NMR Restraints Grid
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NMR Restraints Grid |
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Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
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|
575295 |
2rty   |
11535 | cing | 1-original | 4 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 H1 PHE 1 H PHE 1 1.807 0.001 0.856
2 HA PHE 1 HA PHE 1 1.596 0.659 -1.936
3 HB2 PHE 1 2HB PHE 1 3.971 -0.075 -0.214
4 HB3 PHE 1 3HB PHE 1 4.088 0.418 -1.900
5 HD1 PHE 1 HD2 PHE 1 2.757 2.698 -2.400
6 HD2 PHE 1 HD1 PHE 1 4.371 1.531 1.362
7 HE1 PHE 1 HE2 PHE 1 2.834 5.057 -1.705
8 HE2 PHE 1 HE1 PHE 1 4.450 3.888 2.063
9 HZ PHE 1 HZ PHE 1 3.682 5.655 0.529
10 H SER 2 H SER 2 1.945 -0.645 -3.686
11 HA SER 2 HA SER 2 2.960 -3.285 -3.543
12 HB2 SER 2 2HB SER 2 0.668 -4.301 -4.311
13 HB3 SER 2 3HB SER 2 0.996 -4.086 -2.592
14 HG SER 2 HG SER 2 -1.039 -3.264 -3.070
15 H CYS 3 H CYS 3 3.994 -3.356 -5.416
16 HA CYS 3 HA CYS 3 3.334 -1.770 -7.658
17 HB2 CYS 3 2HB CYS 3 5.596 -2.886 -6.961
18 HB3 CYS 3 3HB CYS 3 4.998 -4.253 -7.894
19 H ASP 4 H ASP 4 1.245 -2.140 -8.337
20 HA ASP 4 HA ASP 4 0.379 -4.826 -8.994
21 HB2 ASP 4 2HB ASP 4 -0.889 -2.181 -8.709
22 HB3 ASP 4 3HB ASP 4 -1.576 -3.198 -9.973
23 H HIS 5 H HIS 5 0.488 -5.747 -10.938
24 HA HIS 5 HA HIS 5 1.923 -4.590 -13.057
25 HB2 HIS 5 2HB HIS 5 0.183 -7.028 -12.819
26 HB3 HIS 5 3HB HIS 5 0.851 -6.553 -14.378
27 HD1 HIS 5 HD1 HIS 5 2.412 -8.562 -14.565
28 HD2 HIS 5 HD2 HIS 5 3.022 -6.306 -11.130
29 HE1 HIS 5 HE1 HIS 5 4.568 -9.405 -13.580
30 H SER 6 H SER 6 -1.503 -4.726 -12.344
31 HA SER 6 HA SER 6 -2.477 -3.963 -14.873
32 HB2 SER 6 2HB SER 6 -3.644 -3.570 -12.109
33 HB3 SER 6 3HB SER 6 -4.520 -3.247 -13.605
34 HG SER 6 HG SER 6 -4.920 -5.355 -12.757
35 H ALA 7 H ALA 7 -1.922 -1.994 -11.952
36 HA ALA 7 HA ALA 7 -2.559 0.488 -12.975
37 HB1 ALA 7 1HB ALA 7 -1.016 1.408 -11.260
38 HB2 ALA 7 2HB ALA 7 -2.132 0.194 -10.632
39 HB3 ALA 7 3HB ALA 7 -0.450 -0.233 -10.947
40 H CYS 8 H CYS 8 0.639 -1.082 -12.965
41 HA CYS 8 HA CYS 8 1.977 0.975 -14.351
42 HB2 CYS 8 2HB CYS 8 3.018 -0.921 -13.014
43 HB3 CYS 8 3HB CYS 8 2.726 -1.948 -14.414
44 H ALA 9 H ALA 9 0.509 -2.056 -15.479
45 HA ALA 9 HA ALA 9 1.205 -1.967 -18.146
46 HB1 ALA 9 1HB ALA 9 0.036 -3.845 -17.070
47 HB2 ALA 9 2HB ALA 9 -1.444 -2.886 -17.036
48 HB3 ALA 9 3HB ALA 9 -0.731 -3.354 -18.580
49 H VAL 10 H VAL 10 -1.633 -0.481 -16.597
50 HA VAL 10 HA VAL 10 -2.622 0.701 -18.985
51 HB VAL 10 HB VAL 10 -3.171 1.495 -16.122
52 HG11 VAL 10 1HG1 VAL 10 -4.631 2.103 -18.689
53 HG12 VAL 10 2HG1 VAL 10 -5.275 2.414 -17.075
54 HG13 VAL 10 3HG1 VAL 10 -3.823 3.253 -17.624
55 HG21 VAL 10 3HG2 VAL 10 -3.900 -0.841 -17.608
56 HG22 VAL 10 1HG2 VAL 10 -4.284 -0.417 -15.940
57 HG23 VAL 10 2HG2 VAL 10 -5.344 0.105 -17.249
58 H ARG 11 H ARG 11 -0.789 2.000 -16.227
59 HA ARG 11 HA ARG 11 -0.619 4.645 -17.112
60 HB2 ARG 11 2HB ARG 11 -0.013 3.788 -14.828
61 HB3 ARG 11 3HB ARG 11 1.482 3.171 -15.520
62 HG2 ARG 11 2HG ARG 11 2.392 5.252 -15.768
63 HG3 ARG 11 3HG ARG 11 0.821 6.042 -15.913
64 HD2 ARG 11 2HD ARG 11 1.344 6.720 -13.811
65 HD3 ARG 11 3HD ARG 11 0.603 5.172 -13.407
66 HE ARG 11 HE ARG 11 3.213 4.543 -13.747
67 HH11 ARG 11 1HH1 ARG 11 1.552 6.936 -11.841
68 HH12 ARG 11 2HH1 ARG 11 2.747 6.954 -10.586
69 HH21 ARG 11 1HH2 ARG 11 4.792 4.558 -12.102
70 HH22 ARG 11 2HH2 ARG 11 4.590 5.602 -10.736
71 H CYS 12 H CYS 12 0.974 1.806 -18.216
72 HA CYS 12 HA CYS 12 3.135 3.244 -19.510
73 HB2 CYS 12 2HB CYS 12 2.348 0.346 -19.333
74 HB3 CYS 12 3HB CYS 12 3.571 0.886 -20.480
75 H LEU 13 H LEU 13 0.346 1.279 -20.528
76 HA LEU 13 HA LEU 13 0.657 1.703 -23.288
77 HB2 LEU 13 2HB LEU 13 -1.246 0.508 -23.524
78 HB3 LEU 13 3HB LEU 13 -0.897 0.100 -21.845
79 HG LEU 13 HG LEU 13 -2.441 2.215 -21.405
80 HD11 LEU 13 1HD1 LEU 13 -3.475 2.998 -23.201
81 HD12 LEU 13 2HD1 LEU 13 -4.258 1.431 -23.406
82 HD13 LEU 13 3HD1 LEU 13 -2.725 1.762 -24.213
83 HD21 LEU 13 3HD2 LEU 13 -3.854 0.695 -20.565
84 HD22 LEU 13 1HD2 LEU 13 -2.678 -0.492 -21.129
85 HD23 LEU 13 2HD2 LEU 13 -4.079 -0.098 -22.125
86 H ALA 14 H ALA 14 -0.677 3.679 -20.778
87 HA ALA 14 HA ALA 14 -2.131 5.419 -22.561
88 HB1 ALA 14 1HB ALA 14 -3.142 5.421 -20.508
89 HB2 ALA 14 2HB ALA 14 -1.614 5.331 -19.631
90 HB3 ALA 14 3HB ALA 14 -2.125 6.854 -20.358
91 H GLN 15 H GLN 15 1.077 5.196 -21.306
92 HA GLN 15 HA GLN 15 1.698 7.961 -21.999
93 HB2 GLN 15 2HB GLN 15 2.829 5.959 -20.234
94 HB3 GLN 15 3HB GLN 15 4.064 6.669 -21.265
95 HG2 GLN 15 2HG GLN 15 3.166 8.925 -20.542
96 HG3 GLN 15 3HG GLN 15 2.256 8.051 -19.311
97 HE21 GLN 15 1HE2 GLN 15 3.846 6.265 -18.288
98 HE22 GLN 15 2HE2 GLN 15 5.297 6.952 -17.651
99 H ARG 16 H ARG 16 1.101 5.630 -23.908
100 HA ARG 16 HA ARG 16 1.745 5.006 -25.999
101 HB2 ARG 16 2HB ARG 16 3.804 7.207 -25.851
102 HB3 ARG 16 3HB ARG 16 3.092 6.499 -27.294
103 HG2 ARG 16 2HG ARG 16 1.664 8.188 -25.251
104 HG3 ARG 16 3HG ARG 16 2.164 8.693 -26.866
105 HD2 ARG 16 2HD ARG 16 0.671 6.334 -27.197
106 HD3 ARG 16 3HD ARG 16 -0.220 7.326 -26.044
107 HE ARG 16 HE ARG 16 0.664 8.772 -28.363
108 HH11 ARG 16 1HH1 ARG 16 -1.840 6.749 -27.037
109 HH12 ARG 16 2HH1 ARG 16 -3.062 7.328 -28.121
110 HH21 ARG 16 1HH2 ARG 16 -0.936 9.542 -29.795
111 HH22 ARG 16 2HH2 ARG 16 -2.547 8.915 -29.690
112 H ARG 17 H ARG 17 2.711 3.392 -24.136
113 HA ARG 17 HA ARG 17 5.433 2.802 -25.075
114 HB2 ARG 17 2HB ARG 17 4.528 2.352 -22.232
115 HB3 ARG 17 3HB ARG 17 6.154 2.190 -22.880
116 HG2 ARG 17 2HG ARG 17 4.638 4.785 -22.720
117 HG3 ARG 17 3HG ARG 17 5.811 4.231 -21.524
118 HD2 ARG 17 2HD ARG 17 6.549 4.416 -24.420
119 HD3 ARG 17 3HD ARG 17 6.578 5.849 -23.394
120 HE ARG 17 HE ARG 17 8.000 3.768 -22.142
121 HH11 ARG 17 1HH1 ARG 17 8.233 5.957 -24.838
122 HH12 ARG 17 2HH1 ARG 17 9.965 5.982 -24.836
123 HH21 ARG 17 1HH2 ARG 17 10.280 3.792 -22.129
124 HH22 ARG 17 2HH2 ARG 17 11.129 4.750 -23.295
125 H LYS 18 H LYS 18 2.512 1.825 -25.456
126 HA LYS 18 HA LYS 18 1.410 -0.144 -25.778
127 HB2 LYS 18 2HB LYS 18 3.786 -0.297 -27.071
128 HB3 LYS 18 3HB LYS 18 3.910 -1.703 -26.022
129 HG2 LYS 18 2HG LYS 18 2.747 -2.825 -27.534
130 HG3 LYS 18 3HG LYS 18 1.347 -1.844 -27.094
131 HD2 LYS 18 2HD LYS 18 1.552 -1.627 -29.430
132 HD3 LYS 18 3HD LYS 18 2.213 -0.133 -28.764
133 HE2 LYS 18 2HE LYS 18 4.412 -1.768 -28.861
134 HE3 LYS 18 3HE LYS 18 3.517 -2.248 -30.303
135 HZ1 LYS 18 3HZ LYS 18 4.575 0.425 -29.610
136 HZ2 LYS 18 1HZ LYS 18 3.374 0.224 -30.784
137 HZ3 LYS 18 2HZ LYS 18 4.886 -0.505 -30.988
138 H GLY 19 H GLY 19 2.188 0.526 -23.034
139 HA2 GLY 19 2HA GLY 19 1.701 -0.521 -21.016
140 HA3 GLY 19 3HA GLY 19 1.630 -2.059 -21.863
141 H GLY 20 H GLY 20 2.785 -2.335 -19.577
142 HA2 GLY 20 2HA GLY 20 5.552 -2.853 -20.238
143 HA3 GLY 20 3HA GLY 20 5.330 -1.644 -18.982
144 H LYS 21 H LYS 21 6.256 -2.855 -17.352
145 HA LYS 21 HA LYS 21 4.516 -4.777 -16.110
146 HB2 LYS 21 2HB LYS 21 6.376 -6.508 -15.947
147 HB3 LYS 21 3HB LYS 21 5.570 -6.366 -17.503
148 HG2 LYS 21 2HG LYS 21 7.904 -4.641 -17.267
149 HG3 LYS 21 3HG LYS 21 8.279 -6.356 -17.084
150 HD2 LYS 21 2HD LYS 21 6.643 -6.483 -19.206
151 HD3 LYS 21 3HD LYS 21 7.299 -4.861 -19.442
152 HE2 LYS 21 2HE LYS 21 8.968 -5.939 -20.492
153 HE3 LYS 21 3HE LYS 21 9.551 -6.257 -18.859
154 HZ1 LYS 21 3HZ LYS 21 9.538 -8.351 -19.732
155 HZ2 LYS 21 1HZ LYS 21 8.208 -8.064 -20.737
156 HZ3 LYS 21 2HZ LYS 21 7.978 -8.311 -19.080
157 H CYS 22 H CYS 22 5.310 -5.439 -13.968
158 HA CYS 22 HA CYS 22 6.870 -3.274 -12.764
159 HB2 CYS 22 2HB CYS 22 4.563 -4.759 -11.965
160 HB3 CYS 22 3HB CYS 22 5.840 -5.039 -10.786
161 H LYS 23 H LYS 23 8.716 -3.606 -11.594
162 HA LYS 23 HA LYS 23 9.738 -6.357 -11.423
163 HB2 LYS 23 2HB LYS 23 10.682 -4.809 -13.333
164 HB3 LYS 23 3HB LYS 23 11.618 -4.108 -12.020
165 HG2 LYS 23 2HG LYS 23 12.711 -6.157 -11.578
166 HG3 LYS 23 3HG LYS 23 11.590 -7.055 -12.605
167 HD2 LYS 23 2HD LYS 23 12.529 -6.218 -14.568
168 HD3 LYS 23 3HD LYS 23 13.291 -4.860 -13.736
169 HE2 LYS 23 2HE LYS 23 15.047 -6.339 -14.231
170 HE3 LYS 23 3HE LYS 23 14.697 -6.598 -12.523
171 HZ1 LYS 23 3HZ LYS 23 14.999 -8.679 -13.762
172 HZ2 LYS 23 1HZ LYS 23 13.669 -8.292 -14.734
173 HZ3 LYS 23 2HZ LYS 23 13.456 -8.564 -13.079
174 H ASN 24 H ASN 24 9.322 -6.473 -9.226
175 HA ASN 24 HA ASN 24 9.634 -6.154 -6.993
176 HB2 ASN 24 2HB ASN 24 12.028 -6.612 -7.993
177 HB3 ASN 24 3HB ASN 24 12.311 -4.933 -7.542
178 HD21 ASN 24 1HD2 ASN 24 12.333 -4.356 -5.378
179 HD22 ASN 24 2HD2 ASN 24 12.463 -5.527 -4.114
180 H GLY 25 H GLY 25 8.381 -3.997 -8.440
181 HA2 GLY 25 2HA GLY 25 7.477 -2.084 -7.241
182 HA3 GLY 25 3HA GLY 25 9.094 -1.783 -6.623
183 H ASP 26 H ASP 26 10.401 -2.229 -9.180
184 HA ASP 26 HA ASP 26 10.127 0.421 -10.230
185 HB2 ASP 26 2HB ASP 26 11.788 -1.945 -11.113
186 HB3 ASP 26 3HB ASP 26 11.868 -0.358 -11.872
187 H CYS 27 H CYS 27 8.441 0.940 -11.461
188 HA CYS 27 HA CYS 27 7.102 -1.005 -13.112
189 HB2 CYS 27 2HB CYS 27 5.793 0.704 -11.973
190 HB3 CYS 27 3HB CYS 27 6.687 1.976 -12.801
191 H VAL 28 H VAL 28 8.347 -1.658 -14.796
192 HA VAL 28 HA VAL 28 9.738 0.303 -16.435
193 HB VAL 28 HB VAL 28 9.577 -2.683 -16.849
194 HG11 VAL 28 1HG1 VAL 28 11.955 -1.915 -17.853
195 HG12 VAL 28 2HG1 VAL 28 10.476 -2.014 -18.810
196 HG13 VAL 28 3HG1 VAL 28 11.005 -0.461 -18.161
197 HG21 VAL 28 3HG2 VAL 28 11.268 -1.030 -15.044
198 HG22 VAL 28 1HG2 VAL 28 10.603 -2.646 -14.806
199 HG23 VAL 28 2HG2 VAL 28 12.007 -2.414 -15.849
200 H CYS 29 H CYS 29 9.137 0.954 -18.428
201 HA CYS 29 HA CYS 29 6.629 -0.161 -19.502
202 HB2 CYS 29 2HB CYS 29 7.728 2.641 -19.512
203 HB3 CYS 29 3HB CYS 29 6.502 2.137 -20.671
204 H ARG 30 H ARG 30 6.817 -1.245 -21.338
205 HA ARG 30 HA ARG 30 8.856 -0.428 -23.282
206 HB2 ARG 30 2HB ARG 30 8.350 -3.291 -22.450
207 HB3 ARG 30 3HB ARG 30 9.469 -2.759 -23.698
208 HG2 ARG 30 2HG ARG 30 10.544 -1.383 -21.772
209 HG3 ARG 30 3HG ARG 30 9.691 -2.527 -20.734
210 HD2 ARG 30 2HD ARG 30 10.828 -4.189 -22.567
211 HD3 ARG 30 3HD ARG 30 12.040 -2.915 -22.447
212 HE ARG 30 HE ARG 30 11.339 -3.608 -19.856
213 HH11 ARG 30 1HH1 ARG 30 12.797 -5.122 -22.631
214 HH12 ARG 30 2HH1 ARG 30 13.756 -6.218 -21.692
215 HH21 ARG 30 1HH2 ARG 30 12.597 -5.044 -18.609
216 HH22 ARG 30 2HH2 ARG 30 13.641 -6.173 -19.404
Start of MODEL 2
1 H1 PHE 1 H PHE 1 2.498 -1.776 0.820
2 HA PHE 1 HA PHE 1 1.273 -1.079 -1.754
3 HB2 PHE 1 2HB PHE 1 3.492 -0.584 -2.701
4 HB3 PHE 1 3HB PHE 1 3.089 0.518 -1.389
5 HD1 PHE 1 HD1 PHE 1 4.125 0.162 0.861
6 HD2 PHE 1 HD2 PHE 1 5.401 -1.949 -2.608
7 HE1 PHE 1 HE1 PHE 1 6.236 -0.410 1.989
8 HE2 PHE 1 HE2 PHE 1 7.513 -2.525 -1.486
9 HZ PHE 1 HZ PHE 1 7.932 -1.756 0.816
10 H SER 2 H SER 2 1.883 -2.480 -3.513
11 HA SER 2 HA SER 2 3.322 -4.916 -2.894
12 HB2 SER 2 2HB SER 2 0.787 -5.101 -2.210
13 HB3 SER 2 3HB SER 2 0.545 -5.309 -3.945
14 HG SER 2 HG SER 2 0.891 -7.286 -2.714
15 H CYS 3 H CYS 3 3.466 -2.622 -4.762
16 HA CYS 3 HA CYS 3 3.934 -2.186 -6.946
17 HB2 CYS 3 2HB CYS 3 5.494 -4.158 -6.375
18 HB3 CYS 3 3HB CYS 3 4.376 -5.140 -7.317
19 H ASP 4 H ASP 4 1.821 -1.581 -7.518
20 HA ASP 4 HA ASP 4 -0.103 -3.493 -8.430
21 HB2 ASP 4 2HB ASP 4 0.011 -0.484 -8.728
22 HB3 ASP 4 3HB ASP 4 -1.370 -1.481 -9.179
23 H HIS 5 H HIS 5 0.510 -4.681 -10.154
24 HA HIS 5 HA HIS 5 2.007 -3.646 -12.342
25 HB2 HIS 5 2HB HIS 5 2.172 -5.989 -11.850
26 HB3 HIS 5 3HB HIS 5 0.430 -6.199 -11.995
27 HD1 HIS 5 HD1 HIS 5 0.337 -7.795 -13.927
28 HD2 HIS 5 HD2 HIS 5 2.685 -4.462 -14.724
29 HE1 HIS 5 HE1 HIS 5 0.902 -7.940 -16.373
30 H SER 6 H SER 6 -1.384 -3.914 -11.621
31 HA SER 6 HA SER 6 -2.405 -3.670 -14.237
32 HB2 SER 6 2HB SER 6 -3.547 -3.030 -11.521
33 HB3 SER 6 3HB SER 6 -4.464 -2.757 -13.002
34 HG SER 6 HG SER 6 -3.708 -5.119 -13.365
35 H ALA 7 H ALA 7 -2.104 -1.185 -11.693
36 HA ALA 7 HA ALA 7 -2.848 1.019 -13.178
37 HB1 ALA 7 1HB ALA 7 -2.579 1.800 -11.108
38 HB2 ALA 7 2HB ALA 7 -1.405 0.548 -10.700
39 HB3 ALA 7 3HB ALA 7 -0.879 2.014 -11.527
40 H CYS 8 H CYS 8 0.419 -0.330 -12.773
41 HA CYS 8 HA CYS 8 1.740 1.565 -14.382
42 HB2 CYS 8 2HB CYS 8 2.493 -1.301 -13.769
43 HB3 CYS 8 3HB CYS 8 3.571 -0.101 -14.477
44 H ALA 9 H ALA 9 0.485 -1.673 -15.139
45 HA ALA 9 HA ALA 9 1.291 -1.893 -17.767
46 HB1 ALA 9 1HB ALA 9 -1.230 -2.870 -16.441
47 HB2 ALA 9 2HB ALA 9 -0.740 -3.333 -18.071
48 HB3 ALA 9 3HB ALA 9 0.275 -3.756 -16.692
49 H VAL 10 H VAL 10 -1.697 -0.405 -16.535
50 HA VAL 10 HA VAL 10 -2.648 0.384 -19.095
51 HB VAL 10 HB VAL 10 -3.368 1.476 -16.371
52 HG11 VAL 10 1HG1 VAL 10 -5.558 1.935 -17.763
53 HG12 VAL 10 2HG1 VAL 10 -4.221 3.088 -17.756
54 HG13 VAL 10 3HG1 VAL 10 -4.420 1.974 -19.110
55 HG21 VAL 10 3HG2 VAL 10 -4.824 -0.575 -18.031
56 HG22 VAL 10 1HG2 VAL 10 -3.738 -0.971 -16.699
57 HG23 VAL 10 2HG2 VAL 10 -5.211 -0.052 -16.392
58 H ARG 11 H ARG 11 -1.020 2.154 -16.473
59 HA ARG 11 HA ARG 11 -0.971 4.664 -17.700
60 HB2 ARG 11 2HB ARG 11 -0.431 4.226 -15.312
61 HB3 ARG 11 3HB ARG 11 1.095 3.513 -15.818
62 HG2 ARG 11 2HG ARG 11 1.886 5.602 -16.645
63 HG3 ARG 11 3HG ARG 11 0.301 6.348 -16.427
64 HD2 ARG 11 2HD ARG 11 1.408 7.102 -14.558
65 HD3 ARG 11 3HD ARG 11 0.638 5.643 -13.934
66 HE ARG 11 HE ARG 11 2.711 4.735 -13.622
67 HH11 ARG 11 1HH1 ARG 11 2.979 7.431 -15.808
68 HH12 ARG 11 2HH1 ARG 11 4.711 7.399 -15.842
69 HH21 ARG 11 1HH2 ARG 11 4.991 4.683 -13.658
70 HH22 ARG 11 2HH2 ARG 11 5.854 5.835 -14.619
71 H CYS 12 H CYS 12 0.837 1.814 -18.353
72 HA CYS 12 HA CYS 12 2.962 3.207 -19.752
73 HB2 CYS 12 2HB CYS 12 2.344 0.313 -19.215
74 HB3 CYS 12 3HB CYS 12 3.582 0.775 -20.379
75 H LEU 13 H LEU 13 0.345 0.945 -20.595
76 HA LEU 13 HA LEU 13 0.750 1.020 -23.374
77 HB2 LEU 13 2HB LEU 13 -1.065 -0.318 -23.514
78 HB3 LEU 13 3HB LEU 13 -0.767 -0.476 -21.784
79 HG LEU 13 HG LEU 13 -2.453 1.573 -21.689
80 HD11 LEU 13 1HD1 LEU 13 -3.454 2.040 -23.608
81 HD12 LEU 13 2HD1 LEU 13 -4.128 0.411 -23.630
82 HD13 LEU 13 3HD1 LEU 13 -2.584 0.737 -24.418
83 HD21 LEU 13 3HD2 LEU 13 -3.809 0.088 -20.704
84 HD22 LEU 13 1HD2 LEU 13 -2.538 -1.082 -21.056
85 HD23 LEU 13 2HD2 LEU 13 -3.913 -0.920 -22.148
86 H ALA 14 H ALA 14 -0.809 3.219 -21.203
87 HA ALA 14 HA ALA 14 -2.285 4.608 -23.254
88 HB1 ALA 14 1HB ALA 14 -2.740 4.396 -20.659
89 HB2 ALA 14 2HB ALA 14 -1.760 5.862 -20.613
90 HB3 ALA 14 3HB ALA 14 -3.239 5.819 -21.573
91 H GLN 15 H GLN 15 0.871 4.765 -21.867
92 HA GLN 15 HA GLN 15 1.355 7.448 -22.905
93 HB2 GLN 15 2HB GLN 15 2.526 5.776 -20.847
94 HB3 GLN 15 3HB GLN 15 3.760 6.423 -21.920
95 HG2 GLN 15 2HG GLN 15 2.694 8.691 -21.540
96 HG3 GLN 15 3HG GLN 15 1.788 7.929 -20.234
97 HE21 GLN 15 1HE2 GLN 15 2.806 7.420 -18.346
98 HE22 GLN 15 2HE2 GLN 15 4.429 7.887 -17.983
99 H ARG 16 H ARG 16 0.984 4.851 -24.502
100 HA ARG 16 HA ARG 16 1.756 3.999 -26.465
101 HB2 ARG 16 2HB ARG 16 3.665 6.336 -26.537
102 HB3 ARG 16 3HB ARG 16 3.076 5.391 -27.899
103 HG2 ARG 16 2HG ARG 16 0.832 6.266 -27.556
104 HG3 ARG 16 3HG ARG 16 1.396 7.188 -26.162
105 HD2 ARG 16 2HD ARG 16 3.053 8.279 -27.755
106 HD3 ARG 16 3HD ARG 16 2.108 7.559 -29.058
107 HE ARG 16 HE ARG 16 0.318 8.914 -27.443
108 HH11 ARG 16 1HH1 ARG 16 3.093 9.677 -29.401
109 HH12 ARG 16 2HH1 ARG 16 2.550 11.279 -29.778
110 HH21 ARG 16 1HH2 ARG 16 -0.408 11.020 -27.931
111 HH22 ARG 16 2HH2 ARG 16 0.559 12.042 -28.940
112 H ARG 17 H ARG 17 2.734 2.713 -24.368
113 HA ARG 17 HA ARG 17 5.526 2.184 -25.121
114 HB2 ARG 17 2HB ARG 17 4.518 2.065 -22.278
115 HB3 ARG 17 3HB ARG 17 6.178 1.906 -22.834
116 HG2 ARG 17 2HG ARG 17 4.508 4.405 -23.017
117 HG3 ARG 17 3HG ARG 17 5.752 4.083 -21.808
118 HD2 ARG 17 2HD ARG 17 6.976 3.604 -24.271
119 HD3 ARG 17 3HD ARG 17 6.018 5.065 -24.508
120 HE ARG 17 HE ARG 17 7.433 6.192 -23.093
121 HH11 ARG 17 1HH1 ARG 17 8.012 2.768 -22.839
122 HH12 ARG 17 2HH1 ARG 17 9.447 2.949 -21.886
123 HH21 ARG 17 1HH2 ARG 17 9.321 6.443 -21.837
124 HH22 ARG 17 2HH2 ARG 17 10.190 5.040 -21.315
125 H LYS 18 H LYS 18 2.688 0.975 -25.470
126 HA LYS 18 HA LYS 18 1.721 -1.087 -25.563
127 HB2 LYS 18 2HB LYS 18 4.558 -2.119 -25.606
128 HB3 LYS 18 3HB LYS 18 3.132 -2.878 -26.302
129 HG2 LYS 18 2HG LYS 18 2.993 -0.753 -27.758
130 HG3 LYS 18 3HG LYS 18 4.673 -0.509 -27.277
131 HD2 LYS 18 2HD LYS 18 4.870 -3.045 -28.007
132 HD3 LYS 18 3HD LYS 18 3.467 -2.622 -28.991
133 HE2 LYS 18 2HE LYS 18 4.813 -0.651 -29.825
134 HE3 LYS 18 3HE LYS 18 6.211 -1.384 -29.039
135 HZ1 LYS 18 3HZ LYS 18 5.218 -3.434 -30.469
136 HZ2 LYS 18 1HZ LYS 18 6.468 -2.418 -30.987
137 HZ3 LYS 18 2HZ LYS 18 4.879 -2.125 -31.486
138 H GLY 19 H GLY 19 2.337 -0.010 -22.908
139 HA2 GLY 19 2HA GLY 19 1.824 -0.810 -20.786
140 HA3 GLY 19 3HA GLY 19 1.883 -2.449 -21.420
141 H GLY 20 H GLY 20 2.950 -2.298 -19.061
142 HA2 GLY 20 2HA GLY 20 5.820 -2.533 -19.582
143 HA3 GLY 20 3HA GLY 20 5.316 -1.434 -18.307
144 H LYS 21 H LYS 21 6.398 -2.636 -16.724
145 HA LYS 21 HA LYS 21 4.838 -4.784 -15.620
146 HB2 LYS 21 2HB LYS 21 6.805 -6.355 -15.501
147 HB3 LYS 21 3HB LYS 21 6.107 -6.150 -17.102
148 HG2 LYS 21 2HG LYS 21 8.198 -4.229 -16.685
149 HG3 LYS 21 3HG LYS 21 8.784 -5.860 -16.352
150 HD2 LYS 21 2HD LYS 21 7.303 -5.058 -18.855
151 HD3 LYS 21 3HD LYS 21 9.061 -5.152 -18.724
152 HE2 LYS 21 2HE LYS 21 8.975 -7.326 -19.165
153 HE3 LYS 21 3HE LYS 21 7.985 -7.579 -17.728
154 HZ1 LYS 21 3HZ LYS 21 6.514 -8.307 -19.247
155 HZ2 LYS 21 1HZ LYS 21 7.195 -7.424 -20.518
156 HZ3 LYS 21 2HZ LYS 21 6.157 -6.663 -19.421
157 H CYS 22 H CYS 22 5.665 -5.476 -13.493
158 HA CYS 22 HA CYS 22 6.700 -3.197 -12.051
159 HB2 CYS 22 2HB CYS 22 4.884 -5.101 -11.403
160 HB3 CYS 22 3HB CYS 22 6.320 -5.759 -10.624
161 H LYS 23 H LYS 23 8.683 -2.961 -11.180
162 HA LYS 23 HA LYS 23 10.593 -5.175 -11.557
163 HB2 LYS 23 2HB LYS 23 11.157 -3.374 -13.048
164 HB3 LYS 23 3HB LYS 23 11.024 -2.192 -11.753
165 HG2 LYS 23 2HG LYS 23 13.038 -2.787 -10.816
166 HG3 LYS 23 3HG LYS 23 13.003 -4.409 -11.512
167 HD2 LYS 23 2HD LYS 23 13.342 -3.396 -13.754
168 HD3 LYS 23 3HD LYS 23 13.506 -1.819 -12.978
169 HE2 LYS 23 2HE LYS 23 15.386 -2.799 -11.627
170 HE3 LYS 23 3HE LYS 23 15.289 -4.226 -12.658
171 HZ1 LYS 23 3HZ LYS 23 16.034 -3.060 -14.488
172 HZ2 LYS 23 1HZ LYS 23 16.951 -2.372 -13.244
173 HZ3 LYS 23 2HZ LYS 23 15.604 -1.552 -13.853
174 H ASN 24 H ASN 24 10.166 -5.991 -9.461
175 HA ASN 24 HA ASN 24 10.422 -6.193 -7.206
176 HB2 ASN 24 2HB ASN 24 12.844 -5.568 -8.259
177 HB3 ASN 24 3HB ASN 24 12.658 -4.263 -7.091
178 HD21 ASN 24 1HD2 ASN 24 11.299 -5.515 -5.077
179 HD22 ASN 24 2HD2 ASN 24 12.293 -6.746 -4.383
180 H GLY 25 H GLY 25 8.538 -4.257 -7.969
181 HA2 GLY 25 2HA GLY 25 7.268 -3.001 -6.326
182 HA3 GLY 25 3HA GLY 25 8.791 -2.380 -5.707
183 H ASP 26 H ASP 26 9.791 -1.972 -8.490
184 HA ASP 26 HA ASP 26 8.698 0.683 -8.826
185 HB2 ASP 26 2HB ASP 26 10.979 -0.833 -10.064
186 HB3 ASP 26 3HB ASP 26 10.423 0.683 -10.769
187 H CYS 27 H CYS 27 8.562 1.328 -11.328
188 HA CYS 27 HA CYS 27 6.892 -0.669 -12.695
189 HB2 CYS 27 2HB CYS 27 6.173 2.067 -11.827
190 HB3 CYS 27 3HB CYS 27 5.682 1.628 -13.459
191 H VAL 28 H VAL 28 8.089 -1.187 -14.418
192 HA VAL 28 HA VAL 28 9.454 0.953 -15.898
193 HB VAL 28 HB VAL 28 9.813 -2.030 -16.202
194 HG11 VAL 28 1HG1 VAL 28 10.459 -0.831 -18.184
195 HG12 VAL 28 2HG1 VAL 28 11.390 0.326 -17.230
196 HG13 VAL 28 3HG1 VAL 28 11.914 -1.355 -17.337
197 HG21 VAL 28 3HG2 VAL 28 10.469 -1.303 -13.961
198 HG22 VAL 28 1HG2 VAL 28 11.875 -1.760 -14.922
199 HG23 VAL 28 2HG2 VAL 28 11.500 -0.056 -14.663
200 H CYS 29 H CYS 29 8.922 1.462 -17.950
201 HA CYS 29 HA CYS 29 6.636 0.035 -19.125
202 HB2 CYS 29 2HB CYS 29 7.622 2.867 -19.378
203 HB3 CYS 29 3HB CYS 29 6.509 2.178 -20.556
204 H ARG 30 H ARG 30 6.996 -1.224 -20.820
205 HA ARG 30 HA ARG 30 9.215 -0.570 -22.633
206 HB2 ARG 30 2HB ARG 30 9.771 -2.954 -22.818
207 HB3 ARG 30 3HB ARG 30 9.971 -2.372 -21.170
208 HG2 ARG 30 2HG ARG 30 8.786 -4.150 -20.560
209 HG3 ARG 30 3HG ARG 30 7.381 -3.288 -21.189
210 HD2 ARG 30 2HD ARG 30 8.424 -4.386 -23.457
211 HD3 ARG 30 3HD ARG 30 8.801 -5.620 -22.255
212 HE ARG 30 HE ARG 30 6.194 -5.061 -21.783
213 HH11 ARG 30 1HH1 ARG 30 7.986 -5.938 -24.636
214 HH12 ARG 30 2HH1 ARG 30 6.652 -6.751 -25.383
215 HH21 ARG 30 1HH2 ARG 30 4.429 -6.129 -22.757
216 HH22 ARG 30 2HH2 ARG 30 4.628 -6.859 -24.314
