671 -3.126 -5.420
99 HE1 TRP 19 HE1 TRP 19 -9.114 -2.387 -5.068
100 HE3 TRP 19 HE3 TRP 19 -8.156 -6.777 -2.170
101 HZ2 TRP 19 HZ2 TRP 19 -11.369 -3.243 -3.596
102 HZ3 TRP 19 HZ3 TRP 19 -10.459 -6.739 -1.322
103 HH2 TRP 19 HH2 TRP 19 -12.038 -5.011 -2.025
104 HA PRO 20 HA PRO 20 -6.792 -3.828 -1.406
105 HB2 PRO 20 HB2 PRO 20 -8.175 -3.570 0.842
106 HB3 PRO 20 HB3 PRO 20 -8.691 -4.702 -0.412
107 HG2 PRO 20 HG3 PRO 20 -7.402 -5.241 2.207
108 HG3 PRO 20 HG2 PRO 20 -8.540 -6.238 1.287
109 HD2 PRO 20 HD3 PRO 20 -5.691 -6.459 1.367
110 HD3 PRO 20 HD2 PRO 20 -6.823 -7.397 0.372
111 H ILE 21 H ILE 21 -4.016 -4.279 -0.127
112 HA ILE 21 HA ILE 21 -4.011 -1.750 1.352
113 HB ILE 21 HB ILE 21 -2.486 -2.642 3.050
114 HG12 ILE 21 HG13 ILE 21 -3.051 -5.354 1.823
115 HG13 ILE 21 HG12 ILE 21 -1.532 -4.479 1.670
116 HG21 ILE 21 HG21 ILE 21 -4.166 -4.239 4.154
117 HG22 ILE 21 HG22 ILE 21 -5.168 -3.956 2.728
118 HG23 ILE 21 HG23 ILE 21 -4.711 -2.606 3.771
119 HD11 ILE 21 HD11 ILE 21 -0.906 -4.916 3.816
120 HD12 ILE 21 HD12 ILE 21 -1.859 -6.359 3.469
121 HD13 ILE 21 HD13 ILE 21 -2.567 -5.035 4.396
122 H CYS 22 H CYS 22 -2.208 -0.510 1.068
123 HA CYS 22 HA CYS 22 -0.442 -1.309 -1.099
124 HB2 CYS 22 HB3 CYS 22 -1.520 1.023 -0.745
125 HB3 CYS 22 HB2 CYS 22 -0.193 1.286 0.374
126 H THR 23 H THR 23 1.730 -1.535 -0.946
127 HA THR 23 HA THR 23 2.924 -1.565 1.744
128 HB THR 23 HB THR 23 4.052 -3.709 1.186
129 HG1 THR 23 HG1 THR 23 2.192 -4.307 -0.801
130 HG21 THR 23 HG21 THR 23 1.831 -5.109 1.214
131 HG22 THR 23 HG22 THR 23 1.082 -3.529 1.438
132 HG23 THR 23 HG23 THR 23 2.273 -4.111 2.600
133 H ARG 24 H ARG 24 4.896 -0.619 1.802
134 HA ARG 24 HA ARG 24 6.172 0.034 -0.730
135 HB2 ARG 24 HB3 ARG 24 7.584 1.521 0.537
136 HB3 ARG 24 HB2 ARG 24 5.915 1.818 0.973
137 HG2 ARG 24 HG3 ARG 24 6.178 0.846 3.083
138 HG3 ARG 24 HG2 ARG 24 7.683 0.043 2.622
139 HD2 ARG 24 HD3 ARG 24 7.214 2.973 3.137
140 HD3 ARG 24 HD2 ARG 24 8.299 1.878 3.992
141 HE ARG 24 HE ARG 24 8.924 3.397 1.711
142 HH11 ARG 24 HH11 ARG 24 9.516 0.215 3.072
143 HH12 ARG 24 HH12 ARG 24 10.900 -0.089 2.064
144 HH21 ARG 24 HH22 ARG 24 10.782 2.974 0.418
145 HH22 ARG 24 HH21 ARG 24 11.595 1.444 0.567
146 H ASP 25 H ASP 25 7.815 -1.126 -1.490
147 HA ASP 25 HA ASP 25 9.415 -2.732 -1.688
148 HB2 ASP 25 HB3 ASP 25 9.939 -2.075 1.226
149 HB3 ASP 25 HB2 ASP 25 11.002 -3.030 0.200
150 H GLY 26 H GLY 26 6.682 -3.411 -0.838
151 HA2 GLY 26 HA3 GLY 26 5.600 -5.433 -0.537
152 HA3 GLY 26 HA2 GLY 26 7.153 -6.180 -0.196
153 H LEU 27 H LEU 27 6.657 -3.396 1.651
154 HA LEU 27 HA LEU 27 5.832 -5.046 3.949
155 HB2 LEU 27 HB3 LEU 27 7.524 -2.543 3.912
156 HB3 LEU 27 HB2 LEU 27 7.039 -3.415 5.354
157 HG LEU 27 HG LEU 27 8.806 -4.521 3.168
158 HD11 LEU 27 HD11 LEU 27 10.412 -3.340 4.156
159 HD12 LEU 27 HD12 LEU 27 10.225 -4.419 5.538
160 HD13 LEU 27 HD13 LEU 27 9.359 -2.883 5.494
161 HD21 LEU 27 HD21 LEU 27 8.378 -5.704 5.889
162 HD22 LEU 27 HD22 LEU 27 9.034 -6.460 4.438
163 HD23 LEU 27 HD23 LEU 27 7.311 -6.102 4.542
164 HA PRO 28 HA PRO 28 2.214 -2.449 4.006
165 HB2 PRO 28 HB2 PRO 28 1.569 -3.703 6.554
166 HB3 PRO 28 HB3 PRO 28 0.761 -3.877 4.995
167 HG2 PRO 28 HG3 PRO 28 2.185 -5.877 6.148
168 HG3 PRO 28 HG2 PRO 28 2.028 -5.691 4.392
169 HD2 PRO 28 HD3 PRO 28 4.303 -4.924 6.185
170 HD3 PRO 28 HD2 PRO 28 4.341 -5.678 4.576
171 H VAL 29 H VAL 29 4.366 -1.019 4.746
172 HA VAL 29 HA VAL 29 4.029 -0.052 7.455
173 HB VAL 29 HB VAL 29 5.892 0.981 5.311
174 HG11 VAL 29 HG11 VAL 29 6.630 1.239 8.137
175 HG12 VAL 29 HG12 VAL 29 5.227 2.190 7.653
176 HG13 VAL 29 HG13 VAL 29 6.764 2.399 6.816
177 HG21 VAL 29 HG21 VAL 29 6.590 -0.918 7.539
178 HG22 VAL 29 HG22 VAL 29 7.602 -0.413 6.186
179 HG23 VAL 29 HG23 VAL 29 6.199 -1.445 5.901
Start of MODEL 8
1 H1 CYS 1 H CYS 1 3.008 0.723 4.494
2 HA CYS 1 HA CYS 1 2.602 3.510 4.579
3 HB2 CYS 1 HB3 CYS 1 0.931 1.628 2.924
4 HB3 CYS 1 HB2 CYS 1 1.464 3.259 2.527
5 H GLY 2 H GLY 2 0.632 0.770 5.519
6 HA2 GLY 2 HA3 GLY 2 -1.271 0.608 6.782
7 HA3 GLY 2 HA2 GLY 2 -0.902 2.224 7.360
8 H GLU 3 H GLU 3 -1.732 1.085 4.103
9 HA GLU 3 HA GLU 3 -4.271 2.498 4.275
10 HB2 GLU 3 HB3 GLU 3 -3.850 3.686 2.149
11 HB3 GLU 3 HB2 GLU 3 -2.769 4.200 3.436
12 HG2 GLU 3 HG3 GLU 3 -0.938 3.085 2.498
13 HG3 GLU 3 HG2 GLU 3 -1.964 2.120 1.437
14 H THR 4 H THR 4 -5.847 1.690 3.008
15 HA THR 4 HA THR 4 -5.275 -0.826 1.648
16 HB THR 4 HB THR 4 -7.812 -0.950 1.541
17 HG1 THR 4 HG1 THR 4 -8.019 1.405 1.890
18 HG21 THR 4 HG21 THR 4 -6.761 -2.234 3.224
19 HG22 THR 4 HG22 THR 4 -8.025 -1.327 4.053
20 HG23 THR 4 HG23 THR 4 -6.344 -0.803 4.167
21 H CYS 5 H CYS 5 -4.814 -0.689 -0.474
22 HA CYS 5 HA CYS 5 -5.735 1.596 -2.000
23 HB2 CYS 5 HB3 CYS 5 -4.286 0.691 -3.796
24 HB3 CYS 5 HB2 CYS 5 -3.424 0.957 -2.285
25 H PHE 6 H PHE 6 -7.978 0.509 -1.476
26 HA PHE 6 HA PHE 6 -8.882 -1.687 -2.953
27 HB2 PHE 6 HB3 PHE 6 -10.241 0.700 -1.757
28 HB3 PHE 6 HB2 PHE 6 -11.154 -0.373 -2.812
29 HD1 PHE 6 HD1 PHE 6 -8.578 -1.057 -0.195
30 HD2 PHE 6 HD2 PHE 6 -12.583 -1.610 -1.520
31 HE1 PHE 6 HE1 PHE 6 -8.992 -2.573 1.697
32 HE2 PHE 6 HE2 PHE 6 -13.005 -3.126 0.370
33 HZ PHE 6 HZ PHE 6 -11.207 -3.609 1.982
34 H GLY 7 H GLY 7 -8.529 1.696 -3.837
35 HA2 GLY 7 HA3 GLY 7 -9.736 1.237 -6.448
36 HA3 GLY 7 HA2 GLY 7 -9.158 2.774 -5.823
37 H GLY 8 H GLY 8 -7.011 0.115 -5.475
38 HA2 GLY 8 HA3 GLY 8 -5.140 -0.554 -6.644
39 HA3 GLY 8 HA2 GLY 8 -5.726 0.352 -8.027
40 H THR 9 H THR 9 -5.875 2.859 -6.446
41 HA THR 9 HA THR 9 -3.094 3.615 -6.782
42 HB THR 9 HB THR 9 -5.258 5.496 -5.904
43 HG1 THR 9 HG1 THR 9 -5.349 3.970 -8.107
44 HG21 THR 9 HG21 THR 9 -3.238 6.104 -7.999
45 HG22 THR 9 HG22 THR 9 -2.675 5.964 -6.334
46 HG23 THR 9 HG23 THR 9 -3.917 7.146 -6.748
47 H CYS 10 H CYS 10 -1.864 4.668 -5.194
48 HA CYS 10 HA CYS 10 -2.734 4.200 -2.424
49 HB2 CYS 10 HB3 CYS 10 0.090 4.157 -3.514
50 HB3 CYS 10 HB2 CYS 10 -0.367 3.901 -1.834
51 H ASN 11 H ASN 11 -2.138 5.741 -0.872
52 HA ASN 11 HA ASN 11 -1.966 8.446 -1.935
53 HB2 ASN 11 HB3 ASN 11 -3.633 7.910 -0.201
54 HB3 ASN 11 HB2 ASN 11 -2.340 7.450 0.901
55 HD21 ASN 11 HD22 ASN 11 -1.719 8.941 2.278
56 HD22 ASN 11 HD21 ASN 11 -1.916 10.646 2.092
57 H THR 12 H THR 12 0.052 6.105 -0.414
58 HA THR 12 HA THR 12 2.042 8.136 0.298
59 HB THR 12 HB THR 12 2.227 5.182 0.856
60 HG1 THR 12 HG1 THR 12 0.307 5.787 1.793
61 HG21 THR 12 HG21 THR 12 3.620 5.925 2.728
62 HG22 THR 12 HG22 THR 12 3.381 7.603 2.243
63 HG23 THR 12 HG23 THR 12 4.262 6.498 1.189
64 HA PRO 13 HA PRO 13 4.220 7.228 -3.502
65 HB2 PRO 13 HB2 PRO 13 6.398 8.737 -2.208
66 HB3 PRO 13 HB3 PRO 13 5.543 9.073 -3.716
67 HG2 PRO 13 HG3 PRO 13 5.159 10.568 -1.523
68 HG3 PRO 13 HG2 PRO 13 3.838 10.211 -2.652
69 HD2 PRO 13 HD3 PRO 13 4.451 8.968 0.005
70 HD3 PRO 13 HD2 PRO 13 2.882 9.435 -0.686
71 H GLY 14 H GLY 14 5.562 5.597 -4.053
72 HA2 GLY 14 HA3 GLY 14 7.469 4.228 -3.835
73 HA3 GLY 14 HA2 GLY 14 7.568 4.674 -2.137
74 H CYS 15 H CYS 15 4.497 4.156 -2.200
75 HA CYS 15 HA CYS 15 4.742 1.384 -1.376
76 HB2 CYS 15 HB3 CYS 15 2.442 3.347 -1.230
77 HB3 CYS 15 HB2 CYS 15 2.377 1.699 -0.619
78 H SER 16 H SER 16 3.918 -0.319 -2.429
79 HA SER 16 HA SER 16 2.732 0.167 -5.069
80 HB2 SER 16 HB3 SER 16 4.024 -2.372 -4.040
81 HB3 SER 16 HB2 SER 16 3.597 -1.993 -5.709
82 HG SER 16 HG SER 16 5.213 -0.098 -4.633
83 H CYS 17 H CYS 17 0.723 -0.618 -5.510
84 HA CYS 17 HA CYS 17 -0.894 -1.371 -3.316
85 HB2 CYS 17 HB3 CYS 17 -1.776 -0.084 -5.210
86 HB3 CYS 17 HB2 CYS 17 -1.551 -1.481 -6.257
87 H THR 18 H THR 18 -1.162 -3.216 -2.456
88 HA THR 18 HA THR 18 -0.895 -5.676 -4.042
89 HB THR 18 HB THR 18 -0.226 -5.454 -1.092
90 HG1 THR 18 HG1 THR 18 1.785 -4.937 -1.608
91 HG21 THR 18 HG21 THR 18 0.631 -7.630 -1.274
92 HG22 THR 18 HG22 THR 18 0.712 -7.549 -3.033
93 HG23 THR 18 HG23 THR 18 -0.851 -7.682 -2.228
94 H TRP 19 H TRP 19 -3.151 -4.871 -4.289
95 HA TRP 19 HA TRP 19 -5.169 -4.409 -2.743
96 HB2 TRP 19 HB3 TRP 19 -5.018 -5.390 -5.252
97 HB3 TRP 19 HB2 TRP 19 -5.798 -6.745 -4.441
98 HD1 TRP 19 HD1 TRP 19 -6.465 -3.260 -5.725
99 HE1 TRP 19 HE1 TRP 19 -8.947 -2.670 -5.370
100 HE3 TRP 19 HE3 TRP 19 -7.812 -7.192 -2.752
101 HZ2 TRP 19 HZ2 TRP 19 -11.176 -3.734 -4.000
102 HZ3 TRP 19 HZ3 TRP 19 -10.126 -7.324 -1.946
103 HH2 TRP 19 HH2 TRP 19 -11.779 -5.633 -2.562
104 HA PRO 20 HA PRO 20 -6.599 -4.221 -1.776
105 HB2 PRO 20 HB2 PRO 20 -8.047 -4.166 0.442
106 HB3 PRO 20 HB3 PRO 20 -8.487 -5.235 -0.893
107 HG2 PRO 20 HG3 PRO 20 -7.233 -5.891 1.718
108 HG3 PRO 20 HG2 PRO 20 -8.313 -6.869 0.711
109 HD2 PRO 20 HD3 PRO 20 -5.461 -6.991 0.842
110 HD3 PRO 20 HD2 PRO 20 -6.535 -7.900 -0.239
111 H ILE 21 H ILE 21 -3.844 -4.668 -0.465
112 HA ILE 21 HA ILE 21 -3.967 -2.258 1.198
113 HB ILE 21 HB ILE 21 -2.411 -3.224 2.837
114 HG12 ILE 21 HG13 ILE 21 -2.904 -5.851 1.412
115 HG13 ILE 21 HG12 ILE 21 -1.404 -4.933 1.335
116 HG21 ILE 21 HG21 ILE 21 -5.053 -4.587 2.401
117 HG22 ILE 21 HG22 ILE 21 -4.650 -3.286 3.526
118 HG23 ILE 21 HG23 ILE 21 -4.056 -4.921 3.820
119 HD11 ILE 21 HD11 ILE 21 -0.681 -5.859 3.208
120 HD12 ILE 21 HD12 ILE 21 -2.096 -6.912 3.171
121 HD13 ILE 21 HD13 ILE 21 -2.149 -5.394 4.067
122 H CYS 22 H CYS 22 -2.302 -0.882 0.946
123 HA CYS 22 HA CYS 22 -0.419 -1.456 -1.190
124 HB2 CYS 22 HB3 CYS 22 -1.681 0.766 -0.791
125 HB3 CYS 22 HB2 CYS 22 -0.427 1.084 0.397
126 H THR 23 H THR 23 1.741 -1.510 -1.002
127 HA THR 23 HA THR 23 2.961 -1.480 1.668
128 HB THR 23 HB THR 23 4.177 -3.623 1.038
129 HG1 THR 23 HG1 THR 23 3.044 -3.289 -1.241
130 HG21 THR 23 HG21 THR 23 1.338 -3.396 1.837
131 HG22 THR 23 HG22 THR 23 2.696 -4.140 2.681
132 HG23 THR 23 HG23 THR 23 1.896 -5.001 1.367
133 H ARG 24 H ARG 24 4.895 -0.423 1.601
134 HA ARG 24 HA ARG 24 6.063 0.075 -1.024
135 HB2 ARG 24 HB3 ARG 24 7.344 1.811 0.011
136 HB3 ARG 24 HB2 ARG 24 5.680 1.995 0.515
137 HG2 ARG 24 HG3 ARG 24 6.148 1.266 2.691
138 HG3 ARG 24 HG2 ARG 24 7.711 0.593 2.218
139 HD2 ARG 24 HD3 ARG 24 6.930 3.492 2.459
140 HD3 ARG 24 HD2 ARG 24 8.168 2.622 3.365
141 HE ARG 24 HE ARG 24 8.522 3.936 0.905
142 HH11 ARG 24 HH11 ARG 24 9.522 1.020 2.578
143 HH12 ARG 24 HH12 ARG 24 10.886 0.742 1.532
144 HH21 ARG 24 HH22 ARG 24 10.356 3.560 -0.443
145 HH22 ARG 24 HH21 ARG 24 11.342 2.155 -0.165
146 H ASP 25 H ASP 25 7.796 -0.997 -1.701
147 HA ASP 25 HA ASP 25 9.510 -2.493 -1.777
148 HB2 ASP 25 HB3 ASP 25 10.031 -1.492 1.038
149 HB3 ASP 25 HB2 ASP 25 11.151 -2.459 0.086
150 H GLY 26 H GLY 26 6.875 -3.299 -0.845
151 HA2 GLY 26 HA3 GLY 26 5.943 -5.343 -0.303
152 HA3 GLY 26 HA2 GLY 26 7.549 -5.933 0.095
153 H LEU 27 H LEU 27 6.958 -3.029 1.679
154 HA LEU 27 HA LEU 27 6.308 -4.492 4.144
155 HB2 LEU 27 HB3 LEU 27 7.604 -1.787 3.795
156 HB3 LEU 27 HB2 LEU 27 7.291 -2.573 5.330
157 HG LEU 27 HG LEU 27 9.160 -3.612 3.196
158 HD11 LEU 27 HD11 LEU 27 9.503 -1.675 5.318
159 HD12 LEU 27 HD12 LEU 27 10.596 -2.123 4.009
160 HD13 LEU 27 HD13 LEU 27 10.585 -3.055 5.507
161 HD21 LEU 27 HD21 LEU 27 9.278 -5.522 4.328
162 HD22 LEU 27 HD22 LEU 27 7.872 -4.986 5.250
163 HD23 LEU 27 HD23 LEU 27 9.497 -4.672 5.859
164 HA PRO 28 HA PRO 28 2.411 -2.327 3.993
165 HB2 PRO 28 HB2 PRO 28 1.655 -3.697 6.405
166 HB3 PRO 28 HB3 PRO 28 1.135 -4.035 4.754
167 HG2 PRO 28 HG3 PRO 28 2.720 -5.708 6.259
168 HG3 PRO 28 HG2 PRO 28 2.663 -5.703 4.488
169 HD2 PRO 28 HD3 PRO 28 4.673 -4.465 6.326
170 HD3 PRO 28 HD2 PRO 28 4.921 -5.293 4.773
171 H VAL 29 H VAL 29 4.513 -0.876 5.026
172 HA VAL 29 HA VAL 29 3.772 0.013 7.681
173 HB VAL 29 HB VAL 29 6.166 -0.232 7.019
174 HG11 VAL 29 HG11 VAL 29 5.326 1.633 4.937
175 HG12 VAL 29 HG12 VAL 29 6.685 0.509 4.980
176 HG13 VAL 29 HG13 VAL 29 6.823 2.089 5.751
177 HG21 VAL 29 HG21 VAL 29 5.602 2.634 7.713
178 HG22 VAL 29 HG22 VAL 29 6.928 1.605 8.257
179 HG23 VAL 29 HG23 VAL 29 5.290 1.319 8.846
Start of MODEL 9
1 H1 CYS 1 H CYS 1 3.000 0.722 4.309
2 HA CYS 1 HA CYS 1 2.251 3.425 4.567
3 HB2 CYS 1 HB3 CYS 1 0.815 1.582 2.696
4 HB3 CYS 1 HB2 CYS 1 1.391 3.225 2.421
5 H GLY 2 H GLY 2 0.490 0.398 4.995
6 HA2 GLY 2 HA3 GLY 2 -1.342 -0.070 6.311
7 HA3 GLY 2 HA2 GLY 2 -1.321 1.597 6.859
8 H GLU 3 H GLU 3 -1.523 2.722 4.204
9 HA GLU 3 HA GLU 3 -4.257 3.031 3.998
10 HB2 GLU 3 HB3 GLU 3 -3.818 4.038 1.783
11 HB3 GLU 3 HB2 GLU 3 -2.751 4.640 3.043
12 HG2 GLU 3 HG3 GLU 3 -0.929 3.358 2.230
13 HG3 GLU 3 HG2 GLU 3 -1.974 2.460 1.128
14 H THR 4 H THR 4 -5.861 2.164 2.874
15 HA THR 4 HA THR 4 -5.460 -0.479 1.739
16 HB THR 4 HB THR 4 -7.989 1.119 2.243
17 HG1 THR 4 HG1 THR 4 -6.361 -0.328 3.882
18 HG21 THR 4 HG21 THR 4 -8.669 -1.545 2.283
19 HG22 THR 4 HG22 THR 4 -7.516 -1.455 0.951
20 HG23 THR 4 HG23 THR 4 -8.954 -0.432 0.944
21 H CYS 5 H CYS 5 -4.896 -0.539 -0.366
22 HA CYS 5 HA CYS 5 -5.747 1.584 -2.153
23 HB2 CYS 5 HB3 CYS 5 -4.253 0.537 -3.794
24 HB3 CYS 5 HB2 CYS 5 -3.424 0.846 -2.273
25 H PHE 6 H PHE 6 -7.971 0.423 -1.426
26 HA PHE 6 HA PHE 6 -8.807 -1.875 -2.774
27 HB2 PHE 6 HB3 PHE 6 -11.133 -0.965 -2.435
28 HB3 PHE 6 HB2 PHE 6 -10.149 -1.072 -0.982
29 HD1 PHE 6 HD2 PHE 6 -11.334 1.319 -3.573
30 HD2 PHE 6 HD1 PHE 6 -9.840 0.785 0.376
31 HE1 PHE 6 HE2 PHE 6 -11.810 3.681 -3.077
32 HE2 PHE 6 HE1 PHE 6 -10.321 3.143 0.881
33 HZ PHE 6 HZ PHE 6 -11.303 4.596 -0.848
34 H GLY 7 H GLY 7 -8.510 1.417 -3.896
35 HA2 GLY 7 HA3 GLY 7 -9.895 0.776 -6.391
36 HA3 GLY 7 HA2 GLY 7 -9.340 2.367 -5.894
37 H GLY 8 H GLY 8 -7.055 -0.134 -5.460
38 HA2 GLY 8 HA3 GLY 8 -5.117 -0.691 -6.553
39 HA3 GLY 8 HA2 GLY 8 -5.931 -0.258 -8.047
40 H THR 9 H THR 9 -5.221 1.835 -5.289
41 HA THR 9 HA THR 9 -3.086 3.171 -6.739