Start of MODEL 3
1 H1 PHE 1 H PHE 1 2.678 -4.034 1.177
2 HA PHE 1 HA PHE 1 1.223 -2.410 -0.521
3 HB2 PHE 1 2HB PHE 1 4.001 -1.322 -0.019
4 HB3 PHE 1 3HB PHE 1 2.923 -0.791 -1.305
5 HD1 PHE 1 HD2 PHE 1 3.482 -0.819 2.326
6 HD2 PHE 1 HD1 PHE 1 1.105 0.686 -0.869
7 HE1 PHE 1 HE2 PHE 1 2.487 0.837 3.850
8 HE2 PHE 1 HE1 PHE 1 0.108 2.345 0.650
9 HZ PHE 1 HZ PHE 1 0.798 2.421 3.013
10 H SER 2 H SER 2 2.051 -2.457 -2.794
11 HA SER 2 HA SER 2 4.225 -4.148 -3.492
12 HB2 SER 2 2HB SER 2 2.006 -5.574 -2.701
13 HB3 SER 2 3HB SER 2 1.801 -5.494 -4.451
14 HG SER 2 HG SER 2 3.664 -6.574 -4.735
15 H CYS 3 H CYS 3 4.868 -3.603 -5.474
16 HA CYS 3 HA CYS 3 3.612 -1.619 -6.977
17 HB2 CYS 3 2HB CYS 3 6.054 -2.415 -7.056
18 HB3 CYS 3 3HB CYS 3 5.486 -3.651 -8.173
19 H ASP 4 H ASP 4 1.542 -1.947 -7.606
20 HA ASP 4 HA ASP 4 0.514 -4.392 -8.581
21 HB2 ASP 4 2HB ASP 4 -0.502 -1.826 -7.946
22 HB3 ASP 4 3HB ASP 4 -0.980 -2.169 -9.607
23 H HIS 5 H HIS 5 0.602 -5.300 -10.531
24 HA HIS 5 HA HIS 5 2.182 -4.145 -12.601
25 HB2 HIS 5 2HB HIS 5 0.659 -6.678 -12.231
26 HB3 HIS 5 3HB HIS 5 1.065 -6.202 -13.877
27 HD1 HIS 5 HD1 HIS 5 3.007 -7.583 -14.534
28 HD2 HIS 5 HD2 HIS 5 3.378 -6.139 -10.656
29 HE1 HIS 5 HE1 HIS 5 5.282 -8.320 -13.757
30 H SER 6 H SER 6 -1.208 -4.215 -11.878
31 HA SER 6 HA SER 6 -2.201 -3.654 -14.467
32 HB2 SER 6 2HB SER 6 -3.275 -3.488 -11.690
33 HB3 SER 6 3HB SER 6 -4.133 -2.613 -12.957
34 HG SER 6 HG SER 6 -4.921 -4.741 -12.727
35 H ALA 7 H ALA 7 -1.664 -1.505 -11.672
36 HA ALA 7 HA ALA 7 -2.313 0.904 -12.850
37 HB1 ALA 7 1HB ALA 7 -0.251 1.621 -11.214
38 HB2 ALA 7 2HB ALA 7 -1.914 1.347 -10.692
39 HB3 ALA 7 3HB ALA 7 -0.720 0.057 -10.547
40 H CYS 8 H CYS 8 0.894 -0.643 -12.730
41 HA CYS 8 HA CYS 8 2.230 1.331 -14.231
42 HB2 CYS 8 2HB CYS 8 3.252 -0.507 -12.780
43 HB3 CYS 8 3HB CYS 8 3.001 -1.583 -14.151
44 H ALA 9 H ALA 9 0.785 -1.769 -15.189
45 HA ALA 9 HA ALA 9 1.487 -1.823 -17.855
46 HB1 ALA 9 1HB ALA 9 -0.970 -2.805 -16.434
47 HB2 ALA 9 2HB ALA 9 -0.720 -3.066 -18.161
48 HB3 ALA 9 3HB ALA 9 0.425 -3.728 -16.995
49 H VAL 10 H VAL 10 -1.367 -0.277 -16.397
50 HA VAL 10 HA VAL 10 -2.361 0.760 -18.849
51 HB VAL 10 HB VAL 10 -2.923 1.694 -16.031
52 HG11 VAL 10 1HG1 VAL 10 -5.118 2.397 -17.207
53 HG12 VAL 10 2HG1 VAL 10 -3.689 3.418 -17.383
54 HG13 VAL 10 3HG1 VAL 10 -4.159 2.323 -18.684
55 HG21 VAL 10 3HG2 VAL 10 -4.806 0.235 -16.037
56 HG22 VAL 10 1HG2 VAL 10 -4.560 -0.174 -17.735
57 HG23 VAL 10 2HG2 VAL 10 -3.406 -0.723 -16.520
58 H ARG 11 H ARG 11 -0.546 2.227 -16.165
59 HA ARG 11 HA ARG 11 -0.397 4.820 -17.196
60 HB2 ARG 11 2HB ARG 11 0.196 4.191 -14.874
61 HB3 ARG 11 3HB ARG 11 1.647 3.402 -15.478
62 HG2 ARG 11 2HG ARG 11 2.752 5.314 -15.390
63 HG3 ARG 11 3HG ARG 11 1.580 6.069 -16.472
64 HD2 ARG 11 2HD ARG 11 0.810 5.721 -13.628
65 HD3 ARG 11 3HD ARG 11 2.015 6.951 -14.002
66 HE ARG 11 HE ARG 11 -0.296 7.113 -15.683
67 HH11 ARG 11 1HH1 ARG 11 1.018 7.990 -12.580
68 HH12 ARG 11 2HH1 ARG 11 -0.024 9.360 -12.380
69 HH21 ARG 11 1HH2 ARG 11 -1.673 8.914 -15.431
70 HH22 ARG 11 2HH2 ARG 11 -1.554 9.884 -14.002
71 H CYS 12 H CYS 12 1.223 1.938 -18.136
72 HA CYS 12 HA CYS 12 3.375 3.321 -19.505
73 HB2 CYS 12 2HB CYS 12 2.614 0.431 -19.166
74 HB3 CYS 12 3HB CYS 12 3.833 0.915 -20.340
75 H LEU 13 H LEU 13 0.607 1.275 -20.416
76 HA LEU 13 HA LEU 13 0.920 1.546 -23.195
77 HB2 LEU 13 2HB LEU 13 -0.971 0.322 -23.366
78 HB3 LEU 13 3HB LEU 13 -0.623 0.013 -21.667
79 HG LEU 13 HG LEU 13 -2.187 2.135 -21.350
80 HD11 LEU 13 1HD1 LEU 13 -3.225 2.804 -23.189
81 HD12 LEU 13 2HD1 LEU 13 -3.991 1.221 -23.308
82 HD13 LEU 13 3HD1 LEU 13 -2.459 1.523 -24.128
83 HD21 LEU 13 3HD2 LEU 13 -3.593 0.652 -20.433
84 HD22 LEU 13 1HD2 LEU 13 -2.399 -0.552 -20.917
85 HD23 LEU 13 2HD2 LEU 13 -3.798 -0.235 -21.943
86 H ALA 14 H ALA 14 -0.437 3.648 -20.803
87 HA ALA 14 HA ALA 14 -1.903 5.271 -22.684
88 HB1 ALA 14 1HB ALA 14 -2.523 6.607 -20.837
89 HB2 ALA 14 2HB ALA 14 -2.523 4.941 -20.257
90 HB3 ALA 14 3HB ALA 14 -1.180 6.013 -19.861
91 H GLN 15 H GLN 15 1.303 5.149 -21.411
92 HA GLN 15 HA GLN 15 1.901 7.876 -22.259
93 HB2 GLN 15 2HB GLN 15 3.046 5.988 -20.381
94 HB3 GLN 15 3HB GLN 15 4.277 6.651 -21.447
95 HG2 GLN 15 2HG GLN 15 3.352 8.936 -20.855
96 HG3 GLN 15 3HG GLN 15 2.450 8.122 -19.578
97 HE21 GLN 15 1HE2 GLN 15 4.264 6.265 -18.722
98 HE22 GLN 15 2HE2 GLN 15 5.627 7.061 -18.020
99 H ARG 16 H ARG 16 1.331 5.435 -24.034
100 HA ARG 16 HA ARG 16 1.987 4.699 -26.084
101 HB2 ARG 16 2HB ARG 16 4.026 6.924 -26.056
102 HB3 ARG 16 3HB ARG 16 3.325 6.128 -27.459
103 HG2 ARG 16 2HG ARG 16 1.094 7.078 -26.282
104 HG3 ARG 16 3HG ARG 16 2.266 8.301 -25.788
105 HD2 ARG 16 2HD ARG 16 1.814 9.230 -27.780
106 HD3 ARG 16 3HD ARG 16 2.891 7.987 -28.415
107 HE ARG 16 HE ARG 16 0.144 7.157 -28.202
108 HH11 ARG 16 1HH1 ARG 16 2.527 8.723 -30.201
109 HH12 ARG 16 2HH1 ARG 16 1.690 8.394 -31.682
110 HH21 ARG 16 1HH2 ARG 16 -0.966 6.718 -30.146
111 HH22 ARG 16 2HH2 ARG 16 -0.297 7.254 -31.649
112 H ARG 17 H ARG 17 2.961 3.203 -24.130
113 HA ARG 17 HA ARG 17 5.692 2.585 -25.027
114 HB2 ARG 17 2HB ARG 17 4.776 2.297 -22.166
115 HB3 ARG 17 3HB ARG 17 6.406 2.098 -22.796
116 HG2 ARG 17 2HG ARG 17 4.873 4.689 -22.746
117 HG3 ARG 17 3HG ARG 17 6.108 4.209 -21.581
118 HD2 ARG 17 2HD ARG 17 7.323 3.839 -24.043
119 HD3 ARG 17 3HD ARG 17 6.395 5.325 -24.243
120 HE ARG 17 HE ARG 17 7.829 6.380 -22.799
121 HH11 ARG 17 1HH1 ARG 17 8.289 2.937 -22.572
122 HH12 ARG 17 2HH1 ARG 17 9.704 3.060 -21.580
123 HH21 ARG 17 1HH2 ARG 17 9.692 6.555 -21.493
124 HH22 ARG 17 2HH2 ARG 17 10.501 5.118 -20.967
125 H LYS 18 H LYS 18 2.781 1.561 -25.360
126 HA LYS 18 HA LYS 18 1.697 -0.432 -25.573
127 HB2 LYS 18 2HB LYS 18 4.178 -0.651 -26.759
128 HB3 LYS 18 3HB LYS 18 4.116 -2.073 -25.726
129 HG2 LYS 18 2HG LYS 18 1.973 -2.702 -26.766
130 HG3 LYS 18 3HG LYS 18 2.116 -1.311 -27.844
131 HD2 LYS 18 2HD LYS 18 4.175 -3.504 -27.650
132 HD3 LYS 18 3HD LYS 18 2.864 -3.490 -28.832
133 HE2 LYS 18 2HE LYS 18 3.803 -1.081 -29.337
134 HE3 LYS 18 3HE LYS 18 5.276 -1.752 -28.638
135 HZ1 LYS 18 3HZ LYS 18 4.110 -2.225 -31.201
136 HZ2 LYS 18 1HZ LYS 18 4.412 -3.672 -30.377
137 HZ3 LYS 18 2HZ LYS 18 5.670 -2.574 -30.649
138 H GLY 19 H GLY 19 2.460 0.398 -22.869
139 HA2 GLY 19 2HA GLY 19 1.977 -0.537 -20.796
140 HA3 GLY 19 3HA GLY 19 1.921 -2.121 -21.555
141 H GLY 20 H GLY 20 3.072 -2.247 -19.249
142 HA2 GLY 20 2HA GLY 20 5.842 -2.789 -19.873
143 HA3 GLY 20 3HA GLY 20 5.612 -1.503 -18.697
144 H LYS 21 H LYS 21 6.540 -2.600 -16.990
145 HA LYS 21 HA LYS 21 4.811 -4.456 -15.636
146 HB2 LYS 21 2HB LYS 21 6.618 -6.184 -15.363
147 HB3 LYS 21 3HB LYS 21 5.930 -6.081 -16.978
148 HG2 LYS 21 2HG LYS 21 8.285 -4.393 -16.565
149 HG3 LYS 21 3HG LYS 21 8.586 -6.125 -16.410
150 HD2 LYS 21 2HD LYS 21 7.011 -5.080 -18.729
151 HD3 LYS 21 3HD LYS 21 8.774 -4.982 -18.743
152 HE2 LYS 21 2HE LYS 21 7.166 -7.502 -18.335
153 HE3 LYS 21 3HE LYS 21 7.929 -7.016 -19.848
154 HZ1 LYS 21 3HZ LYS 21 9.123 -8.120 -17.441
155 HZ2 LYS 21 1HZ LYS 21 10.003 -6.889 -18.196
156 HZ3 LYS 21 2HZ LYS 21 9.593 -8.285 -19.057
157 H CYS 22 H CYS 22 5.748 -5.084 -13.476
158 HA CYS 22 HA CYS 22 7.220 -2.787 -12.392
159 HB2 CYS 22 2HB CYS 22 5.007 -4.423 -11.440
160 HB3 CYS 22 3HB CYS 22 6.290 -4.286 -10.243
161 H LYS 23 H LYS 23 9.118 -3.014 -11.321
162 HA LYS 23 HA LYS 23 10.166 -5.742 -10.964
163 HB2 LYS 23 2HB LYS 23 11.253 -3.528 -12.547
164 HB3 LYS 23 3HB LYS 23 12.415 -4.223 -11.425
165 HG2 LYS 23 2HG LYS 23 12.417 -6.266 -12.477
166 HG3 LYS 23 3HG LYS 23 10.810 -6.032 -13.167
167 HD2 LYS 23 2HD LYS 23 11.630 -5.061 -15.011
168 HD3 LYS 23 3HD LYS 23 12.751 -4.059 -14.086
169 HE2 LYS 23 2HE LYS 23 14.248 -6.016 -13.861
170 HE3 LYS 23 3HE LYS 23 13.146 -6.943 -14.878
171 HZ1 LYS 23 3HZ LYS 23 14.710 -4.547 -15.661
172 HZ2 LYS 23 1HZ LYS 23 13.516 -5.250 -16.632
173 HZ3 LYS 23 2HZ LYS 23 14.906 -6.127 -16.232
174 H ASN 24 H ASN 24 9.791 -5.770 -8.763
175 HA ASN 24 HA ASN 24 10.110 -5.333 -6.551
176 HB2 ASN 24 2HB ASN 24 12.769 -4.347 -7.607
177 HB3 ASN 24 3HB ASN 24 12.419 -4.678 -5.913
178 HD21 ASN 24 1HD2 ASN 24 14.477 -5.976 -6.865
179 HD22 ASN 24 2HD2 ASN 24 14.115 -7.635 -7.186
180 H GLY 25 H GLY 25 8.794 -3.278 -8.101
181 HA2 GLY 25 2HA GLY 25 7.844 -1.337 -6.979
182 HA3 GLY 25 3HA GLY 25 9.459 -0.961 -6.396
183 H ASP 26 H ASP 26 10.767 -1.478 -8.927
184 HA ASP 26 HA ASP 26 10.396 1.102 -10.109
185 HB2 ASP 26 2HB ASP 26 12.149 -1.253 -10.806
186 HB3 ASP 26 3HB ASP 26 12.125 0.225 -11.764
187 H CYS 27 H CYS 27 8.701 1.515 -11.365
188 HA CYS 27 HA CYS 27 7.401 -0.551 -12.896
189 HB2 CYS 27 2HB CYS 27 6.009 1.133 -11.884
190 HB3 CYS 27 3HB CYS 27 6.917 2.423 -12.664
191 H VAL 28 H VAL 28 8.643 -1.263 -14.557
192 HA VAL 28 HA VAL 28 9.991 0.633 -16.301
193 HB VAL 28 HB VAL 28 9.860 -2.372 -16.571
194 HG11 VAL 28 1HG1 VAL 28 10.687 -1.720 -18.586
195 HG12 VAL 28 2HG1 VAL 28 11.321 -0.197 -17.960
196 HG13 VAL 28 3HG1 VAL 28 12.190 -1.703 -17.664
197 HG21 VAL 28 3HG2 VAL 28 12.373 -1.737 -15.638
198 HG22 VAL 28 1HG2 VAL 28 11.314 -0.691 -14.692
199 HG23 VAL 28 2HG2 VAL 28 11.062 -2.436 -14.687
200 H CYS 29 H CYS 29 9.390 1.153 -18.339
201 HA CYS 29 HA CYS 29 6.879 -0.028 -19.332
202 HB2 CYS 29 2HB CYS 29 7.947 2.782 -19.492
203 HB3 CYS 29 3HB CYS 29 6.711 2.206 -20.606
204 H ARG 30 H ARG 30 7.064 -1.194 -21.117
205 HA ARG 30 HA ARG 30 9.476 -1.465 -22.547
206 HB2 ARG 30 2HB ARG 30 6.704 -2.225 -23.483
207 HB3 ARG 30 3HB ARG 30 8.229 -2.882 -24.062
208 HG2 ARG 30 2HG ARG 30 8.443 -3.438 -21.437
209 HG3 ARG 30 3HG ARG 30 6.691 -3.515 -21.637
210 HD2 ARG 30 2HD ARG 30 8.640 -4.969 -23.414
211 HD3 ARG 30 3HD ARG 30 7.913 -5.686 -21.977
212 HE ARG 30 HE ARG 30 5.933 -4.631 -23.722
213 HH11 ARG 30 1HH1 ARG 30 8.090 -7.326 -23.276
214 HH12 ARG 30 2HH1 ARG 30 7.099 -8.435 -24.165
215 HH21 ARG 30 1HH2 ARG 30 4.619 -6.080 -24.895
216 HH22 ARG 30 2HH2 ARG 30 5.125 -7.725 -25.086
Start of MODEL 4
1 H1 PHE 1 H PHE 1 2.330 -0.088 0.728
2 HA PHE 1 HA PHE 1 0.940 0.438 -1.791
3 HB2 PHE 1 2HB PHE 1 3.784 0.932 -0.900
4 HB3 PHE 1 3HB PHE 1 3.224 1.211 -2.546
5 HD1 PHE 1 HD1 PHE 1 0.668 2.462 -2.260
6 HD2 PHE 1 HD2 PHE 1 4.169 2.956 0.111
7 HE1 PHE 1 HE1 PHE 1 -0.086 4.715 -1.622
8 HE2 PHE 1 HE2 PHE 1 3.419 5.209 0.754
9 HZ PHE 1 HZ PHE 1 1.289 6.092 -0.112
10 H SER 2 H SER 2 1.392 -0.663 -3.695
11 HA SER 2 HA SER 2 3.295 -2.827 -3.743
12 HB2 SER 2 2HB SER 2 0.334 -3.349 -3.592
13 HB3 SER 2 3HB SER 2 1.418 -4.482 -4.399
14 HG SER 2 HG SER 2 1.997 -5.176 -2.514
15 H CYS 3 H CYS 3 4.141 -2.824 -5.708
16 HA CYS 3 HA CYS 3 3.005 -1.329 -7.844
17 HB2 CYS 3 2HB CYS 3 5.409 -1.505 -7.643
18 HB3 CYS 3 3HB CYS 3 5.331 -3.259 -7.773
19 H ASP 4 H ASP 4 1.023 -2.150 -8.428
20 HA ASP 4 HA ASP 4 0.682 -4.947 -9.036
21 HB2 ASP 4 2HB ASP 4 -1.024 -2.703 -8.544
22 HB3 ASP 4 3HB ASP 4 -1.471 -3.424 -10.088
23 H HIS 5 H HIS 5 0.549 -5.900 -11.021
24 HA HIS 5 HA HIS 5 1.980 -4.774 -13.157
25 HB2 HIS 5 2HB HIS 5 0.223 -7.183 -12.855
26 HB3 HIS 5 3HB HIS 5 0.779 -6.710 -14.458
27 HD1 HIS 5 HD1 HIS 5 2.454 -8.515 -14.914
28 HD2 HIS 5 HD2 HIS 5 3.037 -6.700 -11.222
29 HE1 HIS 5 HE1 HIS 5 4.632 -9.429 -14.051
30 H SER 6 H SER 6 -1.374 -4.629 -12.294
31 HA SER 6 HA SER 6 -2.376 -3.884 -14.853
32 HB2 SER 6 2HB SER 6 -3.640 -3.196 -12.199
33 HB3 SER 6 3HB SER 6 -4.440 -3.447 -13.751
34 HG SER 6 HG SER 6 -4.574 -5.471 -13.248
35 H ALA 7 H ALA 7 -1.771 -1.985 -11.895
36 HA ALA 7 HA ALA 7 -2.336 0.531 -12.884
37 HB1 ALA 7 1HB ALA 7 -0.024 0.526 -11.111
38 HB2 ALA 7 2HB ALA 7 -1.624 1.235 -10.888
39 HB3 ALA 7 3HB ALA 7 -1.356 -0.470 -10.523
40 H CYS 8 H CYS 8 0.767 -1.201 -12.956
41 HA CYS 8 HA CYS 8 2.201 0.864 -14.260
42 HB2 CYS 8 2HB CYS 8 2.712 -2.102 -14.006
43 HB3 CYS 8 3HB CYS 8 3.840 -0.992 -14.778
44 H ALA 9 H ALA 9 0.629 -2.086 -15.455
45 HA ALA 9 HA ALA 9 1.344 -1.973 -18.116
46 HB1 ALA 9 1HB ALA 9 -1.275 -2.861 -16.916
47 HB2 ALA 9 2HB ALA 9 -0.765 -3.190 -18.572
48 HB3 ALA 9 3HB ALA 9 0.147 -3.859 -17.218
49 H VAL 10 H VAL 10 -1.442 -0.407 -16.552
50 HA VAL 10 HA VAL 10 -2.371 0.857 -18.923
51 HB VAL 10 HB VAL 10 -2.907 1.592 -16.041
52 HG11 VAL 10 1HG1 VAL 10 -5.015 2.567 -17.081
53 HG12 VAL 10 2HG1 VAL 10 -3.514 3.458 -17.339
54 HG13 VAL 10 3HG1 VAL 10 -4.175 2.449 -18.627
55 HG21 VAL 10 3HG2 VAL 10 -3.915 -0.418 -16.042
56 HG22 VAL 10 1HG2 VAL 10 -5.167 0.405 -16.972
57 HG23 VAL 10 2HG2 VAL 10 -3.921 -0.527 -17.802
58 H ARG 11 H ARG 11 -0.506 2.031 -16.130
59 HA ARG 11 HA ARG 11 -0.229 4.684 -16.962
60 HB2 ARG 11 2HB ARG 11 0.336 3.727 -14.693
61 HB3 ARG 11 3HB ARG 11 1.827 3.120 -15.400
62 HG2 ARG 11 2HG ARG 11 2.819 5.099 -15.222
63 HG3 ARG 11 3HG ARG 11 1.447 5.933 -15.956
64 HD2 ARG 11 2HD ARG 11 1.170 4.959 -13.161
65 HD3 ARG 11 3HD ARG 11 2.179 6.376 -13.450
66 HE ARG 11 HE ARG 11 -0.668 6.255 -13.533
67 HH11 ARG 11 1HH1 ARG 11 2.109 7.835 -14.917
68 HH12 ARG 11 2HH1 ARG 11 1.244 9.277 -15.334
69 HH21 ARG 11 1HH2 ARG 11 -1.818 8.149 -14.078
70 HH22 ARG 11 2HH2 ARG 11 -0.990 9.454 -14.856
71 H CYS 12 H CYS 12 1.260 1.807 -18.113
72 HA CYS 12 HA CYS 12 3.483 3.186 -19.367
73 HB2 CYS 12 2HB CYS 12 2.585 0.318 -19.251
74 HB3 CYS 12 3HB CYS 12 3.835 0.832 -20.379
75 H LEU 13 H LEU 13 0.628 1.347 -20.438
76 HA LEU 13 HA LEU 13 0.971 1.811 -23.188
77 HB2 LEU 13 2HB LEU 13 -0.974 0.695 -23.456
78 HB3 LEU 13 3HB LEU 13 -0.652 0.242 -21.784
79 HG LEU 13 HG LEU 13 -2.117 2.406 -21.312
80 HD11 LEU 13 1HD1 LEU 13 -3.949 1.730 -23.337
81 HD12 LEU 13 2HD1 LEU 13 -2.400 2.018 -24.129
82 HD13 LEU 13 3HD1 LEU 13 -3.107 3.262 -23.099
83 HD21 LEU 13 3HD2 LEU 13 -2.459 -0.297 -21.091
84 HD22 LEU 13 1HD2 LEU 13 -3.839 0.174 -22.084
85 HD23 LEU 13 2HD2 LEU 13 -3.590 0.926 -20.508
86 H ALA 14 H ALA 14 -0.301 3.790 -20.648
87 HA ALA 14 HA ALA 14 -1.677 5.617 -22.405
88 HB1 ALA 14 1HB ALA 14 -2.109 6.920 -20.413
89 HB2 ALA 14 2HB ALA 14 -2.444 5.216 -20.099
90 HB3 ALA 14 3HB ALA 14 -0.957 5.948 -19.496
91 H GLN 15 H GLN 15 1.512 5.248 -21.138
92 HA GLN 15 HA GLN 15 2.243 7.999 -21.775
93 HB2 GLN 15 2HB GLN 15 3.286 5.923 -20.043
94 HB3 GLN 15 3HB GLN 15 4.553 6.605 -21.053
95 HG2 GLN 15 2HG GLN 15 3.739 8.879 -20.292
96 HG3 GLN 15 3HG GLN 15 2.787 8.018 -19.084
97 HE21 GLN 15 1HE2 GLN 15 3.803 7.063 -17.358
98 HE22 GLN 15 2HE2 GLN 15 5.467 7.328 -16.981
99 H ARG 16 H ARG 16 1.569 5.729 -23.731
100 HA ARG 16 HA ARG 16 2.201 5.120 -25.829
101 HB2 ARG 16 2HB ARG 16 4.364 7.213 -25.658
102 HB3 ARG 16 3HB ARG 16 3.569 6.594 -27.099
103 HG2 ARG 16 2HG ARG 16 2.238 8.241 -24.958
104 HG3 ARG 16 3HG ARG 16 2.828 8.855 -26.504
105 HD2 ARG 16 2HD ARG 16 0.933 8.258 -27.494
106 HD3 ARG 16 3HD ARG 16 1.168 6.587 -26.983
107 HE ARG 16 HE ARG 16 0.163 8.079 -24.825
108 HH11 ARG 16 1HH1 ARG 16 -0.825 6.832 -27.922
109 HH12 ARG 16 2HH1 ARG 16 -2.495 6.695 -27.480
110 HH21 ARG 16 1HH2 ARG 16 -2.032 7.904 -24.232
111 HH22 ARG 16 2HH2 ARG 16 -3.180 7.306 -25.381
112 H ARG 17 H ARG 17 3.093 3.436 -23.992
113 HA ARG 17 HA ARG 17 5.797 2.760 -24.928
114 HB2 ARG 17 2HB ARG 17 4.848 2.313 -22.097
115 HB3 ARG 17 3HB ARG 17 6.468 2.062 -22.735
116 HG2 ARG 17 2HG ARG 17 5.109 4.742 -22.568
117 HG3 ARG 17 3HG ARG 17 6.226 4.108 -21.358
118 HD2 ARG 17 2HD ARG 17 7.638 3.768 -23.671
119 HD3 ARG 17 3HD ARG 17 6.757 5.260 -23.997
120 HE ARG 17 HE ARG 17 7.776 5.689 -21.536
121 HH11 ARG 17 1HH1 ARG 17 9.184 4.631 -24.539
122 HH12 ARG 17 2HH1 ARG 17 10.736 5.326 -24.207
123 HH21 ARG 17 1HH2 ARG 17 9.815 6.608 -21.087
124 HH22 ARG 17 2HH2 ARG 17 11.094 6.449 -22.242
125 H LYS 18 H LYS 18 2.843 1.902 -25.343
126 HA LYS 18 HA LYS 18 1.668 -0.016 -25.708
127 HB2 LYS 18 2HB LYS 18 3.811 -0.233 -27.161
128 HB3 LYS 18 3HB LYS 18 4.296 -1.444 -25.983
129 HG2 LYS 18 2HG LYS 18 3.294 -2.729 -27.602
130 HG3 LYS 18 3HG LYS 18 1.963 -2.476 -26.470
131 HD2 LYS 18 2HD LYS 18 1.538 -0.363 -28.006
132 HD3 LYS 18 3HD LYS 18 2.390 -1.354 -29.193
133 HE2 LYS 18 2HE LYS 18 0.456 -2.953 -27.811
134 HE3 LYS 18 3HE LYS 18 -0.319 -1.497 -28.434
135 HZ1 LYS 18 3HZ LYS 18 1.115 -3.597 -29.939
136 HZ2 LYS 18 1HZ LYS 18 0.849 -2.064 -30.603
137 HZ3 LYS 18 2HZ LYS 18 -0.464 -3.034 -30.160
138 H GLY 19 H GLY 19 2.455 0.572 -22.948
139 HA2 GLY 19 2HA GLY 19 1.915 -0.493 -20.952
140 HA3 GLY 19 3HA GLY 19 1.791 -2.011 -21.828
141 H GLY 20 H GLY 20 2.932 -2.259 -19.482
142 HA2 GLY 20 2HA GLY 20 5.669 -2.934 -20.152
143 HA3 GLY 20 3HA GLY 20 5.502 -1.707 -18.905
144 H LYS 21 H LYS 21 6.445 -3.021 -17.330
145 HA LYS 21 HA LYS 21 4.596 -4.854 -16.072
146 HB2 LYS 21 2HB LYS 21 6.403 -6.629 -15.871
147 HB3 LYS 21 3HB LYS 21 5.646 -6.464 -17.450
148 HG2 LYS 21 2HG LYS 21 7.989 -4.780 -17.194
149 HG3 LYS 21 3HG LYS 21 8.356 -6.483 -16.909
150 HD2 LYS 21 2HD LYS 21 6.781 -6.697 -19.085
151 HD3 LYS 21 3HD LYS 21 7.496 -5.110 -19.378
152 HE2 LYS 21 2HE LYS 21 9.078 -6.418 -20.368
153 HE3 LYS 21 3HE LYS 21 9.715 -6.396 -18.724
154 HZ1 LYS 21 3HZ LYS 21 9.345 -8.628 -20.070
155 HZ2 LYS 21 1HZ LYS 21 7.807 -8.503 -19.375
156 HZ3 LYS 21 2HZ LYS 21 9.180 -8.553 -18.388
157 H CYS 22 H CYS 22 5.350 -5.534 -13.915
158 HA CYS 22 HA CYS 22 6.885 -3.378 -12.677
159 HB2 CYS 22 2HB CYS 22 4.773 -5.246 -11.789
160 HB3 CYS 22 3HB CYS 22 6.001 -4.863 -10.587
161 H LYS 23 H LYS 23 8.655 -3.735 -11.335
162 HA LYS 23 HA LYS 23 9.751 -6.450 -11.239
163 HB2 LYS 23 2HB LYS 23 10.684 -4.949 -13.164
164 HB3 LYS 23 3HB LYS 23 11.573 -4.154 -11.872
165 HG2 LYS 23 2HG LYS 23 13.025 -5.840 -11.675
166 HG3 LYS 23 3HG LYS 23 11.765 -7.069 -11.816
167 HD2 LYS 23 2HD LYS 23 11.922 -7.159 -14.110
168 HD3 LYS 23 3HD LYS 23 12.543 -5.511 -14.238
169 HE2 LYS 23 2HE LYS 23 14.551 -6.637 -12.865
170 HE3 LYS 23 3HE LYS 23 13.971 -8.054 -13.740
171 HZ1 LYS 23 3HZ LYS 23 14.174 -6.747 -15.807
172 HZ2 LYS 23 1HZ LYS 23 15.656 -6.978 -15.025
173 HZ3 LYS 23 2HZ LYS 23 14.871 -5.484 -14.922
174 H ASN 24 H ASN 24 9.425 -6.624 -9.052
175 HA ASN 24 HA ASN 24 9.733 -6.300 -6.818
176 HB2 ASN 24 2HB ASN 24 12.363 -5.332 -7.937
177 HB3 ASN 24 3HB ASN 24 12.065 -5.464 -6.207
178 HD21 ASN 24 1HD2 ASN 24 13.939 -6.936 -6.440
179 HD22 ASN 24 2HD2 ASN 24 13.618 -8.596 -6.799
180 H GLY 25 H GLY 25 8.384 -4.182 -8.270
181 HA2 GLY 25 2HA GLY 25 7.381 -2.327 -7.061
182 HA3 GLY 25 3HA GLY 25 8.975 -1.962 -6.416
183 H ASP 26 H ASP 26 10.370 -2.276 -8.918
184 HA ASP 26 HA ASP 26 9.967 0.358 -9.955
185 HB2 ASP 26 2HB ASP 26 11.685 -1.749 -11.246
186 HB3 ASP 26 3HB ASP 26 11.911 -0.002 -11.237
187 H CYS 27 H CYS 27 8.320 0.821 -11.252
188 HA CYS 27 HA CYS 27 7.098 -1.174 -12.933
189 HB2 CYS 27 2HB CYS 27 6.528 1.648 -12.185
190 HB3 CYS 27 3HB CYS 27 5.870 1.073 -13.714
191 H VAL 28 H VAL 28 8.407 -1.789 -14.582
192 HA VAL 28 HA VAL 28 9.827 0.184 -16.164
193 HB VAL 28 HB VAL 28 9.622 -2.791 -16.640
194 HG11 VAL 28 1HG1 VAL 28 12.078 -1.789 -17.514
195 HG12 VAL 28 2HG1 VAL 28 10.722 -2.318 -18.513
196 HG13 VAL 28 3HG1 VAL 28 10.875 -0.620 -18.058
197 HG21 VAL 28 3HG2 VAL 28 10.572 -2.679 -14.520
198 HG22 VAL 28 1HG2 VAL 28 11.977 -2.705 -15.585
199 HG23 VAL 28 2HG2 VAL 28 11.435 -1.184 -14.877
200 H CYS 29 H CYS 29 9.409 0.721 -18.279
201 HA CYS 29 HA CYS 29 6.874 -0.277 -19.403
202 HB2 CYS 29 2HB CYS 29 7.988 2.524 -19.358
203 HB3 CYS 29 3HB CYS 29 6.739 2.032 -20.498
204 H ARG 30 H ARG 30 7.102 -1.290 -21.276
205 HA ARG 30 HA ARG 30 9.304 -0.499 -23.059
206 HB2 ARG 30 2HB ARG 30 8.459 -3.311 -22.346
207 HB3 ARG 30 3HB ARG 30 9.545 -2.917 -23.671
208 HG2 ARG 30 2HG ARG 30 10.582 -1.627 -21.406
209 HG3 ARG 30 3HG ARG 30 10.123 -3.251 -20.890
210 HD2 ARG 30 2HD ARG 30 11.703 -2.778 -23.398
211 HD3 ARG 30 3HD ARG 30 12.486 -2.907 -21.823
212 HE ARG 30 HE ARG 30 10.732 -5.096 -22.307
213 HH11 ARG 30 1HH1 ARG 30 13.882 -3.826 -23.069
214 HH12 ARG 30 2HH1 ARG 30 14.578 -5.382 -23.378
215 HH21 ARG 30 1HH2 ARG 30 11.637 -7.150 -22.711
216 HH22 ARG 30 2HH2 ARG 30 13.300 -7.272 -23.175
Start of MODEL 5
1 H1 PHE 1 H PHE 1 3.029 -1.005 1.394
2 HA PHE 1 HA PHE 1 1.663 -0.153 -0.422
3 HB2 PHE 1 2HB PHE 1 3.856 1.523 -0.712
4 HB3 PHE 1 3HB PHE 1 3.897 0.531 -2.166
5 HD1 PHE 1 HD1 PHE 1 1.462 2.465 -0.106
6 HD2 PHE 1 HD2 PHE 1 2.695 1.233 -3.990
7 HE1 PHE 1 HE1 PHE 1 -0.296 3.867 -1.105
8 HE2 PHE 1 HE2 PHE 1 0.940 2.634 -4.995
9 HZ PHE 1 HZ PHE 1 -0.558 3.954 -3.553
10 H SER 2 H SER 2 2.115 -0.776 -2.984
11 HA SER 2 HA SER 2 3.659 -3.180 -3.282
12 HB2 SER 2 2HB SER 2 0.773 -3.310 -2.665
13 HB3 SER 2 3HB SER 2 1.291 -4.287 -4.039
14 HG SER 2 HG SER 2 1.551 -5.550 -2.254
15 H CYS 3 H CYS 3 4.424 -3.088 -5.277
16 HA CYS 3 HA CYS 3 3.426 -1.302 -7.232
17 HB2 CYS 3 2HB CYS 3 5.802 -2.027 -7.071
18 HB3 CYS 3 3HB CYS 3 5.320 -3.628 -7.624
19 H ASP 4 H ASP 4 1.310 -1.735 -7.750
20 HA ASP 4 HA ASP 4 0.401 -4.356 -8.454
21 HB2 ASP 4 2HB ASP 4 -0.772 -1.773 -7.987
22 HB3 ASP 4 3HB ASP 4 -1.384 -2.433 -9.502
23 H HIS 5 H HIS 5 0.878 -5.353 -10.286
24 HA HIS 5 HA HIS 5 2.135 -4.198 -12.487
25 HB2 HIS 5 2HB HIS 5 2.219 -6.593 -12.076
26 HB3 HIS 5 3HB HIS 5 0.483 -6.727 -12.339
27 HD1 HIS 5 HD1 HIS 5 3.689 -6.838 -14.081
28 HD2 HIS 5 HD2 HIS 5 -0.291 -6.222 -15.101
29 HE1 HIS 5 HE1 HIS 5 3.575 -7.165 -16.571
30 H SER 6 H SER 6 -1.237 -4.449 -11.682
31 HA SER 6 HA SER 6 -2.293 -3.982 -14.270
32 HB2 SER 6 2HB SER 6 -3.329 -4.492 -11.705
33 HB3 SER 6 3HB SER 6 -3.998 -2.933 -12.188
34 HG SER 6 HG SER 6 -4.341 -4.228 -14.297
35 H ALA 7 H ALA 7 -1.929 -1.789 -11.480
36 HA ALA 7 HA ALA 7 -2.742 0.559 -12.682
37 HB1 ALA 7 1HB ALA 7 -2.410 1.052 -10.525
38 HB2 ALA 7 2HB ALA 7 -1.139 -0.159 -10.346
39 HB3 ALA 7 3HB ALA 7 -0.758 1.428 -11.015
40 H CYS 8 H CYS 8 0.558 -0.769 -12.526
41 HA CYS 8 HA CYS 8 1.777 1.301 -14.004
42 HB2 CYS 8 2HB CYS 8 2.926 -0.431 -12.545
43 HB3 CYS 8 3HB CYS 8 2.728 -1.562 -13.879
44 H ALA 9 H ALA 9 0.553 -1.887 -14.980
45 HA ALA 9 HA ALA 9 1.294 -1.895 -17.637
46 HB1 ALA 9 1HB ALA 9 0.343 -3.862 -16.771
47 HB2 ALA 9 2HB ALA 9 -1.126 -3.028 -16.264
48 HB3 ALA 9 3HB ALA 9 -0.807 -3.288 -17.979
49 H VAL 10 H VAL 10 -1.674 -0.537 -16.219
50 HA VAL 10 HA VAL 10 -2.698 0.434 -18.686
51 HB VAL 10 HB VAL 10 -3.359 1.326 -15.875
52 HG11 VAL 10 1HG1 VAL 10 -5.582 1.877 -17.101
53 HG12 VAL 10 2HG1 VAL 10 -4.227 3.003 -17.214
54 HG13 VAL 10 3HG1 VAL 10 -4.573 1.900 -18.547
55 HG21 VAL 10 3HG2 VAL 10 -4.351 -0.647 -15.635
56 HG22 VAL 10 1HG2 VAL 10 -5.416 -0.241 -16.981
57 HG23 VAL 10 2HG2 VAL 10 -3.911 -1.109 -17.279
58 H ARG 11 H ARG 11 -1.019 2.015 -15.977
59 HA ARG 11 HA ARG 11 -1.024 4.612 -17.008
60 HB2 ARG 11 2HB ARG 11 -0.350 3.780 -14.667
61 HB3 ARG 11 3HB ARG 11 1.239 3.499 -15.367
62 HG2 ARG 11 2HG ARG 11 1.762 5.670 -15.342
63 HG3 ARG 11 3HG ARG 11 0.167 6.158 -15.918
64 HD2 ARG 11 2HD ARG 11 0.057 7.034 -13.825
65 HD3 ARG 11 3HD ARG 11 -0.516 5.407 -13.462
66 HE ARG 11 HE ARG 11 1.399 5.035 -12.262
67 HH11 ARG 11 1HH1 ARG 11 1.814 7.872 -14.238
68 HH12 ARG 11 2HH1 ARG 11 3.322 8.318 -13.510
69 HH21 ARG 11 1HH2 ARG 11 3.384 5.612 -11.297
70 HH22 ARG 11 2HH2 ARG 11 4.214 7.031 -11.838
71 H CYS 12 H CYS 12 0.792 1.841 -17.923
72 HA CYS 12 HA CYS 12 2.869 3.361 -19.263
73 HB2 CYS 12 2HB CYS 12 2.291 0.427 -18.935
74 HB3 CYS 12 3HB CYS 12 3.494 0.991 -20.090
75 H LEU 13 H LEU 13 0.251 1.141 -20.212
76 HA LEU 13 HA LEU 13 0.585 1.433 -22.986
77 HB2 LEU 13 2HB LEU 13 -1.221 0.090 -23.183
78 HB3 LEU 13 3HB LEU 13 -0.878 -0.197 -21.479
79 HG LEU 13 HG LEU 13 -2.580 1.819 -21.185
80 HD11 LEU 13 1HD1 LEU 13 -2.773 1.194 -23.966
81 HD12 LEU 13 2HD1 LEU 13 -3.633 2.422 -23.038
82 HD13 LEU 13 3HD1 LEU 13 -4.293 0.792 -23.167
83 HD21 LEU 13 3HD2 LEU 13 -3.894 0.248 -20.282
84 HD22 LEU 13 1HD2 LEU 13 -2.624 -0.879 -20.760
85 HD23 LEU 13 2HD2 LEU 13 -4.031 -0.644 -21.797
86 H ALA 14 H ALA 14 -0.938 3.442 -20.615
87 HA ALA 14 HA ALA 14 -2.479 4.968 -22.517
88 HB1 ALA 14 1HB ALA 14 -3.371 4.768 -20.311
89 HB2 ALA 14 2HB ALA 14 -1.884 5.389 -19.594
90 HB3 ALA 14 3HB ALA 14 -2.910 6.454 -20.555
91 H GLN 15 H GLN 15 0.710 5.052 -21.200
92 HA GLN 15 HA GLN 15 1.143 7.812 -22.040
93 HB2 GLN 15 2HB GLN 15 2.381 6.000 -20.146
94 HB3 GLN 15 3HB GLN 15 3.582 6.742 -21.197
95 HG2 GLN 15 2HG GLN 15 2.507 8.962 -20.617
96 HG3 GLN 15 3HG GLN 15 1.639 8.093 -19.353
97 HE21 GLN 15 1HE2 GLN 15 2.850 7.109 -17.669
98 HE22 GLN 15 2HE2 GLN 15 4.422 7.695 -17.257
99 H ARG 16 H ARG 16 0.755 5.341 -23.822
100 HA ARG 16 HA ARG 16 1.484 4.650 -25.863
101 HB2 ARG 16 2HB ARG 16 3.382 6.995 -25.817
102 HB3 ARG 16 3HB ARG 16 2.732 6.165 -27.224
103 HG2 ARG 16 2HG ARG 16 0.435 6.955 -26.252
104 HG3 ARG 16 3HG ARG 16 1.436 8.150 -25.426
105 HD2 ARG 16 2HD ARG 16 1.222 7.678 -28.395
106 HD3 ARG 16 3HD ARG 16 0.668 9.090 -27.496
107 HE ARG 16 HE ARG 16 3.404 8.814 -27.044
108 HH11 ARG 16 1HH1 ARG 16 1.234 9.497 -29.679
109 HH12 ARG 16 2HH1 ARG 16 2.381 10.464 -30.545
110 HH21 ARG 16 1HH2 ARG 16 4.924 10.085 -28.175
111 HH22 ARG 16 2HH2 ARG 16 4.480 10.797 -29.689
112 H ARG 17 H ARG 17 2.527 3.219 -23.896
113 HA ARG 17 HA ARG 17 5.304 2.779 -24.757
114 HB2 ARG 17 2HB ARG 17 4.374 2.426 -21.908
115 HB3 ARG 17 3HB ARG 17 6.021 2.342 -22.518
116 HG2 ARG 17 2HG ARG 17 4.322 4.827 -22.519
117 HG3 ARG 17 3HG ARG 17 5.528 4.427 -21.294
118 HD2 ARG 17 2HD ARG 17 6.269 4.496 -24.193
119 HD3 ARG 17 3HD ARG 17 6.176 5.989 -23.260
120 HE ARG 17 HE ARG 17 7.740 4.205 -21.813
121 HH11 ARG 17 1HH1 ARG 17 7.846 5.881 -24.862
122 HH12 ARG 17 2HH1 ARG 17 9.577 5.960 -24.907
123 HH21 ARG 17 1HH2 ARG 17 10.019 4.302 -21.860
124 HH22 ARG 17 2HH2 ARG 17 10.811 5.060 -23.199
125 H LYS 18 H LYS 18 2.469 1.570 -25.128
126 HA LYS 18 HA LYS 18 1.519 -0.490 -25.354
127 HB2 LYS 18 2HB LYS 18 3.726 -0.566 -26.750
128 HB3 LYS 18 3HB LYS 18 4.275 -1.666 -25.492
129 HG2 LYS 18 2HG LYS 18 2.441 -3.171 -25.962
130 HG3 LYS 18 3HG LYS 18 1.796 -2.048 -27.161
131 HD2 LYS 18 2HD LYS 18 2.980 -3.250 -28.638
132 HD3 LYS 18 3HD LYS 18 4.375 -2.370 -28.009
133 HE2 LYS 18 2HE LYS 18 3.486 -4.840 -26.601
134 HE3 LYS 18 3HE LYS 18 4.351 -5.004 -28.129
135 HZ1 LYS 18 3HZ LYS 18 6.218 -4.736 -26.995
136 HZ2 LYS 18 1HZ LYS 18 5.378 -4.408 -25.564
137 HZ3 LYS 18 2HZ LYS 18 5.755 -3.150 -26.630
138 H GLY 19 H GLY 19 2.192 0.387 -22.641
139 HA2 GLY 19 2HA GLY 19 1.742 -0.578 -20.574
140 HA3 GLY 19 3HA GLY 19 1.800 -2.163 -21.333
141 H GLY 20 H GLY 20 2.925 -2.183 -18.998
142 HA2 GLY 20 2HA GLY 20 5.770 -2.410 -19.605
143 HA3 GLY 20 3HA GLY 20 5.333 -1.327 -18.292
144 H LYS 21 H LYS 21 6.427 -2.568 -16.756
145 HA LYS 21 HA LYS 21 4.873 -4.722 -15.656
146 HB2 LYS 21 2HB LYS 21 6.860 -6.296 -15.607
147 HB3 LYS 21 3HB LYS 21 6.076 -6.093 -17.169
148 HG2 LYS 21 2HG LYS 21 8.208 -4.180 -16.813
149 HG3 LYS 21 3HG LYS 21 8.781 -5.837 -16.607
150 HD2 LYS 21 2HD LYS 21 7.258 -6.155 -18.796
151 HD3 LYS 21 3HD LYS 21 7.732 -4.469 -19.010
152 HE2 LYS 21 2HE LYS 21 9.776 -5.065 -19.654
153 HE3 LYS 21 3HE LYS 21 9.995 -6.054 -18.211
154 HZ1 LYS 21 3HZ LYS 21 8.263 -7.243 -20.177
155 HZ2 LYS 21 1HZ LYS 21 9.572 -7.914 -19.341
156 HZ3 LYS 21 2HZ LYS 21 9.841 -6.997 -20.736
157 H CYS 22 H CYS 22 5.682 -5.420 -13.549
158 HA CYS 22 HA CYS 22 7.139 -3.244 -12.228
159 HB2 CYS 22 2HB CYS 22 4.930 -5.010 -11.465
160 HB3 CYS 22 3HB CYS 22 6.168 -4.863 -10.221
161 H LYS 23 H LYS 23 9.264 -3.793 -12.576
162 HA LYS 23 HA LYS 23 10.203 -6.465 -11.953
163 HB2 LYS 23 2HB LYS 23 11.078 -4.427 -13.644
164 HB3 LYS 23 3HB LYS 23 12.282 -4.478 -12.364
165 HG2 LYS 23 2HG LYS 23 13.045 -6.521 -12.970
166 HG3 LYS 23 3HG LYS 23 11.464 -7.069 -13.531
167 HD2 LYS 23 2HD LYS 23 12.320 -6.791 -15.586
168 HD3 LYS 23 3HD LYS 23 12.031 -5.073 -15.306
169 HE2 LYS 23 2HE LYS 23 14.221 -4.870 -15.774
170 HE3 LYS 23 3HE LYS 23 14.439 -5.393 -14.105
171 HZ1 LYS 23 3HZ LYS 23 14.504 -7.720 -15.020
172 HZ2 LYS 23 1HZ LYS 23 15.829 -6.744 -15.411
173 HZ3 LYS 23 2HZ LYS 23 14.625 -7.036 -16.562
174 H ASN 24 H ASN 24 10.165 -6.876 -9.809
175 HA ASN 24 HA ASN 24 10.630 -6.736 -7.584
176 HB2 ASN 24 2HB ASN 24 13.037 -5.479 -8.867
177 HB3 ASN 24 3HB ASN 24 12.907 -5.555 -7.112
178 HD21 ASN 24 1HD2 ASN 24 13.380 -7.403 -6.097
179 HD22 ASN 24 2HD2 ASN 24 13.786 -8.886 -6.886
180 H GLY 25 H GLY 25 8.936 -4.672 -8.710
181 HA2 GLY 25 2HA GLY 25 7.812 -3.049 -7.330
182 HA3 GLY 25 3HA GLY 25 9.371 -2.621 -6.640
183 H ASP 26 H ASP 26 10.712 -2.548 -9.235
184 HA ASP 26 HA ASP 26 10.160 0.174 -9.884
185 HB2 ASP 26 2HB ASP 26 11.991 -1.898 -11.092
186 HB3 ASP 26 3HB ASP 26 11.864 -0.261 -11.730
187 H CYS 27 H CYS 27 8.506 0.823 -11.079
188 HA CYS 27 HA CYS 27 7.145 -0.970 -12.876
189 HB2 CYS 27 2HB CYS 27 5.827 0.587 -11.567
190 HB3 CYS 27 3HB CYS 27 6.712 1.954 -12.237
191 H VAL 28 H VAL 28 8.576 -1.436 -14.535
192 HA VAL 28 HA VAL 28 9.732 0.742 -16.077
193 HB VAL 28 HB VAL 28 9.913 -2.219 -16.633
194 HG11 VAL 28 1HG1 VAL 28 10.651 -0.040 -18.172
195 HG12 VAL 28 2HG1 VAL 28 12.154 -0.548 -17.400
196 HG13 VAL 28 3HG1 VAL 28 11.221 -1.698 -18.360
197 HG21 VAL 28 3HG2 VAL 28 12.275 -1.775 -15.586
198 HG22 VAL 28 1HG2 VAL 28 11.429 -0.470 -14.754
199 HG23 VAL 28 2HG2 VAL 28 10.891 -2.138 -14.554
200 H CYS 29 H CYS 29 8.967 1.489 -17.958
201 HA CYS 29 HA CYS 29 6.598 0.164 -19.088
202 HB2 CYS 29 2HB CYS 29 7.515 3.026 -19.045
203 HB3 CYS 29 3HB CYS 29 6.355 2.473 -20.249
204 H ARG 30 H ARG 30 6.825 -0.880 -20.944
205 HA ARG 30 HA ARG 30 9.267 -0.670 -22.460
206 HB2 ARG 30 2HB ARG 30 6.766 -2.298 -22.951
207 HB3 ARG 30 3HB ARG 30 8.262 -2.443 -23.865
208 HG2 ARG 30 2HG ARG 30 9.202 -2.790 -21.367
209 HG3 ARG 30 3HG ARG 30 7.572 -3.442 -21.186
210 HD2 ARG 30 2HD ARG 30 8.263 -5.330 -22.129
211 HD3 ARG 30 3HD ARG 30 8.564 -4.439 -23.621
212 HE ARG 30 HE ARG 30 10.720 -4.182 -21.773
213 HH11 ARG 30 1HH1 ARG 30 9.294 -6.307 -24.133
214 HH12 ARG 30 2HH1 ARG 30 10.784 -7.110 -24.502
215 HH21 ARG 30 1HH2 ARG 30 12.688 -5.232 -22.250
216 HH22 ARG 30 2HH2 ARG 30 12.714 -6.498 -23.429
Start of MODEL 6
1 H1 PHE 1 H PHE 1 1.332 -1.218 1.276
2 HA PHE 1 HA PHE 1 1.282 -0.409 -0.873
3 HB2 PHE 1 2HB PHE 1 4.253 0.044 -0.520
4 HB3 PHE 1 3HB PHE 1 3.290 0.593 -1.887
5 HD1 PHE 1 HD2 PHE 1 1.133 1.999 -1.137
6 HD2 PHE 1 HD1 PHE 1 4.729 1.582 1.103
7 HE1 PHE 1 HE2 PHE 1 0.626 4.087 0.060
8 HE2 PHE 1 HE1 PHE 1 4.226 3.669 2.304
9 HZ PHE 1 HZ PHE 1 2.173 4.926 1.783
10 H SER 2 H SER 2 1.567 -1.329 -2.929
11 HA SER 2 HA SER 2 3.392 -3.572 -3.220
12 HB2 SER 2 2HB SER 2 1.801 -5.246 -3.539
13 HB3 SER 2 3HB SER 2 1.108 -4.327 -2.203
14 HG SER 2 HG SER 2 -0.242 -3.284 -3.681
15 H CYS 3 H CYS 3 4.240 -3.537 -5.190
16 HA CYS 3 HA CYS 3 3.456 -1.655 -7.138
17 HB2 CYS 3 2HB CYS 3 5.757 -2.486 -6.956
18 HB3 CYS 3 3HB CYS 3 5.221 -4.096 -7.428
19 H ASP 4 H ASP 4 1.359 -1.892 -7.802
20 HA ASP 4 HA ASP 4 0.302 -4.430 -8.639
21 HB2 ASP 4 2HB ASP 4 -0.765 -1.919 -7.931
22 HB3 ASP 4 3HB ASP 4 -1.236 -2.194 -9.606
23 H HIS 5 H HIS 5 1.092 -5.329 -10.435
24 HA HIS 5 HA HIS 5 2.355 -4.081 -12.551
25 HB2 HIS 5 2HB HIS 5 2.454 -6.490 -12.229
26 HB3 HIS 5 3HB HIS 5 0.733 -6.635 -12.572
27 HD1 HIS 5 HD1 HIS 5 1.076 -8.159 -14.598
28 HD2 HIS 5 HD2 HIS 5 3.018 -4.500 -14.919
29 HE1 HIS 5 HE1 HIS 5 1.819 -8.000 -16.995
30 H SER 6 H SER 6 -1.053 -4.456 -11.926
31 HA SER 6 HA SER 6 -2.030 -3.921 -14.511
32 HB2 SER 6 2HB SER 6 -3.119 -4.248 -11.867
33 HB3 SER 6 3HB SER 6 -3.877 -2.864 -12.654
34 HG SER 6 HG SER 6 -3.920 -5.569 -13.362
35 H ALA 7 H ALA 7 -1.692 -1.737 -11.711
36 HA ALA 7 HA ALA 7 -2.469 0.622 -12.915
37 HB1 ALA 7 1HB ALA 7 -1.339 -0.117 -10.475
38 HB2 ALA 7 2HB ALA 7 -0.249 1.099 -11.142
39 HB3 ALA 7 3HB ALA 7 -1.959 1.471 -10.927
40 H CYS 8 H CYS 8 0.835 -0.695 -12.689
41 HA CYS 8 HA CYS 8 2.076 1.354 -14.165
42 HB2 CYS 8 2HB CYS 8 2.913 -1.530 -13.791
43 HB3 CYS 8 3HB CYS 8 3.946 -0.252 -14.424
44 H ALA 9 H ALA 9 0.832 -1.820 -15.153
45 HA ALA 9 HA ALA 9 1.616 -1.849 -17.797
46 HB1 ALA 9 1HB ALA 9 0.531 -3.735 -16.673
47 HB2 ALA 9 2HB ALA 9 -1.001 -2.860 -16.690
48 HB3 ALA 9 3HB ALA 9 -0.250 -3.355 -18.208
49 H VAL 10 H VAL 10 -1.355 -0.443 -16.434
50 HA VAL 10 HA VAL 10 -2.322 0.536 -18.920
51 HB VAL 10 HB VAL 10 -3.017 1.448 -16.124
52 HG11 VAL 10 1HG1 VAL 10 -3.864 3.130 -17.447
53 HG12 VAL 10 2HG1 VAL 10 -4.144 2.057 -18.820
54 HG13 VAL 10 3HG1 VAL 10 -5.218 2.000 -17.421
55 HG21 VAL 10 3HG2 VAL 10 -4.825 -0.101 -16.184
56 HG22 VAL 10 1HG2 VAL 10 -4.508 -0.499 -17.873
57 HG23 VAL 10 2HG2 VAL 10 -3.366 -0.990 -16.622
58 H ARG 11 H ARG 11 -0.666 2.101 -16.189
59 HA ARG 11 HA ARG 11 -0.614 4.694 -17.227
60 HB2 ARG 11 2HB ARG 11 0.013 3.847 -14.872
61 HB3 ARG 11 3HB ARG 11 1.611 3.563 -15.550
62 HG2 ARG 11 2HG ARG 11 2.128 5.747 -15.582
63 HG3 ARG 11 3HG ARG 11 0.501 6.232 -16.063
64 HD2 ARG 11 2HD ARG 11 0.820 5.149 -13.328
65 HD3 ARG 11 3HD ARG 11 1.526 6.734 -13.641
66 HE ARG 11 HE ARG 11 -1.056 6.787 -14.649
67 HH11 ARG 11 1HH1 ARG 11 0.507 6.390 -11.563
68 HH12 ARG 11 2HH1 ARG 11 -0.805 7.077 -10.664
69 HH21 ARG 11 1HH2 ARG 11 -2.790 7.693 -13.475
70 HH22 ARG 11 2HH2 ARG 11 -2.680 7.817 -11.752
71 H CYS 12 H CYS 12 1.175 1.894 -18.104
72 HA CYS 12 HA CYS 12 3.296 3.378 -19.413
73 HB2 CYS 12 2HB CYS 12 2.669 0.454 -19.087
74 HB3 CYS 12 3HB CYS 12 3.900 0.996 -20.223
75 H LEU 13 H LEU 13 0.662 1.194 -20.399
76 HA LEU 13 HA LEU 13 1.046 1.472 -23.168
77 HB2 LEU 13 2HB LEU 13 -0.776 0.155 -23.391
78 HB3 LEU 13 3HB LEU 13 -0.466 -0.131 -21.680
79 HG LEU 13 HG LEU 13 -2.142 1.912 -21.422
80 HD11 LEU 13 1HD1 LEU 13 -2.298 1.280 -24.203
81 HD12 LEU 13 2HD1 LEU 13 -3.155 2.524 -23.294
82 HD13 LEU 13 3HD1 LEU 13 -3.837 0.903 -23.429
83 HD21 LEU 13 3HD2 LEU 13 -3.622 -0.529 -22.049
84 HD22 LEU 13 1HD2 LEU 13 -3.492 0.364 -20.534
85 HD23 LEU 13 2HD2 LEU 13 -2.234 -0.786 -20.990
86 H ALA 14 H ALA 14 -0.486 3.512 -20.828
87 HA ALA 14 HA ALA 14 -1.972 5.054 -22.760
88 HB1 ALA 14 1HB ALA 14 -2.319 6.585 -20.762
89 HB2 ALA 14 2HB ALA 14 -2.961 4.947 -20.629
90 HB3 ALA 14 3HB ALA 14 -1.454 5.372 -19.818
91 H GLN 15 H GLN 15 1.196 5.094 -21.392
92 HA GLN 15 HA GLN 15 1.684 7.845 -22.232
93 HB2 GLN 15 2HB GLN 15 2.864 6.021 -20.313
94 HB3 GLN 15 3HB GLN 15 4.092 6.740 -21.346
95 HG2 GLN 15 2HG GLN 15 3.044 8.979 -20.791
96 HG3 GLN 15 3HG GLN 15 2.140 8.127 -19.540
97 HE21 GLN 15 1HE2 GLN 15 3.089 7.748 -17.640
98 HE22 GLN 15 2HE2 GLN 15 4.747 8.071 -17.276
99 H ARG 16 H ARG 16 1.288 5.374 -24.013
100 HA ARG 16 HA ARG 16 2.040 4.667 -26.040
101 HB2 ARG 16 2HB ARG 16 3.962 6.992 -25.960
102 HB3 ARG 16 3HB ARG 16 3.349 6.157 -27.380
103 HG2 ARG 16 2HG ARG 16 1.028 6.973 -26.401
104 HG3 ARG 16 3HG ARG 16 2.059 8.209 -25.677
105 HD2 ARG 16 2HD ARG 16 1.870 9.298 -27.616
106 HD3 ARG 16 3HD ARG 16 2.960 8.079 -28.275
107 HE ARG 16 HE ARG 16 0.283 7.167 -28.364
108 HH11 ARG 16 1HH1 ARG 16 2.480 9.379 -29.912
109 HH12 ARG 16 2HH1 ARG 16 1.659 9.332 -31.437
110 HH21 ARG 16 1HH2 ARG 16 -0.806 7.095 -30.367
111 HH22 ARG 16 2HH2 ARG 16 -0.210 8.033 -31.694
112 H ARG 17 H ARG 17 3.029 3.226 -24.052
113 HA ARG 17 HA ARG 17 5.813 2.742 -24.866
114 HB2 ARG 17 2HB ARG 17 4.828 2.419 -22.032
115 HB3 ARG 17 3HB ARG 17 6.484 2.296 -22.613
116 HG2 ARG 17 2HG ARG 17 4.840 4.817 -22.660
117 HG3 ARG 17 3HG ARG 17 6.011 4.398 -21.408
118 HD2 ARG 17 2HD ARG 17 6.804 4.445 -24.295
119 HD3 ARG 17 3HD ARG 17 6.742 5.936 -23.356
120 HE ARG 17 HE ARG 17 8.249 3.885 -22.055
121 HH11 ARG 17 1HH1 ARG 17 8.379 6.359 -24.501
122 HH12 ARG 17 2HH1 ARG 17 10.094 6.572 -24.379
123 HH21 ARG 17 1HH2 ARG 17 10.507 4.156 -21.885
124 HH22 ARG 17 2HH2 ARG 17 11.304 5.318 -22.892
125 H LYS 18 H LYS 18 2.967 1.574 -25.280
126 HA LYS 18 HA LYS 18 1.990 -0.472 -25.516
127 HB2 LYS 18 2HB LYS 18 4.172 -0.598 -26.906
128 HB3 LYS 18 3HB LYS 18 4.758 -1.641 -25.616
129 HG2 LYS 18 2HG LYS 18 3.917 -3.047 -27.322
130 HG3 LYS 18 3HG LYS 18 2.748 -3.088 -26.001
131 HD2 LYS 18 2HD LYS 18 1.132 -2.151 -27.249
132 HD3 LYS 18 3HD LYS 18 2.242 -0.989 -27.979
133 HE2 LYS 18 2HE LYS 18 2.417 -3.856 -28.775
134 HE3 LYS 18 3HE LYS 18 1.105 -2.871 -29.420
135 HZ1 LYS 18 3HZ LYS 18 2.502 -1.711 -30.716
136 HZ2 LYS 18 1HZ LYS 18 3.525 -3.046 -30.530
137 HZ3 LYS 18 2HZ LYS 18 3.740 -1.675 -29.563
138 H GLY 19 H GLY 19 2.631 0.404 -22.794
139 HA2 GLY 19 2HA GLY 19 2.133 -0.548 -20.732
140 HA3 GLY 19 3HA GLY 19 2.180 -2.135 -21.485
141 H GLY 20 H GLY 20 3.266 -2.199 -19.147
142 HA2 GLY 20 2HA GLY 20 6.117 -2.458 -19.702
143 HA3 GLY 20 3HA GLY 20 5.676 -1.365 -18.398
144 H LYS 21 H LYS 21 6.772 -2.653 -16.879
145 HA LYS 21 HA LYS 21 5.154 -4.793 -15.811
146 HB2 LYS 21 2HB LYS 21 7.120 -6.367 -15.695
147 HB3 LYS 21 3HB LYS 21 6.443 -6.130 -17.301
148 HG2 LYS 21 2HG LYS 21 8.489 -4.200 -16.907
149 HG3 LYS 21 3HG LYS 21 9.115 -5.784 -16.441
150 HD2 LYS 21 2HD LYS 21 7.555 -5.630 -18.958
151 HD3 LYS 21 3HD LYS 21 9.161 -4.898 -18.959
152 HE2 LYS 21 2HE LYS 21 9.645 -7.052 -19.608
153 HE3 LYS 21 3HE LYS 21 9.877 -7.156 -17.863
154 HZ1 LYS 21 3HZ LYS 21 8.437 -8.826 -17.908
155 HZ2 LYS 21 1HZ LYS 21 8.005 -8.524 -19.516
156 HZ3 LYS 21 2HZ LYS 21 7.220 -7.705 -18.261
157 H CYS 22 H CYS 22 6.002 -5.561 -13.697
158 HA CYS 22 HA CYS 22 7.319 -3.339 -12.301
159 HB2 CYS 22 2HB CYS 22 5.115 -5.118 -11.654
160 HB3 CYS 22 3HB CYS 22 6.335 -5.109 -10.384
161 H LYS 23 H LYS 23 9.458 -3.671 -12.255
162 HA LYS 23 HA LYS 23 10.504 -6.360 -11.803
163 HB2 LYS 23 2HB LYS 23 11.373 -4.190 -13.335
164 HB3 LYS 23 3HB LYS 23 12.506 -4.270 -11.992
165 HG2 LYS 23 2HG LYS 23 13.365 -6.267 -12.650
166 HG3 LYS 23 3HG LYS 23 11.852 -6.805 -13.382
167 HD2 LYS 23 2HD LYS 23 12.619 -6.205 -15.380
168 HD3 LYS 23 3HD LYS 23 12.740 -4.534 -14.825
169 HE2 LYS 23 2HE LYS 23 14.983 -4.881 -14.065
170 HE3 LYS 23 3HE LYS 23 14.868 -6.616 -14.359
171 HZ1 LYS 23 3HZ LYS 23 15.961 -5.939 -16.225
172 HZ2 LYS 23 1HZ LYS 23 15.208 -4.425 -16.275
173 HZ3 LYS 23 2HZ LYS 23 14.368 -5.804 -16.778
174 H ASN 24 H ASN 24 10.286 -6.839 -9.672
175 HA ASN 24 HA ASN 24 10.632 -6.792 -7.424
176 HB2 ASN 24 2HB ASN 24 13.044 -5.387 -8.515
177 HB3 ASN 24 3HB ASN 24 12.807 -5.472 -6.772
178 HD21 ASN 24 1HD2 ASN 24 13.124 -7.395 -9.695
179 HD22 ASN 24 2HD2 ASN 24 13.723 -8.816 -8.916
180 H GLY 25 H GLY 25 8.977 -4.690 -8.665
181 HA2 GLY 25 2HA GLY 25 7.649 -3.217 -7.268
182 HA3 GLY 25 3HA GLY 25 9.132 -2.746 -6.451
183 H ASP 26 H ASP 26 10.595 -2.552 -9.017
184 HA ASP 26 HA ASP 26 9.993 0.189 -9.562
185 HB2 ASP 26 2HB ASP 26 11.885 -1.683 -11.002
186 HB3 ASP 26 3HB ASP 26 11.859 0.073 -11.143
187 H CYS 27 H CYS 27 8.452 0.886 -10.873
188 HA CYS 27 HA CYS 27 7.183 -0.881 -12.761
189 HB2 CYS 27 2HB CYS 27 6.691 1.872 -11.733
190 HB3 CYS 27 3HB CYS 27 5.996 1.445 -13.293
191 H VAL 28 H VAL 28 8.587 -1.346 -14.408
192 HA VAL 28 HA VAL 28 9.842 0.860 -15.859
193 HB VAL 28 HB VAL 28 10.152 -2.101 -16.357
194 HG11 VAL 28 1HG1 VAL 28 11.504 0.360 -17.386
195 HG12 VAL 28 2HG1 VAL 28 12.382 -1.169 -17.309
196 HG13 VAL 28 3HG1 VAL 28 10.909 -1.044 -18.271
197 HG21 VAL 28 3HG2 VAL 28 11.693 -0.240 -14.566
198 HG22 VAL 28 1HG2 VAL 28 10.916 -1.767 -14.148
199 HG23 VAL 28 2HG2 VAL 28 12.360 -1.761 -15.160
200 H CYS 29 H CYS 29 9.308 1.452 -17.899
201 HA CYS 29 HA CYS 29 6.968 0.119 -19.086
202 HB2 CYS 29 2HB CYS 29 7.951 2.964 -19.214
203 HB3 CYS 29 3HB CYS 29 6.777 2.338 -20.366
204 H ARG 30 H ARG 30 7.281 -1.019 -20.873
205 HA ARG 30 HA ARG 30 9.410 -0.221 -22.727
206 HB2 ARG 30 2HB ARG 30 10.244 -2.442 -22.949
207 HB3 ARG 30 3HB ARG 30 10.184 -2.091 -21.226
208 HG2 ARG 30 2HG ARG 30 9.119 -4.027 -21.009
209 HG3 ARG 30 3HG ARG 30 7.723 -3.223 -21.730
210 HD2 ARG 30 2HD ARG 30 9.113 -3.888 -23.949
211 HD3 ARG 30 3HD ARG 30 9.575 -5.207 -22.875
212 HE ARG 30 HE ARG 30 7.009 -4.776 -24.080
213 HH11 ARG 30 1HH1 ARG 30 8.681 -6.198 -21.378
214 HH12 ARG 30 2HH1 ARG 30 7.449 -7.375 -21.067
215 HH21 ARG 30 1HH2 ARG 30 5.379 -6.321 -23.681
216 HH22 ARG 30 2HH2 ARG 30 5.571 -7.445 -22.378
Start of MODEL 7
1 H1 PHE 1 H PHE 1 1.744 0.033 -0.495
2 HA PHE 1 HA PHE 1 1.707 0.285 -3.170
3 HB2 PHE 1 2HB PHE 1 4.537 0.550 -2.177
4 HB3 PHE 1 3HB PHE 1 4.183 -0.085 -3.781
5 HD1 PHE 1 HD1 PHE 1 3.949 2.873 -1.606
6 HD2 PHE 1 HD2 PHE 1 3.501 1.344 -5.552
7 HE1 PHE 1 HE1 PHE 1 3.804 5.170 -2.475
8 HE2 PHE 1 HE2 PHE 1 3.357 3.638 -6.429
9 HZ PHE 1 HZ PHE 1 3.510 5.555 -4.890
10 H SER 2 H SER 2 1.812 -1.682 -4.238
11 HA SER 2 HA SER 2 2.897 -3.989 -2.821
12 HB2 SER 2 2HB SER 2 0.514 -3.742 -2.092
13 HB3 SER 2 3HB SER 2 0.025 -3.934 -3.776
14 HG SER 2 HG SER 2 0.591 -5.827 -1.989
15 H CYS 3 H CYS 3 3.500 -2.488 -5.289