42 HB THR 9 HB THR 9 -5.346 4.873 -5.716
43 HG1 THR 9 HG1 THR 9 -5.304 3.332 -8.003
44 HG21 THR 9 HG21 THR 9 -2.811 5.461 -6.627
45 HG22 THR 9 HG22 THR 9 -4.158 6.593 -6.515
46 HG23 THR 9 HG23 THR 9 -3.828 5.763 -8.036
47 H CYS 10 H CYS 10 -1.798 4.485 -5.370
48 HA CYS 10 HA CYS 10 -2.402 4.294 -2.503
49 HB2 CYS 10 HB3 CYS 10 0.330 3.882 -3.741
50 HB3 CYS 10 HB2 CYS 10 -0.052 3.828 -2.023
51 H ASN 11 H ASN 11 -1.834 6.014 -1.269
52 HA ASN 11 HA ASN 11 -1.336 8.501 -2.703
53 HB2 ASN 11 HB3 ASN 11 -3.152 8.369 -1.041
54 HB3 ASN 11 HB2 ASN 11 -1.980 7.979 0.211
55 HD21 ASN 11 HD22 ASN 11 -1.343 9.604 1.411
56 HD22 ASN 11 HD21 ASN 11 -1.364 11.272 0.965
57 H THR 12 H THR 12 0.406 6.217 -0.846
58 HA THR 12 HA THR 12 2.486 8.169 -0.165
59 HB THR 12 HB THR 12 2.430 5.258 0.618
60 HG1 THR 12 HG1 THR 12 0.522 6.061 1.412
61 HG21 THR 12 HG21 THR 12 3.807 6.009 2.478
62 HG22 THR 12 HG22 THR 12 3.680 7.679 1.921
63 HG23 THR 12 HG23 THR 12 4.538 6.486 0.946
64 HA PRO 13 HA PRO 13 4.817 6.862 -3.751
65 HB2 PRO 13 HB2 PRO 13 7.024 8.272 -2.388
66 HB3 PRO 13 HB3 PRO 13 6.312 8.572 -3.976
67 HG2 PRO 13 HG3 PRO 13 5.894 10.238 -1.920
68 HG3 PRO 13 HG2 PRO 13 4.630 9.905 -3.120
69 HD2 PRO 13 HD3 PRO 13 4.951 8.813 -0.349
70 HD3 PRO 13 HD2 PRO 13 3.477 9.340 -1.190
71 H GLY 14 H GLY 14 6.043 5.094 -4.117
72 HA2 GLY 14 HA3 GLY 14 7.798 3.580 -3.697
73 HA3 GLY 14 HA2 GLY 14 7.844 4.128 -2.026
74 H CYS 15 H CYS 15 4.751 3.895 -2.251
75 HA CYS 15 HA CYS 15 4.676 1.174 -1.245
76 HB2 CYS 15 HB3 CYS 15 2.599 3.370 -1.339
77 HB3 CYS 15 HB2 CYS 15 2.302 1.770 -0.672
78 H SER 16 H SER 16 3.838 -0.512 -2.282
79 HA SER 16 HA SER 16 2.690 -0.072 -4.950
80 HB2 SER 16 HB3 SER 16 3.985 -2.586 -3.857
81 HB3 SER 16 HB2 SER 16 3.519 -2.273 -5.530
82 HG SER 16 HG SER 16 5.275 -0.483 -4.301
83 H CYS 17 H CYS 17 0.667 -0.834 -5.357
84 HA CYS 17 HA CYS 17 -0.971 -1.488 -3.162
85 HB2 CYS 17 HB3 CYS 17 -1.828 -0.331 -5.148
86 HB3 CYS 17 HB2 CYS 17 -1.583 -1.792 -6.100
87 H THR 18 H THR 18 -1.284 -3.288 -2.192
88 HA THR 18 HA THR 18 -0.955 -5.840 -3.622
89 HB THR 18 HB THR 18 -0.377 -5.512 -0.673
90 HG1 THR 18 HG1 THR 18 1.079 -4.507 -2.675
91 HG21 THR 18 HG21 THR 18 0.984 -7.561 -1.085
92 HG22 THR 18 HG22 THR 18 0.389 -7.573 -2.744
93 HG23 THR 18 HG23 THR 18 -0.736 -7.783 -1.403
94 H TRP 19 H TRP 19 -3.233 -5.067 -3.931
95 HA TRP 19 HA TRP 19 -5.260 -4.562 -2.408
96 HB2 TRP 19 HB3 TRP 19 -5.097 -5.653 -4.867
97 HB3 TRP 19 HB2 TRP 19 -5.847 -6.986 -3.995
98 HD1 TRP 19 HD1 TRP 19 -6.594 -3.604 -5.467
99 HE1 TRP 19 HE1 TRP 19 -9.084 -3.036 -5.125
100 HE3 TRP 19 HE3 TRP 19 -7.839 -7.358 -2.233
101 HZ2 TRP 19 HZ2 TRP 19 -11.280 -4.051 -3.667
102 HZ3 TRP 19 HZ3 TRP 19 -10.143 -7.482 -1.398
103 HH2 TRP 19 HH2 TRP 19 -11.834 -5.865 -2.104
104 HA PRO 20 HA PRO 20 -6.650 -4.327 -1.417
105 HB2 PRO 20 HB2 PRO 20 -8.064 -4.180 0.821
106 HB3 PRO 20 HB3 PRO 20 -8.527 -5.297 -0.467
107 HG2 PRO 20 HG3 PRO 20 -7.249 -5.858 2.152
108 HG3 PRO 20 HG2 PRO 20 -8.333 -6.874 1.188
109 HD2 PRO 20 HD3 PRO 20 -5.476 -6.978 1.302
110 HD3 PRO 20 HD2 PRO 20 -6.557 -7.941 0.274
111 H ILE 21 H ILE 21 -3.871 -4.720 -0.114
112 HA ILE 21 HA ILE 21 -3.995 -2.236 1.435
113 HB ILE 21 HB ILE 21 -2.423 -3.120 3.110
114 HG12 ILE 21 HG13 ILE 21 -2.953 -5.816 1.835
115 HG13 ILE 21 HG12 ILE 21 -1.446 -4.918 1.696
116 HG21 ILE 21 HG21 ILE 21 -5.079 -4.486 2.774
117 HG22 ILE 21 HG22 ILE 21 -4.661 -3.119 3.811
118 HG23 ILE 21 HG23 ILE 21 -4.072 -4.735 4.204
119 HD11 ILE 21 HD11 ILE 21 -0.840 -6.229 3.413
120 HD12 ILE 21 HD12 ILE 21 -2.504 -6.515 3.924
121 HD13 ILE 21 HD13 ILE 21 -1.688 -5.015 4.370
122 H CYS 22 H CYS 22 -2.351 -0.859 1.089
123 HA CYS 22 HA CYS 22 -0.471 -1.549 -1.012
124 HB2 CYS 22 HB3 CYS 22 -1.687 0.698 -0.745
125 HB3 CYS 22 HB2 CYS 22 -0.473 1.057 0.472
126 H THR 23 H THR 23 1.686 -1.676 -0.826
127 HA THR 23 HA THR 23 2.870 -1.589 1.868
128 HB THR 23 HB THR 23 4.111 -3.683 1.356
129 HG1 THR 23 HG1 THR 23 2.290 -4.419 -0.621
130 HG21 THR 23 HG21 THR 23 1.246 -3.495 1.877
131 HG22 THR 23 HG22 THR 23 2.482 -4.452 2.692
132 HG23 THR 23 HG23 THR 23 1.730 -5.056 1.216
133 H ARG 24 H ARG 24 4.799 -0.540 1.904
134 HA ARG 24 HA ARG 24 6.011 0.146 -0.647
135 HB2 ARG 24 HB3 ARG 24 7.347 1.727 0.569
136 HB3 ARG 24 HB2 ARG 24 5.681 1.918 1.067
137 HG2 ARG 24 HG3 ARG 24 6.085 0.980 3.170
138 HG3 ARG 24 HG2 ARG 24 7.616 0.267 2.653
139 HD2 ARG 24 HD3 ARG 24 6.991 3.164 3.182
140 HD3 ARG 24 HD2 ARG 24 8.184 2.142 3.983
141 HE ARG 24 HE ARG 24 8.597 3.690 1.671
142 HH11 ARG 24 HH11 ARG 24 9.465 0.567 3.019
143 HH12 ARG 24 HH12 ARG 24 10.814 0.342 1.943
144 HH21 ARG 24 HH22 ARG 24 10.411 3.375 0.283
145 HH22 ARG 24 HH21 ARG 24 11.331 1.904 0.404
146 H ASP 25 H ASP 25 7.677 -0.936 -1.434
147 HA ASP 25 HA ASP 25 9.347 -2.465 -1.664
148 HB2 ASP 25 HB3 ASP 25 9.927 -1.736 1.220
149 HB3 ASP 25 HB2 ASP 25 11.005 -2.651 0.175
150 H GLY 26 H GLY 26 6.682 -3.273 -0.727
151 HA2 GLY 26 HA3 GLY 26 5.724 -5.351 -0.375
152 HA3 GLY 26 HA2 GLY 26 7.322 -6.000 -0.043
153 H LEU 27 H LEU 27 6.737 -3.216 1.759
154 HA LEU 27 HA LEU 27 6.054 -4.856 4.108
155 HB2 LEU 27 HB3 LEU 27 7.520 -2.220 3.975
156 HB3 LEU 27 HB2 LEU 27 7.145 -3.097 5.445
157 HG LEU 27 HG LEU 27 8.957 -4.096 3.246
158 HD11 LEU 27 HD11 LEU 27 10.588 -2.939 4.197
159 HD12 LEU 27 HD12 LEU 27 10.270 -3.740 5.736
160 HD13 LEU 27 HD13 LEU 27 9.435 -2.240 5.333
161 HD21 LEU 27 HD21 LEU 27 7.995 -5.267 5.823
162 HD22 LEU 27 HD22 LEU 27 9.584 -5.693 5.191
163 HD23 LEU 27 HD23 LEU 27 8.139 -6.021 4.236
164 HA PRO 28 HA PRO 28 2.237 -2.560 4.145
165 HB2 PRO 28 HB2 PRO 28 1.222 -3.621 6.413
166 HB3 PRO 28 HB3 PRO 28 1.296 -4.523 4.895
167 HG2 PRO 28 HG3 PRO 28 3.124 -4.644 7.261
168 HG3 PRO 28 HG2 PRO 28 2.473 -5.971 6.282
169 HD2 PRO 28 HD3 PRO 28 4.990 -4.982 5.966
170 HD3 PRO 28 HD2 PRO 28 4.057 -5.704 4.641
171 H VAL 29 H VAL 29 4.299 -0.974 4.859
172 HA VAL 29 HA VAL 29 3.883 0.026 7.543
173 HB VAL 29 HB VAL 29 5.688 1.125 5.385
174 HG11 VAL 29 HG11 VAL 29 5.168 2.721 7.173
175 HG12 VAL 29 HG12 VAL 29 6.863 2.236 7.201
176 HG13 VAL 29 HG13 VAL 29 5.732 1.554 8.370
177 HG21 VAL 29 HG21 VAL 29 7.390 -0.250 6.053
178 HG22 VAL 29 HG22 VAL 29 6.011 -1.321 6.302
179 HG23 VAL 29 HG23 VAL 29 6.726 -0.470 7.673
Start of MODEL 10
1 H1 CYS 1 H CYS 1 3.177 0.801 4.280
2 HA CYS 1 HA CYS 1 2.406 3.496 4.546
3 HB2 CYS 1 HB3 CYS 1 0.925 1.669 2.705
4 HB3 CYS 1 HB2 CYS 1 1.551 3.290 2.409
5 H GLY 2 H GLY 2 0.643 0.462 4.939
6 HA2 GLY 2 HA3 GLY 2 -1.171 -0.040 6.264
7 HA3 GLY 2 HA2 GLY 2 -1.116 1.600 6.882
8 H GLU 3 H GLU 3 -1.365 2.853 4.295
9 HA GLU 3 HA GLU 3 -4.108 3.175 4.166
10 HB2 GLU 3 HB3 GLU 3 -3.744 4.392 2.093
11 HB3 GLU 3 HB2 GLU 3 -2.512 4.803 3.278
12 HG2 GLU 3 HG3 GLU 3 -0.901 3.411 2.155
13 HG3 GLU 3 HG2 GLU 3 -2.133 2.841 1.029
14 H THR 4 H THR 4 -5.724 2.432 2.923
15 HA THR 4 HA THR 4 -5.357 -0.185 1.726
16 HB THR 4 HB THR 4 -7.852 1.470 2.205
17 HG1 THR 4 HG1 THR 4 -6.360 -0.232 3.781
18 HG21 THR 4 HG21 THR 4 -9.060 -0.674 1.874
19 HG22 THR 4 HG22 THR 4 -7.545 -1.409 1.350
20 HG23 THR 4 HG23 THR 4 -8.260 -0.096 0.413
21 H CYS 5 H CYS 5 -4.900 -0.343 -0.385
22 HA CYS 5 HA CYS 5 -5.494 1.881 -2.156
23 HB2 CYS 5 HB3 CYS 5 -4.163 0.629 -3.822
24 HB3 CYS 5 HB2 CYS 5 -3.279 0.908 -2.328
25 H PHE 6 H PHE 6 -7.816 1.155 -1.489
26 HA PHE 6 HA PHE 6 -9.113 -1.037 -2.545
27 HB2 PHE 6 HB3 PHE 6 -10.142 0.590 -1.002
28 HB3 PHE 6 HB2 PHE 6 -10.194 1.780 -2.297
29 HD1 PHE 6 HD1 PHE 6 -11.144 -1.825 -2.040
30 HD2 PHE 6 HD2 PHE 6 -12.337 2.143 -3.007
31 HE1 PHE 6 HE1 PHE 6 -13.360 -2.659 -2.713
32 HE2 PHE 6 HE2 PHE 6 -14.555 1.318 -3.680
33 HZ PHE 6 HZ PHE 6 -15.068 -1.086 -3.534
34 H GLY 7 H GLY 7 -8.526 2.098 -4.121
35 HA2 GLY 7 HA3 GLY 7 -9.611 1.042 -6.623
36 HA3 GLY 7 HA2 GLY 7 -9.174 2.715 -6.309
37 H GLY 8 H GLY 8 -6.987 0.156 -5.445
38 HA2 GLY 8 HA3 GLY 8 -4.920 -0.435 -6.239
39 HA3 GLY 8 HA2 GLY 8 -5.546 -0.084 -7.841
40 H THR 9 H THR 9 -5.173 2.182 -5.159
41 HA THR 9 HA THR 9 -2.938 3.471 -6.547
42 HB THR 9 HB THR 9 -5.158 5.158 -5.427
43 HG1 THR 9 HG1 THR 9 -5.269 3.606 -7.677
44 HG21 THR 9 HG21 THR 9 -4.210 6.894 -6.674
45 HG22 THR 9 HG22 THR 9 -3.347 5.783 -7.738
46 HG23 THR 9 HG23 THR 9 -2.811 6.006 -6.073
47 H CYS 10 H CYS 10 -1.619 4.738 -5.173
48 HA CYS 10 HA CYS 10 -2.181 4.551 -2.300
49 HB2 CYS 10 HB3 CYS 10 0.509 3.966 -3.561
50 HB3 CYS 10 HB2 CYS 10 0.136 3.935 -1.840
51 H ASN 11 H ASN 11 -1.551 6.270 -1.108
52 HA ASN 11 HA ASN 11 -0.867 8.688 -2.577
53 HB2 ASN 11 HB3 ASN 11 -1.634 8.239 0.316
54 HB3 ASN 11 HB2 ASN 11 -1.387 9.814 -0.428
55 HD21 ASN 11 HD22 ASN 11 -3.528 7.210 0.065
56 HD22 ASN 11 HD21 ASN 11 -4.865 7.847 -0.829
57 H THR 12 H THR 12 0.728 6.316 -0.759
58 HA THR 12 HA THR 12 2.875 8.147 0.033
59 HB THR 12 HB THR 12 2.697 5.212 0.697
60 HG1 THR 12 HG1 THR 12 0.785 6.106 1.457
61 HG21 THR 12 HG21 THR 12 4.598 5.620 1.779
62 HG22 THR 12 HG22 THR 12 3.758 6.799 2.787
63 HG23 THR 12 HG23 THR 12 4.537 7.314 1.291
64 HA PRO 13 HA PRO 13 5.193 6.903 -3.574
65 HB2 PRO 13 HB2 PRO 13 7.579 7.977 -2.746
66 HB3 PRO 13 HB3 PRO 13 6.284 8.910 -3.501
67 HG2 PRO 13 HG3 PRO 13 6.973 8.622 -0.606
68 HG3 PRO 13 HG2 PRO 13 6.477 10.070 -1.503
69 HD2 PRO 13 HD3 PRO 13 4.764 8.710 0.067
70 HD3 PRO 13 HD2 PRO 13 4.238 9.499 -1.434
71 H GLY 14 H GLY 14 6.286 5.088 -4.044
72 HA2 GLY 14 HA3 GLY 14 7.908 3.419 -3.754
73 HA3 GLY 14 HA2 GLY 14 8.071 3.897 -2.070
74 H CYS 15 H CYS 15 4.922 3.856 -2.267
75 HA CYS 15 HA CYS 15 4.727 1.142 -1.259
76 HB2 CYS 15 HB3 CYS 15 2.763 3.438 -1.334
77 HB3 CYS 15 HB2 CYS 15 2.384 1.850 -0.677
78 H SER 16 H SER 16 3.793 -0.503 -2.270
79 HA SER 16 HA SER 16 2.617 -0.023 -4.920
80 HB2 SER 16 HB3 SER 16 3.886 -2.569 -3.875
81 HB3 SER 16 HB2 SER 16 3.379 -2.240 -5.532
82 HG SER 16 HG SER 16 5.201 -0.482 -4.360
83 H CYS 17 H CYS 17 0.598 -0.840 -5.333
84 HA CYS 17 HA CYS 17 -1.043 -1.401 -3.110
85 HB2 CYS 17 HB3 CYS 17 -1.902 -0.315 -5.133
86 HB3 CYS 17 HB2 CYS 17 -1.646 -1.802 -6.041
87 H THR 18 H THR 18 -1.424 -3.173 -2.096
88 HA THR 18 HA THR 18 -1.112 -5.771 -3.437
89 HB THR 18 HB THR 18 -0.459 -5.349 -0.514
90 HG1 THR 18 HG1 THR 18 0.993 -4.547 -2.657
91 HG21 THR 18 HG21 THR 18 -0.910 -7.643 -1.228
92 HG22 THR 18 HG22 THR 18 0.793 -7.448 -0.812
93 HG23 THR 18 HG23 THR 18 0.299 -7.496 -2.504
94 H TRP 19 H TRP 19 -3.380 -4.869 -3.690
95 HA TRP 19 HA TRP 19 -5.354 -4.321 -2.117
96 HB2 TRP 19 HB3 TRP 19 -5.269 -5.388 -4.595
97 HB3 TRP 19 HB2 TRP 19 -6.057 -6.700 -3.723
98 HD1 TRP 19 HD1 TRP 19 -6.692 -3.270 -5.142
99 HE1 TRP 19 HE1 TRP 19 -9.154 -2.616 -4.760
100 HE3 TRP 19 HE3 TRP 19 -8.030 -7.022 -1.946
101 HZ2 TRP 19 HZ2 TRP 19 -11.368 -3.573 -3.285
102 HZ3 TRP 19 HZ3 TRP 19 -10.325 -7.075 -1.080
103 HH2 TRP 19 HH2 TRP 19 -11.967 -5.388 -1.740
104 HA PRO 20 HA PRO 20 -6.730 -4.060 -1.099
105 HB2 PRO 20 HB2 PRO 20 -8.097 -3.904 1.168
106 HB3 PRO 20 HB3 PRO 20 -8.619 -4.984 -0.128
107 HG2 PRO 20 HG3 PRO 20 -7.311 -5.628 2.458
108 HG3 PRO 20 HG2 PRO 20 -8.443 -6.593 1.498
109 HD2 PRO 20 HD3 PRO 20 -5.590 -6.787 1.559
110 HD3 PRO 20 HD2 PRO 20 -6.717 -7.700 0.537
111 H ILE 21 H ILE 21 -3.939 -4.503 0.067
112 HA ILE 21 HA ILE 21 -3.943 -2.068 1.690
113 HB ILE 21 HB ILE 21 -2.344 -3.025 3.294
114 HG12 ILE 21 HG13 ILE 21 -2.952 -5.679 1.965
115 HG13 ILE 21 HG12 ILE 21 -1.437 -4.798 1.803
116 HG21 ILE 21 HG21 ILE 21 -4.548 -3.018 4.081
117 HG22 ILE 21 HG22 ILE 21 -3.984 -4.660 4.387
118 HG23 ILE 21 HG23 ILE 21 -5.034 -4.331 3.006
119 HD11 ILE 21 HD11 ILE 21 -1.750 -6.759 3.541
120 HD12 ILE 21 HD12 ILE 21 -2.366 -5.444 4.541
121 HD13 ILE 21 HD13 ILE 21 -0.731 -5.362 3.884
122 H CYS 22 H CYS 22 -2.256 -0.732 1.318
123 HA CYS 22 HA CYS 22 -0.476 -1.457 -0.863
124 HB2 CYS 22 HB3 CYS 22 -1.626 0.812 -0.580
125 HB3 CYS 22 HB2 CYS 22 -0.392 1.149 0.623
126 H THR 23 H THR 23 1.686 -1.632 -0.747
127 HA THR 23 HA THR 23 2.952 -1.559 1.909
128 HB THR 23 HB THR 23 4.135 -3.678 1.378
129 HG1 THR 23 HG1 THR 23 2.244 -4.347 -0.571
130 HG21 THR 23 HG21 THR 23 2.533 -4.951 2.351
131 HG22 THR 23 HG22 THR 23 1.307 -4.497 1.167
132 HG23 THR 23 HG23 THR 23 1.696 -3.406 2.497
133 H ARG 24 H ARG 24 4.913 -0.579 1.891
134 HA ARG 24 HA ARG 24 6.064 0.097 -0.692
135 HB2 ARG 24 HB3 ARG 24 7.493 1.621 0.524
136 HB3 ARG 24 HB2 ARG 24 5.825 1.891 0.978
137 HG2 ARG 24 HG3 ARG 24 6.137 0.927 3.096
138 HG3 ARG 24 HG2 ARG 24 7.671 0.194 2.625
139 HD2 ARG 24 HD3 ARG 24 7.060 3.077 3.202
140 HD3 ARG 24 HD2 ARG 24 8.282 2.041 3.937
141 HE ARG 24 HE ARG 24 8.661 3.700 1.724
142 HH11 ARG 24 HH11 ARG 24 9.444 0.424 2.723
143 HH12 ARG 24 HH12 ARG 24 10.745 0.261 1.578
144 HH21 ARG 24 HH22 ARG 24 10.426 3.462 0.259
145 HH22 ARG 24 HH21 ARG 24 11.290 1.953 0.207
146 H ASP 25 H ASP 25 7.644 -1.056 -1.531
147 HA ASP 25 HA ASP 25 9.234 -2.651 -1.820
148 HB2 ASP 25 HB3 ASP 25 10.040 -1.742 0.951
149 HB3 ASP 25 HB2 ASP 25 10.970 -2.895 0.004
150 H GLY 26 H GLY 26 6.641 -3.391 -0.784
151 HA2 GLY 26 HA3 GLY 26 5.659 -5.431 -0.316
152 HA3 GLY 26 HA2 GLY 26 7.255 -6.095 -0.009
153 H LEU 27 H LEU 27 6.852 -3.265 1.740
154 HA LEU 27 HA LEU 27 6.198 -4.823 4.148
155 HB2 LEU 27 HB3 LEU 27 7.652 -2.188 3.896
156 HB3 LEU 27 HB2 LEU 27 7.335 -3.034 5.398
157 HG LEU 27 HG LEU 27 9.069 -4.073 3.156
158 HD11 LEU 27 HD11 LEU 27 10.943 -3.581 4.571
159 HD12 LEU 27 HD12 LEU 27 9.877 -3.022 5.861
160 HD13 LEU 27 HD13 LEU 27 9.996 -2.109 4.356
161 HD21 LEU 27 HD21 LEU 27 9.394 -5.984 4.342
162 HD22 LEU 27 HD22 LEU 27 7.756 -5.616 4.882
163 HD23 LEU 27 HD23 LEU 27 9.135 -5.195 5.898
164 HA PRO 28 HA PRO 28 2.374 -2.531 4.233
165 HB2 PRO 28 HB2 PRO 28 1.936 -3.732 6.854
166 HB3 PRO 28 HB3 PRO 28 1.077 -4.023 5.340
167 HG2 PRO 28 HG3 PRO 28 2.696 -5.869 6.487
168 HG3 PRO 28 HG2 PRO 28 2.459 -5.752 4.734
169 HD2 PRO 28 HD3 PRO 28 4.731 -4.751 6.413
170 HD3 PRO 28 HD2 PRO 28 4.771 -5.558 4.830
171 H VAL 29 H VAL 29 4.449 -0.923 4.836
172 HA VAL 29 HA VAL 29 4.130 0.133 7.512
173 HB VAL 29 HB VAL 29 5.852 1.180 5.261
174 HG11 VAL 29 HG11 VAL 29 6.006 2.943 6.640
175 HG12 VAL 29 HG12 VAL 29 7.079 1.902 7.577
176 HG13 VAL 29 HG13 VAL 29 5.379 2.045 8.023
177 HG21 VAL 29 HG21 VAL 29 7.280 -0.114 7.408
178 HG22 VAL 29 HG22 VAL 29 7.357 -0.405 5.671
179 HG23 VAL 29 HG23 VAL 29 6.136 -1.219 6.649
Start of MODEL 11
1 H1 CYS 1 H CYS 1 3.122 0.851 4.392
2 HA CYS 1 HA CYS 1 2.851 3.639 4.514
3 HB2 CYS 1 HB3 CYS 1 0.998 1.946 2.877
4 HB3 CYS 1 HB2 CYS 1 1.794 3.460 2.449
5 H GLY 2 H GLY 2 0.704 1.023 5.436
6 HA2 GLY 2 HA3 GLY 2 -1.177 0.988 6.745
7 HA3 GLY 2 HA2 GLY 2 -0.735 2.601 7.274
8 H GLU 3 H GLU 3 -1.577 1.467 4.022
9 HA GLU 3 HA GLU 3 -4.080 2.948 4.175
10 HB2 GLU 3 HB3 GLU 3 -3.665 4.171 2.124
11 HB3 GLU 3 HB2 GLU 3 -2.414 4.545 3.299
12 HG2 GLU 3 HG3 GLU 3 -0.798 3.326 2.147
13 HG3 GLU 3 HG2 GLU 3 -2.003 2.435 1.217
14 H THR 4 H THR 4 -5.668 2.217 2.836
15 HA THR 4 HA THR 4 -5.165 -0.369 1.585
16 HB THR 4 HB THR 4 -7.747 -0.338 1.449
17 HG1 THR 4 HG1 THR 4 -8.539 1.089 3.249
18 HG21 THR 4 HG21 THR 4 -6.624 -0.268 4.242
19 HG22 THR 4 HG22 THR 4 -6.280 -1.585 3.119
20 HG23 THR 4 HG23 THR 4 -7.941 -1.261 3.616
21 H CYS 5 H CYS 5 -4.730 -0.360 -0.542
22 HA CYS 5 HA CYS 5 -5.559 1.901 -2.161
23 HB2 CYS 5 HB3 CYS 5 -4.154 0.877 -3.926
24 HB3 CYS 5 HB2 CYS 5 -3.274 1.171 -2.432
25 H PHE 6 H PHE 6 -7.836 0.918 -1.578
26 HA PHE 6 HA PHE 6 -8.828 -1.300 -2.965
27 HB2 PHE 6 HB3 PHE 6 -10.091 1.174 -1.848
28 HB3 PHE 6 HB2 PHE 6 -11.050 0.106 -2.864
29 HD1 PHE 6 HD2 PHE 6 -8.516 -0.529 -0.190
30 HD2 PHE 6 HD1 PHE 6 -12.498 -1.098 -1.575
31 HE1 PHE 6 HE2 PHE 6 -8.983 -1.962 1.752
32 HE2 PHE 6 HE1 PHE 6 -12.972 -2.532 0.367
33 HZ PHE 6 HZ PHE 6 -11.213 -2.967 2.033
34 H GLY 7 H GLY 7 -8.363 2.030 -3.981
35 HA2 GLY 7 HA3 GLY 7 -9.625 1.536 -6.554
36 HA3 GLY 7 HA2 GLY 7 -8.946 3.058 -6.002
37 H GLY 8 H GLY 8 -6.931 0.318 -5.570
38 HA2 GLY 8 HA3 GLY 8 -5.132 -0.511 -6.757
39 HA3 GLY 8 HA2 GLY 8 -5.693 0.380 -8.161
40 H THR 9 H THR 9 -5.679 2.945 -6.702
41 HA THR 9 HA THR 9 -2.862 3.530 -7.079
42 HB THR 9 HB THR 9 -4.914 5.566 -6.284
43 HG1 THR 9 HG1 THR 9 -5.093 3.951 -8.423
44 HG21 THR 9 HG21 THR 9 -3.555 7.081 -7.490
45 HG22 THR 9 HG22 THR 9 -2.680 5.776 -8.292
46 HG23 THR 9 HG23 THR 9 -2.437 6.074 -6.571
47 H CYS 10 H CYS 10 -1.569 4.565 -5.538
48 HA CYS 10 HA CYS 10 -2.444 4.215 -2.754
49 HB2 CYS 10 HB3 CYS 10 0.357 4.097 -3.895
50 HB3 CYS 10 HB2 CYS 10 -0.048 3.962 -2.186
51 H ASN 11 H ASN 11 -1.844 5.782 -1.243
52 HA ASN 11 HA ASN 11 -1.703 8.465 -2.350
53 HB2 ASN 11 HB3 ASN 11 -2.111 7.439 0.465
54 HB3 ASN 11 HB2 ASN 11 -2.119 9.143 0.022
55 HD21 ASN 11 HD22 ASN 11 -3.864 6.192 0.058
56 HD22 ASN 11 HD21 ASN 11 -5.351 6.817 -0.573
57 H THR 12 H THR 12 0.324 6.219 -0.614
58 HA THR 12 HA THR 12 2.301 8.342 -0.176
59 HB THR 12 HB THR 12 3.489 6.569 1.203
60 HG1 THR 12 HG1 THR 12 0.993 5.245 0.750
61 HG21 THR 12 HG21 THR 12 0.719 7.421 2.054
62 HG22 THR 12 HG22 THR 12 2.196 8.372 2.221
63 HG23 THR 12 HG23 THR 12 2.004 6.874 3.132
64 HA PRO 13 HA PRO 13 4.596 6.947 -3.703
65 HB2 PRO 13 HB2 PRO 13 6.801 8.509 -2.543
66 HB3 PRO 13 HB3 PRO 13 5.949 8.739 -4.072
67 HG2 PRO 13 HG3 PRO 13 5.626 10.424 -2.003
68 HG3 PRO 13 HG2 PRO 13 4.298 10.031 -3.110
69 HD2 PRO 13 HD3 PRO 13 4.850 8.975 -0.361
70 HD3 PRO 13 HD2 PRO 13 3.305 9.457 -1.093
71 H GLY 14 H GLY 14 6.017 5.323 -4.111
72 HA2 GLY 14 HA3 GLY 14 7.915 3.980 -3.687
73 HA3 GLY 14 HA2 GLY 14 7.856 4.472 -1.999
74 H CYS 15 H CYS 15 4.855 3.983 -2.173
75 HA CYS 15 HA CYS 15 4.997 1.198 -1.383
76 HB2 CYS 15 HB3 CYS 15 2.780 3.249 -1.233
77 HB3 CYS 15 HB2 CYS 15 2.638 1.594 -0.648
78 H SER 16 H SER 16 4.028 -0.463 -2.409
79 HA SER 16 HA SER 16 2.899 0.085 -5.067
80 HB2 SER 16 HB3 SER 16 4.115 -2.493 -4.037
81 HB3 SER 16 HB2 SER 16 3.648 -2.134 -5.700
82 HG SER 16 HG SER 16 5.413 -0.345 -4.550
83 H CYS 17 H CYS 17 0.850 -0.591 -5.501
84 HA CYS 17 HA CYS 17 -0.823 -1.239 -3.334
85 HB2 CYS 17 HB3 CYS 17 -1.627 -0.028 -5.317
86 HB3 CYS 17 HB2 CYS 17 -1.429 -1.490 -6.280
87 H THR 18 H THR 18 -1.305 -3.033 -2.432
88 HA THR 18 HA THR 18 -1.017 -5.582 -3.865
89 HB THR 18 HB THR 18 -0.448 -5.302 -0.910
90 HG1 THR 18 HG1 THR 18 1.063 -4.341 -2.904
91 HG21 THR 18 HG21 THR 18 1.000 -7.319 -2.421
92 HG22 THR 18 HG22 THR 18 -0.747 -7.492 -2.591
93 HG23 THR 18 HG23 THR 18 -0.013 -7.498 -0.988
94 H TRP 19 H TRP 19 -3.265 -4.708 -4.172
95 HA TRP 19 HA TRP 19 -5.274 -4.134 -2.655
96 HB2 TRP 19 HB3 TRP 19 -5.148 -5.233 -5.118
97 HB3 TRP 19 HB2 TRP 19 -5.970 -6.523 -4.245
98 HD1 TRP 19 HD1 TRP 19 -6.529 -3.088 -5.698
99 HE1 TRP 19 HE1 TRP 19 -8.990 -2.399 -5.367
100 HE3 TRP 19 HE3 TRP 19 -7.993 -6.819 -2.527
101 HZ2 TRP 19 HZ2 TRP 19 -11.247 -3.318 -3.939
102 HZ3 TRP 19 HZ3 TRP 19 -10.307 -6.834 -1.710
103 HH2 TRP 19 HH2 TRP 19 -11.907 -5.122 -2.407
104 HA PRO 20 HA PRO 20 -6.682 -3.856 -1.687
105 HB2 PRO 20 HB2 PRO 20 -8.107 -3.656 0.537
106 HB3 PRO 20 HB3 PRO 20 -8.592 -4.768 -0.748
107 HG2 PRO 20 HG3 PRO 20 -7.336 -5.349 1.881
108 HG3 PRO 20 HG2 PRO 20 -8.459 -6.332 0.929
109 HD2 PRO 20 HD3 PRO 20 -5.613 -6.549 1.040
110 HD3 PRO 20 HD2 PRO 20 -6.728 -7.464 0.007
111 H ILE 21 H ILE 21 -3.926 -4.329 -0.368
112 HA ILE 21 HA ILE 21 -3.956 -1.832 1.164
113 HB ILE 21 HB ILE 21 -2.453 -2.763 2.868
114 HG12 ILE 21 HG13 ILE 21 -3.035 -5.447 1.589
115 HG13 ILE 21 HG12 ILE 21 -1.502 -4.590 1.473
116 HG21 ILE 21 HG21 ILE 21 -5.142 -4.053 2.494
117 HG22 ILE 21 HG22 ILE 21 -4.697 -2.704 3.543
118 HG23 ILE 21 HG23 ILE 21 -4.162 -4.339 3.935
119 HD11 ILE 21 HD11 ILE 21 -1.752 -4.671 4.132
120 HD12 ILE 21 HD12 ILE 21 -0.979 -5.947 3.192
121 HD13 ILE 21 HD13 ILE 21 -2.656 -6.125 3.708
122 H CYS 22 H CYS 22 -2.194 -0.558 0.883
123 HA CYS 22 HA CYS 22 -0.349 -1.325 -1.225
124 HB2 CYS 22 HB3 CYS 22 -1.470 0.988 -0.895
125 HB3 CYS 22 HB2 CYS 22 -0.188 1.264 0.272
126 H THR 23 H THR 23 1.833 -1.497 -1.010
127 HA THR 23 HA THR 23 2.951 -1.513 1.709
128 HB THR 23 HB THR 23 4.093 -3.666 1.210
129 HG1 THR 23 HG1 THR 23 2.271 -4.277 -0.814
130 HG21 THR 23 HG21 THR 23 2.408 -4.896 2.098
131 HG22 THR 23 HG22 THR 23 1.250 -4.386 0.870
132 HG23 THR 23 HG23 THR 23 1.620 -3.324 2.230
133 H ARG 24 H ARG 24 4.928 -0.576 1.801
134 HA ARG 24 HA ARG 24 6.277 0.013 -0.714
135 HB2 ARG 24 HB3 ARG 24 7.651 1.539 0.556
136 HB3 ARG 24 HB2 ARG 24 5.968 1.854 0.920
137 HG2 ARG 24 HG3 ARG 24 6.151 0.951 3.070
138 HG3 ARG 24 HG2 ARG 24 7.667 0.129 2.691
139 HD2 ARG 24 HD3 ARG 24 7.193 3.076 3.092
140 HD3 ARG 24 HD2 ARG 24 8.244 2.005 4.019
141 HE ARG 24 HE ARG 24 8.951 3.445 1.708
142 HH11 ARG 24 HH11 ARG 24 9.490 0.317 3.209
143 HH12 ARG 24 HH12 ARG 24 10.906 -0.028 2.259
144 HH21 ARG 24 HH22 ARG 24 10.849 2.969 0.490
145 HH22 ARG 24 HH21 ARG 24 11.652 1.445 0.726
146 H ASP 25 H ASP 25 7.950 -1.171 -1.376
147 HA ASP 25 HA ASP 25 9.556 -2.781 -1.462
148 HB2 ASP 25 HB3 ASP 25 9.958 -2.044 1.451
149 HB3 ASP 25 HB2 ASP 25 11.056 -3.037 0.503
150 H GLY 26 H GLY 26 6.788 -3.425 -0.714
151 HA2 GLY 26 HA3 GLY 26 5.676 -5.427 -0.396
152 HA3 GLY 26 HA2 GLY 26 7.210 -6.177 0.022
153 H LEU 27 H LEU 27 6.695 -3.349 1.788
154 HA LEU 27 HA LEU 27 5.737 -4.928 4.084
155 HB2 LEU 27 HB3 LEU 27 7.506 -2.481 4.062
156 HB3 LEU 27 HB2 LEU 27 6.937 -3.302 5.502
157 HG LEU 27 HG LEU 27 8.752 -4.516 3.416
158 HD11 LEU 27 HD11 LEU 27 10.449 -4.384 5.226
159 HD12 LEU 27 HD12 LEU 27 9.318 -3.400 6.156
160 HD13 LEU 27 HD13 LEU 27 9.936 -2.812 4.612
161 HD21 LEU 27 HD21 LEU 27 8.790 -5.861 5.921
162 HD22 LEU 27 HD22 LEU 27 8.304 -6.482 4.343
163 HD23 LEU 27 HD23 LEU 27 7.113 -5.714 5.394
164 HA PRO 28 HA PRO 28 2.230 -2.178 3.916
165 HB2 PRO 28 HB2 PRO 28 0.896 -3.197 6.027
166 HB3 PRO 28 HB3 PRO 28 1.008 -4.050 4.482
167 HG2 PRO 28 HG3 PRO 28 2.574 -4.469 6.998
168 HG3 PRO 28 HG2 PRO 28 1.877 -5.673 5.900
169 HD2 PRO 28 HD3 PRO 28 4.512 -4.954 5.875
170 HD3 PRO 28 HD2 PRO 28 3.645 -5.550 4.446
171 H VAL 29 H VAL 29 4.405 -0.897 4.884
172 HA VAL 29 HA VAL 29 3.879 0.033 7.578
173 HB VAL 29 HB VAL 29 5.981 1.027 5.648
174 HG11 VAL 29 HG11 VAL 29 6.498 1.074 8.534
175 HG12 VAL 29 HG12 VAL 29 5.201 2.142 7.999
176 HG13 VAL 29 HG13 VAL 29 6.813 2.295 7.302
177 HG21 VAL 29 HG21 VAL 29 5.867 -1.527 6.470
178 HG22 VAL 29 HG22 VAL 29 6.746 -0.815 7.822
179 HG23 VAL 29 HG23 VAL 29 7.379 -0.665 6.183
Start of MODEL 12
1 H1 CYS 1 H CYS 1 3.428 2.141 3.948
2 HA CYS 1 HA CYS 1 2.468 4.792 4.484
3 HB2 CYS 1 HB3 CYS 1 1.448 2.736 2.510
4 HB3 CYS 1 HB2 CYS 1 1.024 4.445 2.532
5 H GLY 2 H GLY 2 1.288 1.513 4.891
6 HA2 GLY 2 HA3 GLY 2 -0.409 0.632 6.148
7 HA3 GLY 2 HA2 GLY 2 -0.334 2.111 7.090
8 H GLU 3 H GLU 3 -1.119 1.921 3.668
9 HA GLU 3 HA GLU 3 -3.835 2.826 4.334
10 HB2 GLU 3 HB3 GLU 3 -3.829 3.983 2.145
11 HB3 GLU 3 HB2 GLU 3 -2.602 4.594 3.248
12 HG2 GLU 3 HG3 GLU 3 -0.869 3.516 2.071
13 HG3 GLU 3 HG2 GLU 3 -2.009 2.545 1.139
14 H THR 4 H THR 4 -5.553 2.039 3.118
15 HA THR 4 HA THR 4 -5.068 -0.585 1.954
16 HB THR 4 HB THR 4 -7.587 -0.735 2.009
17 HG1 THR 4 HG1 THR 4 -7.715 1.701 2.085
18 HG21 THR 4 HG21 THR 4 -5.807 -1.214 3.975
19 HG22 THR 4 HG22 THR 4 -7.538 -1.508 4.142
20 HG23 THR 4 HG23 THR 4 -6.831 -0.023 4.778
21 H CYS 5 H CYS 5 -4.846 -0.773 -0.203
22 HA CYS 5 HA CYS 5 -5.819 1.355 -1.929
23 HB2 CYS 5 HB3 CYS 5 -4.644 0.087 -3.743
24 HB3 CYS 5 HB2 CYS 5 -3.599 0.630 -2.437
25 H PHE 6 H PHE 6 -8.004 0.533 -1.065
26 HA PHE 6 HA PHE 6 -9.205 -1.807 -1.962
27 HB2 PHE 6 HB3 PHE 6 -10.213 -0.248 -0.322
28 HB3 PHE 6 HB2 PHE 6 -10.497 0.912 -1.614
29 HD1 PHE 6 HD2 PHE 6 -11.099 -2.755 -1.222
30 HD2 PHE 6 HD1 PHE 6 -12.716 1.075 -2.129
31 HE1 PHE 6 HE2 PHE 6 -13.290 -3.787 -1.658
32 HE2 PHE 6 HE1 PHE 6 -14.909 0.051 -2.565
33 HZ PHE 6 HZ PHE 6 -15.199 -2.384 -2.331
34 H GLY 7 H GLY 7 -8.841 1.319 -3.569
35 HA2 GLY 7 HA3 GLY 7 -10.175 0.310 -5.961
36 HA3 GLY 7 HA2 GLY 7 -9.640 1.961 -5.689
37 H GLY 8 H GLY 8 -7.437 -0.629 -5.005
38 HA2 GLY 8 HA3 GLY 8 -5.624 -1.467 -6.156
39 HA3 GLY 8 HA2 GLY 8 -6.253 -0.728 -7.616
40 H THR 9 H THR 9 -6.301 1.970 -6.567
41 HA THR 9 HA THR 9 -3.481 2.560 -6.930
42 HB THR 9 HB THR 9 -5.586 4.655 -6.550
43 HG1 THR 9 HG1 THR 9 -5.683 2.703 -8.390
44 HG21 THR 9 HG21 THR 9 -3.440 4.680 -8.623
45 HG22 THR 9 HG22 THR 9 -3.004 4.974 -6.939
46 HG23 THR 9 HG23 THR 9 -4.169 6.025 -7.745
47 H CYS 10 H CYS 10 -2.250 3.814 -5.540
48 HA CYS 10 HA CYS 10 -3.184 3.902 -2.755
49 HB2 CYS 10 HB3 CYS 10 -0.328 3.891 -3.771
50 HB3 CYS 10 HB2 CYS 10 -0.831 3.838 -2.085
51 H ASN 11 H ASN 11 -2.619 5.749 -1.499
52 HA ASN 11 HA ASN 11 -2.683 8.206 -3.056
53 HB2 ASN 11 HB3 ASN 11 -4.224 7.959 -1.169
54 HB3 ASN 11 HB2 ASN 11 -2.871 7.705 -0.073
55 HD21 ASN 11 HD22 ASN 11 -2.243 9.405 1.028
56 HD22 ASN 11 HD21 ASN 11 -2.489 11.056 0.585
57 H THR 12 H THR 12 -0.516 6.382 -1.034
58 HA THR 12 HA THR 12 1.451 8.560 -1.077
59 HB THR 12 HB THR 12 1.730 5.947 0.390
60 HG1 THR 12 HG1 THR 12 -0.172 6.759 1.170
61 HG21 THR 12 HG21 THR 12 3.749 6.997 0.575
62 HG22 THR 12 HG22 THR 12 2.917 7.723 1.950
63 HG23 THR 12 HG23 THR 12 3.051 8.610 0.431
64 HA PRO 13 HA PRO 13 3.396 6.326 -4.446
65 HB2 PRO 13 HB2 PRO 13 5.459 8.400 -4.241
66 HB3 PRO 13 HB3 PRO 13 4.369 8.040 -5.583
67 HG2 PRO 13 HG3 PRO 13 4.119 10.269 -4.080
68 HG3 PRO 13 HG2 PRO 13 2.723 9.443 -4.796
69 HD2 PRO 13 HD3 PRO 13 3.745 9.347 -1.981
70 HD3 PRO 13 HD2 PRO 13 2.070 9.437 -2.570
71 H GLY 14 H GLY 14 4.891 4.770 -4.441
72 HA2 GLY 14 HA3 GLY 14 7.178 4.113 -3.873
73 HA3 GLY 14 HA2 GLY 14 6.885 4.796 -2.278
74 H CYS 15 H CYS 15 4.168 3.787 -2.141
75 HA CYS 15 HA CYS 15 4.826 1.065 -1.328
76 HB2 CYS 15 HB3 CYS 15 2.514 2.903 -0.775
77 HB3 CYS 15 HB2 CYS 15 2.393 1.178 -0.442
78 H SER 16 H SER 16 4.177 -0.708 -2.341
79 HA SER 16 HA SER 16 2.738 -0.408 -4.847
80 HB2 SER 16 HB3 SER 16 3.977 -2.894 -3.632
81 HB3 SER 16 HB2 SER 16 3.459 -2.679 -5.306
82 HG SER 16 HG SER 16 5.739 -2.403 -5.000
83 H CYS 17 H CYS 17 0.684 -1.160 -5.182
84 HA CYS 17 HA CYS 17 -0.916 -1.617 -2.901
85 HB2 CYS 17 HB3 CYS 17 -1.905 -0.587 -4.843
86 HB3 CYS 17 HB2 CYS 17 -1.554 -2.006 -5.824
87 H THR 18 H THR 18 -1.008 -3.315 -1.776
88 HA THR 18 HA THR 18 -0.781 -5.971 -3.022
89 HB THR 18 HB THR 18 -0.147 -5.423 -0.123
90 HG1 THR 18 HG1 THR 18 1.184 -4.323 -2.052
91 HG21 THR 18 HG21 THR 18 0.125 -7.666 -2.019
92 HG22 THR 18 HG22 THR 18 -0.105 -7.683 -0.270
93 HG23 THR 18 HG23 THR 18 1.502 -7.409 -0.946
94 H TRP 19 H TRP 19 -3.058 -5.266 -3.348
95 HA TRP 19 HA TRP 19 -5.052 -4.614 -1.855
96 HB2 TRP 19 HB3 TRP 19 -4.955 -5.943 -4.180
97 HB3 TRP 19 HB2 TRP 19 -5.632 -7.208 -3.160
98 HD1 TRP 19 HD1 TRP 19 -6.551 -4.032 -4.946
99 HE1 TRP 19 HE1 TRP 19 -9.043 -3.503 -4.560
100 HE3 TRP 19 HE3 TRP 19 -7.539 -7.430 -1.261
101 HZ2 TRP 19 HZ2 TRP 19 -11.144 -4.411 -2.909
102 HZ3 TRP 19 HZ3 TRP 19 -9.804 -7.530 -0.321
103 HH2 TRP 19 HH2 TRP 19 -11.574 -6.053 -1.131
104 HA PRO 20 HA PRO 20 -6.376 -4.248 -0.855
105 HB2 PRO 20 HB2 PRO 20 -7.758 -3.857 1.364
106 HB3 PRO 20 HB3 PRO 20 -8.232 -5.120 0.227