16 HA CYS 3 HA CYS 3 4.051 -2.853 -7.468
17 HB2 CYS 3 2HB CYS 3 5.313 -4.695 -6.266
18 HB3 CYS 3 3HB CYS 3 4.012 -5.783 -6.740
19 H ASP 4 H ASP 4 1.778 -2.147 -7.898
20 HA ASP 4 HA ASP 4 -0.079 -4.222 -8.700
21 HB2 ASP 4 2HB ASP 4 -0.205 -1.209 -8.697
22 HB3 ASP 4 3HB ASP 4 -1.470 -2.200 -9.418
23 H HIS 5 H HIS 5 0.718 -5.274 -10.466
24 HA HIS 5 HA HIS 5 2.061 -4.122 -12.628
25 HB2 HIS 5 2HB HIS 5 2.085 -6.523 -12.240
26 HB3 HIS 5 3HB HIS 5 0.352 -6.617 -12.538
27 HD1 HIS 5 HD1 HIS 5 0.483 -8.144 -14.557
28 HD2 HIS 5 HD2 HIS 5 2.763 -4.695 -14.967
29 HE1 HIS 5 HE1 HIS 5 1.201 -8.095 -16.967
30 H SER 6 H SER 6 -1.337 -4.342 -11.901
31 HA SER 6 HA SER 6 -2.342 -3.827 -14.492
32 HB2 SER 6 2HB SER 6 -3.762 -2.926 -12.003
33 HB3 SER 6 3HB SER 6 -4.438 -3.604 -13.484
34 HG SER 6 HG SER 6 -4.080 -5.563 -12.761
35 H ALA 7 H ALA 7 -2.036 -1.630 -11.696
36 HA ALA 7 HA ALA 7 -2.732 0.729 -12.947
37 HB1 ALA 7 1HB ALA 7 -0.560 0.587 -10.875
38 HB2 ALA 7 2HB ALA 7 -1.741 1.870 -11.145
39 HB3 ALA 7 3HB ALA 7 -2.260 0.320 -10.483
40 H CYS 8 H CYS 8 0.450 -0.822 -12.788
41 HA CYS 8 HA CYS 8 1.838 1.253 -14.139
42 HB2 CYS 8 2HB CYS 8 2.771 -0.674 -12.674
43 HB3 CYS 8 3HB CYS 8 2.716 -1.621 -14.157
44 H ALA 9 H ALA 9 0.515 -1.864 -15.215
45 HA ALA 9 HA ALA 9 1.335 -1.850 -17.848
46 HB1 ALA 9 1HB ALA 9 -0.505 -3.334 -18.317
47 HB2 ALA 9 2HB ALA 9 0.162 -3.718 -16.730
48 HB3 ALA 9 3HB ALA 9 -1.345 -2.811 -16.857
49 H VAL 10 H VAL 10 -1.623 -0.408 -16.493
50 HA VAL 10 HA VAL 10 -2.533 0.650 -18.969
51 HB VAL 10 HB VAL 10 -3.248 1.547 -16.174
52 HG11 VAL 10 1HG1 VAL 10 -4.284 2.198 -18.880
53 HG12 VAL 10 2HG1 VAL 10 -5.445 2.049 -17.560
54 HG13 VAL 10 3HG1 VAL 10 -4.130 3.219 -17.451
55 HG21 VAL 10 3HG2 VAL 10 -5.347 0.062 -17.061
56 HG22 VAL 10 1HG2 VAL 10 -3.980 -0.815 -17.750
57 HG23 VAL 10 2HG2 VAL 10 -4.065 -0.540 -16.010
58 H ARG 11 H ARG 11 -0.880 2.113 -16.179
59 HA ARG 11 HA ARG 11 -0.756 4.728 -17.156
60 HB2 ARG 11 2HB ARG 11 -0.252 4.085 -14.822
61 HB3 ARG 11 3HB ARG 11 1.236 3.323 -15.367
62 HG2 ARG 11 2HG ARG 11 2.239 5.364 -15.876
63 HG3 ARG 11 3HG ARG 11 0.695 6.220 -15.898
64 HD2 ARG 11 2HD ARG 11 1.536 6.889 -13.869
65 HD3 ARG 11 3HD ARG 11 0.591 5.478 -13.392
66 HE ARG 11 HE ARG 11 2.531 4.447 -12.769
67 HH11 ARG 11 1HH1 ARG 11 3.300 7.107 -14.880
68 HH12 ARG 11 2HH1 ARG 11 5.011 6.961 -14.655
69 HH21 ARG 11 1HH2 ARG 11 4.783 4.246 -12.464
70 HH22 ARG 11 2HH2 ARG 11 5.854 5.333 -13.281
71 H CYS 12 H CYS 12 0.982 1.908 -18.074
72 HA CYS 12 HA CYS 12 3.154 3.373 -19.319
73 HB2 CYS 12 2HB CYS 12 2.457 0.458 -19.069
74 HB3 CYS 12 3HB CYS 12 3.716 0.998 -20.176
75 H LEU 13 H LEU 13 0.486 1.273 -20.391
76 HA LEU 13 HA LEU 13 0.915 1.606 -23.148
77 HB2 LEU 13 2HB LEU 13 -0.933 0.337 -23.426
78 HB3 LEU 13 3HB LEU 13 -0.653 0.004 -21.719
79 HG LEU 13 HG LEU 13 -2.286 2.078 -21.434
80 HD11 LEU 13 1HD1 LEU 13 -2.418 1.515 -24.232
81 HD12 LEU 13 2HD1 LEU 13 -3.259 2.757 -23.304
82 HD13 LEU 13 3HD1 LEU 13 -3.976 1.156 -23.487
83 HD21 LEU 13 3HD2 LEU 13 -3.810 -0.315 -22.139
84 HD22 LEU 13 1HD2 LEU 13 -3.684 0.541 -20.603
85 HD23 LEU 13 2HD2 LEU 13 -2.445 -0.625 -21.065
86 H ALA 14 H ALA 14 -0.604 3.625 -20.782
87 HA ALA 14 HA ALA 14 -2.027 5.246 -22.697
88 HB1 ALA 14 1HB ALA 14 -2.494 6.696 -20.737
89 HB2 ALA 14 2HB ALA 14 -2.971 5.014 -20.502
90 HB3 ALA 14 3HB ALA 14 -1.495 5.625 -19.755
91 H GLN 15 H GLN 15 1.122 5.182 -21.285
92 HA GLN 15 HA GLN 15 1.684 7.940 -22.055
93 HB2 GLN 15 2HB GLN 15 2.794 6.045 -20.163
94 HB3 GLN 15 3HB GLN 15 4.053 6.760 -21.162
95 HG2 GLN 15 2HG GLN 15 3.047 9.008 -20.569
96 HG3 GLN 15 3HG GLN 15 2.107 8.149 -19.350
97 HE21 GLN 15 1HE2 GLN 15 3.070 7.503 -17.492
98 HE22 GLN 15 2HE2 GLN 15 4.710 7.858 -17.081
99 H ARG 16 H ARG 16 1.257 5.520 -23.898
100 HA ARG 16 HA ARG 16 2.021 4.842 -25.931
101 HB2 ARG 16 2HB ARG 16 4.015 7.101 -25.790
102 HB3 ARG 16 3HB ARG 16 3.348 6.337 -27.227
103 HG2 ARG 16 2HG ARG 16 1.748 7.961 -25.261
104 HG3 ARG 16 3HG ARG 16 2.420 8.581 -26.771
105 HD2 ARG 16 2HD ARG 16 0.946 7.399 -28.072
106 HD3 ARG 16 3HD ARG 16 0.725 6.136 -26.862
107 HE ARG 16 HE ARG 16 -0.323 8.619 -25.963
108 HH11 ARG 16 1HH1 ARG 16 -0.979 5.936 -28.083
109 HH12 ARG 16 2HH1 ARG 16 -2.699 6.129 -28.007
110 HH21 ARG 16 1HH2 ARG 16 -2.586 8.883 -25.856
111 HH22 ARG 16 2HH2 ARG 16 -3.612 7.806 -26.741
112 H ARG 17 H ARG 17 2.949 3.334 -23.964
113 HA ARG 17 HA ARG 17 5.732 2.806 -24.751
114 HB2 ARG 17 2HB ARG 17 4.704 2.434 -21.938
115 HB3 ARG 17 3HB ARG 17 6.364 2.297 -22.501
116 HG2 ARG 17 2HG ARG 17 4.779 4.854 -22.547
117 HG3 ARG 17 3HG ARG 17 5.868 4.381 -21.241
118 HD2 ARG 17 2HD ARG 17 7.479 4.044 -23.388
119 HD3 ARG 17 3HD ARG 17 6.466 5.374 -23.947
120 HE ARG 17 HE ARG 17 7.438 5.841 -21.316
121 HH11 ARG 17 1HH1 ARG 17 8.355 5.911 -24.674
122 HH12 ARG 17 2HH1 ARG 17 9.576 7.120 -24.450
123 HH21 ARG 17 1HH2 ARG 17 9.043 7.433 -21.009
124 HH22 ARG 17 2HH2 ARG 17 9.967 7.984 -22.365
125 H LYS 18 H LYS 18 2.867 1.712 -25.230
126 HA LYS 18 HA LYS 18 1.848 -0.305 -25.527
127 HB2 LYS 18 2HB LYS 18 4.707 -1.272 -25.708
128 HB3 LYS 18 3HB LYS 18 3.291 -2.119 -26.316
129 HG2 LYS 18 2HG LYS 18 2.902 -0.409 -27.955
130 HG3 LYS 18 3HG LYS 18 4.193 0.587 -27.279
131 HD2 LYS 18 2HD LYS 18 5.301 -0.388 -29.033
132 HD3 LYS 18 3HD LYS 18 5.646 -1.556 -27.756
133 HE2 LYS 18 2HE LYS 18 4.180 -3.118 -28.608
134 HE3 LYS 18 3HE LYS 18 3.206 -1.906 -29.438
135 HZ1 LYS 18 3HZ LYS 18 5.980 -2.523 -30.263
136 HZ2 LYS 18 1HZ LYS 18 4.781 -1.715 -31.141
137 HZ3 LYS 18 2HZ LYS 18 4.653 -3.379 -30.869
138 H GLY 19 H GLY 19 2.471 0.494 -22.777
139 HA2 GLY 19 2HA GLY 19 1.922 -0.494 -20.745
140 HA3 GLY 19 3HA GLY 19 1.944 -2.064 -21.534
141 H GLY 20 H GLY 20 2.996 -2.250 -19.205
142 HA2 GLY 20 2HA GLY 20 5.862 -2.483 -19.720
143 HA3 GLY 20 3HA GLY 20 5.382 -1.499 -18.345
144 H LYS 21 H LYS 21 6.416 -2.880 -16.882
145 HA LYS 21 HA LYS 21 4.789 -5.081 -16.001
146 HB2 LYS 21 2HB LYS 21 6.689 -6.721 -16.034
147 HB3 LYS 21 3HB LYS 21 6.046 -6.313 -17.619
148 HG2 LYS 21 2HG LYS 21 8.234 -4.576 -16.841
149 HG3 LYS 21 3HG LYS 21 8.696 -6.279 -16.866
150 HD2 LYS 21 2HD LYS 21 7.345 -6.180 -19.167
151 HD3 LYS 21 3HD LYS 21 7.865 -4.495 -19.084
152 HE2 LYS 21 2HE LYS 21 9.700 -6.876 -18.836
153 HE3 LYS 21 3HE LYS 21 9.436 -5.966 -20.322
154 HZ1 LYS 21 3HZ LYS 21 10.331 -4.615 -17.855
155 HZ2 LYS 21 1HZ LYS 21 10.482 -4.100 -19.459
156 HZ3 LYS 21 2HZ LYS 21 11.442 -5.368 -18.884
157 H CYS 22 H CYS 22 5.626 -6.030 -13.960
158 HA CYS 22 HA CYS 22 6.758 -3.920 -12.315
159 HB2 CYS 22 2HB CYS 22 4.762 -5.672 -11.834
160 HB3 CYS 22 3HB CYS 22 6.108 -6.551 -11.116
161 H LYS 23 H LYS 23 8.774 -3.871 -11.544
162 HA LYS 23 HA LYS 23 10.464 -6.250 -11.960
163 HB2 LYS 23 2HB LYS 23 11.104 -4.372 -13.401
164 HB3 LYS 23 3HB LYS 23 11.262 -3.333 -11.991
165 HG2 LYS 23 2HG LYS 23 12.887 -5.524 -11.444
166 HG3 LYS 23 3HG LYS 23 13.161 -5.163 -13.150
167 HD2 LYS 23 2HD LYS 23 14.039 -3.093 -12.711
168 HD3 LYS 23 3HD LYS 23 13.116 -2.899 -11.219
169 HE2 LYS 23 2HE LYS 23 15.037 -5.104 -11.153
170 HE3 LYS 23 3HE LYS 23 15.778 -3.520 -11.374
171 HZ1 LYS 23 3HZ LYS 23 15.479 -3.108 -9.234
172 HZ2 LYS 23 1HZ LYS 23 14.815 -4.648 -9.015
173 HZ3 LYS 23 2HZ LYS 23 13.809 -3.338 -9.379
174 H ASN 24 H ASN 24 10.014 -7.092 -9.893
175 HA ASN 24 HA ASN 24 10.261 -7.378 -7.646
176 HB2 ASN 24 2HB ASN 24 12.730 -5.748 -8.266
177 HB3 ASN 24 3HB ASN 24 12.444 -6.528 -6.714
178 HD21 ASN 24 1HD2 ASN 24 13.220 -6.985 -10.054
179 HD22 ASN 24 2HD2 ASN 24 13.661 -8.652 -9.939
180 H GLY 25 H GLY 25 8.405 -5.473 -8.154
181 HA2 GLY 25 2HA GLY 25 7.253 -4.118 -6.570
182 HA3 GLY 25 3HA GLY 25 8.803 -3.653 -5.885
183 H ASP 26 H ASP 26 9.884 -3.188 -8.640
184 HA ASP 26 HA ASP 26 9.048 -0.431 -8.831
185 HB2 ASP 26 2HB ASP 26 11.110 -2.060 -10.320
186 HB3 ASP 26 3HB ASP 26 10.783 -0.366 -10.676
187 H CYS 27 H CYS 27 8.858 0.428 -11.207
188 HA CYS 27 HA CYS 27 7.087 -1.352 -12.740
189 HB2 CYS 27 2HB CYS 27 5.671 0.192 -11.494
190 HB3 CYS 27 3HB CYS 27 6.594 1.564 -12.100
191 H VAL 28 H VAL 28 8.180 -1.740 -14.556
192 HA VAL 28 HA VAL 28 9.630 0.474 -15.839
193 HB VAL 28 HB VAL 28 9.892 -2.472 -16.445
194 HG11 VAL 28 1HG1 VAL 28 10.787 -0.159 -17.787
195 HG12 VAL 28 2HG1 VAL 28 12.202 -0.900 -17.037
196 HG13 VAL 28 3HG1 VAL 28 11.188 -1.841 -18.132
197 HG21 VAL 28 3HG2 VAL 28 10.618 -2.241 -14.206
198 HG22 VAL 28 1HG2 VAL 28 12.080 -2.230 -15.193
199 HG23 VAL 28 2HG2 VAL 28 11.438 -0.718 -14.550
200 H CYS 29 H CYS 29 9.019 1.234 -17.775
201 HA CYS 29 HA CYS 29 6.690 -0.019 -19.047
202 HB2 CYS 29 2HB CYS 29 7.797 2.779 -19.081
203 HB3 CYS 29 3HB CYS 29 6.640 2.241 -20.294
204 H ARG 30 H ARG 30 6.997 -1.186 -20.814
205 HA ARG 30 HA ARG 30 9.529 -1.135 -22.196
206 HB2 ARG 30 2HB ARG 30 7.222 -2.916 -22.030
207 HB3 ARG 30 3HB ARG 30 7.840 -2.758 -23.668
208 HG2 ARG 30 2HG ARG 30 10.149 -3.189 -22.524
209 HG3 ARG 30 3HG ARG 30 9.152 -3.889 -21.247
210 HD2 ARG 30 2HD ARG 30 9.102 -4.675 -24.159
211 HD3 ARG 30 3HD ARG 30 9.879 -5.581 -22.862
212 HE ARG 30 HE ARG 30 7.130 -5.138 -22.302
213 HH11 ARG 30 1HH1 ARG 30 9.292 -7.084 -24.216
214 HH12 ARG 30 2HH1 ARG 30 8.200 -8.425 -24.323
215 HH21 ARG 30 1HH2 ARG 30 5.684 -6.897 -22.436
216 HH22 ARG 30 2HH2 ARG 30 6.147 -8.317 -23.311
Start of MODEL 8
1 H1 PHE 1 H PHE 1 0.504 1.988 -6.978
2 HA PHE 1 HA PHE 1 2.362 1.517 -5.515
3 HB2 PHE 1 2HB PHE 1 1.267 1.608 -3.259
4 HB3 PHE 1 3HB PHE 1 0.695 2.830 -4.389
5 HD1 PHE 1 HD1 PHE 1 -0.152 -0.274 -2.633
6 HD2 PHE 1 HD2 PHE 1 -1.557 2.812 -5.206
7 HE1 PHE 1 HE1 PHE 1 -2.467 -1.020 -2.258
8 HE2 PHE 1 HE2 PHE 1 -3.874 2.072 -4.834
9 HZ PHE 1 HZ PHE 1 -4.331 0.154 -3.359
10 H SER 2 H SER 2 3.249 0.126 -3.831
11 HA SER 2 HA SER 2 3.962 -1.907 -3.101
12 HB2 SER 2 2HB SER 2 0.986 -2.311 -3.244
13 HB3 SER 2 3HB SER 2 2.051 -3.632 -2.764
14 HG SER 2 HG SER 2 2.699 -2.474 -1.007
15 H CYS 3 H CYS 3 4.309 -1.436 -5.819
16 HA CYS 3 HA CYS 3 4.814 -2.475 -7.779
17 HB2 CYS 3 2HB CYS 3 5.998 -3.954 -6.048
18 HB3 CYS 3 3HB CYS 3 4.669 -5.086 -6.282
19 H ASP 4 H ASP 4 2.377 -1.796 -8.019
20 HA ASP 4 HA ASP 4 0.624 -4.087 -8.415
21 HB2 ASP 4 2HB ASP 4 0.276 -1.231 -8.003
22 HB3 ASP 4 3HB ASP 4 -0.686 -1.813 -9.359
23 H HIS 5 H HIS 5 1.021 -5.207 -10.220
24 HA HIS 5 HA HIS 5 2.234 -4.276 -12.543
25 HB2 HIS 5 2HB HIS 5 0.601 -6.652 -11.825
26 HB3 HIS 5 3HB HIS 5 0.787 -6.303 -13.541
27 HD1 HIS 5 HD1 HIS 5 2.628 -7.629 -14.492
28 HD2 HIS 5 HD2 HIS 5 3.439 -6.466 -10.587
29 HE1 HIS 5 HE1 HIS 5 4.910 -8.551 -13.976
30 H SER 6 H SER 6 -1.141 -4.262 -11.582
31 HA SER 6 HA SER 6 -2.246 -3.618 -14.098
32 HB2 SER 6 2HB SER 6 -3.342 -2.894 -11.371
33 HB3 SER 6 3HB SER 6 -4.254 -3.018 -12.876
34 HG SER 6 HG SER 6 -3.351 -5.297 -12.836
35 H ALA 7 H ALA 7 -1.534 -1.530 -11.296
36 HA ALA 7 HA ALA 7 -2.196 0.911 -12.402
37 HB1 ALA 7 1HB ALA 7 -1.727 1.027 -10.153
38 HB2 ALA 7 2HB ALA 7 -0.245 0.082 -10.302
39 HB3 ALA 7 3HB ALA 7 -0.279 1.760 -10.844
40 H CYS 8 H CYS 8 0.987 -0.689 -12.456
41 HA CYS 8 HA CYS 8 2.271 1.292 -14.000
42 HB2 CYS 8 2HB CYS 8 3.284 -0.640 -12.593
43 HB3 CYS 8 3HB CYS 8 3.078 -1.602 -14.053
44 H ALA 9 H ALA 9 0.703 -1.762 -14.888
45 HA ALA 9 HA ALA 9 1.306 -1.865 -17.577
46 HB1 ALA 9 1HB ALA 9 -0.797 -3.134 -17.846
47 HB2 ALA 9 2HB ALA 9 0.160 -3.673 -16.465
48 HB3 ALA 9 3HB ALA 9 -1.262 -2.660 -16.212
49 H VAL 10 H VAL 10 -1.429 -0.192 -16.034
50 HA VAL 10 HA VAL 10 -2.464 0.869 -18.458
51 HB VAL 10 HB VAL 10 -2.889 1.926 -15.661
52 HG11 VAL 10 1HG1 VAL 10 -5.013 2.759 -16.585
53 HG12 VAL 10 2HG1 VAL 10 -3.611 3.471 -17.386
54 HG13 VAL 10 3HG1 VAL 10 -4.526 2.190 -18.181
55 HG21 VAL 10 3HG2 VAL 10 -3.687 -0.564 -16.858
56 HG22 VAL 10 1HG2 VAL 10 -3.936 0.018 -15.211
57 HG23 VAL 10 2HG2 VAL 10 -5.103 0.415 -16.473
58 H ARG 11 H ARG 11 -0.496 2.279 -15.852
59 HA ARG 11 HA ARG 11 -0.276 4.855 -16.911
60 HB2 ARG 11 2HB ARG 11 0.417 3.984 -14.595
61 HB3 ARG 11 3HB ARG 11 1.925 3.508 -15.363
62 HG2 ARG 11 2HG ARG 11 2.568 5.701 -15.755
63 HG3 ARG 11 3HG ARG 11 0.920 6.314 -15.598
64 HD2 ARG 11 2HD ARG 11 1.740 6.963 -13.576
65 HD3 ARG 11 3HD ARG 11 1.193 5.342 -13.148
66 HE ARG 11 HE ARG 11 3.741 4.918 -13.900
67 HH11 ARG 11 1HH1 ARG 11 2.281 7.198 -11.713
68 HH12 ARG 11 2HH1 ARG 11 3.667 7.292 -10.678
69 HH21 ARG 11 1HH2 ARG 11 5.573 5.032 -12.546
70 HH22 ARG 11 2HH2 ARG 11 5.539 6.060 -11.154
71 H CYS 12 H CYS 12 1.189 1.901 -17.882
72 HA CYS 12 HA CYS 12 3.346 3.183 -19.338
73 HB2 CYS 12 2HB CYS 12 2.477 0.330 -18.950
74 HB3 CYS 12 3HB CYS 12 3.675 0.755 -20.167
75 H LEU 13 H LEU 13 0.464 1.250 -20.133
76 HA LEU 13 HA LEU 13 0.689 1.487 -22.924
77 HB2 LEU 13 2HB LEU 13 -1.256 0.344 -23.018
78 HB3 LEU 13 3HB LEU 13 -0.861 0.032 -21.329
79 HG LEU 13 HG LEU 13 -2.323 2.220 -20.976
80 HD11 LEU 13 1HD1 LEU 13 -2.719 1.602 -23.737
81 HD12 LEU 13 2HD1 LEU 13 -3.396 2.921 -22.782
82 HD13 LEU 13 3HD1 LEU 13 -4.232 1.370 -22.861
83 HD21 LEU 13 3HD2 LEU 13 -2.633 -0.453 -20.514
84 HD22 LEU 13 1HD2 LEU 13 -4.054 -0.081 -21.491
85 HD23 LEU 13 2HD2 LEU 13 -3.755 0.805 -19.995
86 H ALA 14 H ALA 14 -0.493 3.662 -20.504
87 HA ALA 14 HA ALA 14 -1.955 5.332 -22.346
88 HB1 ALA 14 1HB ALA 14 -1.109 5.952 -19.520
89 HB2 ALA 14 2HB ALA 14 -2.358 6.768 -20.462
90 HB3 ALA 14 3HB ALA 14 -2.587 5.094 -19.957
91 H GLN 15 H GLN 15 1.287 5.083 -21.188
92 HA GLN 15 HA GLN 15 1.968 7.776 -22.078
93 HB2 GLN 15 2HB GLN 15 3.099 5.854 -20.227
94 HB3 GLN 15 3HB GLN 15 4.318 6.456 -21.342
95 HG2 GLN 15 2HG GLN 15 3.515 8.782 -20.736
96 HG3 GLN 15 3HG GLN 15 2.625 8.017 -19.421
97 HE21 GLN 15 1HE2 GLN 15 3.644 8.235 -17.575
98 HE22 GLN 15 2HE2 GLN 15 5.352 8.143 -17.331
99 H ARG 16 H ARG 16 1.232 5.350 -23.812
100 HA ARG 16 HA ARG 16 1.781 4.574 -25.878
101 HB2 ARG 16 2HB ARG 16 3.908 6.714 -25.940
102 HB3 ARG 16 3HB ARG 16 3.130 5.936 -27.311
103 HG2 ARG 16 2HG ARG 16 1.080 7.087 -25.761
104 HG3 ARG 16 3HG ARG 16 2.362 8.292 -25.905
105 HD2 ARG 16 2HD ARG 16 2.169 8.424 -28.189
106 HD3 ARG 16 3HD ARG 16 1.532 6.787 -28.336
107 HE ARG 16 HE ARG 16 -0.581 7.627 -28.088
108 HH11 ARG 16 1HH1 ARG 16 1.724 10.021 -27.052
109 HH12 ARG 16 2HH1 ARG 16 0.538 11.270 -26.864
110 HH21 ARG 16 1HH2 ARG 16 -2.152 9.263 -27.845
111 HH22 ARG 16 2HH2 ARG 16 -1.666 10.838 -27.315
112 H ARG 17 H ARG 17 2.762 3.050 -23.949
113 HA ARG 17 HA ARG 17 5.430 2.313 -24.939
114 HB2 ARG 17 2HB ARG 17 4.624 2.052 -22.045
115 HB3 ARG 17 3HB ARG 17 6.223 1.837 -22.744
116 HG2 ARG 17 2HG ARG 17 4.718 4.441 -22.583
117 HG3 ARG 17 3HG ARG 17 6.035 3.940 -21.519
118 HD2 ARG 17 2HD ARG 17 6.998 3.606 -24.125
119 HD3 ARG 17 3HD ARG 17 6.145 5.149 -24.130
120 HE ARG 17 HE ARG 17 7.680 5.254 -21.888
121 HH11 ARG 17 1HH1 ARG 17 8.324 4.644 -25.254
122 HH12 ARG 17 2HH1 ARG 17 9.926 5.302 -25.202
123 HH21 ARG 17 1HH2 ARG 17 9.788 6.123 -21.806
124 HH22 ARG 17 2HH2 ARG 17 10.758 6.142 -23.239
125 H LYS 18 H LYS 18 2.468 1.410 -25.157
126 HA LYS 18 HA LYS 18 1.295 -0.538 -25.314
127 HB2 LYS 18 2HB LYS 18 3.614 -0.851 -26.676
128 HB3 LYS 18 3HB LYS 18 3.739 -2.188 -25.540
129 HG2 LYS 18 2HG LYS 18 2.625 -3.283 -27.158
130 HG3 LYS 18 3HG LYS 18 1.220 -2.554 -26.378
131 HD2 LYS 18 2HD LYS 18 0.760 -1.824 -28.461
132 HD3 LYS 18 3HD LYS 18 1.936 -0.567 -28.068
133 HE2 LYS 18 2HE LYS 18 2.916 -3.138 -29.209
134 HE3 LYS 18 3HE LYS 18 2.123 -1.987 -30.284
135 HZ1 LYS 18 3HZ LYS 18 4.749 -1.919 -29.230
136 HZ2 LYS 18 1HZ LYS 18 3.911 -0.522 -28.771
137 HZ3 LYS 18 2HZ LYS 18 4.048 -0.926 -30.408
138 H GLY 19 H GLY 19 2.192 0.279 -22.646
139 HA2 GLY 19 2HA GLY 19 1.745 -0.621 -20.550
140 HA3 GLY 19 3HA GLY 19 1.597 -2.207 -21.292
141 H GLY 20 H GLY 20 2.836 -2.270 -18.990
142 HA2 GLY 20 2HA GLY 20 5.589 -2.872 -19.736
143 HA3 GLY 20 3HA GLY 20 5.372 -1.677 -18.465
144 H LYS 21 H LYS 21 6.440 -3.008 -16.963
145 HA LYS 21 HA LYS 21 4.690 -4.901 -15.663
146 HB2 LYS 21 2HB LYS 21 6.422 -6.701 -15.617
147 HB3 LYS 21 3HB LYS 21 5.736 -6.411 -17.210
148 HG2 LYS 21 2HG LYS 21 7.992 -4.744 -16.995
149 HG3 LYS 21 3HG LYS 21 8.465 -6.329 -16.379
150 HD2 LYS 21 2HD LYS 21 6.911 -6.178 -18.918
151 HD3 LYS 21 3HD LYS 21 8.627 -5.765 -18.945
152 HE2 LYS 21 2HE LYS 21 8.464 -8.114 -17.450
153 HE3 LYS 21 3HE LYS 21 7.354 -8.353 -18.799
154 HZ1 LYS 21 3HZ LYS 21 9.173 -8.917 -19.931
155 HZ2 LYS 21 1HZ LYS 21 10.225 -8.246 -18.788
156 HZ3 LYS 21 2HZ LYS 21 9.533 -7.264 -19.979
157 H CYS 22 H CYS 22 5.723 -5.742 -13.610
158 HA CYS 22 HA CYS 22 7.069 -3.516 -12.306
159 HB2 CYS 22 2HB CYS 22 5.035 -4.787 -11.368
160 HB3 CYS 22 3HB CYS 22 6.181 -6.063 -10.969
161 H LYS 23 H LYS 23 9.084 -3.577 -11.426
162 HA LYS 23 HA LYS 23 10.659 -6.023 -11.904
163 HB2 LYS 23 2HB LYS 23 11.304 -4.164 -13.391
164 HB3 LYS 23 3HB LYS 23 11.613 -3.154 -11.985
165 HG2 LYS 23 2HG LYS 23 13.288 -4.958 -11.290
166 HG3 LYS 23 3HG LYS 23 13.141 -5.544 -12.948
167 HD2 LYS 23 2HD LYS 23 13.531 -2.915 -13.403
168 HD3 LYS 23 3HD LYS 23 14.436 -3.108 -11.900
169 HE2 LYS 23 2HE LYS 23 15.191 -5.304 -13.383
170 HE3 LYS 23 3HE LYS 23 15.057 -4.029 -14.593
171 HZ1 LYS 23 3HZ LYS 23 17.155 -3.618 -13.924
172 HZ2 LYS 23 1HZ LYS 23 16.940 -4.310 -12.395
173 HZ3 LYS 23 2HZ LYS 23 16.385 -2.742 -12.698
174 H ASN 24 H ASN 24 10.118 -6.744 -9.772
175 HA ASN 24 HA ASN 24 10.419 -6.985 -7.526
176 HB2 ASN 24 2HB ASN 24 13.036 -5.595 -8.144
177 HB3 ASN 24 3HB ASN 24 12.691 -6.544 -6.701
178 HD21 ASN 24 1HD2 ASN 24 12.968 -6.707 -10.203
179 HD22 ASN 24 2HD2 ASN 24 13.406 -8.377 -10.274
180 H GLY 25 H GLY 25 8.870 -4.769 -8.193
181 HA2 GLY 25 2HA GLY 25 7.942 -3.294 -6.505
182 HA3 GLY 25 3HA GLY 25 9.585 -2.938 -5.992
183 H ASP 26 H ASP 26 10.419 -2.765 -8.876
184 HA ASP 26 HA ASP 26 9.803 0.045 -9.189
185 HB2 ASP 26 2HB ASP 26 11.778 -1.856 -10.327
186 HB3 ASP 26 3HB ASP 26 11.315 -0.496 -11.346
187 H CYS 27 H CYS 27 9.334 0.854 -11.459
188 HA CYS 27 HA CYS 27 7.328 -0.890 -12.735
189 HB2 CYS 27 2HB CYS 27 6.223 0.938 -11.574
190 HB3 CYS 27 3HB CYS 27 7.263 2.113 -12.374
191 H VAL 28 H VAL 28 8.348 -1.640 -14.501
192 HA VAL 28 HA VAL 28 9.887 0.233 -16.155
193 HB VAL 28 HB VAL 28 9.735 -2.770 -16.430
194 HG11 VAL 28 1HG1 VAL 28 11.384 -0.621 -17.704
195 HG12 VAL 28 2HG1 VAL 28 11.996 -2.271 -17.579
196 HG13 VAL 28 3HG1 VAL 28 10.503 -1.948 -18.460
197 HG21 VAL 28 3HG2 VAL 28 11.589 -1.028 -14.834
198 HG22 VAL 28 1HG2 VAL 28 10.692 -2.456 -14.315
199 HG23 VAL 28 2HG2 VAL 28 12.073 -2.627 -15.399
200 H CYS 29 H CYS 29 9.274 0.794 -18.171
201 HA CYS 29 HA CYS 29 6.743 -0.340 -19.162
202 HB2 CYS 29 2HB CYS 29 7.939 2.411 -19.380
203 HB3 CYS 29 3HB CYS 29 6.704 1.868 -20.511
204 H ARG 30 H ARG 30 6.845 -1.533 -20.939
205 HA ARG 30 HA ARG 30 9.301 -1.623 -22.479
206 HB2 ARG 30 2HB ARG 30 6.800 -3.278 -22.388
207 HB3 ARG 30 3HB ARG 30 7.906 -3.422 -23.747
208 HG2 ARG 30 2HG ARG 30 9.626 -3.638 -21.669
209 HG3 ARG 30 3HG ARG 30 8.172 -4.367 -20.984
210 HD2 ARG 30 2HD ARG 30 9.521 -6.072 -22.040
211 HD3 ARG 30 3HD ARG 30 8.024 -5.850 -22.945
212 HE ARG 30 HE ARG 30 10.201 -4.284 -23.961
213 HH11 ARG 30 1HH1 ARG 30 8.684 -7.417 -24.009
214 HH12 ARG 30 2HH1 ARG 30 9.309 -7.840 -25.569
215 HH21 ARG 30 1HH2 ARG 30 11.029 -4.829 -26.015
216 HH22 ARG 30 2HH2 ARG 30 10.644 -6.367 -26.708
Start of MODEL 9
1 H1 PHE 1 H PHE 1 5.676 -7.152 -1.786
2 HA PHE 1 HA PHE 1 4.694 -4.967 -1.729
3 HB2 PHE 1 2HB PHE 1 7.283 -4.099 -3.035
4 HB3 PHE 1 3HB PHE 1 5.931 -3.046 -2.631
5 HD1 PHE 1 HD2 PHE 1 5.181 -3.848 0.031
6 HD2 PHE 1 HD1 PHE 1 9.058 -3.522 -1.694
7 HE1 PHE 1 HE2 PHE 1 6.139 -3.474 2.265
8 HE2 PHE 1 HE1 PHE 1 10.023 -3.148 0.538
9 HZ PHE 1 HZ PHE 1 8.563 -3.123 2.521
10 H SER 2 H SER 2 4.181 -3.447 -3.743
11 HA SER 2 HA SER 2 4.500 -4.451 -6.345
12 HB2 SER 2 2HB SER 2 1.893 -5.080 -6.442
13 HB3 SER 2 3HB SER 2 3.144 -6.278 -6.108
14 HG SER 2 HG SER 2 1.776 -6.561 -4.465
15 H CYS 3 H CYS 3 3.893 -2.936 -7.787
16 HA CYS 3 HA CYS 3 2.418 -0.622 -6.743
17 HB2 CYS 3 2HB CYS 3 3.466 0.680 -8.477
18 HB3 CYS 3 3HB CYS 3 4.714 -0.260 -7.665
19 H ASP 4 H ASP 4 1.181 -3.123 -7.704
20 HA ASP 4 HA ASP 4 -0.631 -3.770 -8.918
21 HB2 ASP 4 2HB ASP 4 -1.286 -1.348 -8.092
22 HB3 ASP 4 3HB ASP 4 -1.152 -0.964 -9.806
23 H HIS 5 H HIS 5 0.342 -4.920 -10.535