107 HG2 PRO 20 HG3 PRO 20 -6.901 -5.360 2.871
108 HG3 PRO 20 HG2 PRO 20 -8.005 -6.483 2.060
109 HD2 PRO 20 HD3 PRO 20 -5.144 -6.571 2.118
110 HD3 PRO 20 HD2 PRO 20 -6.247 -7.652 1.241
111 H ILE 21 H ILE 21 -3.559 -4.448 0.355
112 HA ILE 21 HA ILE 21 -3.650 -1.831 1.668
113 HB ILE 21 HB ILE 21 -2.044 -2.554 3.402
114 HG12 ILE 21 HG13 ILE 21 -2.668 -5.358 2.447
115 HG13 ILE 21 HG12 ILE 21 -1.144 -4.522 2.178
116 HG21 ILE 21 HG21 ILE 21 -4.722 -3.923 3.293
117 HG22 ILE 21 HG22 ILE 21 -4.294 -2.414 4.105
118 HG23 ILE 21 HG23 ILE 21 -3.691 -3.951 4.727
119 HD11 ILE 21 HD11 ILE 21 -2.267 -5.119 4.901
120 HD12 ILE 21 HD12 ILE 21 -0.655 -4.518 4.510
121 HD13 ILE 21 HD13 ILE 21 -1.122 -6.157 4.050
122 H CYS 22 H CYS 22 -2.017 -0.502 1.163
123 HA CYS 22 HA CYS 22 -0.120 -1.340 -0.870
124 HB2 CYS 22 HB3 CYS 22 -0.320 1.341 0.502
125 HB3 CYS 22 HB2 CYS 22 0.527 0.984 -0.993
126 H THR 23 H THR 23 1.945 -1.818 -0.575
127 HA THR 23 HA THR 23 3.303 -1.078 1.904
128 HB THR 23 HB THR 23 4.244 -3.365 2.114
129 HG1 THR 23 HG1 THR 23 2.192 -4.232 0.353
130 HG21 THR 23 HG21 THR 23 1.732 -4.389 2.559
131 HG22 THR 23 HG22 THR 23 1.469 -2.647 2.647
132 HG23 THR 23 HG23 THR 23 2.660 -3.414 3.699
133 H ARG 24 H ARG 24 5.470 -0.599 1.558
134 HA ARG 24 HA ARG 24 6.368 -0.861 -1.202
135 HB2 ARG 24 HB3 ARG 24 8.038 0.756 -0.708
136 HB3 ARG 24 HB2 ARG 24 6.526 1.368 -0.078
137 HG2 ARG 24 HG3 ARG 24 7.190 1.075 2.127
138 HG3 ARG 24 HG2 ARG 24 8.450 -0.084 1.695
139 HD2 ARG 24 HD3 ARG 24 8.443 2.900 1.287
140 HD3 ARG 24 HD2 ARG 24 9.566 1.935 2.244
141 HE ARG 24 HE ARG 24 9.795 2.543 -0.501
142 HH11 ARG 24 HH11 ARG 24 10.401 -0.072 1.763
143 HH12 ARG 24 HH12 ARG 24 11.498 -0.898 0.696
144 HH21 ARG 24 HH22 ARG 24 11.272 1.433 -1.877
145 HH22 ARG 24 HH21 ARG 24 11.969 -0.071 -1.346
146 H ASP 25 H ASP 25 7.660 -2.464 -1.734
147 HA ASP 25 HA ASP 25 9.010 -4.293 -1.609
148 HB2 ASP 25 HB3 ASP 25 10.212 -2.781 0.728
149 HB3 ASP 25 HB2 ASP 25 10.927 -4.202 -0.023
150 H GLY 26 H GLY 26 6.476 -4.220 -0.165
151 HA2 GLY 26 HA3 GLY 26 5.314 -5.858 0.999
152 HA3 GLY 26 HA2 GLY 26 6.845 -6.609 1.421
153 H LEU 27 H LEU 27 7.130 -3.396 2.152
154 HA LEU 27 HA LEU 27 6.566 -3.937 4.975
155 HB2 LEU 27 HB3 LEU 27 8.142 -1.704 3.694
156 HB3 LEU 27 HB2 LEU 27 7.957 -1.956 5.419
157 HG LEU 27 HG LEU 27 9.331 -3.868 3.527
158 HD11 LEU 27 HD11 LEU 27 10.552 -1.754 3.839
159 HD12 LEU 27 HD12 LEU 27 11.392 -3.130 4.554
160 HD13 LEU 27 HD13 LEU 27 10.506 -2.004 5.584
161 HD21 LEU 27 HD21 LEU 27 9.422 -3.908 6.526
162 HD22 LEU 27 HD22 LEU 27 9.879 -5.175 5.387
163 HD23 LEU 27 HD23 LEU 27 8.179 -4.776 5.626
164 HA PRO 28 HA PRO 28 2.980 -1.303 4.600
165 HB2 PRO 28 HB2 PRO 28 2.086 -1.629 7.118
166 HB3 PRO 28 HB3 PRO 28 1.952 -2.909 5.906
167 HG2 PRO 28 HG3 PRO 28 3.936 -2.593 8.120
168 HG3 PRO 28 HG2 PRO 28 3.120 -4.058 7.546
169 HD2 PRO 28 HD3 PRO 28 5.689 -3.357 6.869
170 HD3 PRO 28 HD2 PRO 28 4.647 -4.397 5.879
171 H VAL 29 H VAL 29 4.812 0.396 4.457
172 HA VAL 29 HA VAL 29 5.253 1.885 6.889
173 HB VAL 29 HB VAL 29 6.089 2.572 4.070
174 HG11 VAL 29 HG11 VAL 29 7.154 3.609 6.694
175 HG12 VAL 29 HG12 VAL 29 6.041 4.482 5.640
176 HG13 VAL 29 HG13 VAL 29 7.667 4.094 5.078
177 HG21 VAL 29 HG21 VAL 29 8.376 1.827 5.243
178 HG22 VAL 29 HG22 VAL 29 7.346 0.709 4.349
179 HG23 VAL 29 HG23 VAL 29 7.255 0.776 6.109
Start of MODEL 13
1 H1 CYS 1 H CYS 1 3.345 1.438 4.141
2 HA CYS 1 HA CYS 1 2.527 4.105 4.726
3 HB2 CYS 1 HB3 CYS 1 1.624 2.189 2.569
4 HB3 CYS 1 HB2 CYS 1 1.140 3.880 2.661
5 H GLY 2 H GLY 2 0.976 0.947 4.859
6 HA2 GLY 2 HA3 GLY 2 -0.779 0.239 6.172
7 HA3 GLY 2 HA2 GLY 2 -0.850 1.847 6.868
8 H GLU 3 H GLU 3 -1.212 3.156 4.279
9 HA GLU 3 HA GLU 3 -3.963 3.327 4.207
10 HB2 GLU 3 HB3 GLU 3 -3.717 4.526 2.103
11 HB3 GLU 3 HB2 GLU 3 -2.484 5.024 3.252
12 HG2 GLU 3 HG3 GLU 3 -0.819 3.730 2.118
13 HG3 GLU 3 HG2 GLU 3 -2.034 3.027 1.050
14 H THR 4 H THR 4 -5.576 2.430 3.086
15 HA THR 4 HA THR 4 -5.060 -0.145 1.860
16 HB THR 4 HB THR 4 -7.575 -0.289 1.841
17 HG1 THR 4 HG1 THR 4 -7.684 2.158 1.919
18 HG21 THR 4 HG21 THR 4 -6.095 0.233 4.410
19 HG22 THR 4 HG22 THR 4 -6.513 -1.318 3.682
20 HG23 THR 4 HG23 THR 4 -7.774 -0.307 4.385
21 H CYS 5 H CYS 5 -4.843 -0.361 -0.288
22 HA CYS 5 HA CYS 5 -5.661 1.825 -2.018
23 HB2 CYS 5 HB3 CYS 5 -4.466 0.582 -3.797
24 HB3 CYS 5 HB2 CYS 5 -3.450 0.946 -2.410
25 H PHE 6 H PHE 6 -7.906 1.099 -1.210
26 HA PHE 6 HA PHE 6 -9.224 -1.152 -2.129
27 HB2 PHE 6 HB3 PHE 6 -10.182 0.472 -0.539
28 HB3 PHE 6 HB2 PHE 6 -10.342 1.647 -1.838
29 HD1 PHE 6 HD2 PHE 6 -11.216 -1.966 -1.456
30 HD2 PHE 6 HD1 PHE 6 -12.525 1.964 -2.433
31 HE1 PHE 6 HE2 PHE 6 -13.458 -2.842 -1.961
32 HE2 PHE 6 HE1 PHE 6 -14.770 1.094 -2.938
33 HZ PHE 6 HZ PHE 6 -15.239 -1.311 -2.704
34 H GLY 7 H GLY 7 -8.745 1.955 -3.782
35 HA2 GLY 7 HA3 GLY 7 -10.038 0.911 -6.183
36 HA3 GLY 7 HA2 GLY 7 -9.506 2.564 -5.928
37 H GLY 8 H GLY 8 -7.323 -0.010 -5.160
38 HA2 GLY 8 HA3 GLY 8 -5.357 -0.706 -6.111
39 HA3 GLY 8 HA2 GLY 8 -6.109 -0.390 -7.667
40 H THR 9 H THR 9 -5.380 1.928 -5.091
41 HA THR 9 HA THR 9 -3.180 3.042 -6.639
42 HB THR 9 HB THR 9 -5.340 4.925 -5.732
43 HG1 THR 9 HG1 THR 9 -5.440 3.185 -7.864
44 HG21 THR 9 HG21 THR 9 -4.262 6.508 -7.013
45 HG22 THR 9 HG22 THR 9 -3.561 5.307 -8.098
46 HG23 THR 9 HG23 THR 9 -2.900 5.525 -6.477
47 H CYS 10 H CYS 10 -1.808 4.357 -5.390
48 HA CYS 10 HA CYS 10 -2.362 4.388 -2.502
49 HB2 CYS 10 HB3 CYS 10 0.355 3.961 -3.769
50 HB3 CYS 10 HB2 CYS 10 -0.018 3.932 -2.049
51 H ASN 11 H ASN 11 -1.754 6.198 -1.392
52 HA ASN 11 HA ASN 11 -1.333 8.581 -3.007
53 HB2 ASN 11 HB3 ASN 11 -1.845 8.215 -0.044
54 HB3 ASN 11 HB2 ASN 11 -1.747 9.771 -0.862
55 HD21 ASN 11 HD22 ASN 11 -3.672 7.027 -0.165
56 HD22 ASN 11 HD21 ASN 11 -5.117 7.574 -0.948
57 H THR 12 H THR 12 0.418 6.461 -0.941
58 HA THR 12 HA THR 12 2.617 8.381 -0.662
59 HB THR 12 HB THR 12 2.475 5.638 0.577
60 HG1 THR 12 HG1 THR 12 0.615 6.679 1.263
61 HG21 THR 12 HG21 THR 12 3.972 6.593 2.222
62 HG22 THR 12 HG22 THR 12 3.848 8.177 1.457
63 HG23 THR 12 HG23 THR 12 4.630 6.845 0.606
64 HA PRO 13 HA PRO 13 4.571 6.307 -4.120
65 HB2 PRO 13 HB2 PRO 13 6.874 7.982 -3.368
66 HB3 PRO 13 HB3 PRO 13 5.969 7.938 -4.884
67 HG2 PRO 13 HG3 PRO 13 5.770 10.006 -3.183
68 HG3 PRO 13 HG2 PRO 13 4.385 9.443 -4.136
69 HD2 PRO 13 HD3 PRO 13 5.034 8.940 -1.255
70 HD3 PRO 13 HD2 PRO 13 3.467 9.306 -2.010
71 H GLY 14 H GLY 14 5.905 4.586 -4.276
72 HA2 GLY 14 HA3 GLY 14 7.876 3.378 -3.651
73 HA3 GLY 14 HA2 GLY 14 7.704 4.023 -2.024
74 H CYS 15 H CYS 15 4.797 3.546 -2.026
75 HA CYS 15 HA CYS 15 4.939 0.741 -1.278
76 HB2 CYS 15 HB3 CYS 15 2.982 2.945 -0.744
77 HB3 CYS 15 HB2 CYS 15 2.488 1.267 -0.550
78 H SER 16 H SER 16 4.122 -0.862 -2.392
79 HA SER 16 HA SER 16 2.746 -0.279 -4.897
80 HB2 SER 16 HB3 SER 16 3.836 -2.910 -3.858
81 HB3 SER 16 HB2 SER 16 3.278 -2.579 -5.499
82 HG SER 16 HG SER 16 5.654 -2.463 -4.988
83 H CYS 17 H CYS 17 0.656 -0.929 -5.283
84 HA CYS 17 HA CYS 17 -0.989 -1.342 -3.031
85 HB2 CYS 17 HB3 CYS 17 -1.891 -0.237 -4.978
86 HB3 CYS 17 HB2 CYS 17 -1.605 -1.663 -5.968
87 H THR 18 H THR 18 -1.206 -3.056 -1.926
88 HA THR 18 HA THR 18 -1.108 -5.700 -3.219
89 HB THR 18 HB THR 18 -0.434 -5.240 -0.313
90 HG1 THR 18 HG1 THR 18 0.953 -4.214 -2.266
91 HG21 THR 18 HG21 THR 18 -0.076 -7.436 -2.314
92 HG22 THR 18 HG22 THR 18 -0.689 -7.515 -0.663
93 HG23 THR 18 HG23 THR 18 1.039 -7.311 -0.953
94 H TRP 19 H TRP 19 -3.359 -4.930 -3.523
95 HA TRP 19 HA TRP 19 -5.310 -4.203 -1.996
96 HB2 TRP 19 HB3 TRP 19 -5.280 -5.545 -4.329
97 HB3 TRP 19 HB2 TRP 19 -6.032 -6.756 -3.295
98 HD1 TRP 19 HD1 TRP 19 -6.735 -3.501 -5.062
99 HE1 TRP 19 HE1 TRP 19 -9.194 -2.827 -4.691
100 HE3 TRP 19 HE3 TRP 19 -7.969 -6.899 -1.450
101 HZ2 TRP 19 HZ2 TRP 19 -11.365 -3.635 -3.076
102 HZ3 TRP 19 HZ3 TRP 19 -10.246 -6.876 -0.536
103 HH2 TRP 19 HH2 TRP 19 -11.915 -5.279 -1.334
104 HA PRO 20 HA PRO 20 -6.625 -3.808 -0.990
105 HB2 PRO 20 HB2 PRO 20 -7.971 -3.377 1.245
106 HB3 PRO 20 HB3 PRO 20 -8.496 -4.618 0.105
107 HG2 PRO 20 HG3 PRO 20 -7.153 -4.918 2.736
108 HG3 PRO 20 HG2 PRO 20 -8.296 -6.001 1.927
109 HD2 PRO 20 HD3 PRO 20 -5.440 -6.177 1.965
110 HD3 PRO 20 HD2 PRO 20 -6.581 -7.220 1.090
111 H ILE 21 H ILE 21 -3.801 -4.135 0.304
112 HA ILE 21 HA ILE 21 -3.810 -1.462 1.485
113 HB ILE 21 HB ILE 21 -2.404 -2.052 3.352
114 HG12 ILE 21 HG13 ILE 21 -1.327 -4.053 2.182
115 HG13 ILE 21 HG12 ILE 21 -1.651 -4.223 3.902
116 HG21 ILE 21 HG21 ILE 21 -4.984 -3.538 3.088
117 HG22 ILE 21 HG22 ILE 21 -4.613 -2.086 4.020
118 HG23 ILE 21 HG23 ILE 21 -4.027 -3.656 4.567
119 HD11 ILE 21 HD11 ILE 21 -2.175 -6.191 2.360
120 HD12 ILE 21 HD12 ILE 21 -3.576 -5.248 1.852
121 HD13 ILE 21 HD13 ILE 21 -3.396 -5.719 3.543
122 H CYS 22 H CYS 22 -2.004 -0.269 1.149
123 HA CYS 22 HA CYS 22 -0.199 -1.188 -0.920
124 HB2 CYS 22 HB3 CYS 22 -0.212 1.425 0.589
125 HB3 CYS 22 HB2 CYS 22 0.717 1.076 -0.857
126 H THR 23 H THR 23 1.841 -1.825 -0.693
127 HA THR 23 HA THR 23 3.161 -1.510 1.914
128 HB THR 23 HB THR 23 4.043 -3.790 1.772
129 HG1 THR 23 HG1 THR 23 2.222 -4.479 -0.256
130 HG21 THR 23 HG21 THR 23 1.291 -3.130 2.231
131 HG22 THR 23 HG22 THR 23 2.297 -4.329 3.044
132 HG23 THR 23 HG23 THR 23 1.411 -4.765 1.582
133 H ARG 24 H ARG 24 5.274 -0.868 1.751
134 HA ARG 24 HA ARG 24 6.362 -0.630 -0.937
135 HB2 ARG 24 HB3 ARG 24 8.032 0.818 0.029
136 HB3 ARG 24 HB2 ARG 24 6.439 1.364 0.511
137 HG2 ARG 24 HG3 ARG 24 6.743 0.640 2.719
138 HG3 ARG 24 HG2 ARG 24 8.126 -0.369 2.287
139 HD2 ARG 24 HD3 ARG 24 7.973 2.621 2.520
140 HD3 ARG 24 HD2 ARG 24 9.074 1.506 3.327
141 HE ARG 24 HE ARG 24 9.563 2.824 0.919
142 HH11 ARG 24 HH11 ARG 24 9.912 -0.407 2.260
143 HH12 ARG 24 HH12 ARG 24 11.103 -0.889 1.086
144 HH21 ARG 24 HH22 ARG 24 11.177 2.158 -0.585
145 HH22 ARG 24 HH21 ARG 24 11.801 0.537 -0.501
146 H ASP 25 H ASP 25 7.668 -2.129 -1.672
147 HA ASP 25 HA ASP 25 9.003 -3.964 -1.808
148 HB2 ASP 25 HB3 ASP 25 10.148 -2.799 0.742
149 HB3 ASP 25 HB2 ASP 25 10.845 -4.177 -0.100
150 H GLY 26 H GLY 26 6.427 -4.152 -0.496
151 HA2 GLY 26 HA3 GLY 26 5.253 -5.992 0.307
152 HA3 GLY 26 HA2 GLY 26 6.779 -6.754 0.724
153 H LEU 27 H LEU 27 6.957 -3.718 1.972
154 HA LEU 27 HA LEU 27 6.145 -4.695 4.614
155 HB2 LEU 27 HB3 LEU 27 7.835 -2.310 3.855
156 HB3 LEU 27 HB2 LEU 27 7.502 -2.842 5.492
157 HG LEU 27 HG LEU 27 9.029 -4.433 3.428
158 HD11 LEU 27 HD11 LEU 27 10.125 -2.335 4.330
159 HD12 LEU 27 HD12 LEU 27 11.007 -3.845 4.562
160 HD13 LEU 27 HD13 LEU 27 10.117 -3.128 5.906
161 HD21 LEU 27 HD21 LEU 27 9.000 -6.174 4.826
162 HD22 LEU 27 HD22 LEU 27 7.661 -5.359 5.633
163 HD23 LEU 27 HD23 LEU 27 9.307 -5.157 6.232
164 HA PRO 28 HA PRO 28 2.588 -2.000 4.326
165 HB2 PRO 28 HB2 PRO 28 1.958 -2.870 7.027
166 HB3 PRO 28 HB3 PRO 28 1.121 -3.248 5.520
167 HG2 PRO 28 HG3 PRO 28 2.518 -5.094 6.947
168 HG3 PRO 28 HG2 PRO 28 2.313 -5.175 5.188
169 HD2 PRO 28 HD3 PRO 28 4.660 -4.209 6.782
170 HD3 PRO 28 HD2 PRO 28 4.631 -5.207 5.310
171 H VAL 29 H VAL 29 4.583 -0.413 4.641
172 HA VAL 29 HA VAL 29 4.674 0.767 7.274
173 HB VAL 29 HB VAL 29 6.028 1.684 4.735
174 HG11 VAL 29 HG11 VAL 29 7.403 3.065 6.081
175 HG12 VAL 29 HG12 VAL 29 6.783 2.351 7.570
176 HG13 VAL 29 HG13 VAL 29 5.742 3.377 6.584
177 HG21 VAL 29 HG21 VAL 29 7.174 0.047 6.993
178 HG22 VAL 29 HG22 VAL 29 8.011 0.561 5.529
179 HG23 VAL 29 HG23 VAL 29 6.684 -0.598 5.425
Start of MODEL 14
1 H1 CYS 1 H CYS 1 3.056 0.968 4.467
2 HA CYS 1 HA CYS 1 2.461 3.716 4.524
3 HB2 CYS 1 HB3 CYS 1 0.945 1.784 2.798
4 HB3 CYS 1 HB2 CYS 1 1.521 3.403 2.408
5 H GLY 2 H GLY 2 0.544 0.851 5.247
6 HA2 GLY 2 HA3 GLY 2 -1.299 0.634 6.620
7 HA3 GLY 2 HA2 GLY 2 -1.233 2.363 6.918
8 H GLU 3 H GLU 3 -1.375 3.168 4.196
9 HA GLU 3 HA GLU 3 -4.134 3.380 3.860
10 HB2 GLU 3 HB3 GLU 3 -3.607 4.312 1.640
11 HB3 GLU 3 HB2 GLU 3 -2.608 5.001 2.912
12 HG2 GLU 3 HG3 GLU 3 -0.713 3.804 2.223
13 HG3 GLU 3 HG2 GLU 3 -1.668 2.715 1.215
14 H THR 4 H THR 4 -5.606 2.404 2.583
15 HA THR 4 HA THR 4 -4.906 -0.237 1.569
16 HB THR 4 HB THR 4 -7.454 -0.412 1.336
17 HG1 THR 4 HG1 THR 4 -8.238 1.272 3.113
18 HG21 THR 4 HG21 THR 4 -7.726 -0.544 3.904
19 HG22 THR 4 HG22 THR 4 -6.012 -0.128 3.953
20 HG23 THR 4 HG23 THR 4 -6.541 -1.596 3.130
21 H CYS 5 H CYS 5 -4.633 -0.556 -0.581
22 HA CYS 5 HA CYS 5 -5.241 1.641 -2.373
23 HB2 CYS 5 HB3 CYS 5 -4.021 0.309 -4.075
24 HB3 CYS 5 HB2 CYS 5 -3.065 0.637 -2.635
25 H PHE 6 H PHE 6 -7.560 1.001 -1.643
26 HA PHE 6 HA PHE 6 -8.913 -1.172 -2.743
27 HB2 PHE 6 HB3 PHE 6 -9.871 0.366 -1.059
28 HB3 PHE 6 HB2 PHE 6 -9.955 1.635 -2.276
29 HD1 PHE 6 HD2 PHE 6 -10.952 -1.966 -2.166
30 HD2 PHE 6 HD1 PHE 6 -12.103 2.059 -2.924
31 HE1 PHE 6 HE2 PHE 6 -13.202 -2.733 -2.798
32 HE2 PHE 6 HE1 PHE 6 -14.357 1.301 -3.555
33 HZ PHE 6 HZ PHE 6 -14.908 -1.098 -3.494
34 H GLY 7 H GLY 7 -8.121 1.979 -4.107
35 HA2 GLY 7 HA3 GLY 7 -9.423 1.307 -6.629
36 HA3 GLY 7 HA2 GLY 7 -8.693 2.850 -6.214
37 H GLY 8 H GLY 8 -6.889 -0.045 -5.606
38 HA2 GLY 8 HA3 GLY 8 -5.144 -1.054 -6.728
39 HA3 GLY 8 HA2 GLY 8 -5.581 -0.140 -8.159
40 H THR 9 H THR 9 -5.311 2.465 -6.956
41 HA THR 9 HA THR 9 -2.420 2.644 -7.096
42 HB THR 9 HB THR 9 -3.693 4.183 -8.466
43 HG1 THR 9 HG1 THR 9 -2.601 5.824 -6.450
44 HG21 THR 9 HG21 THR 9 -5.315 4.452 -6.159
45 HG22 THR 9 HG22 THR 9 -5.567 5.151 -7.758
46 HG23 THR 9 HG23 THR 9 -4.654 6.043 -6.541
47 H CYS 10 H CYS 10 -1.302 4.177 -5.692
48 HA CYS 10 HA CYS 10 -2.323 4.153 -2.931
49 HB2 CYS 10 HB3 CYS 10 0.552 3.689 -3.766
50 HB3 CYS 10 HB2 CYS 10 -0.049 3.737 -2.111