24 HA HIS 5 HA HIS 5 1.791 -3.934 -12.684
25 HB2 HIS 5 2HB HIS 5 0.290 -6.443 -12.141
26 HB3 HIS 5 3HB HIS 5 0.740 -6.121 -13.813
27 HD1 HIS 5 HD1 HIS 5 2.751 -7.466 -14.302
28 HD2 HIS 5 HD2 HIS 5 2.921 -5.762 -10.517
29 HE1 HIS 5 HE1 HIS 5 5.004 -8.098 -13.381
30 H SER 6 H SER 6 -1.639 -4.004 -12.160
31 HA SER 6 HA SER 6 -2.410 -3.619 -14.879
32 HB2 SER 6 2HB SER 6 -3.752 -3.620 -12.241
33 HB3 SER 6 3HB SER 6 -4.525 -2.645 -13.491
34 HG SER 6 HG SER 6 -4.323 -5.373 -13.260
35 H ALA 7 H ALA 7 -2.219 -1.418 -12.083
36 HA ALA 7 HA ALA 7 -2.958 0.936 -13.320
37 HB1 ALA 7 1HB ALA 7 -0.732 1.030 -11.348
38 HB2 ALA 7 2HB ALA 7 -2.189 2.019 -11.459
39 HB3 ALA 7 3HB ALA 7 -2.287 0.372 -10.837
40 H CYS 8 H CYS 8 0.326 -0.407 -13.012
41 HA CYS 8 HA CYS 8 1.597 1.652 -14.476
42 HB2 CYS 8 2HB CYS 8 2.643 -0.096 -12.898
43 HB3 CYS 8 3HB CYS 8 2.628 -1.171 -14.292
44 H ALA 9 H ALA 9 0.402 -1.554 -15.406
45 HA ALA 9 HA ALA 9 1.299 -1.683 -18.010
46 HB1 ALA 9 1HB ALA 9 -1.164 -2.743 -16.678
47 HB2 ALA 9 2HB ALA 9 -0.885 -3.000 -18.400
48 HB3 ALA 9 3HB ALA 9 0.273 -3.610 -17.219
49 H VAL 10 H VAL 10 -1.717 -0.211 -16.827
50 HA VAL 10 HA VAL 10 -2.572 0.681 -19.387
51 HB VAL 10 HB VAL 10 -3.379 1.725 -16.668
52 HG11 VAL 10 1HG1 VAL 10 -4.215 3.317 -18.087
53 HG12 VAL 10 2HG1 VAL 10 -4.373 2.191 -19.436
54 HG13 VAL 10 3HG1 VAL 10 -5.537 2.151 -18.111
55 HG21 VAL 10 3HG2 VAL 10 -5.396 0.111 -17.748
56 HG22 VAL 10 1HG2 VAL 10 -3.893 -0.783 -17.975
57 HG23 VAL 10 2HG2 VAL 10 -4.364 -0.245 -16.363
58 H ARG 11 H ARG 11 -1.020 2.335 -16.647
59 HA ARG 11 HA ARG 11 -0.907 4.889 -17.776
60 HB2 ARG 11 2HB ARG 11 -0.442 4.295 -15.381
61 HB3 ARG 11 3HB ARG 11 1.126 3.687 -15.894
62 HG2 ARG 11 2HG ARG 11 1.875 5.834 -16.504
63 HG3 ARG 11 3HG ARG 11 0.245 6.506 -16.424
64 HD2 ARG 11 2HD ARG 11 1.011 7.238 -14.415
65 HD3 ARG 11 3HD ARG 11 0.443 5.645 -13.916
66 HE ARG 11 HE ARG 11 3.028 5.218 -14.635
67 HH11 ARG 11 1HH1 ARG 11 1.445 7.416 -12.448
68 HH12 ARG 11 2HH1 ARG 11 2.788 7.505 -11.358
69 HH21 ARG 11 1HH2 ARG 11 4.804 5.327 -13.207
70 HH22 ARG 11 2HH2 ARG 11 4.699 6.316 -11.791
71 H CYS 12 H CYS 12 0.898 2.047 -18.472
72 HA CYS 12 HA CYS 12 3.084 3.470 -19.743
73 HB2 CYS 12 2HB CYS 12 2.422 0.565 -19.332
74 HB3 CYS 12 3HB CYS 12 3.701 1.054 -20.439
75 H LEU 13 H LEU 13 0.477 1.268 -20.759
76 HA LEU 13 HA LEU 13 0.981 1.440 -23.518
77 HB2 LEU 13 2HB LEU 13 -0.840 0.127 -23.771
78 HB3 LEU 13 3HB LEU 13 -0.604 -0.098 -22.039
79 HG LEU 13 HG LEU 13 -2.275 1.962 -21.926
80 HD11 LEU 13 1HD1 LEU 13 -3.890 0.892 -23.966
81 HD12 LEU 13 2HD1 LEU 13 -2.317 1.229 -24.687
82 HD13 LEU 13 3HD1 LEU 13 -3.201 2.512 -23.862
83 HD21 LEU 13 3HD2 LEU 13 -3.722 -0.512 -22.533
84 HD22 LEU 13 1HD2 LEU 13 -3.695 0.459 -21.061
85 HD23 LEU 13 2HD2 LEU 13 -2.404 -0.700 -21.375
86 H ALA 14 H ALA 14 -0.635 3.573 -21.322
87 HA ALA 14 HA ALA 14 -2.025 5.052 -23.372
88 HB1 ALA 14 1HB ALA 14 -2.868 4.818 -21.036
89 HB2 ALA 14 2HB ALA 14 -1.545 5.858 -20.509
90 HB3 ALA 14 3HB ALA 14 -2.773 6.484 -21.608
91 H GLN 15 H GLN 15 1.081 5.127 -21.867
92 HA GLN 15 HA GLN 15 1.624 7.841 -22.788
93 HB2 GLN 15 2HB GLN 15 2.705 6.085 -20.751
94 HB3 GLN 15 3HB GLN 15 3.983 6.760 -21.754
95 HG2 GLN 15 2HG GLN 15 2.915 9.021 -21.331
96 HG3 GLN 15 3HG GLN 15 1.964 8.218 -20.083
97 HE21 GLN 15 1HE2 GLN 15 3.541 6.657 -18.754
98 HE22 GLN 15 2HE2 GLN 15 4.912 7.479 -18.101
99 H ARG 16 H ARG 16 1.291 5.307 -24.491
100 HA ARG 16 HA ARG 16 2.127 4.519 -26.454
101 HB2 ARG 16 2HB ARG 16 4.082 6.815 -26.391
102 HB3 ARG 16 3HB ARG 16 3.476 5.952 -27.798
103 HG2 ARG 16 2HG ARG 16 1.857 7.741 -25.996
104 HG3 ARG 16 3HG ARG 16 2.468 8.157 -27.598
105 HD2 ARG 16 2HD ARG 16 0.453 6.022 -26.916
106 HD3 ARG 16 3HD ARG 16 0.150 7.531 -27.775
107 HE ARG 16 HE ARG 16 1.260 5.108 -28.859
108 HH11 ARG 16 1HH1 ARG 16 0.990 8.559 -29.225
109 HH12 ARG 16 2HH1 ARG 16 1.304 8.534 -30.929
110 HH21 ARG 16 1HH2 ARG 16 1.674 5.061 -31.102
111 HH22 ARG 16 2HH2 ARG 16 1.692 6.544 -31.995
112 H ARG 17 H ARG 17 3.014 3.148 -24.371
113 HA ARG 17 HA ARG 17 5.827 2.617 -25.039
114 HB2 ARG 17 2HB ARG 17 4.711 2.406 -22.242
115 HB3 ARG 17 3HB ARG 17 6.390 2.248 -22.741
116 HG2 ARG 17 2HG ARG 17 4.791 4.783 -23.001
117 HG3 ARG 17 3HG ARG 17 5.836 4.403 -21.631
118 HD2 ARG 17 2HD ARG 17 7.531 3.948 -23.683
119 HD3 ARG 17 3HD ARG 17 6.523 5.216 -24.379
120 HE ARG 17 HE ARG 17 7.459 6.719 -22.921
121 HH11 ARG 17 1HH1 ARG 17 8.226 3.481 -21.896
122 HH12 ARG 17 2HH1 ARG 17 9.353 3.993 -20.683
123 HH21 ARG 17 1HH2 ARG 17 8.940 7.404 -21.328
124 HH22 ARG 17 2HH2 ARG 17 9.758 6.224 -20.361
125 H LYS 18 H LYS 18 2.993 1.452 -25.538
126 HA LYS 18 HA LYS 18 2.012 -0.595 -25.743
127 HB2 LYS 18 2HB LYS 18 4.557 -0.747 -26.762
128 HB3 LYS 18 3HB LYS 18 4.526 -2.106 -25.647
129 HG2 LYS 18 2HG LYS 18 2.161 -2.440 -26.919
130 HG3 LYS 18 3HG LYS 18 3.139 -1.725 -28.203
131 HD2 LYS 18 2HD LYS 18 4.897 -3.516 -27.290
132 HD3 LYS 18 3HD LYS 18 3.405 -4.343 -26.837
133 HE2 LYS 18 2HE LYS 18 2.884 -4.820 -28.968
134 HE3 LYS 18 3HE LYS 18 3.391 -3.235 -29.548
135 HZ1 LYS 18 3HZ LYS 18 4.930 -5.705 -29.307
136 HZ2 LYS 18 1HZ LYS 18 5.749 -4.254 -29.017
137 HZ3 LYS 18 2HZ LYS 18 4.983 -4.510 -30.503
138 H GLY 19 H GLY 19 2.538 0.376 -23.029
139 HA2 GLY 19 2HA GLY 19 1.942 -0.496 -20.958
140 HA3 GLY 19 3HA GLY 19 2.007 -2.110 -21.650
141 H GLY 20 H GLY 20 2.990 -2.096 -19.265
142 HA2 GLY 20 2HA GLY 20 5.818 -2.539 -19.664
143 HA3 GLY 20 3HA GLY 20 5.450 -1.219 -18.563
144 H LYS 21 H LYS 21 6.305 -2.215 -16.756
145 HA LYS 21 HA LYS 21 4.553 -4.080 -15.443
146 HB2 LYS 21 2HB LYS 21 6.323 -5.767 -15.006
147 HB3 LYS 21 3HB LYS 21 5.859 -5.675 -16.700
148 HG2 LYS 21 2HG LYS 21 8.135 -3.987 -15.889
149 HG3 LYS 21 3HG LYS 21 8.401 -5.732 -15.853
150 HD2 LYS 21 2HD LYS 21 7.055 -4.656 -18.255
151 HD3 LYS 21 3HD LYS 21 8.755 -4.226 -18.050
152 HE2 LYS 21 2HE LYS 21 7.866 -7.065 -17.730
153 HE3 LYS 21 3HE LYS 21 8.116 -6.393 -19.340
154 HZ1 LYS 21 3HZ LYS 21 10.134 -6.522 -17.165
155 HZ2 LYS 21 1HZ LYS 21 10.382 -5.804 -18.676
156 HZ3 LYS 21 2HZ LYS 21 10.111 -7.470 -18.566
157 H CYS 22 H CYS 22 5.338 -4.573 -13.200
158 HA CYS 22 HA CYS 22 6.569 -2.162 -12.093
159 HB2 CYS 22 2HB CYS 22 4.676 -4.216 -11.095
160 HB3 CYS 22 3HB CYS 22 5.787 -3.537 -9.910
161 H LYS 23 H LYS 23 8.300 -2.224 -10.644
162 HA LYS 23 HA LYS 23 9.710 -4.779 -10.358
163 HB2 LYS 23 2HB LYS 23 10.709 -2.305 -11.691
164 HB3 LYS 23 3HB LYS 23 11.844 -3.240 -10.726
165 HG2 LYS 23 2HG LYS 23 11.038 -5.252 -12.106
166 HG3 LYS 23 3HG LYS 23 10.379 -4.042 -13.210
167 HD2 LYS 23 2HD LYS 23 12.441 -3.334 -13.881
168 HD3 LYS 23 3HD LYS 23 13.195 -3.708 -12.329
169 HE2 LYS 23 2HE LYS 23 12.250 -5.827 -14.246
170 HE3 LYS 23 3HE LYS 23 13.880 -5.156 -14.290
171 HZ1 LYS 23 3HZ LYS 23 13.772 -5.788 -11.750
172 HZ2 LYS 23 1HZ LYS 23 14.227 -6.917 -12.925
173 HZ3 LYS 23 2HZ LYS 23 12.650 -6.922 -12.313
174 H ASN 24 H ASN 24 9.365 -4.937 -8.187
175 HA ASN 24 HA ASN 24 9.526 -4.499 -5.957
176 HB2 ASN 24 2HB ASN 24 12.019 -3.224 -7.060
177 HB3 ASN 24 3HB ASN 24 11.673 -3.205 -5.333
178 HD21 ASN 24 1HD2 ASN 24 11.401 -5.597 -7.945
179 HD22 ASN 24 2HD2 ASN 24 12.248 -6.851 -7.112
180 H GLY 25 H GLY 25 7.672 -2.891 -7.103
181 HA2 GLY 25 2HA GLY 25 6.421 -1.126 -6.157
182 HA3 GLY 25 3HA GLY 25 7.898 -0.489 -5.450
183 H ASP 26 H ASP 26 9.332 -0.745 -8.038
184 HA ASP 26 HA ASP 26 8.687 1.852 -9.048
185 HB2 ASP 26 2HB ASP 26 10.568 -0.208 -10.218
186 HB3 ASP 26 3HB ASP 26 10.547 1.518 -10.572
187 H CYS 27 H CYS 27 8.299 2.291 -11.359
188 HA CYS 27 HA CYS 27 6.608 0.214 -12.590
189 HB2 CYS 27 2HB CYS 27 5.180 1.976 -11.759
190 HB3 CYS 27 3HB CYS 27 6.183 3.206 -12.522
191 H VAL 28 H VAL 28 7.974 -0.583 -14.105
192 HA VAL 28 HA VAL 28 9.481 1.255 -15.799
193 HB VAL 28 HB VAL 28 9.489 -1.763 -15.878
194 HG11 VAL 28 1HG1 VAL 28 11.913 -1.011 -16.741
195 HG12 VAL 28 2HG1 VAL 28 10.534 -1.241 -17.818
196 HG13 VAL 28 3HG1 VAL 28 10.970 0.380 -17.274
197 HG21 VAL 28 3HG2 VAL 28 11.650 -1.516 -14.605
198 HG22 VAL 28 1HG2 VAL 28 11.178 0.152 -14.283
199 HG23 VAL 28 2HG2 VAL 28 10.185 -1.176 -13.684
200 H CYS 29 H CYS 29 9.077 1.608 -17.921
201 HA CYS 29 HA CYS 29 6.715 0.267 -19.066
202 HB2 CYS 29 2HB CYS 29 7.718 3.093 -19.331
203 HB3 CYS 29 3HB CYS 29 6.625 2.396 -20.522
204 H ARG 30 H ARG 30 7.097 -1.006 -20.745
205 HA ARG 30 HA ARG 30 9.672 -1.220 -21.927
206 HB2 ARG 30 2HB ARG 30 7.018 -2.513 -22.338
207 HB3 ARG 30 3HB ARG 30 8.211 -2.655 -23.621
208 HG2 ARG 30 2HG ARG 30 9.810 -3.563 -21.941
209 HG3 ARG 30 3HG ARG 30 8.492 -3.564 -20.768
210 HD2 ARG 30 2HD ARG 30 8.622 -5.103 -23.357
211 HD3 ARG 30 3HD ARG 30 8.708 -5.765 -21.726
212 HE ARG 30 HE ARG 30 6.318 -4.457 -21.796
213 HH11 ARG 30 1HH1 ARG 30 7.812 -6.945 -23.720
214 HH12 ARG 30 2HH1 ARG 30 6.311 -7.699 -24.145
215 HH21 ARG 30 1HH2 ARG 30 4.336 -5.441 -22.349
216 HH22 ARG 30 2HH2 ARG 30 4.335 -6.842 -23.366
Start of MODEL 10
1 H1 PHE 1 H PHE 1 2.004 -2.030 1.582
2 HA PHE 1 HA PHE 1 0.988 -0.994 -0.350
3 HB2 PHE 1 2HB PHE 1 2.322 0.355 -1.861
4 HB3 PHE 1 3HB PHE 1 2.498 0.974 -0.222
5 HD1 PHE 1 HD1 PHE 1 4.567 0.264 1.092
6 HD2 PHE 1 HD2 PHE 1 4.189 -0.210 -3.121
7 HE1 PHE 1 HE1 PHE 1 7.013 0.088 0.896
8 HE2 PHE 1 HE2 PHE 1 6.635 -0.387 -3.324
9 HZ PHE 1 HZ PHE 1 8.050 -0.239 -1.314
10 H SER 2 H SER 2 1.706 -1.407 -2.820
11 HA SER 2 HA SER 2 3.443 -3.640 -3.226
12 HB2 SER 2 2HB SER 2 0.526 -4.088 -2.851
13 HB3 SER 2 3HB SER 2 1.313 -4.972 -4.158
14 HG SER 2 HG SER 2 1.257 -5.881 -1.879
15 H CYS 3 H CYS 3 4.241 -3.392 -5.197
16 HA CYS 3 HA CYS 3 3.315 -1.482 -7.022
17 HB2 CYS 3 2HB CYS 3 5.641 -2.361 -6.936
18 HB3 CYS 3 3HB CYS 3 5.062 -3.881 -7.611
19 H ASP 4 H ASP 4 1.253 -1.658 -7.731
20 HA ASP 4 HA ASP 4 0.076 -4.144 -8.513
21 HB2 ASP 4 2HB ASP 4 -0.759 -1.296 -8.445
22 HB3 ASP 4 3HB ASP 4 -1.601 -2.339 -9.588
23 H HIS 5 H HIS 5 0.796 -5.182 -10.258
24 HA HIS 5 HA HIS 5 2.171 -4.098 -12.411
25 HB2 HIS 5 2HB HIS 5 2.141 -6.497 -11.926
26 HB3 HIS 5 3HB HIS 5 0.436 -6.576 -12.359
27 HD1 HIS 5 HD1 HIS 5 1.035 -8.324 -14.206
28 HD2 HIS 5 HD2 HIS 5 2.728 -4.569 -14.752
29 HE1 HIS 5 HE1 HIS 5 1.859 -8.297 -16.582
30 H SER 6 H SER 6 -1.284 -4.483 -11.905
31 HA SER 6 HA SER 6 -2.137 -3.936 -14.528
32 HB2 SER 6 2HB SER 6 -3.573 -3.373 -11.922
33 HB3 SER 6 3HB SER 6 -4.322 -3.440 -13.517
34 HG SER 6 HG SER 6 -3.926 -5.435 -11.859
35 H ALA 7 H ALA 7 -1.838 -1.780 -11.709
36 HA ALA 7 HA ALA 7 -2.650 0.589 -12.873
37 HB1 ALA 7 1HB ALA 7 -2.030 1.510 -10.934
38 HB2 ALA 7 2HB ALA 7 -1.621 -0.133 -10.440
39 HB3 ALA 7 3HB ALA 7 -0.371 0.931 -11.084
40 H CYS 8 H CYS 8 0.647 -0.747 -12.744
41 HA CYS 8 HA CYS 8 1.846 1.347 -14.217
42 HB2 CYS 8 2HB CYS 8 2.704 -1.498 -13.681
43 HB3 CYS 8 3HB CYS 8 3.706 -0.343 -14.553
44 H ALA 9 H ALA 9 0.626 -1.846 -15.162
45 HA ALA 9 HA ALA 9 1.401 -1.909 -17.807
46 HB1 ALA 9 1HB ALA 9 -0.858 -3.193 -18.091
47 HB2 ALA 9 2HB ALA 9 0.434 -3.871 -17.099
48 HB3 ALA 9 3HB ALA 9 -0.928 -3.051 -16.335
49 H VAL 10 H VAL 10 -1.565 -0.487 -16.451
50 HA VAL 10 HA VAL 10 -2.546 0.455 -18.947
51 HB VAL 10 HB VAL 10 -3.229 1.389 -16.155
52 HG11 VAL 10 1HG1 VAL 10 -5.342 2.159 -17.234
53 HG12 VAL 10 2HG1 VAL 10 -3.906 3.052 -17.740
54 HG13 VAL 10 3HG1 VAL 10 -4.604 1.828 -18.801
55 HG21 VAL 10 3HG2 VAL 10 -3.824 -1.036 -17.570
56 HG22 VAL 10 1HG2 VAL 10 -4.253 -0.569 -15.924
57 HG23 VAL 10 2HG2 VAL 10 -5.309 -0.134 -17.267
58 H ARG 11 H ARG 11 -0.879 2.060 -16.246
59 HA ARG 11 HA ARG 11 -0.836 4.638 -17.321
60 HB2 ARG 11 2HB ARG 11 -0.275 4.094 -14.975
61 HB3 ARG 11 3HB ARG 11 1.222 3.351 -15.519
62 HG2 ARG 11 2HG ARG 11 2.254 5.328 -15.813
63 HG3 ARG 11 3HG ARG 11 0.792 6.126 -16.395
64 HD2 ARG 11 2HD ARG 11 0.886 5.326 -13.539
65 HD3 ARG 11 3HD ARG 11 1.883 6.692 -14.038
66 HE ARG 11 HE ARG 11 -0.785 6.940 -14.995
67 HH11 ARG 11 1HH1 ARG 11 1.203 7.310 -12.161
68 HH12 ARG 11 2HH1 ARG 11 0.179 8.507 -11.439
69 HH21 ARG 11 1HH2 ARG 11 -2.141 8.514 -14.054
70 HH22 ARG 11 2HH2 ARG 11 -1.723 9.190 -12.516
71 H CYS 12 H CYS 12 0.954 1.828 -18.165
72 HA CYS 12 HA CYS 12 3.067 3.296 -19.504
73 HB2 CYS 12 2HB CYS 12 2.447 0.378 -19.125
74 HB3 CYS 12 3HB CYS 12 3.665 0.900 -20.284
75 H LEU 13 H LEU 13 0.433 1.094 -20.447
76 HA LEU 13 HA LEU 13 0.805 1.332 -23.222
77 HB2 LEU 13 2HB LEU 13 -1.017 0.010 -23.418
78 HB3 LEU 13 3HB LEU 13 -0.698 -0.251 -21.705
79 HG LEU 13 HG LEU 13 -2.376 1.793 -21.468
80 HD11 LEU 13 1HD1 LEU 13 -4.079 0.756 -23.453
81 HD12 LEU 13 2HD1 LEU 13 -2.544 1.118 -24.240
82 HD13 LEU 13 3HD1 LEU 13 -3.395 2.378 -23.346
83 HD21 LEU 13 3HD2 LEU 13 -3.723 0.255 -20.554
84 HD22 LEU 13 1HD2 LEU 13 -2.463 -0.897 -20.996
85 HD23 LEU 13 2HD2 LEU 13 -3.853 -0.662 -22.056
86 H ALA 14 H ALA 14 -0.722 3.403 -20.906
87 HA ALA 14 HA ALA 14 -2.217 4.915 -22.854
88 HB1 ALA 14 1HB ALA 14 -3.022 6.184 -21.069
89 HB2 ALA 14 2HB ALA 14 -2.810 4.573 -20.383
90 HB3 ALA 14 3HB ALA 14 -1.617 5.831 -20.062
91 H GLN 15 H GLN 15 0.954 4.983 -21.491
92 HA GLN 15 HA GLN 15 1.435 7.721 -22.379
93 HB2 GLN 15 2HB GLN 15 2.621 5.932 -20.430
94 HB3 GLN 15 3HB GLN 15 3.846 6.641 -21.475
95 HG2 GLN 15 2HG GLN 15 2.774 8.882 -20.955
96 HG3 GLN 15 3HG GLN 15 1.895 8.040 -19.680
97 HE21 GLN 15 1HE2 GLN 15 3.250 6.816 -18.128
98 HE22 GLN 15 2HE2 GLN 15 4.761 7.508 -17.657
99 H ARG 16 H ARG 16 1.043 5.222 -24.119
100 HA ARG 16 HA ARG 16 1.795 4.482 -26.134
101 HB2 ARG 16 2HB ARG 16 3.725 6.801 -26.098
102 HB3 ARG 16 3HB ARG 16 3.091 5.952 -27.501
103 HG2 ARG 16 2HG ARG 16 0.786 6.797 -26.516
104 HG3 ARG 16 3HG ARG 16 1.830 8.032 -25.808
105 HD2 ARG 16 2HD ARG 16 1.127 8.920 -27.869
106 HD3 ARG 16 3HD ARG 16 2.775 8.356 -28.143
107 HE ARG 16 HE ARG 16 0.995 6.301 -28.822
108 HH11 ARG 16 1HH1 ARG 16 1.965 9.460 -29.918
109 HH12 ARG 16 2HH1 ARG 16 1.595 9.140 -31.580
110 HH21 ARG 16 1HH2 ARG 16 0.504 5.868 -31.007
111 HH22 ARG 16 2HH2 ARG 16 0.763 7.097 -32.198
112 H ARG 17 H ARG 17 2.784 3.074 -24.122
113 HA ARG 17 HA ARG 17 5.569 2.579 -24.926
114 HB2 ARG 17 2HB ARG 17 4.589 2.280 -22.089
115 HB3 ARG 17 3HB ARG 17 6.245 2.182 -22.672
116 HG2 ARG 17 2HG ARG 17 4.551 4.670 -22.720
117 HG3 ARG 17 3HG ARG 17 5.754 4.284 -21.488
118 HD2 ARG 17 2HD ARG 17 7.119 3.955 -23.870
119 HD3 ARG 17 3HD ARG 17 6.103 5.366 -24.161
120 HE ARG 17 HE ARG 17 7.385 6.554 -22.680
121 HH11 ARG 17 1HH1 ARG 17 8.044 3.157 -22.302
122 HH12 ARG 17 2HH1 ARG 17 9.384 3.403 -21.232
123 HH21 ARG 17 1HH2 ARG 17 9.148 6.891 -21.272
124 HH22 ARG 17 2HH2 ARG 17 10.011 5.527 -20.646
125 H LYS 18 H LYS 18 2.722 1.403 -25.324
126 HA LYS 18 HA LYS 18 1.747 -0.646 -25.531
127 HB2 LYS 18 2HB LYS 18 4.640 -1.500 -25.745
128 HB3 LYS 18 3HB LYS 18 3.258 -2.475 -26.226
129 HG2 LYS 18 2HG LYS 18 2.731 -1.029 -28.011
130 HG3 LYS 18 3HG LYS 18 3.816 0.227 -27.411
131 HD2 LYS 18 2HD LYS 18 5.544 -1.838 -27.700
132 HD3 LYS 18 3HD LYS 18 4.399 -2.185 -28.997
133 HE2 LYS 18 2HE LYS 18 4.935 -0.294 -30.161
134 HE3 LYS 18 3HE LYS 18 5.368 0.608 -28.709
135 HZ1 LYS 18 3HZ LYS 18 7.109 -0.525 -30.474
136 HZ2 LYS 18 1HZ LYS 18 7.114 -1.607 -29.174
137 HZ3 LYS 18 2HZ LYS 18 7.488 0.022 -28.918
138 H GLY 19 H GLY 19 2.387 0.268 -22.822
139 HA2 GLY 19 2HA GLY 19 1.892 -0.653 -20.746
140 HA3 GLY 19 3HA GLY 19 1.935 -2.251 -21.476
141 H GLY 20 H GLY 20 3.026 -2.326 -19.158
142 HA2 GLY 20 2HA GLY 20 5.861 -2.633 -19.703
143 HA3 GLY 20 3HA GLY 20 5.464 -1.458 -18.458
144 H LYS 21 H LYS 21 6.526 -2.671 -16.866
145 HA LYS 21 HA LYS 21 4.871 -4.684 -15.643
146 HB2 LYS 21 2HB LYS 21 6.820 -6.318 -15.489
147 HB3 LYS 21 3HB LYS 21 6.007 -6.205 -17.045
148 HG2 LYS 21 2HG LYS 21 8.207 -4.340 -16.866
149 HG3 LYS 21 3HG LYS 21 8.729 -5.999 -16.564
150 HD2 LYS 21 2HD LYS 21 6.887 -5.587 -18.841
151 HD3 LYS 21 3HD LYS 21 8.520 -4.944 -19.023
152 HE2 LYS 21 2HE LYS 21 9.499 -7.060 -18.770
153 HE3 LYS 21 3HE LYS 21 8.028 -7.754 -18.088
154 HZ1 LYS 21 3HZ LYS 21 7.028 -7.208 -20.372
155 HZ2 LYS 21 1HZ LYS 21 8.049 -8.551 -20.243
156 HZ3 LYS 21 2HZ LYS 21 8.632 -7.105 -20.900
157 H CYS 22 H CYS 22 5.664 -5.306 -13.499
158 HA CYS 22 HA CYS 22 7.046 -3.066 -12.245
159 HB2 CYS 22 2HB CYS 22 5.002 -4.956 -11.445
160 HB3 CYS 22 3HB CYS 22 6.306 -4.900 -10.263
161 H LYS 23 H LYS 23 8.977 -3.200 -11.215
162 HA LYS 23 HA LYS 23 10.291 -5.828 -11.093
163 HB2 LYS 23 2HB LYS 23 11.010 -4.293 -13.050
164 HB3 LYS 23 3HB LYS 23 11.813 -3.337 -11.811
165 HG2 LYS 23 2HG LYS 23 13.353 -4.988 -11.342
166 HG3 LYS 23 3HG LYS 23 12.325 -6.272 -11.984
167 HD2 LYS 23 2HD LYS 23 12.657 -5.276 -14.260
168 HD3 LYS 23 3HD LYS 23 13.847 -4.186 -13.543
169 HE2 LYS 23 2HE LYS 23 14.224 -7.033 -12.916
170 HE3 LYS 23 3HE LYS 23 14.422 -6.613 -14.617
171 HZ1 LYS 23 3HZ LYS 23 15.741 -4.841 -12.743
172 HZ2 LYS 23 1HZ LYS 23 16.299 -5.481 -14.206
173 HZ3 LYS 23 2HZ LYS 23 16.362 -6.414 -12.797
174 H ASN 24 H ASN 24 9.968 -5.986 -8.880
175 HA ASN 24 HA ASN 24 10.379 -5.675 -6.664
176 HB2 ASN 24 2HB ASN 24 12.848 -4.555 -7.953
177 HB3 ASN 24 3HB ASN 24 12.646 -4.465 -6.205
178 HD21 ASN 24 1HD2 ASN 24 14.657 -5.902 -7.612
179 HD22 ASN 24 2HD2 ASN 24 14.459 -7.576 -7.232
180 H GLY 25 H GLY 25 8.826 -3.650 -8.133
181 HA2 GLY 25 2HA GLY 25 7.644 -1.928 -6.876
182 HA3 GLY 25 3HA GLY 25 9.197 -1.427 -6.225
183 H ASP 26 H ASP 26 10.490 -1.707 -8.879
184 HA ASP 26 HA ASP 26 9.863 0.946 -9.831
185 HB2 ASP 26 2HB ASP 26 11.931 -1.103 -10.623
186 HB3 ASP 26 3HB ASP 26 11.734 0.422 -11.482
187 H CYS 27 H CYS 27 8.238 1.281 -11.187
188 HA CYS 27 HA CYS 27 7.193 -0.833 -12.845
189 HB2 CYS 27 2HB CYS 27 6.371 1.902 -12.073
190 HB3 CYS 27 3HB CYS 27 5.842 1.366 -13.664
191 H VAL 28 H VAL 28 8.527 -1.366 -14.494
192 HA VAL 28 HA VAL 28 9.784 0.712 -16.097
193 HB VAL 28 HB VAL 28 9.919 -2.279 -16.486
194 HG11 VAL 28 1HG1 VAL 28 11.938 -1.787 -17.756
195 HG12 VAL 28 2HG1 VAL 28 10.549 -0.943 -18.442
196 HG13 VAL 28 3HG1 VAL 28 11.719 -0.062 -17.459
197 HG21 VAL 28 3HG2 VAL 28 12.297 -1.719 -15.433
198 HG22 VAL 28 1HG2 VAL 28 11.352 -0.464 -14.630
199 HG23 VAL 28 2HG2 VAL 28 10.908 -2.161 -14.439
200 H CYS 29 H CYS 29 9.129 1.356 -18.061
201 HA CYS 29 HA CYS 29 6.754 0.039 -19.193
202 HB2 CYS 29 2HB CYS 29 7.752 2.875 -19.294
203 HB3 CYS 29 3HB CYS 29 6.592 2.280 -20.477
204 H ARG 30 H ARG 30 7.031 -1.128 -20.966
205 HA ARG 30 HA ARG 30 9.507 -1.242 -22.348
206 HB2 ARG 30 2HB ARG 30 6.807 -2.473 -22.737
207 HB3 ARG 30 3HB ARG 30 8.000 -2.587 -24.024
208 HG2 ARG 30 2HG ARG 30 9.577 -3.567 -22.327
209 HG3 ARG 30 3HG ARG 30 8.201 -3.659 -21.225
210 HD2 ARG 30 2HD ARG 30 8.210 -4.893 -23.971
211 HD3 ARG 30 3HD ARG 30 8.710 -5.761 -22.520
212 HE ARG 30 HE ARG 30 6.124 -4.590 -22.237
213 HH11 ARG 30 1HH1 ARG 30 7.847 -7.304 -23.573
214 HH12 ARG 30 2HH1 ARG 30 6.477 -8.363 -23.526
215 HH21 ARG 30 1HH2 ARG 30 4.313 -5.975 -22.170
216 HH22 ARG 30 2HH2 ARG 30 4.467 -7.606 -22.729
Start of MODEL 11
1 H1 PHE 1 H PHE 1 3.594 -0.563 0.784
2 HA PHE 1 HA PHE 1 4.570 -1.657 -1.123
3 HB2 PHE 1 2HB PHE 1 3.233 -3.855 0.085
4 HB3 PHE 1 3HB PHE 1 2.642 -3.721 -1.569
5 HD1 PHE 1 HD1 PHE 1 5.971 -3.234 0.051
6 HD2 PHE 1 HD2 PHE 1 3.694 -5.207 -2.956
7 HE1 PHE 1 HE1 PHE 1 8.011 -4.343 -0.761
8 HE2 PHE 1 HE2 PHE 1 5.731 -6.319 -3.773
9 HZ PHE 1 HZ PHE 1 7.893 -5.889 -2.675
10 H SER 2 H SER 2 3.816 -1.522 -3.306
11 HA SER 2 HA SER 2 1.057 -0.903 -3.838
12 HB2 SER 2 2HB SER 2 2.044 1.241 -2.897
13 HB3 SER 2 3HB SER 2 3.069 1.296 -4.331
14 HG SER 2 HG SER 2 1.362 2.399 -5.005
15 H CYS 3 H CYS 3 2.835 -2.871 -4.781
16 HA CYS 3 HA CYS 3 3.815 -2.089 -7.375
17 HB2 CYS 3 2HB CYS 3 4.740 -3.935 -5.799
18 HB3 CYS 3 3HB CYS 3 3.460 -4.935 -6.477
19 H ASP 4 H ASP 4 1.407 -1.284 -7.664
20 HA ASP 4 HA ASP 4 -0.481 -3.287 -8.466
21 HB2 ASP 4 2HB ASP 4 -0.523 -0.313 -9.017
22 HB3 ASP 4 3HB ASP 4 -1.887 -1.420 -9.138
23 H HIS 5 H HIS 5 0.321 -4.520 -10.116
24 HA HIS 5 HA HIS 5 1.748 -3.581 -12.338
25 HB2 HIS 5 2HB HIS 5 1.599 -5.969 -11.608
26 HB3 HIS 5 3HB HIS 5 -0.044 -6.016 -12.241
27 HD1 HIS 5 HD1 HIS 5 1.077 -7.989 -13.741
28 HD2 HIS 5 HD2 HIS 5 2.221 -4.090 -14.606
29 HE1 HIS 5 HE1 HIS 5 2.086 -8.080 -16.043
30 H SER 6 H SER 6 -1.684 -3.792 -11.700
31 HA SER 6 HA SER 6 -2.609 -3.454 -14.341