51 H ASN 11 H ASN 11 -1.639 5.899 -1.625
52 HA ASN 11 HA ASN 11 -1.207 8.340 -3.147
53 HB2 ASN 11 HB3 ASN 11 -2.976 8.258 -1.443
54 HB3 ASN 11 HB2 ASN 11 -1.778 7.898 -0.206
55 HD21 ASN 11 HD22 ASN 11 -1.088 9.550 0.931
56 HD22 ASN 11 HD21 ASN 11 -1.130 11.207 0.450
57 H THR 12 H THR 12 0.570 6.202 -1.105
58 HA THR 12 HA THR 12 2.670 8.198 -0.671
59 HB THR 12 HB THR 12 2.555 5.393 0.434
60 HG1 THR 12 HG1 THR 12 0.708 6.380 1.168
61 HG21 THR 12 HG21 THR 12 4.570 5.960 1.200
62 HG22 THR 12 HG22 THR 12 3.752 7.116 2.250
63 HG23 THR 12 HG23 THR 12 4.373 7.635 0.683
64 HA PRO 13 HA PRO 13 4.991 6.480 -4.087
65 HB2 PRO 13 HB2 PRO 13 7.211 8.008 -2.884
66 HB3 PRO 13 HB3 PRO 13 6.501 8.142 -4.495
67 HG2 PRO 13 HG3 PRO 13 6.103 10.026 -2.631
68 HG3 PRO 13 HG2 PRO 13 4.834 9.578 -3.787
69 HD2 PRO 13 HD3 PRO 13 5.150 8.785 -0.917
70 HD3 PRO 13 HD2 PRO 13 3.680 9.240 -1.805
71 H GLY 14 H GLY 14 6.225 4.681 -4.255
72 HA2 GLY 14 HA3 GLY 14 7.988 3.233 -3.637
73 HA3 GLY 14 HA2 GLY 14 7.954 3.921 -2.018
74 H CYS 15 H CYS 15 4.895 3.678 -2.294
75 HA CYS 15 HA CYS 15 4.767 1.026 -1.125
76 HB2 CYS 15 HB3 CYS 15 2.692 3.212 -1.416
77 HB3 CYS 15 HB2 CYS 15 2.408 1.676 -0.606
78 H SER 16 H SER 16 3.912 -0.712 -2.081
79 HA SER 16 HA SER 16 2.874 -0.407 -4.812
80 HB2 SER 16 HB3 SER 16 4.068 -2.875 -3.523
81 HB3 SER 16 HB2 SER 16 3.670 -2.657 -5.228
82 HG SER 16 HG SER 16 5.411 -0.816 -4.063
83 H CYS 17 H CYS 17 0.891 -1.251 -5.311
84 HA CYS 17 HA CYS 17 -0.894 -1.689 -3.172
85 HB2 CYS 17 HB3 CYS 17 -1.608 -0.712 -5.314
86 HB3 CYS 17 HB2 CYS 17 -1.325 -2.261 -6.104
87 H THR 18 H THR 18 -1.445 -3.394 -2.144
88 HA THR 18 HA THR 18 -1.042 -6.066 -3.286
89 HB THR 18 HB THR 18 -0.610 -5.484 -0.349
90 HG1 THR 18 HG1 THR 18 1.014 -4.794 -2.398
91 HG21 THR 18 HG21 THR 18 0.323 -7.628 -0.239
92 HG22 THR 18 HG22 THR 18 0.597 -7.701 -1.979
93 HG23 THR 18 HG23 THR 18 -1.041 -7.832 -1.338
94 H TRP 19 H TRP 19 -3.259 -5.069 -3.746
95 HA TRP 19 HA TRP 19 -5.319 -4.393 -2.365
96 HB2 TRP 19 HB3 TRP 19 -5.106 -5.574 -4.772
97 HB3 TRP 19 HB2 TRP 19 -5.987 -6.828 -3.904
98 HD1 TRP 19 HD1 TRP 19 -6.428 -3.440 -5.497
99 HE1 TRP 19 HE1 TRP 19 -8.894 -2.713 -5.315
100 HE3 TRP 19 HE3 TRP 19 -8.091 -7.030 -2.265
101 HZ2 TRP 19 HZ2 TRP 19 -11.231 -3.558 -3.970
102 HZ3 TRP 19 HZ3 TRP 19 -10.442 -6.995 -1.567
103 HH2 TRP 19 HH2 TRP 19 -11.986 -5.296 -2.406
104 HA PRO 20 HA PRO 20 -6.768 -4.034 -1.493
105 HB2 PRO 20 HB2 PRO 20 -8.305 -3.693 0.636
106 HB3 PRO 20 HB3 PRO 20 -8.755 -4.849 -0.620
107 HG2 PRO 20 HG3 PRO 20 -7.653 -5.341 2.096
108 HG3 PRO 20 HG2 PRO 20 -8.761 -6.332 1.134
109 HD2 PRO 20 HD3 PRO 20 -5.936 -6.640 1.399
110 HD3 PRO 20 HD2 PRO 20 -7.028 -7.559 0.345
111 H ILE 21 H ILE 21 -4.100 -4.515 -0.046
112 HA ILE 21 HA ILE 21 -4.135 -1.982 1.430
113 HB ILE 21 HB ILE 21 -2.689 -2.892 3.184
114 HG12 ILE 21 HG13 ILE 21 -3.197 -5.593 1.912
115 HG13 ILE 21 HG12 ILE 21 -1.674 -4.716 1.830
116 HG21 ILE 21 HG21 ILE 21 -4.944 -2.863 3.806
117 HG22 ILE 21 HG22 ILE 21 -4.414 -4.499 4.200
118 HG23 ILE 21 HG23 ILE 21 -5.354 -4.204 2.734
119 HD11 ILE 21 HD11 ILE 21 -2.575 -5.020 4.556
120 HD12 ILE 21 HD12 ILE 21 -1.044 -5.481 3.812
121 HD13 ILE 21 HD13 ILE 21 -2.426 -6.574 3.735
122 H CYS 22 H CYS 22 -2.328 -0.741 1.193
123 HA CYS 22 HA CYS 22 -0.462 -1.585 -0.881
124 HB2 CYS 22 HB3 CYS 22 -1.614 0.712 -0.749
125 HB3 CYS 22 HB2 CYS 22 -0.414 1.091 0.474
126 H THR 23 H THR 23 1.701 -1.729 -0.637
127 HA THR 23 HA THR 23 2.820 -1.545 2.079
128 HB THR 23 HB THR 23 4.033 -3.695 1.678
129 HG1 THR 23 HG1 THR 23 2.158 -4.475 -0.240
130 HG21 THR 23 HG21 THR 23 2.434 -4.494 3.012
131 HG22 THR 23 HG22 THR 23 1.496 -4.905 1.576
132 HG23 THR 23 HG23 THR 23 1.265 -3.344 2.363
133 H ARG 24 H ARG 24 4.756 -0.508 2.088
134 HA ARG 24 HA ARG 24 6.047 -0.021 -0.469
135 HB2 ARG 24 HB3 ARG 24 7.369 1.628 0.666
136 HB3 ARG 24 HB2 ARG 24 5.694 1.869 1.112
137 HG2 ARG 24 HG3 ARG 24 6.044 1.070 3.281
138 HG3 ARG 24 HG2 ARG 24 7.581 0.316 2.850
139 HD2 ARG 24 HD3 ARG 24 6.963 3.244 3.164
140 HD3 ARG 24 HD2 ARG 24 8.129 2.275 4.063
141 HE ARG 24 HE ARG 24 8.610 3.655 1.659
142 HH11 ARG 24 HH11 ARG 24 9.422 0.632 3.245
143 HH12 ARG 24 HH12 ARG 24 10.793 0.323 2.219
144 HH21 ARG 24 HH22 ARG 24 10.452 3.233 0.341
145 HH22 ARG 24 HH21 ARG 24 11.359 1.770 0.587
146 H ASP 25 H ASP 25 7.725 -1.164 -1.137
147 HA ASP 25 HA ASP 25 9.381 -2.722 -1.218
148 HB2 ASP 25 HB3 ASP 25 9.893 -1.804 1.626
149 HB3 ASP 25 HB2 ASP 25 10.989 -2.798 0.674
150 H GLY 26 H GLY 26 6.690 -3.448 -0.318
151 HA2 GLY 26 HA3 GLY 26 5.686 -5.474 0.162
152 HA3 GLY 26 HA2 GLY 26 7.267 -6.129 0.556
153 H LEU 27 H LEU 27 6.641 -3.216 2.158
154 HA LEU 27 HA LEU 27 5.911 -4.694 4.599
155 HB2 LEU 27 HB3 LEU 27 7.458 -2.115 4.327
156 HB3 LEU 27 HB2 LEU 27 7.036 -2.888 5.843
157 HG LEU 27 HG LEU 27 8.845 -4.079 3.737
158 HD11 LEU 27 HD11 LEU 27 9.362 -2.085 5.667
159 HD12 LEU 27 HD12 LEU 27 10.515 -2.936 4.638
160 HD13 LEU 27 HD13 LEU 27 10.120 -3.572 6.235
161 HD21 LEU 27 HD21 LEU 27 8.696 -5.059 6.539
162 HD22 LEU 27 HD22 LEU 27 9.085 -5.928 5.055
163 HD23 LEU 27 HD23 LEU 27 7.409 -5.521 5.426
164 HA PRO 28 HA PRO 28 2.176 -2.266 4.438
165 HB2 PRO 28 HB2 PRO 28 1.075 -3.176 6.726
166 HB3 PRO 28 HB3 PRO 28 1.161 -4.165 5.263
167 HG2 PRO 28 HG3 PRO 28 2.921 -4.203 7.685
168 HG3 PRO 28 HG2 PRO 28 2.257 -5.564 6.761
169 HD2 PRO 28 HD3 PRO 28 4.811 -4.652 6.466
170 HD3 PRO 28 HD2 PRO 28 3.900 -5.441 5.164
171 H VAL 29 H VAL 29 4.296 -0.735 5.127
172 HA VAL 29 HA VAL 29 3.854 0.420 7.744
173 HB VAL 29 HB VAL 29 5.766 1.327 5.588
174 HG11 VAL 29 HG11 VAL 29 5.956 3.099 6.944
175 HG12 VAL 29 HG12 VAL 29 6.869 2.012 7.990
176 HG13 VAL 29 HG13 VAL 29 5.151 2.281 8.283
177 HG21 VAL 29 HG21 VAL 29 7.152 -0.331 6.106
178 HG22 VAL 29 HG22 VAL 29 5.842 -1.057 7.038
179 HG23 VAL 29 HG23 VAL 29 7.003 0.008 7.831
Start of MODEL 15
1 H1 CYS 1 H CYS 1 3.232 1.526 4.202
2 HA CYS 1 HA CYS 1 2.288 4.169 4.783
3 HB2 CYS 1 HB3 CYS 1 1.477 2.192 2.641
4 HB3 CYS 1 HB2 CYS 1 0.875 3.845 2.746
5 H GLY 2 H GLY 2 0.971 0.906 4.943
6 HA2 GLY 2 HA3 GLY 2 -0.698 0.072 6.301
7 HA3 GLY 2 HA2 GLY 2 -0.894 1.679 6.979
8 H GLU 3 H GLU 3 -1.386 2.961 4.449
9 HA GLU 3 HA GLU 3 -4.138 2.901 4.343
10 HB2 GLU 3 HB3 GLU 3 -3.895 4.053 2.141
11 HB3 GLU 3 HB2 GLU 3 -2.942 4.760 3.439
12 HG2 GLU 3 HG3 GLU 3 -0.937 3.901 2.586
13 HG3 GLU 3 HG2 GLU 3 -1.777 2.780 1.514
14 H THR 4 H THR 4 -5.660 1.910 3.170
15 HA THR 4 HA THR 4 -4.926 -0.567 1.846
16 HB THR 4 HB THR 4 -7.431 -0.887 1.762
17 HG1 THR 4 HG1 THR 4 -7.745 1.516 1.974
18 HG21 THR 4 HG21 THR 4 -7.673 -1.216 4.222
19 HG22 THR 4 HG22 THR 4 -6.143 -0.367 4.444
20 HG23 THR 4 HG23 THR 4 -6.185 -1.894 3.563
21 H CYS 5 H CYS 5 -4.666 -0.643 -0.318
22 HA CYS 5 HA CYS 5 -5.573 1.596 -1.924
23 HB2 CYS 5 HB3 CYS 5 -4.296 0.501 -3.755
24 HB3 CYS 5 HB2 CYS 5 -3.319 0.844 -2.332
25 H PHE 6 H PHE 6 -7.790 0.723 -1.198
26 HA PHE 6 HA PHE 6 -8.981 -1.528 -2.305
27 HB2 PHE 6 HB3 PHE 6 -10.023 -0.089 -0.584
28 HB3 PHE 6 HB2 PHE 6 -10.251 1.173 -1.787
29 HD1 PHE 6 HD1 PHE 6 -10.924 -2.502 -1.668
30 HD2 PHE 6 HD2 PHE 6 -12.440 1.409 -2.391
31 HE1 PHE 6 HE1 PHE 6 -13.112 -3.462 -2.257
32 HE2 PHE 6 HE2 PHE 6 -14.629 0.456 -2.979
33 HZ PHE 6 HZ PHE 6 -14.969 -1.983 -2.912
34 H GLY 7 H GLY 7 -8.542 1.704 -3.667
35 HA2 GLY 7 HA3 GLY 7 -9.832 0.896 -6.156
36 HA3 GLY 7 HA2 GLY 7 -9.269 2.511 -5.752
37 H GLY 8 H GLY 8 -7.114 -0.137 -5.190
38 HA2 GLY 8 HA3 GLY 8 -5.286 -0.928 -6.356
39 HA3 GLY 8 HA2 GLY 8 -5.882 -0.100 -7.782
40 H THR 9 H THR 9 -5.944 2.521 -6.502
41 HA THR 9 HA THR 9 -3.130 3.148 -6.838
42 HB THR 9 HB THR 9 -5.250 5.188 -6.265
43 HG1 THR 9 HG1 THR 9 -5.335 3.408 -8.268
44 HG21 THR 9 HG21 THR 9 -3.146 5.466 -8.349
45 HG22 THR 9 HG22 THR 9 -2.644 5.523 -6.659
46 HG23 THR 9 HG23 THR 9 -3.830 6.678 -7.267
47 H CYS 10 H CYS 10 -1.904 4.322 -5.357
48 HA CYS 10 HA CYS 10 -2.851 4.234 -2.573
49 HB2 CYS 10 HB3 CYS 10 0.018 4.083 -3.541
50 HB3 CYS 10 HB2 CYS 10 -0.529 3.951 -1.873
51 H ASN 11 H ASN 11 -2.212 5.978 -1.213
52 HA ASN 11 HA ASN 11 -2.066 8.506 -2.645
53 HB2 ASN 11 HB3 ASN 11 -3.680 8.271 -0.824
54 HB3 ASN 11 HB2 ASN 11 -2.386 7.871 0.299
55 HD21 ASN 11 HD22 ASN 11 -1.614 9.462 1.474
56 HD22 ASN 11 HD21 ASN 11 -1.762 11.147 1.126
57 H THR 12 H THR 12 -0.069 6.455 -0.677
58 HA THR 12 HA THR 12 1.995 8.527 -0.496
59 HB THR 12 HB THR 12 2.024 5.796 0.786
60 HG1 THR 12 HG1 THR 12 0.201 6.806 1.571
61 HG21 THR 12 HG21 THR 12 3.761 8.140 0.813
62 HG22 THR 12 HG22 THR 12 4.095 6.477 1.292
63 HG23 THR 12 HG23 THR 12 3.317 7.583 2.426
64 HA PRO 13 HA PRO 13 4.044 6.590 -3.973
65 HB2 PRO 13 HB2 PRO 13 6.232 8.426 -3.274
66 HB3 PRO 13 HB3 PRO 13 5.286 8.327 -4.761
67 HG2 PRO 13 HG3 PRO 13 5.000 10.364 -3.032
68 HG3 PRO 13 HG2 PRO 13 3.632 9.720 -3.959
69 HD2 PRO 13 HD3 PRO 13 4.383 9.231 -1.100
70 HD3 PRO 13 HD2 PRO 13 2.778 9.504 -1.813
71 H GLY 14 H GLY 14 5.585 5.024 -4.190
72 HA2 GLY 14 HA3 GLY 14 7.650 3.987 -3.568
73 HA3 GLY 14 HA2 GLY 14 7.408 4.580 -1.930
74 H CYS 15 H CYS 15 4.566 3.834 -1.976
75 HA CYS 15 HA CYS 15 4.931 1.046 -1.251
76 HB2 CYS 15 HB3 CYS 15 2.822 3.108 -0.740
77 HB3 CYS 15 HB2 CYS 15 2.405 1.404 -0.597
78 H SER 16 H SER 16 4.003 -0.648 -2.237
79 HA SER 16 HA SER 16 2.792 -0.151 -4.858
80 HB2 SER 16 HB3 SER 16 3.963 -2.725 -3.767
81 HB3 SER 16 HB2 SER 16 3.510 -2.390 -5.440
82 HG SER 16 HG SER 16 5.254 -0.548 -4.453
83 H CYS 17 H CYS 17 0.789 -1.023 -5.355
84 HA CYS 17 HA CYS 17 -0.897 -1.523 -3.124
85 HB2 CYS 17 HB3 CYS 17 -1.732 -0.364 -5.108
86 HB3 CYS 17 HB2 CYS 17 -1.503 -1.825 -6.062
87 H THR 18 H THR 18 -1.019 -3.287 -2.093
88 HA THR 18 HA THR 18 -0.842 -5.865 -3.499
89 HB THR 18 HB THR 18 -0.197 -5.403 -0.571
90 HG1 THR 18 HG1 THR 18 1.566 -4.503 -1.383
91 HG21 THR 18 HG21 THR 18 0.765 -7.687 -2.254
92 HG22 THR 18 HG22 THR 18 -0.865 -7.715 -1.580
93 HG23 THR 18 HG23 THR 18 0.531 -7.607 -0.507
94 H TRP 19 H TRP 19 -3.079 -5.077 -3.851
95 HA TRP 19 HA TRP 19 -5.109 -4.472 -2.360
96 HB2 TRP 19 HB3 TRP 19 -4.964 -5.572 -4.798
97 HB3 TRP 19 HB2 TRP 19 -5.707 -6.914 -3.931
98 HD1 TRP 19 HD1 TRP 19 -6.470 -3.515 -5.372
99 HE1 TRP 19 HE1 TRP 19 -8.970 -2.980 -5.049
100 HE3 TRP 19 HE3 TRP 19 -7.711 -7.327 -2.204
101 HZ2 TRP 19 HZ2 TRP 19 -11.171 -4.042 -3.635
102 HZ3 TRP 19 HZ3 TRP 19 -10.023 -7.491 -1.400
103 HH2 TRP 19 HH2 TRP 19 -11.723 -5.883 -2.104
104 HA PRO 20 HA PRO 20 -6.543 -4.204 -1.439
105 HB2 PRO 20 HB2 PRO 20 -8.048 -3.994 0.728
106 HB3 PRO 20 HB3 PRO 20 -8.458 -5.153 -0.538
107 HG2 PRO 20 HG3 PRO 20 -7.271 -5.625 2.144
108 HG3 PRO 20 HG2 PRO 20 -8.334 -6.666 1.186
109 HD2 PRO 20 HD3 PRO 20 -5.485 -6.791 1.387
110 HD3 PRO 20 HD2 PRO 20 -6.542 -7.772 0.353
111 H ILE 21 H ILE 21 -3.815 -4.561 -0.077
112 HA ILE 21 HA ILE 21 -3.954 -2.070 1.460
113 HB ILE 21 HB ILE 21 -2.414 -2.945 3.160
114 HG12 ILE 21 HG13 ILE 21 -2.867 -5.641 1.857
115 HG13 ILE 21 HG12 ILE 21 -1.374 -4.715 1.758
116 HG21 ILE 21 HG21 ILE 21 -4.671 -2.992 3.813
117 HG22 ILE 21 HG22 ILE 21 -4.048 -4.591 4.221
118 HG23 ILE 21 HG23 ILE 21 -5.032 -4.372 2.772
119 HD11 ILE 21 HD11 ILE 21 -1.111 -4.897 4.182
120 HD12 ILE 21 HD12 ILE 21 -1.196 -6.478 3.406
121 HD13 ILE 21 HD13 ILE 21 -2.598 -5.840 4.265
122 H CYS 22 H CYS 22 -2.285 -0.703 1.156
123 HA CYS 22 HA CYS 22 -0.373 -1.380 -0.929
124 HB2 CYS 22 HB3 CYS 22 -1.654 0.866 -0.601
125 HB3 CYS 22 HB2 CYS 22 -0.358 1.233 0.520
126 H THR 23 H THR 23 1.738 -1.579 -0.684
127 HA THR 23 HA THR 23 2.994 -1.228 1.936
128 HB THR 23 HB THR 23 4.023 -3.567 1.645
129 HG1 THR 23 HG1 THR 23 2.470 -4.997 0.516
130 HG21 THR 23 HG21 THR 23 1.208 -4.120 2.193
131 HG22 THR 23 HG22 THR 23 1.823 -2.710 3.056
132 HG23 THR 23 HG23 THR 23 2.617 -4.273 3.244
133 H ARG 24 H ARG 24 5.104 -0.564 1.746
134 HA ARG 24 HA ARG 24 6.193 -0.438 -0.952
135 HB2 ARG 24 HB3 ARG 24 7.791 1.131 -0.093
136 HB3 ARG 24 HB2 ARG 24 6.199 1.615 0.449
137 HG2 ARG 24 HG3 ARG 24 6.639 0.992 2.657
138 HG3 ARG 24 HG2 ARG 24 8.031 0.008 2.194
139 HD2 ARG 24 HD3 ARG 24 7.802 3.009 2.244
140 HD3 ARG 24 HD2 ARG 24 8.910 1.986 3.157
141 HE ARG 24 HE ARG 24 9.360 3.055 0.594
142 HH11 ARG 24 HH11 ARG 24 9.921 0.117 2.431
143 HH12 ARG 24 HH12 ARG 24 11.161 -0.459 1.354
144 HH21 ARG 24 HH22 ARG 24 11.029 2.276 -0.791
145 HH22 ARG 24 HH21 ARG 24 11.766 0.737 -0.455
146 H ASP 25 H ASP 25 7.660 -1.848 -1.630
147 HA ASP 25 HA ASP 25 9.113 -3.604 -1.670
148 HB2 ASP 25 HB3 ASP 25 10.001 -2.480 1.004
149 HB3 ASP 25 HB2 ASP 25 10.883 -3.674 0.062
150 H GLY 26 H GLY 26 6.468 -3.892 -0.517
151 HA2 GLY 26 HA3 GLY 26 5.260 -5.681 0.303
152 HA3 GLY 26 HA2 GLY 26 6.775 -6.504 0.639
153 H LEU 27 H LEU 27 6.800 -3.412 1.960
154 HA LEU 27 HA LEU 27 6.183 -4.519 4.610
155 HB2 LEU 27 HB3 LEU 27 7.798 -2.079 3.866
156 HB3 LEU 27 HB2 LEU 27 7.531 -2.664 5.497
157 HG LEU 27 HG LEU 27 9.017 -4.165 3.338
158 HD11 LEU 27 HD11 LEU 27 11.016 -3.526 4.350
159 HD12 LEU 27 HD12 LEU 27 10.208 -2.972 5.816
160 HD13 LEU 27 HD13 LEU 27 10.065 -2.042 4.324
161 HD21 LEU 27 HD21 LEU 27 9.715 -5.263 5.731
162 HD22 LEU 27 HD22 LEU 27 8.500 -5.920 4.635
163 HD23 LEU 27 HD23 LEU 27 8.008 -4.900 5.987
164 HA PRO 28 HA PRO 28 2.583 -1.907 4.655
165 HB2 PRO 28 HB2 PRO 28 1.772 -2.489 7.157
166 HB3 PRO 28 HB3 PRO 28 1.625 -3.646 5.829
167 HG2 PRO 28 HG3 PRO 28 3.684 -3.498 7.994
168 HG3 PRO 28 HG2 PRO 28 2.863 -4.920 7.324
169 HD2 PRO 28 HD3 PRO 28 5.390 -4.149 6.613
170 HD3 PRO 28 HD2 PRO 28 4.305 -5.067 5.551
171 H VAL 29 H VAL 29 4.556 -0.241 4.702
172 HA VAL 29 HA VAL 29 4.816 1.085 7.255
173 HB VAL 29 HB VAL 29 5.918 1.909 4.566
174 HG11 VAL 29 HG11 VAL 29 7.531 2.853 6.660
175 HG12 VAL 29 HG12 VAL 29 5.867 3.229 7.110
176 HG13 VAL 29 HG13 VAL 29 6.514 3.797 5.571
177 HG21 VAL 29 HG21 VAL 29 6.617 -0.327 5.974
178 HG22 VAL 29 HG22 VAL 29 7.775 0.862 6.568
179 HG23 VAL 29 HG23 VAL 29 7.661 0.529 4.840
Start of MODEL 16
1 H1 CYS 1 H CYS 1 2.965 0.640 4.420
2 HA CYS 1 HA CYS 1 2.384 3.395 4.542
3 HB2 CYS 1 HB3 CYS 1 0.924 1.480 2.735
4 HB3 CYS 1 HB2 CYS 1 1.418 3.139 2.409
5 H GLY 2 H GLY 2 0.483 0.507 5.162
6 HA2 GLY 2 HA3 GLY 2 -1.362 0.207 6.498
7 HA3 GLY 2 HA2 GLY 2 -1.283 1.909 6.913
8 H GLU 3 H GLU 3 -1.480 2.882 4.231
9 HA GLU 3 HA GLU 3 -4.250 3.115 4.017
10 HB2 GLU 3 HB3 GLU 3 -3.864 4.287 1.943
11 HB3 GLU 3 HB2 GLU 3 -2.645 4.758 3.117
12 HG2 GLU 3 HG3 GLU 3 -0.985 3.443 2.045
13 HG3 GLU 3 HG2 GLU 3 -2.183 2.673 1.005
14 H THR 4 H THR 4 -5.784 2.171 2.833
15 HA THR 4 HA THR 4 -5.173 -0.411 1.654
16 HB THR 4 HB THR 4 -7.690 -0.564 1.483
17 HG1 THR 4 HG1 THR 4 -7.846 1.860 1.579
18 HG21 THR 4 HG21 THR 4 -6.820 0.104 4.287
19 HG22 THR 4 HG22 THR 4 -6.276 -1.355 3.459
20 HG23 THR 4 HG23 THR 4 -7.995 -1.102 3.761
21 H CYS 5 H CYS 5 -4.770 -0.554 -0.485
22 HA CYS 5 HA CYS 5 -5.494 1.667 -2.202
23 HB2 CYS 5 HB3 CYS 5 -4.131 0.516 -3.914
24 HB3 CYS 5 HB2 CYS 5 -3.245 0.806 -2.422
25 H PHE 6 H PHE 6 -7.818 0.793 -1.579
26 HA PHE 6 HA PHE 6 -8.891 -1.418 -2.921
27 HB2 PHE 6 HB3 PHE 6 -10.061 1.118 -1.841
28 HB3 PHE 6 HB2 PHE 6 -11.060 0.075 -2.845
29 HD1 PHE 6 HD2 PHE 6 -8.538 -0.680 -0.194
30 HD2 PHE 6 HD1 PHE 6 -12.572 -1.003 -1.508
31 HE1 PHE 6 HE2 PHE 6 -9.061 -2.072 1.765
32 HE2 PHE 6 HE1 PHE 6 -13.102 -2.394 0.449
33 HZ PHE 6 HZ PHE 6 -11.345 -2.931 2.088
34 H GLY 7 H GLY 7 -8.300 1.878 -3.972
35 HA2 GLY 7 HA3 GLY 7 -9.548 1.396 -6.556
36 HA3 GLY 7 HA2 GLY 7 -8.836 2.906 -6.007
37 H GLY 8 H GLY 8 -6.946 0.066 -5.556
38 HA2 GLY 8 HA3 GLY 8 -5.155 -0.825 -6.695
39 HA3 GLY 8 HA2 GLY 8 -5.649 0.084 -8.109
40 H THR 9 H THR 9 -5.517 2.671 -6.729
41 HA THR 9 HA THR 9 -2.655 3.044 -7.000
42 HB THR 9 HB THR 9 -4.109 4.589 -8.180
43 HG1 THR 9 HG1 THR 9 -3.081 6.286 -6.233
44 HG21 THR 9 HG21 THR 9 -5.375 4.845 -5.543
45 HG22 THR 9 HG22 THR 9 -6.063 5.050 -7.155
46 HG23 THR 9 HG23 THR 9 -5.150 6.364 -6.411
47 H CYS 10 H CYS 10 -1.568 4.563 -5.539
48 HA CYS 10 HA CYS 10 -2.455 4.325 -2.746
49 HB2 CYS 10 HB3 CYS 10 0.374 3.877 -3.731
50 HB3 CYS 10 HB2 CYS 10 -0.135 3.885 -2.046
51 H ASN 11 H ASN 11 -1.854 6.013 -1.402
52 HA ASN 11 HA ASN 11 -1.340 8.521 -2.786
53 HB2 ASN 11 HB3 ASN 11 -2.061 7.926 0.092
54 HB3 ASN 11 HB2 ASN 11 -1.931 9.538 -0.604
55 HD21 ASN 11 HD22 ASN 11 -3.874 6.768 -0.190
56 HD22 ASN 11 HD21 ASN 11 -5.260 7.336 -1.057
57 H THR 12 H THR 12 0.385 6.224 -0.946
58 HA THR 12 HA THR 12 2.435 8.177 -0.183
59 HB THR 12 HB THR 12 2.405 5.249 0.534
60 HG1 THR 12 HG1 THR 12 0.442 6.066 1.259
61 HG21 THR 12 HG21 THR 12 3.950 5.778 2.156
62 HG22 THR 12 HG22 THR 12 3.424 7.458 2.264
63 HG23 THR 12 HG23 THR 12 4.396 6.923 0.892
64 HA PRO 13 HA PRO 13 4.815 6.957 -3.765
65 HB2 PRO 13 HB2 PRO 13 7.117 8.234 -2.991
66 HB3 PRO 13 HB3 PRO 13 5.758 9.041 -3.781
67 HG2 PRO 13 HG3 PRO 13 6.469 8.927 -0.880
68 HG3 PRO 13 HG2 PRO 13 5.868 10.295 -1.835
69 HD2 PRO 13 HD3 PRO 13 4.262 8.880 -0.200
70 HD3 PRO 13 HD2 PRO 13 3.676 9.570 -1.727
71 H GLY 14 H GLY 14 6.014 5.186 -4.141
72 HA2 GLY 14 HA3 GLY 14 7.787 3.684 -3.753
73 HA3 GLY 14 HA2 GLY 14 7.840 4.212 -2.077
74 H CYS 15 H CYS 15 4.751 3.948 -2.238
75 HA CYS 15 HA CYS 15 4.730 1.205 -1.293
76 HB2 CYS 15 HB3 CYS 15 2.605 3.359 -1.311
77 HB3 CYS 15 HB2 CYS 15 2.363 1.745 -0.655
78 H SER 16 H SER 16 3.860 -0.471 -2.328
79 HA SER 16 HA SER 16 2.690 -0.001 -4.982
80 HB2 SER 16 HB3 SER 16 4.008 -2.520 -3.931
81 HB3 SER 16 HB2 SER 16 3.514 -2.197 -5.594
82 HG SER 16 HG SER 16 5.274 -0.398 -4.390
83 H CYS 17 H CYS 17 0.697 -0.856 -5.431
84 HA CYS 17 HA CYS 17 -0.970 -1.457 -3.248
85 HB2 CYS 17 HB3 CYS 17 -1.794 -0.412 -5.320
86 HB3 CYS 17 HB2 CYS 17 -1.524 -1.927 -6.177
87 H THR 18 H THR 18 -1.470 -3.220 -2.281
88 HA THR 18 HA THR 18 -1.048 -5.831 -3.552
89 HB THR 18 HB THR 18 -0.488 -5.361 -0.616
90 HG1 THR 18 HG1 THR 18 1.029 -4.582 -2.727
91 HG21 THR 18 HG21 THR 18 0.968 -7.434 -1.081
92 HG22 THR 18 HG22 THR 18 0.058 -7.565 -2.586
93 HG23 THR 18 HG23 THR 18 -0.782 -7.650 -1.038
94 H TRP 19 H TRP 19 -3.305 -4.880 -3.871
95 HA TRP 19 HA TRP 19 -5.319 -4.307 -2.383
96 HB2 TRP 19 HB3 TRP 19 -5.164 -5.451 -4.832
97 HB3 TRP 19 HB2 TRP 19 -6.030 -6.703 -3.947
98 HD1 TRP 19 HD1 TRP 19 -6.486 -3.283 -5.478
99 HE1 TRP 19 HE1 TRP 19 -8.937 -2.536 -5.202
100 HE3 TRP 19 HE3 TRP 19 -8.082 -6.921 -2.263
101 HZ2 TRP 19 HZ2 TRP 19 -11.237 -3.379 -3.794
102 HZ3 TRP 19 HZ3 TRP 19 -10.408 -6.870 -1.483
103 HH2 TRP 19 HH2 TRP 19 -11.959 -5.139 -2.238
104 HA PRO 20 HA PRO 20 -6.735 -4.009 -1.431
105 HB2 PRO 20 HB2 PRO 20 -8.163 -3.771 0.791
106 HB3 PRO 20 HB3 PRO 20 -8.659 -4.887 -0.485
107 HG2 PRO 20 HG3 PRO 20 -7.420 -5.461 2.152
108 HG3 PRO 20 HG2 PRO 20 -8.547 -6.441 1.201
109 HD2 PRO 20 HD3 PRO 20 -5.705 -6.685 1.332
110 HD3 PRO 20 HD2 PRO 20 -6.822 -7.597 0.299
111 H ILE 21 H ILE 21 -3.992 -4.494 -0.092
112 HA ILE 21 HA ILE 21 -4.014 -1.990 1.431
113 HB ILE 21 HB ILE 21 -2.494 -2.914 3.116
114 HG12 ILE 21 HG13 ILE 21 -3.030 -5.597 1.814
115 HG13 ILE 21 HG12 ILE 21 -1.515 -4.707 1.694
116 HG21 ILE 21 HG21 ILE 21 -5.170 -4.221 2.733
117 HG22 ILE 21 HG22 ILE 21 -4.716 -2.915 3.831
118 HG23 ILE 21 HG23 ILE 21 -4.177 -4.563 4.153
119 HD11 ILE 21 HD11 ILE 21 -2.703 -5.639 4.293
120 HD12 ILE 21 HD12 ILE 21 -1.090 -4.980 4.020
121 HD13 ILE 21 HD13 ILE 21 -1.522 -6.557 3.360
122 H CYS 22 H CYS 22 -2.232 -0.723 1.176
123 HA CYS 22 HA CYS 22 -0.442 -1.472 -0.994
124 HB2 CYS 22 HB3 CYS 22 -1.600 0.815 -0.679
125 HB3 CYS 22 HB2 CYS 22 -0.309 1.138 0.467
126 H THR 23 H THR 23 1.724 -1.629 -0.851
127 HA THR 23 HA THR 23 2.973 -1.552 1.811
128 HB THR 23 HB THR 23 4.151 -3.679 1.305
129 HG1 THR 23 HG1 THR 23 2.277 -4.355 -0.660
130 HG21 THR 23 HG21 THR 23 2.403 -4.106 2.748
131 HG22 THR 23 HG22 THR 23 1.980 -5.152 1.393
132 HG23 THR 23 HG23 THR 23 1.180 -3.593 1.585
133 H ARG 24 H ARG 24 4.924 -0.510 1.758
134 HA ARG 24 HA ARG 24 6.057 0.040 -0.868
135 HB2 ARG 24 HB3 ARG 24 7.356 1.745 0.165
136 HB3 ARG 24 HB2 ARG 24 5.719 1.914 0.754
137 HG2 ARG 24 HG3 ARG 24 6.288 1.142 2.884
138 HG3 ARG 24 HG2 ARG 24 7.812 0.449 2.319
139 HD2 ARG 24 HD3 ARG 24 7.107 3.358 2.655
140 HD3 ARG 24 HD2 ARG 24 8.361 2.444 3.491
141 HE ARG 24 HE ARG 24 8.641 3.796 1.041
142 HH11 ARG 24 HH11 ARG 24 9.643 0.826 2.616
143 HH12 ARG 24 HH12 ARG 24 10.959 0.543 1.513
144 HH21 ARG 24 HH22 ARG 24 10.416 3.413 -0.380
145 HH22 ARG 24 HH21 ARG 24 11.382 1.982 -0.169
146 H ASP 25 H ASP 25 7.714 -1.075 -1.613
147 HA ASP 25 HA ASP 25 9.394 -2.599 -1.772
148 HB2 ASP 25 HB3 ASP 25 10.049 -1.636 1.027
149 HB3 ASP 25 HB2 ASP 25 11.107 -2.621 0.027
150 H GLY 26 H GLY 26 6.773 -3.361 -0.714
151 HA2 GLY 26 HA3 GLY 26 5.870 -5.435 -0.199
152 HA3 GLY 26 HA2 GLY 26 7.479 -6.006 0.214
153 H LEU 27 H LEU 27 6.999 -3.119 1.788
154 HA LEU 27 HA LEU 27 6.320 -4.542 4.264
155 HB2 LEU 27 HB3 LEU 27 7.542 -1.808 3.873
156 HB3 LEU 27 HB2 LEU 27 7.262 -2.588 5.417
157 HG LEU 27 HG LEU 27 9.144 -3.596 3.281
158 HD11 LEU 27 HD11 LEU 27 10.830 -2.484 4.259
159 HD12 LEU 27 HD12 LEU 27 10.186 -2.731 5.883
160 HD13 LEU 27 HD13 LEU 27 9.549 -1.437 4.869
161 HD21 LEU 27 HD21 LEU 27 8.928 -4.520 6.133
162 HD22 LEU 27 HD22 LEU 27 9.804 -5.270 4.798
163 HD23 LEU 27 HD23 LEU 27 8.041 -5.291 4.816
164 HA PRO 28 HA PRO 28 2.354 -2.495 4.000
165 HB2 PRO 28 HB2 PRO 28 1.215 -3.724 6.107
166 HB3 PRO 28 HB3 PRO 28 1.496 -4.563 4.577
167 HG2 PRO 28 HG3 PRO 28 3.081 -4.661 7.111
168 HG3 PRO 28 HG2 PRO 28 2.638 -5.982 6.016
169 HD2 PRO 28 HD3 PRO 28 5.091 -4.754 6.024
170 HD3 PRO 28 HD2 PRO 28 4.391 -5.560 4.607
171 H VAL 29 H VAL 29 4.386 -0.960 5.035
172 HA VAL 29 HA VAL 29 3.583 -0.064 7.669
173 HB VAL 29 HB VAL 29 5.993 -0.224 7.069
174 HG11 VAL 29 HG11 VAL 29 6.529 0.471 5.018
175 HG12 VAL 29 HG12 VAL 29 6.588 2.081 5.739
176 HG13 VAL 29 HG13 VAL 29 5.129 1.539 4.909
177 HG21 VAL 29 HG21 VAL 29 6.514 2.232 7.804
178 HG22 VAL 29 HG22 VAL 29 5.711 1.117 8.909
179 HG23 VAL 29 HG23 VAL 29 4.766 2.317 8.027
Start of MODEL 17
1 H1 CYS 1 H CYS 1 3.123 0.819 4.285
2 HA CYS 1 HA CYS 1 2.353 3.519 4.493
3 HB2 CYS 1 HB3 CYS 1 0.858 1.634 2.718
4 HB3 CYS 1 HB2 CYS 1 1.442 3.261 2.379
5 H GLY 2 H GLY 2 0.586 0.496 4.977
6 HA2 GLY 2 HA3 GLY 2 -1.223 0.039 6.333
7 HA3 GLY 2 HA2 GLY 2 -1.162 1.700 6.897
8 H GLU 3 H GLU 3 -1.394 2.864 4.275
9 HA GLU 3 HA GLU 3 -4.119 3.237 4.107
10 HB2 GLU 3 HB3 GLU 3 -3.674 4.256 1.894
11 HB3 GLU 3 HB2 GLU 3 -2.586 4.820 3.154
12 HG2 GLU 3 HG3 GLU 3 -0.806 3.469 2.320
13 HG3 GLU 3 HG2 GLU 3 -1.885 2.658 1.184
14 H THR 4 H THR 4 -5.754 2.462 2.931
15 HA THR 4 HA THR 4 -5.449 -0.195 1.803
16 HB THR 4 HB THR 4 -7.923 1.500 2.241
17 HG1 THR 4 HG1 THR 4 -6.406 -0.070 3.912
18 HG21 THR 4 HG21 THR 4 -8.215 -0.250 0.523
19 HG22 THR 4 HG22 THR 4 -9.187 -0.553 1.962
20 HG23 THR 4 HG23 THR 4 -7.700 -1.462 1.695
21 H CYS 5 H CYS 5 -4.952 -0.358 -0.305
22 HA CYS 5 HA CYS 5 -5.586 1.827 -2.108
23 HB2 CYS 5 HB3 CYS 5 -4.227 0.585 -3.751
24 HB3 CYS 5 HB2 CYS 5 -3.355 0.878 -2.252
25 H PHE 6 H PHE 6 -7.899 1.070 -1.440
26 HA PHE 6 HA PHE 6 -9.149 -1.154 -2.497
27 HB2 PHE 6 HB3 PHE 6 -10.211 0.440 -0.944
28 HB3 PHE 6 HB2 PHE 6 -10.287 1.638 -2.231
29 HD1 PHE 6 HD2 PHE 6 -11.175 -1.983 -1.975
30 HD2 PHE 6 HD1 PHE 6 -12.427 1.963 -2.961
31 HE1 PHE 6 HE2 PHE 6 -13.377 -2.853 -2.645
32 HE2 PHE 6 HE1 PHE 6 -14.631 1.100 -3.629
33 HZ PHE 6 HZ PHE 6 -15.108 -1.311 -3.473
34 H GLY 7 H GLY 7 -8.582 1.989 -4.057
35 HA2 GLY 7 HA3 GLY 7 -9.684 0.956 -6.560
36 HA3 GLY 7 HA2 GLY 7 -9.231 2.622 -6.238
37 H GLY 8 H GLY 8 -7.042 0.063 -5.392
38 HA2 GLY 8 HA3 GLY 8 -4.987 -0.538 -6.209
39 HA3 GLY 8 HA2 GLY 8 -5.633 -0.194 -7.805
40 H THR 9 H THR 9 -5.173 2.062 -5.119
41 HA THR 9 HA THR 9 -2.950 3.325 -6.540
42 HB THR 9 HB THR 9 -5.161 5.059 -5.474
43 HG1 THR 9 HG1 THR 9 -5.257 3.469 -7.705
44 HG21 THR 9 HG21 THR 9 -3.542 6.540 -5.981
45 HG22 THR 9 HG22 THR 9 -4.077 6.299 -7.644
46 HG23 THR 9 HG23 THR 9 -2.691 5.401 -7.024
47 H CYS 10 H CYS 10 -1.623 4.598 -5.184
48 HA CYS 10 HA CYS 10 -2.213 4.484 -2.313
49 HB2 CYS 10 HB3 CYS 10 0.487 3.849 -3.527
50 HB3 CYS 10 HB2 CYS 10 0.085 3.842 -1.813
51 H ASN 11 H ASN 11 -1.539 6.212 -1.140
52 HA ASN 11 HA ASN 11 -0.850 8.598 -2.658
53 HB2 ASN 11 HB3 ASN 11 -2.689 8.638 -1.004
54 HB3 ASN 11 HB2 ASN 11 -1.538 8.254 0.271
55 HD21 ASN 11 HD22 ASN 11 -0.816 9.908 1.383
56 HD22 ASN 11 HD21 ASN 11 -0.748 11.547 0.846
57 H THR 12 H THR 12 0.753 6.255 -0.782
58 HA THR 12 HA THR 12 2.921 8.101 -0.083
59 HB THR 12 HB THR 12 2.720 5.191 0.679
60 HG1 THR 12 HG1 THR 12 0.854 6.103 1.475
61 HG21 THR 12 HG21 THR 12 3.860 6.828 2.687
62 HG22 THR 12 HG22 THR 12 4.615 7.270 1.157
63 HG23 THR 12 HG23 THR 12 4.652 5.595 1.706
64 HA PRO 13 HA PRO 13 5.208 6.755 -3.670
65 HB2 PRO 13 HB2 PRO 13 7.606 7.836 -2.886
66 HB3 PRO 13 HB3 PRO 13 6.308 8.756 -3.654
67 HG2 PRO 13 HG3 PRO 13 7.019 8.535 -0.758
68 HG3 PRO 13 HG2 PRO 13 6.521 9.963 -1.686
69 HD2 PRO 13 HD3 PRO 13 4.816 8.649 -0.071
70 HD3 PRO 13 HD2 PRO 13 4.280 9.402 -1.587
71 H GLY 14 H GLY 14 6.171 4.874 -4.076
72 HA2 GLY 14 HA3 GLY 14 7.820 3.214 -3.796
73 HA3 GLY 14 HA2 GLY 14 8.024 3.726 -2.127
74 H CYS 15 H CYS 15 4.852 3.713 -2.355
75 HA CYS 15 HA CYS 15 4.629 1.052 -1.216
76 HB2 CYS 15 HB3 CYS 15 2.684 3.354 -1.438
77 HB3 CYS 15 HB2 CYS 15 2.273 1.799 -0.724
78 H SER 16 H SER 16 3.750 -0.641 -2.188
79 HA SER 16 HA SER 16 2.626 -0.283 -4.878
80 HB2 SER 16 HB3 SER 16 3.818 -2.799 -3.685
81 HB3 SER 16 HB2 SER 16 3.403 -2.512 -5.376
82 HG SER 16 HG SER 16 5.113 -0.637 -4.371
83 H CYS 17 H CYS 17 0.594 -1.050 -5.275
84 HA CYS 17 HA CYS 17 -1.050 -1.579 -3.027
85 HB2 CYS 17 HB3 CYS 17 -1.902 -0.384 -4.980
86 HB3 CYS 17 HB2 CYS 17 -1.698 -1.830 -5.963
87 H THR 18 H THR 18 -1.357 -3.364 -2.041
88 HA THR 18 HA THR 18 -1.215 -5.919 -3.486
89 HB THR 18 HB THR 18 -0.444 -5.533 -0.577
90 HG1 THR 18 HG1 THR 18 1.554 -5.140 -1.208
91 HG21 THR 18 HG21 THR 18 -1.232 -7.796 -1.370
92 HG22 THR 18 HG22 THR 18 0.396 -7.766 -0.689
93 HG23 THR 18 HG23 THR 18 0.172 -7.828 -2.438
94 H TRP 19 H TRP 19 -3.442 -5.079 -3.743
95 HA TRP 19 HA TRP 19 -5.411 -4.459 -2.174
96 HB2 TRP 19 HB3 TRP 19 -5.343 -5.548 -4.636
97 HB3 TRP 19 HB2 TRP 19 -6.132 -6.853 -3.754
98 HD1 TRP 19 HD1 TRP 19 -6.754 -3.410 -5.165
99 HE1 TRP 19 HE1 TRP 19 -9.218 -2.757 -4.797
100 HE3 TRP 19 HE3 TRP 19 -8.120 -7.190 -2.013
101 HZ2 TRP 19 HZ2 TRP 19 -11.445 -3.726 -3.347
102 HZ3 TRP 19 HZ3 TRP 19 -10.421 -7.250 -1.166
103 HH2 TRP 19 HH2 TRP 19 -12.055 -5.555 -1.824
104 HA PRO 20 HA PRO 20 -6.816 -4.183 -1.192
105 HB2 PRO 20 HB2 PRO 20 -8.236 -3.993 1.037
106 HB3 PRO 20 HB3 PRO 20 -8.723 -5.103 -0.248
107 HG2 PRO 20 HG3 PRO 20 -7.468 -5.687 2.379
108 HG3 PRO 20 HG2 PRO 20 -8.576 -6.677 1.415
109 HD2 PRO 20 HD3 PRO 20 -5.722 -6.854 1.538
110 HD3 PRO 20 HD2 PRO 20 -6.825 -7.794 0.513
111 H ILE 21 H ILE 21 -4.053 -4.618 0.059
112 HA ILE 21 HA ILE 21 -4.098 -2.157 1.644
113 HB ILE 21 HB ILE 21 -2.535 -3.094 3.295
114 HG12 ILE 21 HG13 ILE 21 -3.114 -5.763 1.983
115 HG13 ILE 21 HG12 ILE 21 -1.594 -4.885 1.850