32 HB2 SER 6 2HB SER 6 -4.138 -2.342 -12.019
33 HB3 SER 6 3HB SER 6 -4.726 -3.236 -13.421
34 HG SER 6 HG SER 6 -4.718 -4.450 -11.431
35 H ALA 7 H ALA 7 -2.350 -1.059 -11.709
36 HA ALA 7 HA ALA 7 -3.036 1.203 -13.133
37 HB1 ALA 7 1HB ALA 7 -2.666 1.064 -10.671
38 HB2 ALA 7 2HB ALA 7 -0.930 1.112 -10.981
39 HB3 ALA 7 3HB ALA 7 -1.945 2.482 -11.433
40 H CYS 8 H CYS 8 0.171 -0.277 -12.780
41 HA CYS 8 HA CYS 8 1.559 1.681 -14.281
42 HB2 CYS 8 2HB CYS 8 2.294 -1.214 -13.796
43 HB3 CYS 8 3HB CYS 8 3.388 0.050 -14.349
44 H ALA 9 H ALA 9 0.263 -1.512 -15.145
45 HA ALA 9 HA ALA 9 1.118 -1.684 -17.761
46 HB1 ALA 9 1HB ALA 9 -1.307 -2.713 -16.349
47 HB2 ALA 9 2HB ALA 9 -1.122 -2.958 -18.086
48 HB3 ALA 9 3HB ALA 9 0.087 -3.596 -16.972
49 H VAL 10 H VAL 10 -1.861 -0.160 -16.550
50 HA VAL 10 HA VAL 10 -2.746 0.709 -19.107
51 HB VAL 10 HB VAL 10 -3.496 1.767 -16.378
52 HG11 VAL 10 1HG1 VAL 10 -5.663 2.155 -17.953
53 HG12 VAL 10 2HG1 VAL 10 -4.439 3.385 -17.628
54 HG13 VAL 10 3HG1 VAL 10 -4.360 2.430 -19.109
55 HG21 VAL 10 3HG2 VAL 10 -5.595 0.313 -17.016
56 HG22 VAL 10 1HG2 VAL 10 -4.414 -0.559 -17.993
57 HG23 VAL 10 2HG2 VAL 10 -4.184 -0.416 -16.251
58 H ARG 11 H ARG 11 -1.132 2.379 -16.413
59 HA ARG 11 HA ARG 11 -1.006 4.916 -17.577
60 HB2 ARG 11 2HB ARG 11 -0.521 4.397 -15.188
61 HB3 ARG 11 3HB ARG 11 1.007 3.684 -15.688
62 HG2 ARG 11 2HG ARG 11 1.849 5.778 -16.412
63 HG3 ARG 11 3HG ARG 11 0.264 6.539 -16.261
64 HD2 ARG 11 2HD ARG 11 1.284 7.254 -14.329
65 HD3 ARG 11 3HD ARG 11 0.474 5.793 -13.764
66 HE ARG 11 HE ARG 11 2.524 4.820 -13.427
67 HH11 ARG 11 1HH1 ARG 11 2.909 7.705 -15.336
68 HH12 ARG 11 2HH1 ARG 11 4.639 7.698 -15.236
69 HH21 ARG 11 1HH2 ARG 11 4.801 4.799 -13.287
70 HH22 ARG 11 2HH2 ARG 11 5.714 6.044 -14.071
71 H CYS 12 H CYS 12 0.754 2.045 -18.264
72 HA CYS 12 HA CYS 12 2.936 3.425 -19.587
73 HB2 CYS 12 2HB CYS 12 2.248 0.534 -19.126
74 HB3 CYS 12 3HB CYS 12 3.513 0.993 -20.261
75 H LEU 13 H LEU 13 0.290 1.240 -20.534
76 HA LEU 13 HA LEU 13 0.752 1.371 -23.302
77 HB2 LEU 13 2HB LEU 13 -1.088 0.076 -23.509
78 HB3 LEU 13 3HB LEU 13 -0.827 -0.130 -21.778
79 HG LEU 13 HG LEU 13 -2.472 1.952 -21.667
80 HD11 LEU 13 1HD1 LEU 13 -4.133 0.875 -23.667
81 HD12 LEU 13 2HD1 LEU 13 -2.567 1.183 -24.417
82 HD13 LEU 13 3HD1 LEU 13 -3.422 2.488 -23.595
83 HD21 LEU 13 3HD2 LEU 13 -3.901 0.477 -20.764
84 HD22 LEU 13 1HD2 LEU 13 -2.624 -0.699 -21.076
85 HD23 LEU 13 2HD2 LEU 13 -3.953 -0.518 -22.221
86 H ALA 14 H ALA 14 -0.805 3.551 -21.110
87 HA ALA 14 HA ALA 14 -2.210 5.019 -23.157
88 HB1 ALA 14 1HB ALA 14 -2.801 6.559 -21.357
89 HB2 ALA 14 2HB ALA 14 -3.115 4.886 -20.894
90 HB3 ALA 14 3HB ALA 14 -1.693 5.722 -20.270
91 H GLN 15 H GLN 15 0.919 5.078 -21.700
92 HA GLN 15 HA GLN 15 1.480 7.773 -22.667
93 HB2 GLN 15 2HB GLN 15 2.571 6.032 -20.622
94 HB3 GLN 15 3HB GLN 15 3.841 6.680 -21.652
95 HG2 GLN 15 2HG GLN 15 2.802 8.958 -21.244
96 HG3 GLN 15 3HG GLN 15 1.863 8.181 -19.970
97 HE21 GLN 15 1HE2 GLN 15 2.733 8.083 -18.023
98 HE22 GLN 15 2HE2 GLN 15 4.400 8.335 -17.646
99 H ARG 16 H ARG 16 1.091 5.221 -24.330
100 HA ARG 16 HA ARG 16 1.889 4.396 -26.294
101 HB2 ARG 16 2HB ARG 16 3.852 6.689 -26.273
102 HB3 ARG 16 3HB ARG 16 3.267 5.792 -27.667
103 HG2 ARG 16 2HG ARG 16 0.953 6.765 -26.557
104 HG3 ARG 16 3HG ARG 16 2.106 8.074 -26.290
105 HD2 ARG 16 2HD ARG 16 1.181 8.531 -28.390
106 HD3 ARG 16 3HD ARG 16 2.735 7.781 -28.748
107 HE ARG 16 HE ARG 16 1.629 6.004 -29.687
108 HH11 ARG 16 1HH1 ARG 16 -0.620 7.934 -27.860
109 HH12 ARG 16 2HH1 ARG 16 -2.017 7.092 -28.444
110 HH21 ARG 16 1HH2 ARG 16 -0.203 4.888 -30.463
111 HH22 ARG 16 2HH2 ARG 16 -1.779 5.359 -29.923
112 H ARG 17 H ARG 17 2.791 3.043 -24.205
113 HA ARG 17 HA ARG 17 5.588 2.470 -24.907
114 HB2 ARG 17 2HB ARG 17 4.518 2.295 -22.091
115 HB3 ARG 17 3HB ARG 17 6.188 2.137 -22.618
116 HG2 ARG 17 2HG ARG 17 4.561 4.661 -22.826
117 HG3 ARG 17 3HG ARG 17 5.695 4.295 -21.525
118 HD2 ARG 17 2HD ARG 17 6.589 4.178 -24.376
119 HD3 ARG 17 3HD ARG 17 6.467 5.732 -23.553
120 HE ARG 17 HE ARG 17 7.925 3.951 -21.944
121 HH11 ARG 17 1HH1 ARG 17 8.207 5.715 -24.932
122 HH12 ARG 17 2HH1 ARG 17 9.932 5.841 -24.846
123 HH21 ARG 17 1HH2 ARG 17 10.197 4.110 -21.819
124 HH22 ARG 17 2HH2 ARG 17 11.063 4.927 -23.076
125 H LYS 18 H LYS 18 2.733 1.332 -25.349
126 HA LYS 18 HA LYS 18 1.725 -0.706 -25.512
127 HB2 LYS 18 2HB LYS 18 4.261 -0.902 -26.558
128 HB3 LYS 18 3HB LYS 18 4.214 -2.254 -25.434
129 HG2 LYS 18 2HG LYS 18 2.390 -3.247 -26.545
130 HG3 LYS 18 3HG LYS 18 2.065 -1.783 -27.477
131 HD2 LYS 18 2HD LYS 18 4.764 -2.927 -27.794
132 HD3 LYS 18 3HD LYS 18 3.439 -3.907 -28.428
133 HE2 LYS 18 2HE LYS 18 3.783 -2.627 -30.263
134 HE3 LYS 18 3HE LYS 18 2.714 -1.523 -29.400
135 HZ1 LYS 18 3HZ LYS 18 4.720 -0.432 -30.261
136 HZ2 LYS 18 1HZ LYS 18 5.680 -1.433 -29.291
137 HZ3 LYS 18 2HZ LYS 18 4.614 -0.331 -28.576
138 H GLY 19 H GLY 19 2.302 0.294 -22.819
139 HA2 GLY 19 2HA GLY 19 1.728 -0.544 -20.728
140 HA3 GLY 19 3HA GLY 19 1.764 -2.167 -21.400
141 H GLY 20 H GLY 20 2.785 -2.254 -19.082
142 HA2 GLY 20 2HA GLY 20 5.649 -2.523 -19.525
143 HA3 GLY 20 3HA GLY 20 5.175 -1.401 -18.258
144 H LYS 21 H LYS 21 6.187 -2.651 -16.663
145 HA LYS 21 HA LYS 21 4.519 -4.736 -15.587
146 HB2 LYS 21 2HB LYS 21 6.413 -6.381 -15.429
147 HB3 LYS 21 3HB LYS 21 5.781 -6.137 -17.051
148 HG2 LYS 21 2HG LYS 21 7.883 -4.281 -16.662
149 HG3 LYS 21 3HG LYS 21 8.447 -5.864 -16.120
150 HD2 LYS 21 2HD LYS 21 6.960 -5.773 -18.680
151 HD3 LYS 21 3HD LYS 21 8.577 -5.066 -18.671
152 HE2 LYS 21 2HE LYS 21 9.500 -7.149 -17.817
153 HE3 LYS 21 3HE LYS 21 7.886 -7.856 -17.753
154 HZ1 LYS 21 3HZ LYS 21 8.032 -7.059 -20.307
155 HZ2 LYS 21 1HZ LYS 21 8.420 -8.617 -19.774
156 HZ3 LYS 21 2HZ LYS 21 9.645 -7.477 -20.014
157 H CYS 22 H CYS 22 5.278 -5.458 -13.443
158 HA CYS 22 HA CYS 22 6.335 -3.214 -11.969
159 HB2 CYS 22 2HB CYS 22 4.479 -5.090 -11.365
160 HB3 CYS 22 3HB CYS 22 5.890 -5.785 -10.574
161 H LYS 23 H LYS 23 8.240 -3.116 -10.833
162 HA LYS 23 HA LYS 23 10.133 -5.337 -11.228
163 HB2 LYS 23 2HB LYS 23 10.459 -3.204 -12.679
164 HB3 LYS 23 3HB LYS 23 11.033 -2.472 -11.186
165 HG2 LYS 23 2HG LYS 23 13.036 -3.239 -11.778
166 HG3 LYS 23 3HG LYS 23 12.440 -4.822 -11.273
167 HD2 LYS 23 2HD LYS 23 11.942 -5.462 -13.468
168 HD3 LYS 23 3HD LYS 23 11.981 -3.798 -14.057
169 HE2 LYS 23 2HE LYS 23 14.013 -4.470 -14.814
170 HE3 LYS 23 3HE LYS 23 14.493 -3.978 -13.191
171 HZ1 LYS 23 3HZ LYS 23 15.418 -6.109 -13.618
172 HZ2 LYS 23 1HZ LYS 23 13.934 -6.733 -14.138
173 HZ3 LYS 23 2HZ LYS 23 14.158 -6.332 -12.511
174 H ASN 24 H ASN 24 9.681 -6.079 -9.120
175 HA ASN 24 HA ASN 24 9.901 -6.215 -6.856
176 HB2 ASN 24 2HB ASN 24 12.239 -4.351 -7.316
177 HB3 ASN 24 3HB ASN 24 12.008 -5.425 -5.940
178 HD21 ASN 24 1HD2 ASN 24 13.127 -7.220 -6.021
179 HD22 ASN 24 2HD2 ASN 24 13.642 -8.041 -7.452
180 H GLY 25 H GLY 25 8.051 -4.277 -7.730
181 HA2 GLY 25 2HA GLY 25 6.740 -2.957 -6.187
182 HA3 GLY 25 3HA GLY 25 8.243 -2.370 -5.489
183 H ASP 26 H ASP 26 9.347 -2.065 -8.283
184 HA ASP 26 HA ASP 26 8.413 0.645 -8.660
185 HB2 ASP 26 2HB ASP 26 10.623 -1.013 -9.840
186 HB3 ASP 26 3HB ASP 26 10.159 0.515 -10.586
187 H CYS 27 H CYS 27 8.368 1.258 -11.183
188 HA CYS 27 HA CYS 27 6.614 -0.656 -12.561
189 HB2 CYS 27 2HB CYS 27 5.998 2.113 -11.706
190 HB3 CYS 27 3HB CYS 27 5.498 1.678 -13.337
191 H VAL 28 H VAL 28 7.849 -1.223 -14.247
192 HA VAL 28 HA VAL 28 9.292 0.870 -15.718
193 HB VAL 28 HB VAL 28 9.573 -2.121 -16.020
194 HG11 VAL 28 1HG1 VAL 28 11.262 0.189 -16.970
195 HG12 VAL 28 2HG1 VAL 28 11.714 -1.512 -17.100
196 HG13 VAL 28 3HG1 VAL 28 10.305 -0.903 -17.970
197 HG21 VAL 28 3HG2 VAL 28 10.201 -1.507 -13.767
198 HG22 VAL 28 1HG2 VAL 28 11.649 -1.867 -14.706
199 HG23 VAL 28 2HG2 VAL 28 11.208 -0.193 -14.374
200 H CYS 29 H CYS 29 8.784 1.404 -17.765
201 HA CYS 29 HA CYS 29 6.467 0.057 -18.963
202 HB2 CYS 29 2HB CYS 29 7.628 2.817 -19.296
203 HB3 CYS 29 3HB CYS 29 6.459 2.161 -20.437
204 H ARG 30 H ARG 30 6.802 -1.291 -20.591
205 HA ARG 30 HA ARG 30 9.188 -0.897 -22.276
206 HB2 ARG 30 2HB ARG 30 8.091 -3.321 -20.973
207 HB3 ARG 30 3HB ARG 30 8.675 -3.523 -22.619
208 HG2 ARG 30 2HG ARG 30 10.672 -2.067 -21.368
209 HG3 ARG 30 3HG ARG 30 10.152 -3.237 -20.153
210 HD2 ARG 30 2HD ARG 30 11.804 -4.384 -21.314
211 HD3 ARG 30 3HD ARG 30 10.315 -4.959 -22.063
212 HE ARG 30 HE ARG 30 11.008 -2.885 -23.638
213 HH11 ARG 30 1HH1 ARG 30 12.762 -5.655 -22.466
214 HH12 ARG 30 2HH1 ARG 30 13.798 -5.748 -23.851
215 HH21 ARG 30 1HH2 ARG 30 12.366 -2.997 -25.467
216 HH22 ARG 30 2HH2 ARG 30 13.573 -4.235 -25.557
Start of MODEL 12
1 H1 PHE 1 H PHE 1 3.303 -2.916 1.319
2 HA PHE 1 HA PHE 1 1.941 -1.178 -0.325
3 HB2 PHE 1 2HB PHE 1 4.446 -0.176 -0.132
4 HB3 PHE 1 3HB PHE 1 4.651 -1.248 -1.513
5 HD1 PHE 1 HD1 PHE 1 2.153 1.239 -0.279
6 HD2 PHE 1 HD2 PHE 1 4.361 -0.303 -3.575
7 HE1 PHE 1 HE1 PHE 1 1.152 2.944 -1.743
8 HE2 PHE 1 HE2 PHE 1 3.364 1.401 -5.044
9 HZ PHE 1 HZ PHE 1 1.758 3.028 -4.129
10 H SER 2 H SER 2 2.257 -1.846 -2.773
11 HA SER 2 HA SER 2 3.148 -4.559 -3.164
12 HB2 SER 2 2HB SER 2 0.866 -5.335 -3.925
13 HB3 SER 2 3HB SER 2 1.029 -5.098 -2.185
14 HG SER 2 HG SER 2 -0.068 -3.202 -3.991
15 H CYS 3 H CYS 3 3.978 -4.646 -5.136
16 HA CYS 3 HA CYS 3 3.759 -2.552 -6.997
17 HB2 CYS 3 2HB CYS 3 5.583 -4.392 -6.728
18 HB3 CYS 3 3HB CYS 3 4.553 -5.333 -7.802
19 H ASP 4 H ASP 4 1.738 -2.076 -7.704
20 HA ASP 4 HA ASP 4 -0.085 -4.137 -8.570
21 HB2 ASP 4 2HB ASP 4 -0.273 -1.122 -8.748
22 HB3 ASP 4 3HB ASP 4 -1.575 -2.241 -9.140
23 H HIS 5 H HIS 5 0.910 -5.159 -10.302
24 HA HIS 5 HA HIS 5 2.176 -3.979 -12.465
25 HB2 HIS 5 2HB HIS 5 2.260 -6.375 -12.103
26 HB3 HIS 5 3HB HIS 5 0.525 -6.512 -12.375
27 HD1 HIS 5 HD1 HIS 5 3.774 -6.291 -14.145
28 HD2 HIS 5 HD2 HIS 5 -0.272 -6.277 -15.092
29 HE1 HIS 5 HE1 HIS 5 3.663 -6.665 -16.629
30 H SER 6 H SER 6 -1.215 -4.235 -11.748
31 HA SER 6 HA SER 6 -2.229 -3.758 -14.341
32 HB2 SER 6 2HB SER 6 -3.602 -2.896 -11.800
33 HB3 SER 6 3HB SER 6 -4.333 -3.442 -13.309
34 HG SER 6 HG SER 6 -3.940 -4.918 -11.271
35 H ALA 7 H ALA 7 -1.887 -1.529 -11.576
36 HA ALA 7 HA ALA 7 -2.626 0.814 -12.831
37 HB1 ALA 7 1HB ALA 7 -0.368 0.858 -10.880
38 HB2 ALA 7 2HB ALA 7 -1.756 1.938 -11.019
39 HB3 ALA 7 3HB ALA 7 -1.963 0.316 -10.358
40 H CYS 8 H CYS 8 0.583 -0.692 -12.705
41 HA CYS 8 HA CYS 8 1.910 1.370 -14.134
42 HB2 CYS 8 2HB CYS 8 2.622 -1.522 -13.628
43 HB3 CYS 8 3HB CYS 8 3.690 -0.396 -14.460
44 H ALA 9 H ALA 9 0.593 -1.779 -15.113
45 HA ALA 9 HA ALA 9 1.365 -1.823 -17.760
46 HB1 ALA 9 1HB ALA 9 -0.668 -3.211 -18.152
47 HB2 ALA 9 2HB ALA 9 0.308 -3.729 -16.776
48 HB3 ALA 9 3HB ALA 9 -1.184 -2.828 -16.509
49 H VAL 10 H VAL 10 -1.574 -0.363 -16.385
50 HA VAL 10 HA VAL 10 -2.535 0.633 -18.868
51 HB VAL 10 HB VAL 10 -3.204 1.605 -16.087
52 HG11 VAL 10 1HG1 VAL 10 -4.093 2.367 -18.744
53 HG12 VAL 10 2HG1 VAL 10 -5.428 1.865 -17.705
54 HG13 VAL 10 3HG1 VAL 10 -4.352 3.165 -17.193
55 HG21 VAL 10 3HG2 VAL 10 -3.550 -0.834 -16.412
56 HG22 VAL 10 1HG2 VAL 10 -5.042 0.056 -16.113
57 HG23 VAL 10 2HG2 VAL 10 -4.638 -0.463 -17.749
58 H ARG 11 H ARG 11 -0.839 2.168 -16.143
59 HA ARG 11 HA ARG 11 -0.746 4.760 -17.182
60 HB2 ARG 11 2HB ARG 11 -0.149 3.972 -14.830
61 HB3 ARG 11 3HB ARG 11 1.423 3.536 -15.485
62 HG2 ARG 11 2HG ARG 11 2.098 5.688 -15.672
63 HG3 ARG 11 3HG ARG 11 0.474 6.284 -16.018
64 HD2 ARG 11 2HD ARG 11 0.719 5.186 -13.336
65 HD3 ARG 11 3HD ARG 11 1.832 6.523 -13.625
66 HE ARG 11 HE ARG 11 -1.031 6.664 -13.410
67 HH11 ARG 11 1HH1 ARG 11 1.826 8.195 -14.680
68 HH12 ARG 11 2HH1 ARG 11 1.108 9.770 -14.754
69 HH21 ARG 11 1HH2 ARG 11 -1.988 8.733 -13.502
70 HH22 ARG 11 2HH2 ARG 11 -1.061 10.075 -14.083
71 H CYS 12 H CYS 12 0.989 1.928 -18.066
72 HA CYS 12 HA CYS 12 3.131 3.374 -19.385
73 HB2 CYS 12 2HB CYS 12 2.454 0.462 -19.054
74 HB3 CYS 12 3HB CYS 12 3.689 0.982 -20.196
75 H LEU 13 H LEU 13 0.456 1.236 -20.359
76 HA LEU 13 HA LEU 13 0.833 1.506 -23.130
77 HB2 LEU 13 2HB LEU 13 -1.013 0.222 -23.345
78 HB3 LEU 13 3HB LEU 13 -0.701 -0.070 -21.635
79 HG LEU 13 HG LEU 13 -2.340 2.003 -21.370
80 HD11 LEU 13 1HD1 LEU 13 -3.360 2.629 -23.233
81 HD12 LEU 13 2HD1 LEU 13 -4.055 1.015 -23.376
82 HD13 LEU 13 3HD1 LEU 13 -2.513 1.383 -24.150
83 HD21 LEU 13 3HD2 LEU 13 -4.030 0.479 -20.813
84 HD22 LEU 13 1HD2 LEU 13 -2.529 -0.415 -20.571
85 HD23 LEU 13 2HD2 LEU 13 -3.496 -0.692 -22.020
86 H ALA 14 H ALA 14 -0.654 3.573 -20.784
87 HA ALA 14 HA ALA 14 -2.121 5.141 -22.710
88 HB1 ALA 14 1HB ALA 14 -2.564 6.633 -20.778
89 HB2 ALA 14 2HB ALA 14 -3.021 4.954 -20.491
90 HB3 ALA 14 3HB ALA 14 -1.536 5.596 -19.789
91 H GLN 15 H GLN 15 1.054 5.126 -21.355
92 HA GLN 15 HA GLN 15 1.586 7.868 -22.199
93 HB2 GLN 15 2HB GLN 15 2.742 6.024 -20.284
94 HB3 GLN 15 3HB GLN 15 3.978 6.722 -21.322
95 HG2 GLN 15 2HG GLN 15 2.972 8.978 -20.764
96 HG3 GLN 15 3HG GLN 15 2.057 8.143 -19.509
97 HE21 GLN 15 1HE2 GLN 15 3.187 7.181 -17.779
98 HE22 GLN 15 2HE2 GLN 15 4.781 7.694 -17.357
99 H ARG 16 H ARG 16 1.140 5.404 -23.977
100 HA ARG 16 HA ARG 16 1.871 4.682 -26.007
101 HB2 ARG 16 2HB ARG 16 3.843 6.965 -25.944
102 HB3 ARG 16 3HB ARG 16 3.186 6.150 -27.357
103 HG2 ARG 16 2HG ARG 16 0.901 7.021 -26.357
104 HG3 ARG 16 3HG ARG 16 1.965 8.219 -25.618
105 HD2 ARG 16 2HD ARG 16 2.922 8.317 -28.097
106 HD3 ARG 16 3HD ARG 16 1.288 7.772 -28.472
107 HE ARG 16 HE ARG 16 1.089 9.931 -26.718
108 HH11 ARG 16 1HH1 ARG 16 2.157 9.271 -29.965
109 HH12 ARG 16 2HH1 ARG 16 1.786 10.859 -30.549
110 HH21 ARG 16 1HH2 ARG 16 0.597 12.025 -27.475
111 HH22 ARG 16 2HH2 ARG 16 0.899 12.426 -29.132
112 H ARG 17 H ARG 17 2.842 3.224 -24.022
113 HA ARG 17 HA ARG 17 5.613 2.692 -24.848
114 HB2 ARG 17 2HB ARG 17 4.643 2.372 -22.009
115 HB3 ARG 17 3HB ARG 17 6.294 2.248 -22.602
116 HG2 ARG 17 2HG ARG 17 4.660 4.776 -22.641
117 HG3 ARG 17 3HG ARG 17 5.817 4.347 -21.379
118 HD2 ARG 17 2HD ARG 17 6.610 4.434 -24.271
119 HD3 ARG 17 3HD ARG 17 6.602 5.890 -23.277
120 HE ARG 17 HE ARG 17 8.044 3.981 -21.883
121 HH11 ARG 17 1HH1 ARG 17 8.271 5.669 -24.919
122 HH12 ARG 17 2HH1 ARG 17 10.002 5.617 -24.967
123 HH21 ARG 17 1HH2 ARG 17 10.323 3.906 -21.935
124 HH22 ARG 17 2HH2 ARG 17 11.168 4.613 -23.270
125 H LYS 18 H LYS 18 2.746 1.574 -25.248
126 HA LYS 18 HA LYS 18 1.732 -0.455 -25.479
127 HB2 LYS 18 2HB LYS 18 4.193 -0.591 -26.655
128 HB3 LYS 18 3HB LYS 18 4.259 -1.964 -25.558
129 HG2 LYS 18 2HG LYS 18 1.793 -2.255 -26.702
130 HG3 LYS 18 3HG LYS 18 2.757 -1.606 -28.031
131 HD2 LYS 18 2HD LYS 18 4.367 -3.378 -27.796
132 HD3 LYS 18 3HD LYS 18 3.564 -3.971 -26.341
133 HE2 LYS 18 2HE LYS 18 2.261 -5.263 -27.588
134 HE3 LYS 18 3HE LYS 18 1.628 -3.837 -28.408
135 HZ1 LYS 18 3HZ LYS 18 2.871 -5.748 -29.701
136 HZ2 LYS 18 1HZ LYS 18 4.233 -4.842 -29.267
137 HZ3 LYS 18 2HZ LYS 18 2.997 -4.129 -30.175
138 H GLY 19 H GLY 19 2.400 0.411 -22.761
139 HA2 GLY 19 2HA GLY 19 1.894 -0.532 -20.696
140 HA3 GLY 19 3HA GLY 19 1.910 -2.120 -21.449
141 H GLY 20 H GLY 20 3.005 -2.214 -19.121
142 HA2 GLY 20 2HA GLY 20 5.851 -2.506 -19.686
143 HA3 GLY 20 3HA GLY 20 5.426 -1.421 -18.370
144 H LYS 21 H LYS 21 6.507 -2.737 -16.865
145 HA LYS 21 HA LYS 21 4.863 -4.832 -15.776
146 HB2 LYS 21 2HB LYS 21 6.688 -6.530 -15.775
147 HB3 LYS 21 3HB LYS 21 6.060 -6.169 -17.378
148 HG2 LYS 21 2HG LYS 21 8.186 -4.396 -16.994
149 HG3 LYS 21 3HG LYS 21 8.741 -5.953 -16.374
150 HD2 LYS 21 2HD LYS 21 7.426 -5.627 -19.064
151 HD3 LYS 21 3HD LYS 21 9.172 -5.523 -18.826
152 HE2 LYS 21 2HE LYS 21 9.389 -7.745 -18.590
153 HE3 LYS 21 3HE LYS 21 7.933 -7.878 -17.605
154 HZ1 LYS 21 3HZ LYS 21 7.288 -7.249 -20.298
155 HZ2 LYS 21 1HZ LYS 21 6.782 -8.560 -19.355
156 HZ3 LYS 21 2HZ LYS 21 8.228 -8.653 -20.227
157 H CYS 22 H CYS 22 5.787 -5.682 -13.714
158 HA CYS 22 HA CYS 22 6.944 -3.482 -12.225
159 HB2 CYS 22 2HB CYS 22 5.362 -5.854 -11.621
160 HB3 CYS 22 3HB CYS 22 6.684 -5.627 -10.480
161 H LYS 23 H LYS 23 8.928 -3.430 -11.276
162 HA LYS 23 HA LYS 23 10.696 -5.744 -11.707
163 HB2 LYS 23 2HB LYS 23 11.091 -3.854 -13.338
164 HB3 LYS 23 3HB LYS 23 11.569 -2.865 -11.964
165 HG2 LYS 23 2HG LYS 23 13.619 -3.691 -12.033
166 HG3 LYS 23 3HG LYS 23 13.000 -5.338 -11.892
167 HD2 LYS 23 2HD LYS 23 12.872 -5.610 -14.214
168 HD3 LYS 23 3HD LYS 23 12.966 -3.873 -14.511
169 HE2 LYS 23 2HE LYS 23 15.304 -4.056 -13.422
170 HE3 LYS 23 3HE LYS 23 15.143 -5.782 -13.741
171 HZ1 LYS 23 3HZ LYS 23 14.817 -3.714 -15.839
172 HZ2 LYS 23 1HZ LYS 23 14.981 -5.384 -16.051
173 HZ3 LYS 23 2HZ LYS 23 16.295 -4.468 -15.509
174 H ASN 24 H ASN 24 10.672 -6.468 -9.617
175 HA ASN 24 HA ASN 24 11.094 -6.550 -7.380
176 HB2 ASN 24 2HB ASN 24 13.145 -4.401 -7.919
177 HB3 ASN 24 3HB ASN 24 13.187 -5.647 -6.675
178 HD21 ASN 24 1HD2 ASN 24 13.900 -7.670 -7.174
179 HD22 ASN 24 2HD2 ASN 24 14.599 -8.084 -8.699
180 H GLY 25 H GLY 25 8.994 -4.794 -8.148
181 HA2 GLY 25 2HA GLY 25 7.640 -3.601 -6.557
182 HA3 GLY 25 3HA GLY 25 9.111 -2.922 -5.877
183 H ASP 26 H ASP 26 10.190 -2.368 -8.587
184 HA ASP 26 HA ASP 26 9.029 0.245 -8.880
185 HB2 ASP 26 2HB ASP 26 11.279 -1.211 -10.254
186 HB3 ASP 26 3HB ASP 26 10.718 0.360 -10.822
187 H CYS 27 H CYS 27 8.777 0.984 -11.318
188 HA CYS 27 HA CYS 27 7.129 -1.004 -12.727
189 HB2 CYS 27 2HB CYS 27 6.378 1.678 -11.736
190 HB3 CYS 27 3HB CYS 27 5.865 1.305 -13.378
191 H VAL 28 H VAL 28 8.334 -1.441 -14.473
192 HA VAL 28 HA VAL 28 9.642 0.762 -15.899
193 HB VAL 28 HB VAL 28 9.949 -2.199 -16.399
194 HG11 VAL 28 1HG1 VAL 28 11.559 0.197 -17.268
195 HG12 VAL 28 2HG1 VAL 28 12.044 -1.482 -17.513
196 HG13 VAL 28 3HG1 VAL 28 10.590 -0.859 -18.295
197 HG21 VAL 28 3HG2 VAL 28 11.646 -0.362 -14.712
198 HG22 VAL 28 1HG2 VAL 28 10.652 -1.699 -14.132
199 HG23 VAL 28 2HG2 VAL 28 12.060 -2.020 -15.145
200 H CYS 29 H CYS 29 9.062 1.388 -17.906
201 HA CYS 29 HA CYS 29 6.717 0.065 -19.085
202 HB2 CYS 29 2HB CYS 29 7.762 2.884 -19.237
203 HB3 CYS 29 3HB CYS 29 6.595 2.275 -20.406
204 H ARG 30 H ARG 30 7.005 -1.124 -20.841
205 HA ARG 30 HA ARG 30 9.532 -1.134 -22.219
206 HB2 ARG 30 2HB ARG 30 6.988 -2.648 -22.834
207 HB3 ARG 30 3HB ARG 30 8.573 -2.968 -23.526
208 HG2 ARG 30 2HG ARG 30 8.598 -2.989 -20.621
209 HG3 ARG 30 3HG ARG 30 7.492 -4.180 -21.310
210 HD2 ARG 30 2HD ARG 30 10.056 -4.069 -22.688
211 HD3 ARG 30 3HD ARG 30 10.209 -4.486 -20.982
212 HE ARG 30 HE ARG 30 8.172 -6.057 -21.998
213 HH11 ARG 30 1HH1 ARG 30 11.578 -5.597 -22.551
214 HH12 ARG 30 2HH1 ARG 30 11.848 -7.231 -23.062
215 HH21 ARG 30 1HH2 ARG 30 8.515 -8.210 -22.668
216 HH22 ARG 30 2HH2 ARG 30 10.105 -8.716 -23.128
Start of MODEL 13
1 H1 PHE 1 H PHE 1 1.081 -1.632 0.832
2 HA PHE 1 HA PHE 1 0.362 -0.282 -1.638
3 HB2 PHE 1 2HB PHE 1 2.921 0.265 -0.137
4 HB3 PHE 1 3HB PHE 1 2.752 0.573 -1.862
5 HD1 PHE 1 HD1 PHE 1 1.038 1.328 1.362
6 HD2 PHE 1 HD2 PHE 1 2.083 2.663 -2.543
7 HE1 PHE 1 HE1 PHE 1 0.062 3.532 1.857
8 HE2 PHE 1 HE2 PHE 1 1.110 4.869 -2.053
9 HZ PHE 1 HZ PHE 1 0.098 5.306 0.149
10 H SER 2 H SER 2 1.500 -1.091 -3.490
11 HA SER 2 HA SER 2 3.444 -3.113 -3.402
12 HB2 SER 2 2HB SER 2 0.707 -4.005 -2.957
13 HB3 SER 2 3HB SER 2 1.429 -4.769 -4.373
14 HG SER 2 HG SER 2 1.819 -5.401 -1.861
15 H CYS 3 H CYS 3 4.363 -3.184 -5.348
16 HA CYS 3 HA CYS 3 3.424 -1.631 -7.493
17 HB2 CYS 3 2HB CYS 3 5.798 -2.145 -7.176
18 HB3 CYS 3 3HB CYS 3 5.483 -3.848 -7.495
19 H ASP 4 H ASP 4 1.409 -2.176 -8.213
20 HA ASP 4 HA ASP 4 0.788 -4.921 -8.913
21 HB2 ASP 4 2HB ASP 4 -0.708 -2.523 -8.344
22 HB3 ASP 4 3HB ASP 4 -1.240 -3.218 -9.872
23 H HIS 5 H HIS 5 1.073 -5.790 -10.854
24 HA HIS 5 HA HIS 5 2.364 -4.498 -12.957
25 HB2 HIS 5 2HB HIS 5 0.873 -7.066 -12.673
26 HB3 HIS 5 3HB HIS 5 1.261 -6.509 -14.298
27 HD1 HIS 5 HD1 HIS 5 3.296 -7.643 -15.094
28 HD2 HIS 5 HD2 HIS 5 3.514 -6.775 -11.037
29 HE1 HIS 5 HE1 HIS 5 5.562 -8.445 -14.356
30 H SER 6 H SER 6 -1.020 -4.726 -12.176
31 HA SER 6 HA SER 6 -2.091 -4.046 -14.692
32 HB2 SER 6 2HB SER 6 -3.136 -3.762 -11.877
33 HB3 SER 6 3HB SER 6 -4.076 -3.245 -13.277
34 HG SER 6 HG SER 6 -4.246 -5.542 -12.377
35 H ALA 7 H ALA 7 -1.563 -1.993 -11.822
36 HA ALA 7 HA ALA 7 -2.260 0.444 -12.913
37 HB1 ALA 7 1HB ALA 7 -1.384 1.387 -11.039
38 HB2 ALA 7 2HB ALA 7 -1.423 -0.292 -10.502