116 HG21 ILE 21 HG21 ILE 21 -4.200 -4.708 4.376
117 HG22 ILE 21 HG22 ILE 21 -5.216 -4.411 2.963
118 HG23 ILE 21 HG23 ILE 21 -4.763 -3.074 4.023
119 HD11 ILE 21 HD11 ILE 21 -1.630 -5.010 4.453
120 HD12 ILE 21 HD12 ILE 21 -1.113 -6.399 3.498
121 HD13 ILE 21 HD13 ILE 21 -2.742 -6.349 4.171
122 H CYS 22 H CYS 22 -2.403 -0.826 1.310
123 HA CYS 22 HA CYS 22 -0.578 -1.550 -0.830
124 HB2 CYS 22 HB3 CYS 22 -1.722 0.730 -0.548
125 HB3 CYS 22 HB2 CYS 22 -0.497 1.047 0.671
126 H THR 23 H THR 23 1.570 -1.717 -0.679
127 HA THR 23 HA THR 23 2.811 -1.682 1.990
128 HB THR 23 HB THR 23 4.026 -3.825 1.280
129 HG1 THR 23 HG1 THR 23 2.852 -3.484 -0.942
130 HG21 THR 23 HG21 THR 23 1.061 -3.932 1.862
131 HG22 THR 23 HG22 THR 23 2.361 -3.849 3.052
132 HG23 THR 23 HG23 THR 23 2.178 -5.284 2.042
133 H ARG 24 H ARG 24 4.712 -0.625 1.956
134 HA ARG 24 HA ARG 24 5.915 -0.045 -0.629
135 HB2 ARG 24 HB3 ARG 24 6.676 1.861 0.271
136 HB3 ARG 24 HB2 ARG 24 5.496 1.558 1.527
137 HG2 ARG 24 HG3 ARG 24 7.271 1.949 2.855
138 HG3 ARG 24 HG2 ARG 24 7.589 0.238 2.557
139 HD2 ARG 24 HD3 ARG 24 9.596 1.624 2.242
140 HD3 ARG 24 HD2 ARG 24 9.111 0.805 0.757
141 HE ARG 24 HE ARG 24 7.976 3.399 0.897
142 HH11 ARG 24 HH11 ARG 24 10.961 1.694 0.195
143 HH12 ARG 24 HH12 ARG 24 11.596 2.979 -0.787
144 HH21 ARG 24 HH22 ARG 24 8.802 5.078 -0.412
145 HH22 ARG 24 HH21 ARG 24 10.373 4.907 -1.126
146 H ASP 25 H ASP 25 7.683 -0.994 -1.332
147 HA ASP 25 HA ASP 25 9.361 -2.523 -1.515
148 HB2 ASP 25 HB3 ASP 25 9.905 -1.677 1.343
149 HB3 ASP 25 HB2 ASP 25 11.027 -2.564 0.318
150 H GLY 26 H GLY 26 6.740 -3.421 -0.611
151 HA2 GLY 26 HA3 GLY 26 5.836 -5.501 -0.174
152 HA3 GLY 26 HA2 GLY 26 7.456 -6.098 0.149
153 H LEU 27 H LEU 27 6.676 -3.282 1.885
154 HA LEU 27 HA LEU 27 6.071 -4.899 4.274
155 HB2 LEU 27 HB3 LEU 27 7.575 -2.287 4.090
156 HB3 LEU 27 HB2 LEU 27 7.189 -3.128 5.579
157 HG LEU 27 HG LEU 27 8.978 -4.204 3.397
158 HD11 LEU 27 HD11 LEU 27 9.486 -2.610 5.844
159 HD12 LEU 27 HD12 LEU 27 10.341 -2.628 4.301
160 HD13 LEU 27 HD13 LEU 27 10.608 -3.919 5.472
161 HD21 LEU 27 HD21 LEU 27 9.580 -5.868 5.165
162 HD22 LEU 27 HD22 LEU 27 7.935 -6.017 4.549
163 HD23 LEU 27 HD23 LEU 27 8.224 -5.262 6.116
164 HA PRO 28 HA PRO 28 2.305 -2.540 4.391
165 HB2 PRO 28 HB2 PRO 28 1.381 -3.436 6.762
166 HB3 PRO 28 HB3 PRO 28 1.397 -4.448 5.313
167 HG2 PRO 28 HG3 PRO 28 3.311 -4.400 7.613
168 HG3 PRO 28 HG2 PRO 28 2.626 -5.793 6.757
169 HD2 PRO 28 HD3 PRO 28 5.131 -4.821 6.280
170 HD3 PRO 28 HD2 PRO 28 4.158 -5.657 5.055
171 H VAL 29 H VAL 29 4.388 -0.911 4.890
172 HA VAL 29 HA VAL 29 4.128 0.250 7.526
173 HB VAL 29 HB VAL 29 5.795 1.217 5.201
174 HG11 VAL 29 HG11 VAL 29 5.836 1.894 8.136
175 HG12 VAL 29 HG12 VAL 29 5.493 2.977 6.787
176 HG13 VAL 29 HG13 VAL 29 7.118 2.330 7.006
177 HG21 VAL 29 HG21 VAL 29 6.183 -1.165 6.258
178 HG22 VAL 29 HG22 VAL 29 6.977 -0.224 7.520
179 HG23 VAL 29 HG23 VAL 29 7.539 -0.112 5.853
Start of MODEL 18
1 H1 CYS 1 H CYS 1 3.524 1.448 4.107
2 HA CYS 1 HA CYS 1 2.767 4.155 4.656
3 HB2 CYS 1 HB3 CYS 1 1.641 2.215 2.624
4 HB3 CYS 1 HB2 CYS 1 1.338 3.950 2.664
5 H GLY 2 H GLY 2 1.254 0.993 4.938
6 HA2 GLY 2 HA3 GLY 2 -0.581 0.261 6.101
7 HA3 GLY 2 HA2 GLY 2 -0.353 1.672 7.120
8 H GLU 3 H GLU 3 -1.088 1.656 3.676
9 HA GLU 3 HA GLU 3 -3.667 2.917 4.311
10 HB2 GLU 3 HB3 GLU 3 -3.445 4.138 2.174
11 HB3 GLU 3 HB2 GLU 3 -2.162 4.530 3.313
12 HG2 GLU 3 HG3 GLU 3 -0.576 3.271 2.122
13 HG3 GLU 3 HG2 GLU 3 -1.820 2.470 1.161
14 H THR 4 H THR 4 -5.418 2.472 2.936
15 HA THR 4 HA THR 4 -5.260 -0.168 1.699
16 HB THR 4 HB THR 4 -7.588 1.542 2.596
17 HG1 THR 4 HG1 THR 4 -6.549 -0.971 3.447
18 HG21 THR 4 HG21 THR 4 -9.106 -0.190 1.901
19 HG22 THR 4 HG22 THR 4 -7.771 -1.198 1.342
20 HG23 THR 4 HG23 THR 4 -8.152 0.305 0.502
21 H CYS 5 H CYS 5 -5.021 -0.303 -0.436
22 HA CYS 5 HA CYS 5 -5.620 1.993 -2.117
23 HB2 CYS 5 HB3 CYS 5 -4.622 0.548 -3.935
24 HB3 CYS 5 HB2 CYS 5 -3.529 0.969 -2.622
25 H PHE 6 H PHE 6 -7.910 1.472 -1.291
26 HA PHE 6 HA PHE 6 -9.428 -0.646 -2.229
27 HB2 PHE 6 HB3 PHE 6 -10.087 1.230 -0.608
28 HB3 PHE 6 HB2 PHE 6 -10.478 2.175 -2.041
29 HD1 PHE 6 HD1 PHE 6 -11.089 -1.335 -0.925
30 HD2 PHE 6 HD2 PHE 6 -12.727 2.285 -2.452
31 HE1 PHE 6 HE1 PHE 6 -13.318 -2.374 -0.985
32 HE2 PHE 6 HE2 PHE 6 -14.959 1.250 -2.515
33 HZ PHE 6 HZ PHE 6 -15.257 -1.081 -1.781
34 H GLY 7 H GLY 7 -8.602 2.405 -3.805
35 HA2 GLY 7 HA3 GLY 7 -10.039 1.619 -6.220
36 HA3 GLY 7 HA2 GLY 7 -9.270 3.172 -5.927
37 H GLY 8 H GLY 8 -7.485 0.280 -5.239
38 HA2 GLY 8 HA3 GLY 8 -5.820 -0.825 -6.399
39 HA3 GLY 8 HA2 GLY 8 -6.277 0.063 -7.842
40 H THR 9 H THR 9 -5.915 2.692 -6.768
41 HA THR 9 HA THR 9 -3.018 2.807 -6.959
42 HB THR 9 HB THR 9 -4.755 5.227 -6.685
43 HG1 THR 9 HG1 THR 9 -5.085 3.315 -8.541
44 HG21 THR 9 HG21 THR 9 -2.085 4.929 -7.056
45 HG22 THR 9 HG22 THR 9 -3.006 6.336 -7.589
46 HG23 THR 9 HG23 THR 9 -2.642 5.039 -8.727
47 H CYS 10 H CYS 10 -1.680 3.807 -5.478
48 HA CYS 10 HA CYS 10 -2.743 4.022 -2.750
49 HB2 CYS 10 HB3 CYS 10 0.132 3.668 -3.643
50 HB3 CYS 10 HB2 CYS 10 -0.436 3.689 -1.978
51 H ASN 11 H ASN 11 -1.989 5.769 -1.427
52 HA ASN 11 HA ASN 11 -1.735 8.240 -2.937
53 HB2 ASN 11 HB3 ASN 11 -3.347 8.132 -1.099
54 HB3 ASN 11 HB2 ASN 11 -2.063 7.716 0.029
55 HD21 ASN 11 HD22 ASN 11 -1.310 9.319 1.190
56 HD22 ASN 11 HD21 ASN 11 -1.356 10.994 0.771
57 H THR 12 H THR 12 0.202 6.133 -0.977
58 HA THR 12 HA THR 12 2.354 8.125 -0.855
59 HB THR 12 HB THR 12 2.383 5.409 0.443
60 HG1 THR 12 HG1 THR 12 0.538 6.332 1.244
61 HG21 THR 12 HG21 THR 12 4.089 7.743 0.421
62 HG22 THR 12 HG22 THR 12 4.400 6.128 1.056
63 HG23 THR 12 HG23 THR 12 3.587 7.328 2.060
64 HA PRO 13 HA PRO 13 4.208 6.041 -4.359
65 HB2 PRO 13 HB2 PRO 13 6.507 7.773 -3.746
66 HB3 PRO 13 HB3 PRO 13 5.524 7.693 -5.211
67 HG2 PRO 13 HG3 PRO 13 5.379 9.777 -3.517
68 HG3 PRO 13 HG2 PRO 13 3.961 9.185 -4.403
69 HD2 PRO 13 HD3 PRO 13 4.743 8.721 -1.549
70 HD3 PRO 13 HD2 PRO 13 3.139 9.050 -2.239
71 H GLY 14 H GLY 14 5.568 4.343 -4.545
72 HA2 GLY 14 HA3 GLY 14 7.584 3.179 -3.991
73 HA3 GLY 14 HA2 GLY 14 7.487 3.865 -2.373
74 H CYS 15 H CYS 15 4.580 3.329 -2.231
75 HA CYS 15 HA CYS 15 4.828 0.565 -1.372
76 HB2 CYS 15 HB3 CYS 15 2.906 2.776 -0.831
77 HB3 CYS 15 HB2 CYS 15 2.316 1.123 -0.689
78 H SER 16 H SER 16 3.977 -1.128 -2.338
79 HA SER 16 HA SER 16 2.640 -0.742 -4.895
80 HB2 SER 16 HB3 SER 16 3.567 -3.321 -3.606
81 HB3 SER 16 HB2 SER 16 3.156 -3.064 -5.303
82 HG SER 16 HG SER 16 5.047 -1.313 -4.499
83 H CYS 17 H CYS 17 0.546 -1.427 -5.293
84 HA CYS 17 HA CYS 17 -1.113 -1.646 -2.984
85 HB2 CYS 17 HB3 CYS 17 -1.970 -0.450 -4.880
86 HB3 CYS 17 HB2 CYS 17 -1.775 -1.857 -5.916
87 H THR 18 H THR 18 -1.273 -3.365 -1.883
88 HA THR 18 HA THR 18 -1.460 -5.980 -3.218
89 HB THR 18 HB THR 18 -0.658 -5.526 -0.328
90 HG1 THR 18 HG1 THR 18 1.157 -4.814 -1.197
91 HG21 THR 18 HG21 THR 18 -1.534 -7.758 -0.916
92 HG22 THR 18 HG22 THR 18 0.170 -7.814 -0.465
93 HG23 THR 18 HG23 THR 18 -0.296 -7.901 -2.164
94 H TRP 19 H TRP 19 -3.614 -4.925 -3.491
95 HA TRP 19 HA TRP 19 -5.500 -4.091 -1.926
96 HB2 TRP 19 HB3 TRP 19 -5.582 -5.221 -4.350
97 HB3 TRP 19 HB2 TRP 19 -6.410 -6.477 -3.437
98 HD1 TRP 19 HD1 TRP 19 -6.944 -3.099 -4.971
99 HE1 TRP 19 HE1 TRP 19 -9.352 -2.301 -4.521
100 HE3 TRP 19 HE3 TRP 19 -8.315 -6.594 -1.510
101 HZ2 TRP 19 HZ2 TRP 19 -11.538 -3.058 -2.899
102 HZ3 TRP 19 HZ3 TRP 19 -10.565 -6.481 -0.542
103 HH2 TRP 19 HH2 TRP 19 -12.152 -4.752 -1.227
104 HA PRO 20 HA PRO 20 -6.796 -3.636 -0.888
105 HB2 PRO 20 HB2 PRO 20 -8.123 -3.251 1.374
106 HB3 PRO 20 HB3 PRO 20 -8.762 -4.330 0.130
107 HG2 PRO 20 HG3 PRO 20 -7.505 -4.989 2.736
108 HG3 PRO 20 HG2 PRO 20 -8.730 -5.881 1.819
109 HD2 PRO 20 HD3 PRO 20 -5.901 -6.333 1.878
110 HD3 PRO 20 HD2 PRO 20 -7.120 -7.192 0.915
111 H ILE 21 H ILE 21 -4.041 -4.237 0.178
112 HA ILE 21 HA ILE 21 -3.809 -1.802 1.772
113 HB ILE 21 HB ILE 21 -2.200 -2.963 3.335
114 HG12 ILE 21 HG13 ILE 21 -3.083 -5.526 3.490
115 HG13 ILE 21 HG12 ILE 21 -3.121 -5.285 1.748
116 HG21 ILE 21 HG21 ILE 21 -5.117 -3.723 3.355
117 HG22 ILE 21 HG22 ILE 21 -4.362 -2.326 4.128
118 HG23 ILE 21 HG23 ILE 21 -4.026 -3.950 4.725
119 HD11 ILE 21 HD11 ILE 21 -0.723 -4.486 1.964
120 HD12 ILE 21 HD12 ILE 21 -1.024 -6.206 2.212
121 HD13 ILE 21 HD13 ILE 21 -0.770 -5.147 3.599
122 H CYS 22 H CYS 22 -2.106 -0.590 1.291
123 HA CYS 22 HA CYS 22 -0.322 -1.464 -0.826
124 HB2 CYS 22 HB3 CYS 22 -0.367 1.159 0.670
125 HB3 CYS 22 HB2 CYS 22 0.544 0.818 -0.791
126 H THR 23 H THR 23 1.732 -2.025 -0.636
127 HA THR 23 HA THR 23 3.121 -1.664 1.926
128 HB THR 23 HB THR 23 4.049 -4.051 1.525
129 HG1 THR 23 HG1 THR 23 2.434 -5.402 0.482
130 HG21 THR 23 HG21 THR 23 1.394 -3.294 2.648
131 HG22 THR 23 HG22 THR 23 2.833 -3.903 3.467
132 HG23 THR 23 HG23 THR 23 1.811 -5.005 2.546
133 H ARG 24 H ARG 24 5.201 -1.007 1.663
134 HA ARG 24 HA ARG 24 6.271 -1.011 -1.056
135 HB2 ARG 24 HB3 ARG 24 7.899 0.613 -0.218
136 HB3 ARG 24 HB2 ARG 24 6.259 1.160 0.057
137 HG2 ARG 24 HG3 ARG 24 6.430 0.944 2.335
138 HG3 ARG 24 HG2 ARG 24 7.703 -0.276 2.232
139 HD2 ARG 24 HD3 ARG 24 8.016 2.643 1.536
140 HD3 ARG 24 HD2 ARG 24 8.552 1.888 3.038
141 HE ARG 24 HE ARG 24 9.717 0.421 1.005
142 HH11 ARG 24 HH11 ARG 24 9.809 3.765 2.063
143 HH12 ARG 24 HH12 ARG 24 11.426 4.020 1.505
144 HH21 ARG 24 HH22 ARG 24 11.795 0.726 0.280
145 HH22 ARG 24 HH21 ARG 24 12.577 2.273 0.476
146 H ASP 25 H ASP 25 7.868 -2.356 -1.600
147 HA ASP 25 HA ASP 25 9.418 -4.022 -1.472
148 HB2 ASP 25 HB3 ASP 25 10.095 -2.868 1.248
149 HB3 ASP 25 HB2 ASP 25 11.133 -3.866 0.238
150 H GLY 26 H GLY 26 6.704 -4.335 -0.397
151 HA2 GLY 26 HA3 GLY 26 5.519 -6.137 0.431
152 HA3 GLY 26 HA2 GLY 26 7.045 -6.906 0.841
153 H LEU 27 H LEU 27 6.969 -3.783 2.063
154 HA LEU 27 HA LEU 27 6.208 -4.807 4.715
155 HB2 LEU 27 HB3 LEU 27 7.999 -2.490 3.985
156 HB3 LEU 27 HB2 LEU 27 7.604 -2.985 5.619
157 HG LEU 27 HG LEU 27 9.122 -4.659 3.615
158 HD11 LEU 27 HD11 LEU 27 10.953 -3.590 4.256
159 HD12 LEU 27 HD12 LEU 27 10.621 -4.006 5.937
160 HD13 LEU 27 HD13 LEU 27 9.976 -2.514 5.255
161 HD21 LEU 27 HD21 LEU 27 8.897 -6.389 4.994
162 HD22 LEU 27 HD22 LEU 27 7.674 -5.457 5.858
163 HD23 LEU 27 HD23 LEU 27 9.354 -5.414 6.391
164 HA PRO 28 HA PRO 28 2.788 -1.968 4.555
165 HB2 PRO 28 HB2 PRO 28 2.282 -2.590 7.335
166 HB3 PRO 28 HB3 PRO 28 1.389 -3.122 5.910
167 HG2 PRO 28 HG3 PRO 28 2.873 -4.795 7.482
168 HG3 PRO 28 HG2 PRO 28 2.543 -5.090 5.765
169 HD2 PRO 28 HD3 PRO 28 5.000 -3.968 7.060
170 HD3 PRO 28 HD2 PRO 28 4.860 -5.123 5.716
171 H VAL 29 H VAL 29 4.801 -0.393 4.600
172 HA VAL 29 HA VAL 29 5.138 0.943 7.135
173 HB VAL 29 HB VAL 29 6.262 1.691 4.435
174 HG11 VAL 29 HG11 VAL 29 6.803 3.589 5.487
175 HG12 VAL 29 HG12 VAL 29 7.993 2.617 6.353
176 HG13 VAL 29 HG13 VAL 29 6.412 2.925 7.073
177 HG21 VAL 29 HG21 VAL 29 6.926 -0.462 6.189
178 HG22 VAL 29 HG22 VAL 29 8.265 0.685 6.148
179 HG23 VAL 29 HG23 VAL 29 7.660 -0.019 4.648
Start of MODEL 19
1 H1 CYS 1 H CYS 1 3.515 0.820 4.221
2 HA CYS 1 HA CYS 1 2.864 3.548 4.545
3 HB2 CYS 1 HB3 CYS 1 1.118 1.847 2.850
4 HB3 CYS 1 HB2 CYS 1 1.914 3.372 2.469
5 H GLY 2 H GLY 2 1.108 0.553 5.146
6 HA2 GLY 2 HA3 GLY 2 -0.749 0.073 6.398
7 HA3 GLY 2 HA2 GLY 2 -0.379 1.535 7.299
8 H GLU 3 H GLU 3 -1.216 1.304 3.878
9 HA GLU 3 HA GLU 3 -3.714 2.722 4.489
10 HB2 GLU 3 HB3 GLU 3 -3.414 3.965 2.355
11 HB3 GLU 3 HB2 GLU 3 -2.195 4.334 3.565
12 HG2 GLU 3 HG3 GLU 3 -0.562 3.028 2.436
13 HG3 GLU 3 HG2 GLU 3 -1.770 2.366 1.334
14 H THR 4 H THR 4 -5.500 2.206 3.320
15 HA THR 4 HA THR 4 -5.425 -0.351 1.945
16 HB THR 4 HB THR 4 -7.758 1.423 2.717
17 HG1 THR 4 HG1 THR 4 -6.755 -0.953 3.935
18 HG21 THR 4 HG21 THR 4 -7.596 -1.023 1.134
19 HG22 THR 4 HG22 THR 4 -8.926 0.121 1.314
20 HG23 THR 4 HG23 THR 4 -8.696 -1.158 2.505
21 H CYS 5 H CYS 5 -4.982 -0.311 -0.177
22 HA CYS 5 HA CYS 5 -5.675 2.021 -1.764
23 HB2 CYS 5 HB3 CYS 5 -4.410 0.884 -3.568
24 HB3 CYS 5 HB2 CYS 5 -3.463 1.103 -2.102
25 H PHE 6 H PHE 6 -7.967 1.232 -1.072
26 HA PHE 6 HA PHE 6 -9.275 -0.899 -2.245
27 HB2 PHE 6 HB3 PHE 6 -10.260 0.580 -0.532
28 HB3 PHE 6 HB2 PHE 6 -10.381 1.870 -1.723
29 HD1 PHE 6 HD1 PHE 6 -11.282 -1.757 -1.697
30 HD2 PHE 6 HD2 PHE 6 -12.546 2.255 -2.338
31 HE1 PHE 6 HE1 PHE 6 -13.513 -2.567 -2.341
32 HE2 PHE 6 HE2 PHE 6 -14.781 1.451 -2.982
33 HZ PHE 6 HZ PHE 6 -15.267 -0.963 -2.984
34 H GLY 7 H GLY 7 -8.780 2.363 -3.576
35 HA2 GLY 7 HA3 GLY 7 -9.983 1.529 -6.103
36 HA3 GLY 7 HA2 GLY 7 -9.492 3.162 -5.676
37 H GLY 8 H GLY 8 -7.304 0.530 -5.113
38 HA2 GLY 8 HA3 GLY 8 -5.292 -0.032 -6.059
39 HA3 GLY 8 HA2 GLY 8 -5.997 0.439 -7.598
40 H THR 9 H THR 9 -5.504 2.541 -4.819
41 HA THR 9 HA THR 9 -3.326 3.901 -6.236
42 HB THR 9 HB THR 9 -5.409 5.521 -4.813
43 HG1 THR 9 HG1 THR 9 -5.778 4.117 -7.132
44 HG21 THR 9 HG21 THR 9 -3.896 7.075 -5.384
45 HG22 THR 9 HG22 THR 9 -4.526 6.899 -7.022
46 HG23 THR 9 HG23 THR 9 -3.095 5.996 -6.527
47 H CYS 10 H CYS 10 -1.870 4.991 -4.868
48 HA CYS 10 HA CYS 10 -2.233 4.545 -1.988
49 HB2 CYS 10 HB3 CYS 10 0.361 4.162 -3.502
50 HB3 CYS 10 HB2 CYS 10 0.129 3.957 -1.769
51 H ASN 11 H ASN 11 -1.523 6.136 -0.663
52 HA ASN 11 HA ASN 11 -0.998 8.711 -1.917
53 HB2 ASN 11 HB3 ASN 11 -2.702 8.497 -0.128
54 HB3 ASN 11 HB2 ASN 11 -1.441 8.000 0.994
55 HD21 ASN 11 HD22 ASN 11 -0.674 9.536 2.238
56 HD22 ASN 11 HD21 ASN 11 -0.674 11.227 1.891
57 H THR 12 H THR 12 0.736 6.190 -0.410
58 HA THR 12 HA THR 12 2.969 7.962 0.274
59 HB THR 12 HB THR 12 2.824 5.000 0.803
60 HG1 THR 12 HG1 THR 12 1.003 5.803 1.794
61 HG21 THR 12 HG21 THR 12 4.452 5.401 2.458
62 HG22 THR 12 HG22 THR 12 4.178 7.144 2.421
63 HG23 THR 12 HG23 THR 12 4.974 6.347 1.064
64 HA PRO 13 HA PRO 13 4.915 6.863 -3.598
65 HB2 PRO 13 HB2 PRO 13 7.303 8.050 -2.336
66 HB3 PRO 13 HB3 PRO 13 6.465 8.521 -3.818
67 HG2 PRO 13 HG3 PRO 13 6.322 10.014 -1.597
68 HG3 PRO 13 HG2 PRO 13 4.941 9.844 -2.695
69 HD2 PRO 13 HD3 PRO 13 5.455 8.493 -0.072
70 HD3 PRO 13 HD2 PRO 13 3.940 9.162 -0.718
71 H GLY 14 H GLY 14 6.009 5.090 -4.228
72 HA2 GLY 14 HA3 GLY 14 7.699 3.461 -4.127
73 HA3 GLY 14 HA2 GLY 14 7.969 3.876 -2.440
74 H CYS 15 H CYS 15 4.828 3.762 -2.385
75 HA CYS 15 HA CYS 15 4.768 1.002 -1.498
76 HB2 CYS 15 HB3 CYS 15 2.740 3.239 -1.327
77 HB3 CYS 15 HB2 CYS 15 2.477 1.619 -0.689
78 H SER 16 H SER 16 3.754 -0.618 -2.479
79 HA SER 16 HA SER 16 2.474 -0.073 -5.064
80 HB2 SER 16 HB3 SER 16 3.622 -2.694 -4.073
81 HB3 SER 16 HB2 SER 16 3.136 -2.295 -5.721
82 HG SER 16 HG SER 16 4.969 -0.546 -4.710
83 H CYS 17 H CYS 17 0.405 -0.777 -5.410
84 HA CYS 17 HA CYS 17 -1.146 -1.359 -3.103
85 HB2 CYS 17 HB3 CYS 17 -2.069 -0.030 -4.917
86 HB3 CYS 17 HB2 CYS 17 -1.934 -1.399 -6.013
87 H THR 18 H THR 18 -1.315 -3.189 -2.180
88 HA THR 18 HA THR 18 -1.323 -5.673 -3.759
89 HB THR 18 HB THR 18 -0.592 -5.471 -0.826
90 HG1 THR 18 HG1 THR 18 1.453 -5.103 -1.367
91 HG21 THR 18 HG21 THR 18 0.602 -7.655 -1.475
92 HG22 THR 18 HG22 THR 18 -0.390 -7.608 -2.931
93 HG23 THR 18 HG23 THR 18 -1.157 -7.690 -1.345
94 H TRP 19 H TRP 19 -3.542 -4.755 -3.968
95 HA TRP 19 HA TRP 19 -5.487 -4.174 -2.359
96 HB2 TRP 19 HB3 TRP 19 -5.472 -5.120 -4.872
97 HB3 TRP 19 HB2 TRP 19 -6.264 -6.468 -4.061
98 HD1 TRP 19 HD1 TRP 19 -6.878 -2.960 -5.285
99 HE1 TRP 19 HE1 TRP 19 -9.327 -2.299 -4.832
100 HE3 TRP 19 HE3 TRP 19 -8.221 -6.860 -2.271
101 HZ2 TRP 19 HZ2 TRP 19 -11.532 -3.307 -3.382
102 HZ3 TRP 19 HZ3 TRP 19 -10.505 -6.933 -1.380
103 HH2 TRP 19 HH2 TRP 19 -12.133 -5.194 -1.928
104 HA PRO 20 HA PRO 20 -6.866 -3.909 -1.344
105 HB2 PRO 20 HB2 PRO 20 -8.235 -3.782 0.920
106 HB3 PRO 20 HB3 PRO 20 -8.779 -4.817 -0.402
107 HG2 PRO 20 HG3 PRO 20 -7.477 -5.553 2.165
108 HG3 PRO 20 HG2 PRO 20 -8.648 -6.462 1.197
109 HD2 PRO 20 HD3 PRO 20 -5.808 -6.758 1.225
110 HD3 PRO 20 HD2 PRO 20 -6.972 -7.593 0.177
111 H ILE 21 H ILE 21 -4.091 -4.490 -0.166
112 HA ILE 21 HA ILE 21 -4.037 -2.099 1.527
113 HB ILE 21 HB ILE 21 -2.460 -3.153 3.097
114 HG12 ILE 21 HG13 ILE 21 -3.171 -5.749 1.709
115 HG13 ILE 21 HG12 ILE 21 -1.629 -4.916 1.541
116 HG21 ILE 21 HG21 ILE 21 -5.190 -4.369 2.777
117 HG22 ILE 21 HG22 ILE 21 -4.675 -3.082 3.870
118 HG23 ILE 21 HG23 ILE 21 -4.155 -4.743 4.156
119 HD11 ILE 21 HD11 ILE 21 -1.297 -5.179 3.987
120 HD12 ILE 21 HD12 ILE 21 -1.372 -6.701 3.100
121 HD13 ILE 21 HD13 ILE 21 -2.765 -6.155 4.033
122 H CYS 22 H CYS 22 -2.390 -0.762 1.137
123 HA CYS 22 HA CYS 22 -0.567 -1.445 -1.019
124 HB2 CYS 22 HB3 CYS 22 -1.725 0.817 -0.701
125 HB3 CYS 22 HB2 CYS 22 -0.515 1.126 0.532
126 H THR 23 H THR 23 1.577 -1.613 -0.880
127 HA THR 23 HA THR 23 2.897 -1.508 1.738
128 HB THR 23 HB THR 23 3.969 -3.763 1.164
129 HG1 THR 23 HG1 THR 23 2.583 -3.498 -1.012
130 HG21 THR 23 HG21 THR 23 2.629 -4.564 2.760
131 HG22 THR 23 HG22 THR 23 1.263 -4.606 1.645
132 HG23 THR 23 HG23 THR 23 1.609 -3.139 2.560
133 H ARG 24 H ARG 24 4.969 -0.733 1.570
134 HA ARG 24 HA ARG 24 5.993 -0.357 -1.132
135 HB2 ARG 24 HB3 ARG 24 7.705 1.087 -0.037
136 HB3 ARG 24 HB2 ARG 24 6.062 1.655 0.140
137 HG2 ARG 24 HG3 ARG 24 6.919 2.044 2.225
138 HG3 ARG 24 HG2 ARG 24 6.191 0.455 2.447
139 HD2 ARG 24 HD3 ARG 24 8.596 0.927 3.334
140 HD3 ARG 24 HD2 ARG 24 8.228 -0.612 2.565
141 HE ARG 24 HE ARG 24 9.818 -0.123 1.024
142 HH11 ARG 24 HH11 ARG 24 8.674 2.956 2.277
143 HH12 ARG 24 HH12 ARG 24 9.755 3.884 1.297
144 HH21 ARG 24 HH22 ARG 24 11.225 1.067 -0.233
145 HH22 ARG 24 HH21 ARG 24 11.218 2.808 -0.142
146 H ASP 25 H ASP 25 7.588 -1.527 -1.944
147 HA ASP 25 HA ASP 25 9.122 -3.197 -2.169
148 HB2 ASP 25 HB3 ASP 25 9.929 -2.451 0.656
149 HB3 ASP 25 HB2 ASP 25 10.919 -3.293 -0.530
150 H GLY 26 H GLY 26 6.472 -3.765 -1.028
151 HA2 GLY 26 HA3 GLY 26 5.379 -5.711 -0.434
152 HA3 GLY 26 HA2 GLY 26 6.943 -6.488 -0.238
153 H LEU 27 H LEU 27 6.695 -3.557 1.446
154 HA LEU 27 HA LEU 27 6.208 -5.023 3.952
155 HB2 LEU 27 HB3 LEU 27 7.797 -2.495 3.500
156 HB3 LEU 27 HB2 LEU 27 7.546 -3.273 5.051
157 HG LEU 27 HG LEU 27 9.031 -4.493 2.721
158 HD11 LEU 27 HD11 LEU 27 10.671 -3.127 3.379
159 HD12 LEU 27 HD12 LEU 27 10.803 -4.186 4.782
160 HD13 LEU 27 HD13 LEU 27 9.847 -2.707 4.880
161 HD21 LEU 27 HD21 LEU 27 8.079 -6.239 4.020
162 HD22 LEU 27 HD22 LEU 27 8.507 -5.438 5.531
163 HD23 LEU 27 HD23 LEU 27 9.771 -6.110 4.501
164 HA PRO 28 HA PRO 28 2.583 -2.475 4.332
165 HB2 PRO 28 HB2 PRO 28 2.286 -3.546 7.013
166 HB3 PRO 28 HB3 PRO 28 1.327 -3.889 5.572
167 HG2 PRO 28 HG3 PRO 28 2.975 -5.717 6.740
168 HG3 PRO 28 HG2 PRO 28 2.587 -5.718 5.011
169 HD2 PRO 28 HD3 PRO 28 5.031 -4.688 6.405
170 HD3 PRO 28 HD2 PRO 28 4.899 -5.603 4.886
171 H VAL 29 H VAL 29 4.767 -0.955 4.670
172 HA VAL 29 HA VAL 29 4.799 0.163 7.337
173 HB VAL 29 HB VAL 29 6.292 1.089 4.880
174 HG11 VAL 29 HG11 VAL 29 6.223 2.859 6.468
175 HG12 VAL 29 HG12 VAL 29 7.820 2.121 6.583
176 HG13 VAL 29 HG13 VAL 29 6.594 1.761 7.799
177 HG21 VAL 29 HG21 VAL 29 7.112 -1.056 5.230
178 HG22 VAL 29 HG22 VAL 29 6.965 -0.932 6.983
179 HG23 VAL 29 HG23 VAL 29 8.236 -0.046 6.140
Start of MODEL 20
1 H1 CYS 1 H CYS 1 3.274 1.543 4.298
2 HA CYS 1 HA CYS 1 2.393 4.207 4.943
3 HB2 CYS 1 HB3 CYS 1 1.469 2.365 2.724
4 HB3 CYS 1 HB2 CYS 1 1.136 4.090 2.844
5 H GLY 2 H GLY 2 1.039 0.966 4.897
6 HA2 GLY 2 HA3 GLY 2 -0.810 0.045 5.880
7 HA3 GLY 2 HA2 GLY 2 -0.729 1.380 7.017
8 H GLU 3 H GLU 3 -1.223 1.767 3.567
9 HA GLU 3 HA GLU 3 -3.879 2.847 4.168
10 HB2 GLU 3 HB3 GLU 3 -3.651 4.011 1.959
11 HB3 GLU 3 HB2 GLU 3 -2.493 4.516 3.182
12 HG2 GLU 3 HG3 GLU 3 -0.743 3.291 2.145
13 HG3 GLU 3 HG2 GLU 3 -1.871 2.496 1.047
14 H THR 4 H THR 4 -5.658 2.270 2.969
15 HA THR 4 HA THR 4 -5.502 -0.354 1.735
16 HB THR 4 HB THR 4 -7.904 1.403 2.315
17 HG1 THR 4 HG1 THR 4 -6.614 -0.647 3.797
18 HG21 THR 4 HG21 THR 4 -9.001 -0.971 2.266
19 HG22 THR 4 HG22 THR 4 -7.608 -1.381 1.264
20 HG23 THR 4 HG23 THR 4 -8.713 -0.103 0.758
21 H CYS 5 H CYS 5 -4.969 -0.390 -0.368
22 HA CYS 5 HA CYS 5 -5.710 1.821 -2.098
23 HB2 CYS 5 HB3 CYS 5 -4.335 0.661 -3.797
24 HB3 CYS 5 HB2 CYS 5 -3.449 0.984 -2.312
25 H PHE 6 H PHE 6 -7.987 0.985 -1.451
26 HA PHE 6 HA PHE 6 -9.163 -1.265 -2.549
27 HB2 PHE 6 HB3 PHE 6 -10.271 0.245 -0.947
28 HB3 PHE 6 HB2 PHE 6 -10.395 1.478 -2.196
29 HD1 PHE 6 HD1 PHE 6 -11.164 -2.177 -2.037
30 HD2 PHE 6 HD2 PHE 6 -12.546 1.751 -2.914
31 HE1 PHE 6 HE1 PHE 6 -13.338 -3.100 -2.727
32 HE2 PHE 6 HE2 PHE 6 -14.722 0.835 -3.605
33 HZ PHE 6 HZ PHE 6 -15.121 -1.593 -3.512
34 H GLY 7 H GLY 7 -8.685 1.925 -4.033
35 HA2 GLY 7 HA3 GLY 7 -9.870 1.015 -6.528
36 HA3 GLY 7 HA2 GLY 7 -9.270 2.629 -6.188
37 H GLY 8 H GLY 8 -7.168 0.028 -5.384
38 HA2 GLY 8 HA3 GLY 8 -5.208 -0.728 -6.307
39 HA3 GLY 8 HA2 GLY 8 -5.909 -0.371 -7.877
40 H THR 9 H THR 9 -5.291 1.936 -5.290
41 HA THR 9 HA THR 9 -2.976 3.010 -6.691
42 HB THR 9 HB THR 9 -5.172 4.918 -5.935
43 HG1 THR 9 HG1 THR 9 -5.149 3.172 -8.061
44 HG21 THR 9 HG21 THR 9 -3.679 5.693 -8.221
45 HG22 THR 9 HG22 THR 9 -2.541 5.140 -6.991
46 HG23 THR 9 HG23 THR 9 -3.687 6.427 -6.617
47 H CYS 10 H CYS 10 -1.677 4.317 -5.352
48 HA CYS 10 HA CYS 10 -2.412 4.285 -2.504
49 HB2 CYS 10 HB3 CYS 10 0.385 4.006 -3.627
50 HB3 CYS 10 HB2 CYS 10 -0.084 3.908 -1.932
51 H ASN 11 H ASN 11 -1.855 6.048 -1.281
52 HA ASN 11 HA ASN 11 -1.505 8.521 -2.775
53 HB2 ASN 11 HB3 ASN 11 -3.246 8.393 -1.048
54 HB3 ASN 11 HB2 ASN 11 -2.030 8.012 0.166
55 HD21 ASN 11 HD22 ASN 11 -1.314 9.639 1.326
56 HD22 ASN 11 HD21 ASN 11 -1.383 11.307 0.889
57 H THR 12 H THR 12 0.303 6.370 -0.781
58 HA THR 12 HA THR 12 2.418 8.363 -0.392
59 HB THR 12 HB THR 12 2.414 5.576 0.735
60 HG1 THR 12 HG1 THR 12 0.478 6.380 1.442
61 HG21 THR 12 HG21 THR 12 4.394 7.261 0.802
62 HG22 THR 12 HG22 THR 12 3.956 6.381 2.265
63 HG23 THR 12 HG23 THR 12 3.442 8.055 2.058
64 HA PRO 13 HA PRO 13 4.561 6.547 -3.880
65 HB2 PRO 13 HB2 PRO 13 6.797 8.206 -2.912
66 HB3 PRO 13 HB3 PRO 13 5.969 8.240 -4.470
67 HG2 PRO 13 HG3 PRO 13 5.643 10.196 -2.663
68 HG3 PRO 13 HG2 PRO 13 4.316 9.663 -3.712
69 HD2 PRO 13 HD3 PRO 13 4.843 9.005 -0.837
70 HD3 PRO 13 HD2 PRO 13 3.305 9.380 -1.644
71 H GLY 14 H GLY 14 5.953 4.864 -4.098
72 HA2 GLY 14 HA3 GLY 14 7.875 3.601 -3.486
73 HA3 GLY 14 HA2 GLY 14 7.709 4.204 -1.842
74 H CYS 15 H CYS 15 4.789 3.730 -1.908
75 HA CYS 15 HA CYS 15 4.896 0.934 -1.141
76 HB2 CYS 15 HB3 CYS 15 3.055 3.214 -0.639
77 HB3 CYS 15 HB2 CYS 15 2.348 1.603 -0.633
78 H SER 16 H SER 16 3.916 -0.701 -2.150
79 HA SER 16 HA SER 16 2.726 -0.142 -4.772
80 HB2 SER 16 HB3 SER 16 3.843 -2.759 -3.735
81 HB3 SER 16 HB2 SER 16 3.409 -2.372 -5.401
82 HG SER 16 HG SER 16 5.187 -0.597 -4.351
83 H CYS 17 H CYS 17 0.697 -0.924 -5.258
84 HA CYS 17 HA CYS 17 -0.994 -1.453 -3.041
85 HB2 CYS 17 HB3 CYS 17 -1.821 -0.222 -4.968
86 HB3 CYS 17 HB2 CYS 17 -1.584 -1.634 -5.992
87 H THR 18 H THR 18 -1.076 -3.253 -2.038
88 HA THR 18 HA THR 18 -0.970 -5.790 -3.525
89 HB THR 18 HB THR 18 -0.345 -5.432 -0.578
90 HG1 THR 18 HG1 THR 18 1.445 -4.537 -1.323
91 HG21 THR 18 HG21 THR 18 -0.067 -7.686 -2.548
92 HG22 THR 18 HG22 THR 18 -0.868 -7.685 -0.977
93 HG23 THR 18 HG23 THR 18 0.892 -7.635 -1.069
94 H TRP 19 H TRP 19 -3.202 -4.969 -3.867
95 HA TRP 19 HA TRP 19 -5.238 -4.391 -2.371
96 HB2 TRP 19 HB3 TRP 19 -5.078 -5.440 -4.838
97 HB3 TRP 19 HB2 TRP 19 -5.857 -6.782 -4.006
98 HD1 TRP 19 HD1 TRP 19 -6.539 -3.351 -5.402
99 HE1 TRP 19 HE1 TRP 19 -9.028 -2.764 -5.086
100 HE3 TRP 19 HE3 TRP 19 -7.879 -7.174 -2.289
101 HZ2 TRP 19 HZ2 TRP 19 -11.259 -3.793 -3.693
102 HZ3 TRP 19 HZ3 TRP 19 -10.198 -7.295 -1.497
103 HH2 TRP 19 HH2 TRP 19 -11.859 -5.641 -2.189
104 HA PRO 20 HA PRO 20 -6.676 -4.137 -1.438
105 HB2 PRO 20 HB2 PRO 20 -8.149 -3.959 0.754
106 HB3 PRO 20 HB3 PRO 20 -8.595 -5.078 -0.538
107 HG2 PRO 20 HG3 PRO 20 -7.376 -5.641 2.114
108 HG3 PRO 20 HG2 PRO 20 -8.477 -6.636 1.147
109 HD2 PRO 20 HD3 PRO 20 -5.634 -6.835 1.299
110 HD3 PRO 20 HD2 PRO 20 -6.726 -7.749 0.241
111 H ILE 21 H ILE 21 -3.944 -4.589 -0.092
112 HA ILE 21 HA ILE 21 -4.037 -2.115 1.474
113 HB ILE 21 HB ILE 21 -2.509 -3.045 3.167
114 HG12 ILE 21 HG13 ILE 21 -3.089 -5.722 1.874
115 HG13 ILE 21 HG12 ILE 21 -1.559 -4.859 1.747
116 HG21 ILE 21 HG21 ILE 21 -5.190 -4.352 2.781
117 HG22 ILE 21 HG22 ILE 21 -4.763 -2.994 3.825
118 HG23 ILE 21 HG23 ILE 21 -4.213 -4.621 4.227
119 HD11 ILE 21 HD11 ILE 21 -1.552 -4.950 4.318
120 HD12 ILE 21 HD12 ILE 21 -1.171 -6.415 3.413
121 HD13 ILE 21 HD13 ILE 21 -2.773 -6.208 4.121
122 H CYS 22 H CYS 22 -2.420 -0.751 1.098
123 HA CYS 22 HA CYS 22 -0.458 -1.470 -0.919
124 HB2 CYS 22 HB3 CYS 22 -1.701 0.752 -0.791
125 HB3 CYS 22 HB2 CYS 22 -0.604 1.165 0.515
126 H THR 23 H THR 23 1.654 -1.649 -0.635
127 HA THR 23 HA THR 23 2.868 -1.264 1.996
128 HB THR 23 HB THR 23 3.893 -3.620 1.741
129 HG1 THR 23 HG1 THR 23 2.259 -5.039 0.663
130 HG21 THR 23 HG21 THR 23 1.622 -4.656 2.612
131 HG22 THR 23 HG22 THR 23 1.135 -2.962 2.651
132 HG23 THR 23 HG23 THR 23 2.533 -3.499 3.584
133 H ARG 24 H ARG 24 5.011 -0.682 1.849
134 HA ARG 24 HA ARG 24 6.143 -0.580 -0.837
135 HB2 ARG 24 HB3 ARG 24 7.785 0.946 0.078
136 HB3 ARG 24 HB2 ARG 24 6.178 1.498 0.497
137 HG2 ARG 24 HG3 ARG 24 6.512 1.203 2.712
138 HG3 ARG 24 HG2 ARG 24 7.559 -0.200 2.481
139 HD2 ARG 24 HD3 ARG 24 8.309 2.685 2.007
140 HD3 ARG 24 HD2 ARG 24 8.829 1.683 3.363
141 HE ARG 24 HE ARG 24 9.531 0.407 0.943
142 HH11 ARG 24 HH11 ARG 24 10.446 3.203 2.853
143 HH12 ARG 24 HH12 ARG 24 12.079 3.207 2.283
144 HH21 ARG 24 HH22 ARG 24 11.639 0.396 0.194
145 HH22 ARG 24 HH21 ARG 24 12.770 1.594 0.755
146 H ASP 25 H ASP 25 7.652 -1.979 -1.463
147 HA ASP 25 HA ASP 25 9.123 -3.723 -1.443
148 HB2 ASP 25 HB3 ASP 25 9.873 -2.763 1.335
149 HB3 ASP 25 HB2 ASP 25 10.852 -3.754 0.264
150 H GLY 26 H GLY 26 6.402 -3.972 -0.352
151 HA2 GLY 26 HA3 GLY 26 5.149 -5.765 0.395
152 HA3 GLY 26 HA2 GLY 26 6.644 -6.620 0.746
153 H LEU 27 H LEU 27 6.671 -3.545 2.106
154 HA LEU 27 HA LEU 27 5.964 -4.669 4.729
155 HB2 LEU 27 HB3 LEU 27 7.718 -2.304 4.058
156 HB3 LEU 27 HB2 LEU 27 7.379 -2.890 5.675
157 HG LEU 27 HG LEU 27 8.849 -4.440 3.540
158 HD11 LEU 27 HD11 LEU 27 10.738 -3.502 4.229
159 HD12 LEU 27 HD12 LEU 27 10.339 -3.800 5.921
160 HD13 LEU 27 HD13 LEU 27 9.761 -2.337 5.123
161 HD21 LEU 27 HD21 LEU 27 9.457 -5.799 5.662
162 HD22 LEU 27 HD22 LEU 27 7.897 -6.067 4.884
163 HD23 LEU 27 HD23 LEU 27 7.998 -5.072 6.338
164 HA PRO 28 HA PRO 28 2.511 -1.873 4.739
165 HB2 PRO 28 HB2 PRO 28 1.640 -2.401 7.232
166 HB3 PRO 28 HB3 PRO 28 1.457 -3.559 5.910
167 HG2 PRO 28 HG3 PRO 28 3.483 -3.494 8.108
168 HG3 PRO 28 HG2 PRO 28 2.614 -4.881 7.426
169 HD2 PRO 28 HD3 PRO 28 5.187 -4.215 6.761
170 HD3 PRO 28 HD2 PRO 28 4.087 -5.105 5.690
171 H VAL 29 H VAL 29 4.533 -0.281 4.790
172 HA VAL 29 HA VAL 29 4.847 1.028 7.345
173 HB VAL 29 HB VAL 29 5.975 1.807 4.653
174 HG11 VAL 29 HG11 VAL 29 5.783 3.433 6.782
175 HG12 VAL 29 HG12 VAL 29 7.121 3.491 5.634
176 HG13 VAL 29 HG13 VAL 29 7.305 2.625 7.158
177 HG21 VAL 29 HG21 VAL 29 6.963 -0.010 6.809
178 HG22 VAL 29 HG22 VAL 29 8.115 0.891 5.824
179 HG23 VAL 29 HG23 VAL 29 6.986 -0.227 5.058