39 HB3 ALA 7 3HB ALA 7 0.082 0.409 -11.096
40 H CYS 8 H CYS 8 0.998 -1.002 -12.810
41 HA CYS 8 HA CYS 8 2.285 1.037 -14.250
42 HB2 CYS 8 2HB CYS 8 3.284 -0.922 -12.872
43 HB3 CYS 8 3HB CYS 8 3.160 -1.836 -14.371
44 H ALA 9 H ALA 9 0.865 -2.033 -15.325
45 HA ALA 9 HA ALA 9 1.578 -1.994 -17.989
46 HB1 ALA 9 1HB ALA 9 -0.873 -3.032 -16.604
47 HB2 ALA 9 2HB ALA 9 -0.640 -3.218 -18.342
48 HB3 ALA 9 3HB ALA 9 0.516 -3.930 -17.216
49 H VAL 10 H VAL 10 -1.282 -0.500 -16.488
50 HA VAL 10 HA VAL 10 -2.267 0.622 -18.907
51 HB VAL 10 HB VAL 10 -2.840 1.441 -16.055
52 HG11 VAL 10 1HG1 VAL 10 -3.585 3.234 -17.321
53 HG12 VAL 10 2HG1 VAL 10 -4.047 2.212 -18.683
54 HG13 VAL 10 3HG1 VAL 10 -5.022 2.217 -17.213
55 HG21 VAL 10 3HG2 VAL 10 -3.526 -0.907 -17.492
56 HG22 VAL 10 1HG2 VAL 10 -4.043 -0.416 -15.879
57 HG23 VAL 10 2HG2 VAL 10 -4.991 0.053 -17.290
58 H ARG 11 H ARG 11 -0.462 1.995 -16.166
59 HA ARG 11 HA ARG 11 -0.310 4.622 -17.106
60 HB2 ARG 11 2HB ARG 11 0.325 3.686 -14.803
61 HB3 ARG 11 3HB ARG 11 1.880 3.294 -15.525
62 HG2 ARG 11 2HG ARG 11 2.470 5.514 -15.782
63 HG3 ARG 11 3HG ARG 11 0.797 6.070 -15.717
64 HD2 ARG 11 2HD ARG 11 1.663 4.690 -13.295
65 HD3 ARG 11 3HD ARG 11 2.596 6.144 -13.645
66 HE ARG 11 HE ARG 11 -0.159 6.003 -12.826
67 HH11 ARG 11 1HH1 ARG 11 2.268 7.915 -14.431
68 HH12 ARG 11 2HH1 ARG 11 1.457 9.420 -14.147
69 HH21 ARG 11 1HH2 ARG 11 -1.236 7.977 -12.446
70 HH22 ARG 11 2HH2 ARG 11 -0.536 9.454 -13.017
71 H CYS 12 H CYS 12 1.314 1.775 -18.140
72 HA CYS 12 HA CYS 12 3.471 3.205 -19.452
73 HB2 CYS 12 2HB CYS 12 2.710 0.305 -19.216
74 HB3 CYS 12 3HB CYS 12 3.933 0.830 -20.368
75 H LEU 13 H LEU 13 0.707 1.191 -20.443
76 HA LEU 13 HA LEU 13 1.030 1.558 -23.210
77 HB2 LEU 13 2HB LEU 13 -0.860 0.341 -23.431
78 HB3 LEU 13 3HB LEU 13 -0.518 -0.027 -21.742
79 HG LEU 13 HG LEU 13 -2.084 2.082 -21.358
80 HD11 LEU 13 1HD1 LEU 13 -3.116 2.815 -23.175
81 HD12 LEU 13 2HD1 LEU 13 -3.879 1.235 -23.354
82 HD13 LEU 13 3HD1 LEU 13 -2.345 1.568 -24.156
83 HD21 LEU 13 3HD2 LEU 13 -2.290 -0.566 -20.928
84 HD22 LEU 13 1HD2 LEU 13 -3.619 -0.334 -22.065
85 HD23 LEU 13 2HD2 LEU 13 -3.574 0.586 -20.561
86 H ALA 14 H ALA 14 -0.337 3.576 -20.752
87 HA ALA 14 HA ALA 14 -1.796 5.263 -22.581
88 HB1 ALA 14 1HB ALA 14 -1.981 6.736 -20.500
89 HB2 ALA 14 2HB ALA 14 -2.750 5.149 -20.448
90 HB3 ALA 14 3HB ALA 14 -1.202 5.405 -19.643
91 H GLN 15 H GLN 15 1.405 5.098 -21.301
92 HA GLN 15 HA GLN 15 2.005 7.853 -22.051
93 HB2 GLN 15 2HB GLN 15 3.143 5.901 -20.235
94 HB3 GLN 15 3HB GLN 15 4.378 6.601 -21.274
95 HG2 GLN 15 2HG GLN 15 3.450 8.863 -20.606
96 HG3 GLN 15 3HG GLN 15 2.545 8.005 -19.360
97 HE21 GLN 15 1HE2 GLN 15 4.070 6.337 -18.187
98 HE22 GLN 15 2HE2 GLN 15 5.542 7.024 -17.599
99 H ARG 16 H ARG 16 1.443 5.475 -23.912
100 HA ARG 16 HA ARG 16 2.106 4.811 -25.984
101 HB2 ARG 16 2HB ARG 16 4.160 7.017 -25.889
102 HB3 ARG 16 3HB ARG 16 3.421 6.291 -27.310
103 HG2 ARG 16 2HG ARG 16 2.031 8.016 -25.270
104 HG3 ARG 16 3HG ARG 16 2.514 8.499 -26.897
105 HD2 ARG 16 2HD ARG 16 1.020 6.170 -27.243
106 HD3 ARG 16 3HD ARG 16 0.152 7.091 -26.015
107 HE ARG 16 HE ARG 16 0.445 7.754 -28.798
108 HH11 ARG 16 1HH1 ARG 16 -0.184 8.986 -25.604
109 HH12 ARG 16 2HH1 ARG 16 -1.030 10.388 -26.169
110 HH21 ARG 16 1HH2 ARG 16 -0.666 9.596 -29.556
111 HH22 ARG 16 2HH2 ARG 16 -1.305 10.734 -28.417
112 H ARG 17 H ARG 17 3.074 3.247 -24.080
113 HA ARG 17 HA ARG 17 5.808 2.662 -24.988
114 HB2 ARG 17 2HB ARG 17 4.891 2.257 -22.142
115 HB3 ARG 17 3HB ARG 17 6.524 2.113 -22.778
116 HG2 ARG 17 2HG ARG 17 4.955 4.679 -22.658
117 HG3 ARG 17 3HG ARG 17 6.153 4.170 -21.466
118 HD2 ARG 17 2HD ARG 17 7.234 3.982 -24.125
119 HD3 ARG 17 3HD ARG 17 6.595 5.600 -23.834
120 HE ARG 17 HE ARG 17 8.076 5.000 -21.605
121 HH11 ARG 17 1HH1 ARG 17 8.678 5.192 -25.029
122 HH12 ARG 17 2HH1 ARG 17 10.337 5.656 -24.843
123 HH21 ARG 17 1HH2 ARG 17 10.259 5.610 -21.348
124 HH22 ARG 17 2HH2 ARG 17 11.235 5.892 -22.749
125 H LYS 18 H LYS 18 2.898 1.650 -25.366
126 HA LYS 18 HA LYS 18 1.815 -0.336 -25.652
127 HB2 LYS 18 2HB LYS 18 4.262 -0.504 -26.873
128 HB3 LYS 18 3HB LYS 18 4.274 -1.934 -25.849
129 HG2 LYS 18 2HG LYS 18 2.018 -2.501 -26.845
130 HG3 LYS 18 3HG LYS 18 2.332 -1.228 -28.027
131 HD2 LYS 18 2HD LYS 18 4.092 -3.628 -27.524
132 HD3 LYS 18 3HD LYS 18 2.966 -3.447 -28.871
133 HE2 LYS 18 2HE LYS 18 5.352 -1.690 -28.298
134 HE3 LYS 18 3HE LYS 18 5.255 -2.929 -29.549
135 HZ1 LYS 18 3HZ LYS 18 4.605 -1.242 -30.840
136 HZ2 LYS 18 1HZ LYS 18 4.204 -0.244 -29.534
137 HZ3 LYS 18 2HZ LYS 18 3.102 -1.404 -30.081
138 H GLY 19 H GLY 19 2.569 0.400 -22.918
139 HA2 GLY 19 2HA GLY 19 2.079 -0.607 -20.881
140 HA3 GLY 19 3HA GLY 19 2.028 -2.164 -21.694
141 H GLY 20 H GLY 20 3.172 -2.352 -19.382
142 HA2 GLY 20 2HA GLY 20 5.941 -2.884 -20.016
143 HA3 GLY 20 3HA GLY 20 5.713 -1.629 -18.806
144 H LYS 21 H LYS 21 6.715 -2.848 -17.192
145 HA LYS 21 HA LYS 21 4.954 -4.687 -15.842
146 HB2 LYS 21 2HB LYS 21 6.746 -6.458 -15.664
147 HB3 LYS 21 3HB LYS 21 5.982 -6.311 -17.241
148 HG2 LYS 21 2HG LYS 21 8.258 -4.599 -17.164
149 HG3 LYS 21 3HG LYS 21 8.728 -6.208 -16.608
150 HD2 LYS 21 2HD LYS 21 7.027 -5.973 -19.044
151 HD3 LYS 21 3HD LYS 21 8.746 -5.590 -19.170
152 HE2 LYS 21 2HE LYS 21 8.823 -7.823 -19.626
153 HE3 LYS 21 3HE LYS 21 8.981 -7.881 -17.872
154 HZ1 LYS 21 3HZ LYS 21 7.066 -9.132 -19.405
155 HZ2 LYS 21 1HZ LYS 21 6.250 -7.862 -18.640
156 HZ3 LYS 21 2HZ LYS 21 7.092 -9.003 -17.718
157 H CYS 22 H CYS 22 5.995 -5.458 -13.746
158 HA CYS 22 HA CYS 22 7.379 -3.174 -12.557
159 HB2 CYS 22 2HB CYS 22 5.493 -5.208 -11.607
160 HB3 CYS 22 3HB CYS 22 6.820 -4.904 -10.491
161 H LYS 23 H LYS 23 9.230 -3.420 -11.246
162 HA LYS 23 HA LYS 23 10.654 -5.974 -11.457
163 HB2 LYS 23 2HB LYS 23 11.306 -4.148 -13.227
164 HB3 LYS 23 3HB LYS 23 12.171 -3.427 -11.876
165 HG2 LYS 23 2HG LYS 23 13.872 -4.752 -12.384
166 HG3 LYS 23 3HG LYS 23 12.896 -6.106 -11.811
167 HD2 LYS 23 2HD LYS 23 12.442 -6.834 -13.905
168 HD3 LYS 23 3HD LYS 23 12.354 -5.200 -14.567
169 HE2 LYS 23 2HE LYS 23 15.013 -6.159 -13.679
170 HE3 LYS 23 3HE LYS 23 14.342 -6.893 -15.135
171 HZ1 LYS 23 3HZ LYS 23 15.774 -4.769 -15.323
172 HZ2 LYS 23 1HZ LYS 23 14.362 -3.964 -14.851
173 HZ3 LYS 23 2HZ LYS 23 14.370 -4.902 -16.258
174 H ASN 24 H ASN 24 10.477 -6.428 -9.301
175 HA ASN 24 HA ASN 24 10.840 -6.305 -7.055
176 HB2 ASN 24 2HB ASN 24 13.234 -4.694 -7.972
177 HB3 ASN 24 3HB ASN 24 13.041 -5.417 -6.378
178 HD21 ASN 24 1HD2 ASN 24 15.188 -5.955 -8.065
179 HD22 ASN 24 2HD2 ASN 24 15.110 -7.613 -8.545
180 H GLY 25 H GLY 25 9.003 -4.419 -7.998
181 HA2 GLY 25 2HA GLY 25 7.858 -2.841 -6.598
182 HA3 GLY 25 3HA GLY 25 9.419 -2.281 -6.018
183 H ASP 26 H ASP 26 10.582 -2.177 -8.700
184 HA ASP 26 HA ASP 26 9.802 0.484 -9.361
185 HB2 ASP 26 2HB ASP 26 11.569 -1.428 -10.903
186 HB3 ASP 26 3HB ASP 26 11.465 0.313 -11.150
187 H CYS 27 H CYS 27 9.357 1.071 -11.718
188 HA CYS 27 HA CYS 27 7.460 -0.842 -12.905
189 HB2 CYS 27 2HB CYS 27 6.146 0.852 -11.790
190 HB3 CYS 27 3HB CYS 27 7.091 2.136 -12.536
191 H VAL 28 H VAL 28 8.713 -1.512 -14.583
192 HA VAL 28 HA VAL 28 10.077 0.452 -16.249
193 HB VAL 28 HB VAL 28 9.998 -2.546 -16.593
194 HG11 VAL 28 1HG1 VAL 28 12.200 -2.028 -17.775
195 HG12 VAL 28 2HG1 VAL 28 10.711 -1.583 -18.611
196 HG13 VAL 28 3HG1 VAL 28 11.662 -0.349 -17.785
197 HG21 VAL 28 3HG2 VAL 28 11.021 -2.405 -14.544
198 HG22 VAL 28 1HG2 VAL 28 12.413 -2.207 -15.609
199 HG23 VAL 28 2HG2 VAL 28 11.671 -0.796 -14.856
200 H CYS 29 H CYS 29 9.495 1.005 -18.286
201 HA CYS 29 HA CYS 29 6.993 -0.166 -19.315
202 HB2 CYS 29 2HB CYS 29 8.072 2.640 -19.417
203 HB3 CYS 29 3HB CYS 29 6.870 2.089 -20.580
204 H ARG 30 H ARG 30 7.196 -1.329 -21.100
205 HA ARG 30 HA ARG 30 9.600 -1.637 -22.507
206 HB2 ARG 30 2HB ARG 30 6.768 -2.309 -23.318
207 HB3 ARG 30 3HB ARG 30 8.199 -2.834 -24.195
208 HG2 ARG 30 2HG ARG 30 8.873 -3.766 -21.815
209 HG3 ARG 30 3HG ARG 30 7.122 -3.754 -21.592
210 HD2 ARG 30 2HD ARG 30 8.480 -5.024 -23.959
211 HD3 ARG 30 3HD ARG 30 8.103 -5.902 -22.477
212 HE ARG 30 HE ARG 30 6.262 -5.099 -24.534
213 HH11 ARG 30 1HH1 ARG 30 6.614 -5.956 -21.179
214 HH12 ARG 30 2HH1 ARG 30 4.965 -6.458 -20.999
215 HH21 ARG 30 1HH2 ARG 30 4.089 -5.757 -24.311
216 HH22 ARG 30 2HH2 ARG 30 3.531 -6.345 -22.781
Start of MODEL 14
1 H1 PHE 1 H PHE 1 3.828 0.115 -0.572
2 HA PHE 1 HA PHE 1 1.659 0.059 -2.567
3 HB2 PHE 1 2HB PHE 1 4.644 0.148 -3.054
4 HB3 PHE 1 3HB PHE 1 3.423 -0.037 -4.308
5 HD1 PHE 1 HD2 PHE 1 1.589 1.837 -4.358
6 HD2 PHE 1 HD1 PHE 1 5.426 2.252 -2.563
7 HE1 PHE 1 HE2 PHE 1 1.407 4.283 -4.543
8 HE2 PHE 1 HE1 PHE 1 5.250 4.699 -2.743
9 HZ PHE 1 HZ PHE 1 3.239 5.718 -3.736
10 H SER 2 H SER 2 1.846 -1.809 -4.105
11 HA SER 2 HA SER 2 3.089 -4.178 -2.918
12 HB2 SER 2 2HB SER 2 0.500 -3.755 -2.374
13 HB3 SER 2 3HB SER 2 0.320 -4.532 -3.947
14 HG SER 2 HG SER 2 0.855 -5.654 -1.581
15 H CYS 3 H CYS 3 3.572 -2.485 -5.292
16 HA CYS 3 HA CYS 3 4.063 -2.680 -7.507
17 HB2 CYS 3 2HB CYS 3 5.296 -4.678 -6.350
18 HB3 CYS 3 3HB CYS 3 4.105 -5.662 -7.194
19 H ASP 4 H ASP 4 1.711 -2.041 -7.739
20 HA ASP 4 HA ASP 4 -0.153 -4.056 -8.564
21 HB2 ASP 4 2HB ASP 4 -0.200 -1.213 -8.022
22 HB3 ASP 4 3HB ASP 4 -1.064 -1.582 -9.512
23 H HIS 5 H HIS 5 0.534 -5.179 -10.324
24 HA HIS 5 HA HIS 5 1.885 -4.137 -12.539
25 HB2 HIS 5 2HB HIS 5 1.836 -6.523 -12.105
26 HB3 HIS 5 3HB HIS 5 0.090 -6.563 -12.330
27 HD1 HIS 5 HD1 HIS 5 3.303 -6.513 -14.200
28 HD2 HIS 5 HD2 HIS 5 -0.770 -6.435 -15.018
29 HE1 HIS 5 HE1 HIS 5 3.103 -6.969 -16.665
30 H SER 6 H SER 6 -1.486 -4.144 -11.713
31 HA SER 6 HA SER 6 -2.538 -3.680 -14.301
32 HB2 SER 6 2HB SER 6 -3.534 -3.681 -11.550
33 HB3 SER 6 3HB SER 6 -4.325 -2.478 -12.568
34 HG SER 6 HG SER 6 -5.316 -4.590 -12.605
35 H ALA 7 H ALA 7 -1.998 -1.426 -11.588
36 HA ALA 7 HA ALA 7 -2.644 0.933 -12.868
37 HB1 ALA 7 1HB ALA 7 -0.468 0.554 -10.814
38 HB2 ALA 7 2HB ALA 7 -1.288 2.066 -11.206
39 HB3 ALA 7 3HB ALA 7 -2.186 0.744 -10.462
40 H CYS 8 H CYS 8 0.491 -0.728 -12.780
41 HA CYS 8 HA CYS 8 1.890 1.225 -14.280
42 HB2 CYS 8 2HB CYS 8 2.490 -1.719 -13.917
43 HB3 CYS 8 3HB CYS 8 3.614 -0.519 -14.547
44 H ALA 9 H ALA 9 0.376 -1.858 -15.188
45 HA ALA 9 HA ALA 9 1.068 -1.965 -17.855
46 HB1 ALA 9 1HB ALA 9 -1.416 -2.869 -16.427
47 HB2 ALA 9 2HB ALA 9 -1.149 -3.179 -18.143
48 HB3 ALA 9 3HB ALA 9 -0.032 -3.833 -16.945
49 H VAL 10 H VAL 10 -1.750 -0.341 -16.411
50 HA VAL 10 HA VAL 10 -2.730 0.680 -18.876
51 HB VAL 10 HB VAL 10 -3.266 1.709 -16.086
52 HG11 VAL 10 1HG1 VAL 10 -5.518 2.206 -17.432
53 HG12 VAL 10 2HG1 VAL 10 -4.185 3.360 -17.343
54 HG13 VAL 10 3HG1 VAL 10 -4.367 2.328 -18.763
55 HG21 VAL 10 3HG2 VAL 10 -4.068 -0.400 -15.849
56 HG22 VAL 10 1HG2 VAL 10 -5.456 0.299 -16.683
57 HG23 VAL 10 2HG2 VAL 10 -4.266 -0.639 -17.585
58 H ARG 11 H ARG 11 -0.877 2.149 -16.218
59 HA ARG 11 HA ARG 11 -0.680 4.723 -17.287
60 HB2 ARG 11 2HB ARG 11 -0.062 3.949 -14.946
61 HB3 ARG 11 3HB ARG 11 1.457 3.388 -15.630
62 HG2 ARG 11 2HG ARG 11 2.176 5.553 -16.118
63 HG3 ARG 11 3HG ARG 11 0.550 6.222 -15.971
64 HD2 ARG 11 2HD ARG 11 1.385 6.884 -13.962
65 HD3 ARG 11 3HD ARG 11 0.804 5.285 -13.501
66 HE ARG 11 HE ARG 11 3.346 4.805 -14.268
67 HH11 ARG 11 1HH1 ARG 11 1.918 7.099 -12.073
68 HH12 ARG 11 2HH1 ARG 11 3.304 7.167 -11.036
69 HH21 ARG 11 1HH2 ARG 11 5.177 4.886 -12.910
70 HH22 ARG 11 2HH2 ARG 11 5.158 5.908 -11.514
71 H CYS 12 H CYS 12 0.879 1.796 -18.190
72 HA CYS 12 HA CYS 12 3.053 3.116 -19.586
73 HB2 CYS 12 2HB CYS 12 2.236 0.247 -19.204
74 HB3 CYS 12 3HB CYS 12 3.462 0.691 -20.387
75 H LEU 13 H LEU 13 0.243 1.112 -20.459
76 HA LEU 13 HA LEU 13 0.551 1.337 -23.242
77 HB2 LEU 13 2HB LEU 13 -1.365 0.149 -23.390
78 HB3 LEU 13 3HB LEU 13 -1.017 -0.143 -21.687
79 HG LEU 13 HG LEU 13 -2.538 2.014 -21.397
80 HD11 LEU 13 1HD1 LEU 13 -4.360 1.100 -23.342
81 HD12 LEU 13 2HD1 LEU 13 -2.825 1.380 -24.164
82 HD13 LEU 13 3HD1 LEU 13 -3.578 2.677 -23.236
83 HD21 LEU 13 3HD2 LEU 13 -3.854 -0.619 -21.984
84 HD22 LEU 13 1HD2 LEU 13 -4.286 0.587 -20.772
85 HD23 LEU 13 2HD2 LEU 13 -2.828 -0.385 -20.568
86 H ALA 14 H ALA 14 -0.756 3.500 -20.877
87 HA ALA 14 HA ALA 14 -2.195 5.124 -22.777
88 HB1 ALA 14 1HB ALA 14 -1.483 5.635 -19.891
89 HB2 ALA 14 2HB ALA 14 -2.559 6.633 -20.870
90 HB3 ALA 14 3HB ALA 14 -3.000 4.967 -20.495
91 H GLN 15 H GLN 15 1.012 4.957 -21.514
92 HA GLN 15 HA GLN 15 1.662 7.659 -22.402
93 HB2 GLN 15 2HB GLN 15 2.775 5.775 -20.502
94 HB3 GLN 15 3HB GLN 15 4.016 6.397 -21.582
95 HG2 GLN 15 2HG GLN 15 3.143 8.708 -21.020
96 HG3 GLN 15 3HG GLN 15 2.226 7.933 -19.729
97 HE21 GLN 15 1HE2 GLN 15 3.254 7.282 -17.903
98 HE22 GLN 15 2HE2 GLN 15 4.925 7.580 -17.582
99 H ARG 16 H ARG 16 1.036 5.205 -24.140
100 HA ARG 16 HA ARG 16 1.669 4.427 -26.182
101 HB2 ARG 16 2HB ARG 16 3.746 6.617 -26.188
102 HB3 ARG 16 3HB ARG 16 3.040 5.808 -27.580
103 HG2 ARG 16 2HG ARG 16 0.868 6.810 -27.054
104 HG3 ARG 16 3HG ARG 16 1.594 7.637 -25.675
105 HD2 ARG 16 2HD ARG 16 3.276 8.492 -27.520
106 HD3 ARG 16 3HD ARG 16 1.918 8.144 -28.590
107 HE ARG 16 HE ARG 16 1.054 9.670 -26.372
108 HH11 ARG 16 1HH1 ARG 16 2.846 9.936 -29.345
109 HH12 ARG 16 2HH1 ARG 16 2.478 11.614 -29.569
110 HH21 ARG 16 1HH2 ARG 16 0.563 11.879 -26.656
111 HH22 ARG 16 2HH2 ARG 16 1.180 12.719 -28.039
112 H ARG 17 H ARG 17 2.621 2.939 -24.210
113 HA ARG 17 HA ARG 17 5.335 2.254 -25.109
114 HB2 ARG 17 2HB ARG 17 4.414 2.053 -22.240
115 HB3 ARG 17 3HB ARG 17 6.032 1.762 -22.863
116 HG2 ARG 17 2HG ARG 17 4.616 4.419 -22.849
117 HG3 ARG 17 3HG ARG 17 5.866 3.909 -21.713
118 HD2 ARG 17 2HD ARG 17 6.842 3.485 -24.344
119 HD3 ARG 17 3HD ARG 17 6.167 5.112 -24.272
120 HE ARG 17 HE ARG 17 8.560 4.190 -23.019
121 HH11 ARG 17 1HH1 ARG 17 5.921 6.440 -22.722
122 HH12 ARG 17 2HH1 ARG 17 6.818 7.567 -21.760
123 HH21 ARG 17 1HH2 ARG 17 9.752 5.666 -21.753
124 HH22 ARG 17 2HH2 ARG 17 8.998 7.126 -21.210
125 H LYS 18 H LYS 18 2.402 1.284 -25.415
126 HA LYS 18 HA LYS 18 1.278 -0.690 -25.595
127 HB2 LYS 18 2HB LYS 18 3.782 -0.985 -26.754
128 HB3 LYS 18 3HB LYS 18 3.625 -2.412 -25.738
129 HG2 LYS 18 2HG LYS 18 1.265 -2.573 -26.872
130 HG3 LYS 18 3HG LYS 18 2.040 -1.591 -28.118
131 HD2 LYS 18 2HD LYS 18 2.641 -3.610 -28.937
132 HD3 LYS 18 3HD LYS 18 3.939 -3.464 -27.751
133 HE2 LYS 18 2HE LYS 18 1.306 -4.724 -27.055
134 HE3 LYS 18 3HE LYS 18 2.598 -5.652 -27.816
135 HZ1 LYS 18 3HZ LYS 18 3.921 -4.475 -25.824
136 HZ2 LYS 18 1HZ LYS 18 3.203 -6.002 -25.696
137 HZ3 LYS 18 2HZ LYS 18 2.397 -4.636 -25.108
138 H GLY 19 H GLY 19 2.070 0.164 -22.906
139 HA2 GLY 19 2HA GLY 19 1.576 -0.732 -20.818
140 HA3 GLY 19 3HA GLY 19 1.487 -2.326 -21.553
141 H GLY 20 H GLY 20 2.641 -2.514 -19.285
142 HA2 GLY 20 2HA GLY 20 5.446 -2.952 -19.919
143 HA3 GLY 20 3HA GLY 20 5.130 -1.820 -18.613
144 H LYS 21 H LYS 21 6.143 -3.138 -17.083
145 HA LYS 21 HA LYS 21 4.427 -5.130 -15.924
146 HB2 LYS 21 2HB LYS 21 6.196 -6.906 -15.912
147 HB3 LYS 21 3HB LYS 21 5.503 -6.580 -17.496
148 HG2 LYS 21 2HG LYS 21 7.795 -4.913 -17.084
149 HG3 LYS 21 3HG LYS 21 8.209 -6.600 -16.770
150 HD2 LYS 21 2HD LYS 21 6.787 -6.907 -19.023
151 HD3 LYS 21 3HD LYS 21 7.402 -5.274 -19.290
152 HE2 LYS 21 2HE LYS 21 9.673 -6.386 -18.531
153 HE3 LYS 21 3HE LYS 21 8.870 -7.856 -19.081
154 HZ1 LYS 21 3HZ LYS 21 10.263 -6.570 -20.757
155 HZ2 LYS 21 1HZ LYS 21 8.999 -5.446 -20.785
156 HZ3 LYS 21 2HZ LYS 21 8.714 -7.048 -21.244
157 H CYS 22 H CYS 22 5.336 -5.973 -13.858
158 HA CYS 22 HA CYS 22 6.567 -3.807 -12.409
159 HB2 CYS 22 2HB CYS 22 4.742 -5.707 -11.724
160 HB3 CYS 22 3HB CYS 22 6.210 -6.397 -11.040
161 H LYS 23 H LYS 23 8.523 -3.870 -11.285
162 HA LYS 23 HA LYS 23 10.346 -6.074 -11.970
163 HB2 LYS 23 2HB LYS 23 10.725 -4.062 -13.426
164 HB3 LYS 23 3HB LYS 23 11.127 -3.155 -11.974
165 HG2 LYS 23 2HG LYS 23 13.210 -3.750 -12.697
166 HG3 LYS 23 3HG LYS 23 12.850 -5.093 -11.609
167 HD2 LYS 23 2HD LYS 23 11.992 -6.343 -13.623
168 HD3 LYS 23 3HD LYS 23 12.664 -5.049 -14.617
169 HE2 LYS 23 2HE LYS 23 14.540 -6.267 -14.622
170 HE3 LYS 23 3HE LYS 23 14.762 -5.684 -12.973
171 HZ1 LYS 23 3HZ LYS 23 13.054 -7.868 -12.838
172 HZ2 LYS 23 1HZ LYS 23 14.656 -7.775 -12.300
173 HZ3 LYS 23 2HZ LYS 23 14.320 -8.320 -13.865
174 H ASN 24 H ASN 24 9.965 -6.878 -9.852
175 HA ASN 24 HA ASN 24 10.336 -7.116 -7.617
176 HB2 ASN 24 2HB ASN 24 12.736 -5.361 -8.178
177 HB3 ASN 24 3HB ASN 24 12.542 -6.472 -6.825
178 HD21 ASN 24 1HD2 ASN 24 14.457 -6.260 -9.153
179 HD22 ASN 24 2HD2 ASN 24 14.474 -7.851 -9.828
180 H GLY 25 H GLY 25 8.489 -5.136 -8.191
181 HA2 GLY 25 2HA GLY 25 7.391 -3.795 -6.521
182 HA3 GLY 25 3HA GLY 25 8.973 -3.288 -5.950
183 H ASP 26 H ASP 26 9.893 -2.886 -8.761
184 HA ASP 26 HA ASP 26 8.943 -0.163 -9.009
185 HB2 ASP 26 2HB ASP 26 11.149 -1.769 -10.239
186 HB3 ASP 26 3HB ASP 26 10.621 -0.289 -11.035
187 H CYS 27 H CYS 27 8.696 0.591 -11.426
188 HA CYS 27 HA CYS 27 6.924 -1.306 -12.817
189 HB2 CYS 27 2HB CYS 27 6.391 1.464 -11.902
190 HB3 CYS 27 3HB CYS 27 5.806 1.047 -13.509
191 H VAL 28 H VAL 28 7.929 -1.830 -14.644
192 HA VAL 28 HA VAL 28 9.441 0.238 -16.084
193 HB VAL 28 HB VAL 28 9.532 -2.744 -16.542
194 HG11 VAL 28 1HG1 VAL 28 11.878 -1.831 -17.431
195 HG12 VAL 28 2HG1 VAL 28 10.443 -1.928 -18.453
196 HG13 VAL 28 3HG1 VAL 28 10.897 -0.393 -17.712
197 HG21 VAL 28 3HG2 VAL 28 10.280 -2.191 -14.270
198 HG22 VAL 28 1HG2 VAL 28 11.612 -2.751 -15.280
199 HG23 VAL 28 2HG2 VAL 28 11.429 -1.031 -14.936
200 H CYS 29 H CYS 29 8.969 0.782 -18.165
201 HA CYS 29 HA CYS 29 6.503 -0.377 -19.283
202 HB2 CYS 29 2HB CYS 29 7.694 2.381 -19.453
203 HB3 CYS 29 3HB CYS 29 6.506 1.828 -20.629
204 H ARG 30 H ARG 30 6.686 -1.555 -21.063
205 HA ARG 30 HA ARG 30 8.876 -0.992 -22.934
206 HB2 ARG 30 2HB ARG 30 8.119 -3.735 -21.911
207 HB3 ARG 30 3HB ARG 30 9.257 -3.422 -23.215
208 HG2 ARG 30 2HG ARG 30 9.661 -2.255 -20.486
209 HG3 ARG 30 3HG ARG 30 10.186 -3.894 -20.878
210 HD2 ARG 30 2HD ARG 30 11.906 -3.175 -22.134
211 HD3 ARG 30 3HD ARG 30 10.970 -1.856 -22.836
212 HE ARG 30 HE ARG 30 11.393 -1.001 -20.318
213 HH11 ARG 30 1HH1 ARG 30 13.518 -2.260 -22.772
214 HH12 ARG 30 2HH1 ARG 30 14.890 -1.348 -22.236
215 HH21 ARG 30 1HH2 ARG 30 13.192 0.205 -19.603
216 HH22 ARG 30 2HH2 ARG 30 14.704 0.053 -20.433
Start of MODEL 15
1 H1 PHE 1 H PHE 1 2.598 -1.814 1.156
2 HA PHE 1 HA PHE 1 1.249 -0.324 -0.859
3 HB2 PHE 1 2HB PHE 1 3.984 0.439 -0.178
4 HB3 PHE 1 3HB PHE 1 3.805 0.000 -1.874
5 HD1 PHE 1 HD1 PHE 1 1.762 1.881 0.624
6 HD2 PHE 1 HD2 PHE 1 3.524 1.802 -3.249
7 HE1 PHE 1 HE1 PHE 1 0.818 4.103 0.154
8 HE2 PHE 1 HE2 PHE 1 2.584 4.025 -3.726
9 HZ PHE 1 HZ PHE 1 1.229 5.179 -2.023
10 H SER 2 H SER 2 1.951 -1.090 -3.098
11 HA SER 2 HA SER 2 3.393 -3.532 -3.330
12 HB2 SER 2 2HB SER 2 0.855 -3.912 -2.354
13 HB3 SER 2 3HB SER 2 0.613 -4.106 -4.090
14 HG SER 2 HG SER 2 1.458 -6.004 -3.873
15 H CYS 3 H CYS 3 4.207 -3.534 -5.312
16 HA CYS 3 HA CYS 3 3.463 -1.653 -7.271
17 HB2 CYS 3 2HB CYS 3 5.718 -2.810 -6.985
18 HB3 CYS 3 3HB CYS 3 5.002 -4.191 -7.810
19 H ASP 4 H ASP 4 1.387 -1.760 -7.973
20 HA ASP 4 HA ASP 4 0.140 -4.251 -8.688
21 HB2 ASP 4 2HB ASP 4 -0.664 -1.424 -8.484
22 HB3 ASP 4 3HB ASP 4 -1.486 -2.334 -9.748
23 H HIS 5 H HIS 5 0.651 -5.294 -10.489
24 HA HIS 5 HA HIS 5 2.038 -4.197 -12.663
25 HB2 HIS 5 2HB HIS 5 1.826 -6.653 -12.013
26 HB3 HIS 5 3HB HIS 5 0.263 -6.631 -12.824
27 HD1 HIS 5 HD1 HIS 5 3.768 -7.218 -13.443
28 HD2 HIS 5 HD2 HIS 5 0.536 -5.859 -15.674
29 HE1 HIS 5 HE1 HIS 5 4.453 -7.479 -15.849
30 H SER 6 H SER 6 -1.357 -4.362 -11.940
31 HA SER 6 HA SER 6 -2.334 -3.913 -14.564
32 HB2 SER 6 2HB SER 6 -3.626 -3.274 -11.900
33 HB3 SER 6 3HB SER 6 -4.455 -3.337 -13.456
34 HG SER 6 HG SER 6 -4.136 -5.312 -11.820
35 H ALA 7 H ALA 7 -2.046 -1.690 -11.788
36 HA ALA 7 HA ALA 7 -2.764 0.655 -13.055
37 HB1 ALA 7 1HB ALA 7 -1.284 -0.059 -10.640
38 HB2 ALA 7 2HB ALA 7 -0.837 1.510 -11.312
39 HB3 ALA 7 3HB ALA 7 -2.518 1.176 -10.894
40 H CYS 8 H CYS 8 0.488 -0.759 -12.771
41 HA CYS 8 HA CYS 8 1.817 1.281 -14.202
42 HB2 CYS 8 2HB CYS 8 2.568 -1.611 -13.733
43 HB3 CYS 8 3HB CYS 8 3.647 -0.408 -14.434
44 H ALA 9 H ALA 9 0.559 -1.884 -15.206
45 HA ALA 9 HA ALA 9 1.407 -1.932 -17.829
46 HB1 ALA 9 1HB ALA 9 -0.730 -3.264 -18.242
47 HB2 ALA 9 2HB ALA 9 0.378 -3.872 -17.011
48 HB3 ALA 9 3HB ALA 9 -1.080 -3.003 -16.534
49 H VAL 10 H VAL 10 -1.582 -0.491 -16.544
50 HA VAL 10 HA VAL 10 -2.481 0.485 -19.057
51 HB VAL 10 HB VAL 10 -3.234 1.427 -16.287
52 HG11 VAL 10 1HG1 VAL 10 -4.494 1.856 -18.987
53 HG12 VAL 10 2HG1 VAL 10 -5.344 2.132 -17.465
54 HG13 VAL 10 3HG1 VAL 10 -3.907 3.076 -17.857
55 HG21 VAL 10 3HG2 VAL 10 -4.367 -0.467 -16.043
56 HG22 VAL 10 1HG2 VAL 10 -5.238 -0.158 -17.545
57 HG23 VAL 10 2HG2 VAL 10 -3.714 -1.046 -17.576
58 H ARG 11 H ARG 11 -0.875 2.046 -16.294
59 HA ARG 11 HA ARG 11 -0.774 4.635 -17.343
60 HB2 ARG 11 2HB ARG 11 -0.295 4.147 -14.998
61 HB3 ARG 11 3HB ARG 11 1.154 3.265 -15.461
62 HG2 ARG 11 2HG ARG 11 2.217 5.263 -16.216
63 HG3 ARG 11 3HG ARG 11 0.727 6.188 -16.022
64 HD2 ARG 11 2HD ARG 11 1.779 6.762 -14.082
65 HD3 ARG 11 3HD ARG 11 0.933 5.314 -13.536
66 HE ARG 11 HE ARG 11 3.312 4.350 -14.381
67 HH11 ARG 11 1HH1 ARG 11 2.412 6.919 -12.210
68 HH12 ARG 11 2HH1 ARG 11 3.827 6.756 -11.223
69 HH21 ARG 11 1HH2 ARG 11 5.179 4.127 -13.089
70 HH22 ARG 11 2HH2 ARG 11 5.400 5.168 -11.724
71 H CYS 12 H CYS 12 1.009 1.813 -18.163
72 HA CYS 12 HA CYS 12 3.175 3.271 -19.428
73 HB2 CYS 12 2HB CYS 12 2.513 0.355 -19.101
74 HB3 CYS 12 3HB CYS 12 3.775 0.879 -20.211
75 H LEU 13 H LEU 13 0.545 1.106 -20.466
76 HA LEU 13 HA LEU 13 0.999 1.366 -23.227
77 HB2 LEU 13 2HB LEU 13 -0.830 0.065 -23.487
78 HB3 LEU 13 3HB LEU 13 -0.563 -0.215 -21.768
79 HG LEU 13 HG LEU 13 -2.226 1.844 -21.560
80 HD11 LEU 13 1HD1 LEU 13 -3.880 0.841 -23.603
81 HD12 LEU 13 2HD1 LEU 13 -2.320 1.201 -24.341
82 HD13 LEU 13 3HD1 LEU 13 -3.188 2.456 -23.458
83 HD21 LEU 13 3HD2 LEU 13 -2.355 -0.769 -20.992
84 HD22 LEU 13 1HD2 LEU 13 -3.601 -0.683 -22.238
85 HD23 LEU 13 2HD2 LEU 13 -3.723 0.328 -20.797
86 H ALA 14 H ALA 14 -0.570 3.432 -20.934
87 HA ALA 14 HA ALA 14 -1.995 4.978 -22.909
88 HB1 ALA 14 1HB ALA 14 -3.070 4.944 -20.844
89 HB2 ALA 14 2HB ALA 14 -1.576 5.237 -19.953
90 HB3 ALA 14 3HB ALA 14 -2.314 6.536 -20.890
91 H GLN 15 H GLN 15 1.139 4.997 -21.464
92 HA GLN 15 HA GLN 15 1.673 7.739 -22.306
93 HB2 GLN 15 2HB GLN 15 2.788 5.914 -20.350
94 HB3 GLN 15 3HB GLN 15 4.048 6.617 -21.355
95 HG2 GLN 15 2HG GLN 15 3.005 8.867 -20.838
96 HG3 GLN 15 3HG GLN 15 2.065 8.030 -19.604
97 HE21 GLN 15 1HE2 GLN 15 3.343 6.756 -18.024
98 HE22 GLN 15 2HE2 GLN 15 4.848 7.415 -17.490
99 H ARG 16 H ARG 16 1.298 5.262 -24.084
100 HA ARG 16 HA ARG 16 2.093 4.537 -26.088
101 HB2 ARG 16 2HB ARG 16 4.037 6.842 -25.975
102 HB3 ARG 16 3HB ARG 16 3.443 6.008 -27.404
103 HG2 ARG 16 2HG ARG 16 1.153 6.944 -26.141
104 HG3 ARG 16 3HG ARG 16 2.325 8.253 -25.981
105 HD2 ARG 16 2HD ARG 16 2.543 8.512 -28.273
106 HD3 ARG 16 3HD ARG 16 1.960 6.882 -28.612
107 HE ARG 16 HE ARG 16 -0.190 7.679 -28.593
108 HH11 ARG 16 1HH1 ARG 16 1.937 10.063 -27.210
109 HH12 ARG 16 2HH1 ARG 16 0.726 11.300 -27.152
110 HH21 ARG 16 1HH2 ARG 16 -1.794 9.299 -28.522
111 HH22 ARG 16 2HH2 ARG 16 -1.396 10.864 -27.898
112 H ARG 17 H ARG 17 3.019 3.097 -24.069
113 HA ARG 17 HA ARG 17 5.817 2.584 -24.812
114 HB2 ARG 17 2HB ARG 17 4.760 2.284 -22.001
115 HB3 ARG 17 3HB ARG 17 6.428 2.143 -22.540
116 HG2 ARG 17 2HG ARG 17 4.788 4.669 -22.576
117 HG3 ARG 17 3HG ARG 17 6.010 4.249 -21.373
118 HD2 ARG 17 2HD ARG 17 7.123 3.968 -23.990
119 HD3 ARG 17 3HD ARG 17 6.370 5.556 -23.849
120 HE ARG 17 HE ARG 17 8.756 4.665 -22.556
121 HH11 ARG 17 1HH1 ARG 17 6.017 6.792 -22.258
122 HH12 ARG 17 2HH1 ARG 17 6.830 7.904 -21.207
123 HH21 ARG 17 1HH2 ARG 17 9.837 6.121 -21.173
124 HH22 ARG 17 2HH2 ARG 17 9.003 7.522 -20.591
125 H LYS 18 H LYS 18 2.971 1.440 -25.289
126 HA LYS 18 HA LYS 18 1.981 -0.598 -25.539
127 HB2 LYS 18 2HB LYS 18 4.562 -0.733 -26.552
128 HB3 LYS 18 3HB LYS 18 4.431 -2.175 -25.552
129 HG2 LYS 18 2HG LYS 18 2.584 -2.979 -26.795
130 HG3 LYS 18 3HG LYS 18 2.393 -1.438 -27.634
131 HD2 LYS 18 2HD LYS 18 4.533 -1.764 -28.751
132 HD3 LYS 18 3HD LYS 18 4.773 -3.279 -27.878
133 HE2 LYS 18 2HE LYS 18 3.685 -4.353 -29.488
134 HE3 LYS 18 3HE LYS 18 2.236 -3.423 -29.109
135 HZ1 LYS 18 3HZ LYS 18 2.484 -2.175 -30.924
136 HZ2 LYS 18 1HZ LYS 18 3.561 -3.363 -31.465
137 HZ3 LYS 18 2HZ LYS 18 4.148 -1.976 -30.695
138 H GLY 19 H GLY 19 2.564 0.286 -22.807
139 HA2 GLY 19 2HA GLY 19 2.007 -0.652 -20.753
140 HA3 GLY 19 3HA GLY 19 2.057 -2.243 -21.497
141 H GLY 20 H GLY 20 3.088 -2.375 -19.166
142 HA2 GLY 20 2HA GLY 20 5.942 -2.657 -19.639
143 HA3 GLY 20 3HA GLY 20 5.498 -1.531 -18.365
144 H LYS 21 H LYS 21 6.515 -2.793 -16.783
145 HA LYS 21 HA LYS 21 4.838 -4.847 -15.675
146 HB2 LYS 21 2HB LYS 21 6.762 -6.504 -15.546
147 HB3 LYS 21 3HB LYS 21 5.997 -6.316 -17.119
148 HG2 LYS 21 2HG LYS 21 8.191 -4.475 -16.830
149 HG3 LYS 21 3HG LYS 21 8.712 -6.134 -16.524
150 HD2 LYS 21 2HD LYS 21 7.260 -6.582 -18.703
151 HD3 LYS 21 3HD LYS 21 7.664 -4.891 -19.011
152 HE2 LYS 21 2HE LYS 21 10.000 -5.359 -18.929
153 HE3 LYS 21 3HE LYS 21 9.713 -6.992 -18.330
154 HZ1 LYS 21 3HZ LYS 21 9.684 -6.002 -21.026
155 HZ2 LYS 21 1HZ LYS 21 8.323 -6.934 -20.651
156 HZ3 LYS 21 2HZ LYS 21 9.872 -7.584 -20.458
157 H CYS 22 H CYS 22 5.561 -5.533 -13.535
158 HA CYS 22 HA CYS 22 6.941 -3.355 -12.177
159 HB2 CYS 22 2HB CYS 22 4.978 -5.420 -11.424
160 HB3 CYS 22 3HB CYS 22 6.188 -5.070 -10.194
161 H LYS 23 H LYS 23 8.898 -3.508 -11.247
162 HA LYS 23 HA LYS 23 10.167 -6.159 -11.102
163 HB2 LYS 23 2HB LYS 23 10.986 -4.899 -13.081
164 HB3 LYS 23 3HB LYS 23 11.525 -3.613 -12.009
165 HG2 LYS 23 2HG LYS 23 13.111 -5.097 -10.958
166 HG3 LYS 23 3HG LYS 23 12.518 -6.455 -11.918
167 HD2 LYS 23 2HD LYS 23 13.209 -5.246 -13.969
168 HD3 LYS 23 3HD LYS 23 13.895 -3.976 -12.952
169 HE2 LYS 23 2HE LYS 23 15.047 -6.188 -11.882
170 HE3 LYS 23 3HE LYS 23 14.909 -6.666 -13.573
171 HZ1 LYS 23 3HZ LYS 23 16.005 -4.509 -14.130
172 HZ2 LYS 23 1HZ LYS 23 16.991 -5.606 -13.302
173 HZ3 LYS 23 2HZ LYS 23 16.312 -4.294 -12.480
174 H ASN 24 H ASN 24 9.899 -6.332 -8.894
175 HA ASN 24 HA ASN 24 10.280 -5.985 -6.675
176 HB2 ASN 24 2HB ASN 24 12.802 -4.606 -7.609
177 HB3 ASN 24 3HB ASN 24 12.533 -5.405 -6.063
178 HD21 ASN 24 1HD2 ASN 24 11.904 -7.759 -6.267
179 HD22 ASN 24 2HD2 ASN 24 12.788 -8.693 -7.422
180 H GLY 25 H GLY 25 8.690 -4.004 -7.968
181 HA2 GLY 25 2HA GLY 25 7.654 -2.183 -6.788
182 HA3 GLY 25 3HA GLY 25 9.236 -1.743 -6.162
183 H ASP 26 H ASP 26 10.520 -2.059 -8.790
184 HA ASP 26 HA ASP 26 9.930 0.588 -9.786
185 HB2 ASP 26 2HB ASP 26 11.951 -1.455 -10.735
186 HB3 ASP 26 3HB ASP 26 11.867 0.225 -11.259
187 H CYS 27 H CYS 27 8.238 0.838 -11.090
188 HA CYS 27 HA CYS 27 7.307 -1.286 -12.801
189 HB2 CYS 27 2HB CYS 27 6.370 1.455 -12.085
190 HB3 CYS 27 3HB CYS 27 5.777 0.740 -13.580
191 H VAL 28 H VAL 28 8.667 -1.712 -14.460
192 HA VAL 28 HA VAL 28 9.872 0.438 -15.988
193 HB VAL 28 HB VAL 28 9.993 -2.531 -16.529
194 HG11 VAL 28 1HG1 VAL 28 12.324 -1.403 -17.412
195 HG12 VAL 28 2HG1 VAL 28 10.932 -1.794 -18.425
196 HG13 VAL 28 3HG1 VAL 28 11.136 -0.158 -17.796
197 HG21 VAL 28 3HG2 VAL 28 11.535 -0.789 -14.662
198 HG22 VAL 28 1HG2 VAL 28 10.953 -2.440 -14.442
199 HG23 VAL 28 2HG2 VAL 28 12.355 -2.127 -15.467
200 H CYS 29 H CYS 29 9.200 1.187 -17.907
201 HA CYS 29 HA CYS 29 6.803 -0.049 -19.080
202 HB2 CYS 29 2HB CYS 29 7.834 2.769 -19.011
203 HB3 CYS 29 3HB CYS 29 6.725 2.268 -20.283
204 H ARG 30 H ARG 30 7.052 -1.154 -20.895
205 HA ARG 30 HA ARG 30 9.514 -1.226 -22.312
206 HB2 ARG 30 2HB ARG 30 6.946 -2.615 -22.396
207 HB3 ARG 30 3HB ARG 30 7.644 -2.377 -23.992
208 HG2 ARG 30 2HG ARG 30 9.811 -3.279 -22.733
209 HG3 ARG 30 3HG ARG 30 8.573 -4.053 -21.742
210 HD2 ARG 30 2HD ARG 30 8.304 -4.206 -24.698
211 HD3 ARG 30 3HD ARG 30 9.541 -5.197 -23.926
212 HE ARG 30 HE ARG 30 7.213 -5.612 -22.500
213 HH11 ARG 30 1HH1 ARG 30 8.325 -6.071 -25.767
214 HH12 ARG 30 2HH1 ARG 30 7.291 -7.428 -26.067
215 HH21 ARG 30 1HH2 ARG 30 5.847 -7.398 -22.883
216 HH22 ARG 30 2HH2 ARG 30 5.881 -8.182 -24.426
Start of MODEL 16
1 H1 PHE 1 H PHE 1 2.742 -2.037 1.246
2 HA PHE 1 HA PHE 1 2.410 -0.292 -1.101
3 HB2 PHE 1 2HB PHE 1 4.941 -1.819 -0.484
4 HB3 PHE 1 3HB PHE 1 4.692 -0.613 -1.742
5 HD1 PHE 1 HD2 PHE 1 4.073 1.770 -0.935
6 HD2 PHE 1 HD1 PHE 1 5.865 -1.197 1.535
7 HE1 PHE 1 HE2 PHE 1 4.870 3.528 0.592
8 HE2 PHE 1 HE1 PHE 1 6.664 0.556 3.067
9 HZ PHE 1 HZ PHE 1 6.168 2.922 2.595
10 H SER 2 H SER 2 2.114 -1.297 -3.058
11 HA SER 2 HA SER 2 2.416 -4.157 -3.324
12 HB2 SER 2 2HB SER 2 -0.337 -3.240 -3.969
13 HB3 SER 2 3HB SER 2 0.222 -4.806 -3.380
14 HG SER 2 HG SER 2 -0.982 -3.091 -1.953
15 H CYS 3 H CYS 3 3.457 -4.238 -5.200
16 HA CYS 3 HA CYS 3 3.299 -2.274 -7.217
17 HB2 CYS 3 2HB CYS 3 5.219 -3.855 -6.830
18 HB3 CYS 3 3HB CYS 3 4.239 -5.126 -7.553
19 H ASP 4 H ASP 4 1.206 -1.937 -7.894
20 HA ASP 4 HA ASP 4 -0.451 -4.123 -8.778
21 HB2 ASP 4 2HB ASP 4 -0.755 -1.156 -8.580
22 HB3 ASP 4 3HB ASP 4 -1.843 -2.049 -9.640
23 H HIS 5 H HIS 5 0.308 -5.136 -10.555
24 HA HIS 5 HA HIS 5 1.696 -3.958 -12.678
25 HB2 HIS 5 2HB HIS 5 1.771 -6.344 -12.362
26 HB3 HIS 5 3HB HIS 5 0.028 -6.476 -12.578
27 HD1 HIS 5 HD1 HIS 5 3.216 -6.297 -14.448
28 HD2 HIS 5 HD2 HIS 5 -0.855 -6.208 -15.273
29 HE1 HIS 5 HE1 HIS 5 3.024 -6.662 -16.929
30 H SER 6 H SER 6 -1.693 -4.110 -11.978
31 HA SER 6 HA SER 6 -2.689 -3.642 -14.582
32 HB2 SER 6 2HB SER 6 -3.917 -2.938 -11.905
33 HB3 SER 6 3HB SER 6 -4.773 -2.976 -13.446
34 HG SER 6 HG SER 6 -3.747 -5.102 -11.923
35 H ALA 7 H ALA 7 -2.308 -1.388 -11.842
36 HA ALA 7 HA ALA 7 -2.967 0.958 -13.137
37 HB1 ALA 7 1HB ALA 7 -0.986 0.483 -10.919
38 HB2 ALA 7 2HB ALA 7 -1.506 2.085 -11.444
39 HB3 ALA 7 3HB ALA 7 -2.680 0.953 -10.772
40 H CYS 8 H CYS 8 0.205 -0.621 -12.937
41 HA CYS 8 HA CYS 8 1.600 1.381 -14.382
42 HB2 CYS 8 2HB CYS 8 2.511 -0.518 -12.851
43 HB3 CYS 8 3HB CYS 8 2.464 -1.493 -14.316
44 H ALA 9 H ALA 9 0.208 -1.745 -15.327
45 HA ALA 9 HA ALA 9 1.020 -1.863 -17.959
46 HB1 ALA 9 1HB ALA 9 -0.147 -3.689 -16.863
47 HB2 ALA 9 2HB ALA 9 -1.631 -2.737 -16.818
48 HB3 ALA 9 3HB ALA 9 -0.961 -3.253 -18.366
49 H VAL 10 H VAL 10 -1.892 -0.286 -16.659
50 HA VAL 10 HA VAL 10 -2.782 0.691 -19.176
51 HB VAL 10 HB VAL 10 -3.463 1.670 -16.399
52 HG11 VAL 10 1HG1 VAL 10 -4.159 3.395 -17.776
53 HG12 VAL 10 2HG1 VAL 10 -4.549 2.310 -19.112
54 HG13 VAL 10 3HG1 VAL 10 -5.597 2.378 -17.694
55 HG21 VAL 10 3HG2 VAL 10 -4.221 -0.693 -17.894
56 HG22 VAL 10 1HG2 VAL 10 -4.509 -0.287 -16.203
57 HG23 VAL 10 2HG2 VAL 10 -5.622 0.281 -17.448
58 H ARG 11 H ARG 11 -1.081 2.224 -16.453
59 HA ARG 11 HA ARG 11 -0.890 4.792 -17.538
60 HB2 ARG 11 2HB ARG 11 -0.401 4.408 -15.211
61 HB3 ARG 11 3HB ARG 11 0.929 3.333 -15.620
62 HG2 ARG 11 2HG ARG 11 2.202 5.169 -16.516
63 HG3 ARG 11 3HG ARG 11 0.845 6.270 -16.273
64 HD2 ARG 11 2HD ARG 11 1.966 6.747 -14.366
65 HD3 ARG 11 3HD ARG 11 1.094 5.331 -13.780
66 HE ARG 11 HE ARG 11 3.503 4.471 -14.905
67 HH11 ARG 11 1HH1 ARG 11 2.364 6.327 -12.189
68 HH12 ARG 11 2HH1 ARG 11 3.713 5.923 -11.179
69 HH21 ARG 11 1HH2 ARG 11 5.284 3.931 -13.586
70 HH22 ARG 11 2HH2 ARG 11 5.374 4.560 -11.975
71 H CYS 12 H CYS 12 0.769 1.890 -18.341
72 HA CYS 12 HA CYS 12 2.975 3.244 -19.652
73 HB2 CYS 12 2HB CYS 12 2.202 0.361 -19.277
74 HB3 CYS 12 3HB CYS 12 3.470 0.820 -20.409
75 H LEU 13 H LEU 13 0.250 1.171 -20.629
76 HA LEU 13 HA LEU 13 0.678 1.377 -23.398
77 HB2 LEU 13 2HB LEU 13 -1.204 0.146 -23.619
78 HB3 LEU 13 3HB LEU 13 -0.927 -0.122 -21.899
79 HG LEU 13 HG LEU 13 -2.504 2.005 -21.699
80 HD11 LEU 13 1HD1 LEU 13 -3.472 2.628 -23.591
81 HD12 LEU 13 2HD1 LEU 13 -4.219 1.036 -23.713
82 HD13 LEU 13 3HD1 LEU 13 -2.655 1.336 -24.470
83 HD21 LEU 13 3HD2 LEU 13 -4.212 0.555 -21.085
84 HD22 LEU 13 1HD2 LEU 13 -2.764 -0.436 -20.906
85 HD23 LEU 13 2HD2 LEU 13 -3.792 -0.625 -22.327
86 H ALA 14 H ALA 14 -0.779 3.534 -21.116
87 HA ALA 14 HA ALA 14 -2.165 5.109 -23.095
88 HB1 ALA 14 1HB ALA 14 -1.779 5.257 -20.148
89 HB2 ALA 14 2HB ALA 14 -2.262 6.717 -21.013
90 HB3 ALA 14 3HB ALA 14 -3.266 5.270 -21.096
91 H GLN 15 H GLN 15 0.985 5.021 -21.688
92 HA GLN 15 HA GLN 15 1.618 7.728 -22.575
93 HB2 GLN 15 2HB GLN 15 2.684 5.886 -20.607
94 HB3 GLN 15 3HB GLN 15 3.958 6.525 -21.637
95 HG2 GLN 15 2HG GLN 15 3.014 8.822 -21.138
96 HG3 GLN 15 3HG GLN 15 2.055 8.040 -19.882
97 HE21 GLN 15 1HE2 GLN 15 3.783 6.227 -18.854
98 HE22 GLN 15 2HE2 GLN 15 5.132 7.028 -18.131
99 H ARG 16 H ARG 16 1.121 5.245 -24.313
100 HA ARG 16 HA ARG 16 1.861 4.462 -26.317
101 HB2 ARG 16 2HB ARG 16 3.919 6.665 -26.281
102 HB3 ARG 16 3HB ARG 16 3.215 5.865 -27.680
103 HG2 ARG 16 2HG ARG 16 0.995 6.849 -26.938
104 HG3 ARG 16 3HG ARG 16 1.937 7.856 -25.836
105 HD2 ARG 16 2HD ARG 16 2.430 9.258 -27.486
106 HD3 ARG 16 3HD ARG 16 3.120 7.942 -28.435
107 HE ARG 16 HE ARG 16 0.340 7.813 -28.665
108 HH11 ARG 16 1HH1 ARG 16 2.970 9.909 -29.566
109 HH12 ARG 16 2HH1 ARG 16 2.171 10.523 -30.975
110 HH21 ARG 16 1HH2 ARG 16 -0.723 8.613 -30.518
111 HH22 ARG 16 2HH2 ARG 16 0.070 9.786 -31.515
112 H ARG 17 H ARG 17 2.755 3.013 -24.289
113 HA ARG 17 HA ARG 17 5.520 2.378 -25.059
114 HB2 ARG 17 2HB ARG 17 4.483 2.171 -22.232
115 HB3 ARG 17 3HB ARG 17 6.135 1.933 -22.784
116 HG2 ARG 17 2HG ARG 17 4.647 4.547 -22.908
117 HG3 ARG 17 3HG ARG 17 5.782 4.088 -21.638
118 HD2 ARG 17 2HD ARG 17 7.051 3.636 -24.129
119 HD3 ARG 17 3HD ARG 17 6.319 5.239 -24.188
120 HE ARG 17 HE ARG 17 7.580 5.219 -21.794
121 HH11 ARG 17 1HH1 ARG 17 8.595 4.504 -25.046
122 HH12 ARG 17 2HH1 ARG 17 10.231 5.009 -24.786
123 HH21 ARG 17 1HH2 ARG 17 9.732 5.887 -21.438
124 HH22 ARG 17 2HH2 ARG 17 10.877 5.795 -22.733
125 H LYS 18 H LYS 18 2.625 1.343 -25.486
126 HA LYS 18 HA LYS 18 1.551 -0.657 -25.695
127 HB2 LYS 18 2HB LYS 18 3.848 -0.895 -26.979
128 HB3 LYS 18 3HB LYS 18 4.185 -2.070 -25.714
129 HG2 LYS 18 2HG LYS 18 3.071 -3.589 -26.870
130 HG3 LYS 18 3HG LYS 18 1.599 -2.636 -26.671
131 HD2 LYS 18 2HD LYS 18 2.844 -1.291 -28.682
132 HD3 LYS 18 3HD LYS 18 3.349 -2.951 -29.009
133 HE2 LYS 18 2HE LYS 18 0.805 -3.463 -28.626
134 HE3 LYS 18 3HE LYS 18 0.615 -1.754 -29.013
135 HZ1 LYS 18 3HZ LYS 18 2.347 -2.985 -30.877
136 HZ2 LYS 18 1HZ LYS 18 0.870 -2.206 -31.152
137 HZ3 LYS 18 2HZ LYS 18 0.900 -3.857 -30.789
138 H GLY 19 H GLY 19 2.204 0.240 -22.982
139 HA2 GLY 19 2HA GLY 19 1.635 -0.646 -20.909
140 HA3 GLY 19 3HA GLY 19 1.613 -2.249 -21.631
141 H GLY 20 H GLY 20 2.668 -2.483 -19.358
142 HA2 GLY 20 2HA GLY 20 5.491 -2.883 -19.843
143 HA3 GLY 20 3HA GLY 20 5.138 -1.686 -18.605
144 H LYS 21 H LYS 21 6.123 -2.951 -17.001
145 HA LYS 21 HA LYS 21 4.353 -4.865 -15.784
146 HB2 LYS 21 2HB LYS 21 5.969 -6.705 -15.693
147 HB3 LYS 21 3HB LYS 21 5.538 -6.319 -17.354
148 HG2 LYS 21 2HG LYS 21 7.807 -4.769 -16.686
149 HG3 LYS 21 3HG LYS 21 8.112 -6.425 -16.156
150 HD2 LYS 21 2HD LYS 21 7.020 -6.860 -18.599
151 HD3 LYS 21 3HD LYS 21 7.842 -5.321 -18.871
152 HE2 LYS 21 2HE LYS 21 9.845 -6.493 -17.696
153 HE3 LYS 21 3HE LYS 21 8.987 -7.978 -18.106
154 HZ1 LYS 21 3HZ LYS 21 10.274 -6.026 -19.869
155 HZ2 LYS 21 1HZ LYS 21 8.907 -6.838 -20.449
156 HZ3 LYS 21 2HZ LYS 21 10.265 -7.716 -19.954
157 H CYS 22 H CYS 22 5.360 -5.725 -13.699
158 HA CYS 22 HA CYS 22 6.525 -3.467 -12.306
159 HB2 CYS 22 2HB CYS 22 4.766 -5.539 -11.607
160 HB3 CYS 22 3HB CYS 22 6.234 -5.842 -10.684
161 H LYS 23 H LYS 23 8.429 -3.569 -11.042
162 HA LYS 23 HA LYS 23 10.251 -5.793 -11.638
163 HB2 LYS 23 2HB LYS 23 10.745 -3.935 -13.194
164 HB3 LYS 23 3HB LYS 23 10.993 -2.867 -11.819
165 HG2 LYS 23 2HG LYS 23 12.600 -5.299 -11.707
166 HG3 LYS 23 3HG LYS 23 12.940 -4.283 -13.110
167 HD2 LYS 23 2HD LYS 23 12.872 -2.389 -11.225
168 HD3 LYS 23 3HD LYS 23 13.367 -3.756 -10.224
169 HE2 LYS 23 2HE LYS 23 14.772 -3.359 -12.808
170 HE3 LYS 23 3HE LYS 23 15.116 -2.217 -11.510
171 HZ1 LYS 23 3HZ LYS 23 15.238 -5.141 -11.085
172 HZ2 LYS 23 1HZ LYS 23 15.914 -3.913 -10.138
173 HZ3 LYS 23 2HZ LYS 23 16.569 -4.268 -11.656
174 H ASN 24 H ASN 24 10.002 -6.570 -9.540
175 HA ASN 24 HA ASN 24 10.347 -6.736 -7.294
176 HB2 ASN 24 2HB ASN 24 12.650 -4.973 -8.129
177 HB3 ASN 24 3HB ASN 24 12.477 -5.588 -6.488
178 HD21 ASN 24 1HD2 ASN 24 13.381 -7.466 -6.054
179 HD22 ASN 24 2HD2 ASN 24 13.878 -8.644 -7.215
180 H GLY 25 H GLY 25 8.453 -4.756 -8.104
181 HA2 GLY 25 2HA GLY 25 7.167 -3.498 -6.488
182 HA3 GLY 25 3HA GLY 25 8.682 -2.940 -5.792
183 H ASP 26 H ASP 26 9.698 -2.563 -8.637
184 HA ASP 26 HA ASP 26 8.774 0.172 -8.881
185 HB2 ASP 26 2HB ASP 26 10.792 -1.293 -10.591
186 HB3 ASP 26 3HB ASP 26 10.562 0.450 -10.483
187 H CYS 27 H CYS 27 8.534 0.957 -11.270
188 HA CYS 27 HA CYS 27 6.758 -0.921 -12.687
189 HB2 CYS 27 2HB CYS 27 5.395 0.776 -11.621
190 HB3 CYS 27 3HB CYS 27 6.400 2.056 -12.294
191 H VAL 28 H VAL 28 7.744 -1.510 -14.501
192 HA VAL 28 HA VAL 28 9.319 0.497 -15.972
193 HB VAL 28 HB VAL 28 9.453 -2.504 -16.280
194 HG11 VAL 28 1HG1 VAL 28 10.275 -1.591 -18.250
195 HG12 VAL 28 2HG1 VAL 28 10.987 -0.202 -17.427
196 HG13 VAL 28 3HG1 VAL 28 11.730 -1.795 -17.275
197 HG21 VAL 28 3HG2 VAL 28 11.278 -0.673 -14.721
198 HG22 VAL 28 1HG2 VAL 28 10.161 -1.854 -14.035
199 HG23 VAL 28 2HG2 VAL 28 11.534 -2.396 -14.999
200 H CYS 29 H CYS 29 8.854 0.975 -18.061
201 HA CYS 29 HA CYS 29 6.436 -0.272 -19.185
202 HB2 CYS 29 2HB CYS 29 7.617 2.482 -19.486
203 HB3 CYS 29 3HB CYS 29 6.426 1.861 -20.624
204 H ARG 30 H ARG 30 6.678 -1.549 -20.888
205 HA ARG 30 HA ARG 30 9.135 -1.298 -22.492
206 HB2 ARG 30 2HB ARG 30 7.592 -3.619 -21.503
207 HB3 ARG 30 3HB ARG 30 8.199 -3.750 -23.148
208 HG2 ARG 30 2HG ARG 30 10.146 -2.801 -21.161
209 HG3 ARG 30 3HG ARG 30 9.590 -4.463 -20.955
210 HD2 ARG 30 2HD ARG 30 11.326 -4.833 -22.383
211 HD3 ARG 30 3HD ARG 30 10.046 -4.547 -23.562
212 HE ARG 30 HE ARG 30 11.190 -2.085 -23.008
213 HH11 ARG 30 1HH1 ARG 30 12.171 -5.139 -24.362
214 HH12 ARG 30 2HH1 ARG 30 13.377 -4.443 -25.393
215 HH21 ARG 30 1HH2 ARG 30 12.775 -1.157 -24.361
216 HH22 ARG 30 2HH2 ARG 30 13.720 -2.178 -25.391
Start of MODEL 17
1 H1 PHE 1 H PHE 1 5.566 -0.154 -1.804
2 HA PHE 1 HA PHE 1 2.825 0.085 -1.833
3 HB2 PHE 1 2HB PHE 1 4.044 0.945 -4.342
4 HB3 PHE 1 3HB PHE 1 2.873 -0.351 -4.567
5 HD1 PHE 1 HD1 PHE 1 0.533 -0.036 -3.772
6 HD2 PHE 1 HD2 PHE 1 3.361 3.143 -3.849
7 HE1 PHE 1 HE1 PHE 1 -1.303 1.596 -3.624
8 HE2 PHE 1 HE2 PHE 1 1.530 4.780 -3.700
9 HZ PHE 1 HZ PHE 1 -0.805 4.007 -3.587
10 H SER 2 H SER 2 1.794 -1.803 -3.238
11 HA SER 2 HA SER 2 3.415 -4.166 -2.628
12 HB2 SER 2 2HB SER 2 0.458 -3.716 -2.970
13 HB3 SER 2 3HB SER 2 1.145 -5.340 -3.020
14 HG SER 2 HG SER 2 0.396 -4.384 -0.900
15 H CYS 3 H CYS 3 3.905 -2.565 -4.998
16 HA CYS 3 HA CYS 3 4.247 -2.774 -7.240
17 HB2 CYS 3 2HB CYS 3 5.620 -4.638 -6.578
18 HB3 CYS 3 3HB CYS 3 4.213 -5.685 -6.429
19 H ASP 4 H ASP 4 2.267 -1.884 -7.901
20 HA ASP 4 HA ASP 4 0.069 -3.723 -8.464
21 HB2 ASP 4 2HB ASP 4 0.333 -0.732 -8.396
22 HB3 ASP 4 3HB ASP 4 -1.028 -1.488 -9.221
23 H HIS 5 H HIS 5 0.547 -4.875 -10.263
24 HA HIS 5 HA HIS 5 1.940 -3.900 -12.506
25 HB2 HIS 5 2HB HIS 5 1.797 -6.275 -12.112
26 HB3 HIS 5 3HB HIS 5 0.039 -6.233 -12.217
27 HD1 HIS 5 HD1 HIS 5 -0.223 -7.766 -14.206
28 HD2 HIS 5 HD2 HIS 5 2.359 -4.594 -14.936
29 HE1 HIS 5 HE1 HIS 5 0.237 -7.829 -16.678
30 H SER 6 H SER 6 -1.425 -3.804 -11.604
31 HA SER 6 HA SER 6 -2.511 -3.234 -14.149
32 HB2 SER 6 2HB SER 6 -3.515 -3.626 -11.573
33 HB3 SER 6 3HB SER 6 -3.970 -1.971 -11.978
34 HG SER 6 HG SER 6 -5.573 -3.154 -12.829
35 H ALA 7 H ALA 7 -1.828 -1.045 -11.415
36 HA ALA 7 HA ALA 7 -2.394 1.356 -12.651
37 HB1 ALA 7 1HB ALA 7 -0.046 1.277 -10.836
38 HB2 ALA 7 2HB ALA 7 -1.432 2.367 -10.850
39 HB3 ALA 7 3HB ALA 7 -1.600 0.736 -10.202
40 H CYS 8 H CYS 8 0.686 -0.414 -12.613
41 HA CYS 8 HA CYS 8 2.125 1.498 -14.127
42 HB2 CYS 8 2HB CYS 8 2.603 -1.447 -13.646
43 HB3 CYS 8 3HB CYS 8 3.739 -0.398 -14.488
44 H ALA 9 H ALA 9 0.477 -1.517 -15.016
45 HA ALA 9 HA ALA 9 1.140 -1.666 -17.688
46 HB1 ALA 9 1HB ALA 9 -1.486 -2.375 -16.388
47 HB2 ALA 9 2HB ALA 9 -0.976 -2.893 -17.995
48 HB3 ALA 9 3HB ALA 9 -0.083 -3.427 -16.571
49 H VAL 10 H VAL 10 -1.586 0.094 -16.228
50 HA VAL 10 HA VAL 10 -2.536 1.154 -18.688
51 HB VAL 10 HB VAL 10 -2.999 2.237 -15.907
52 HG11 VAL 10 1HG1 VAL 10 -5.251 2.782 -17.237
53 HG12 VAL 10 2HG1 VAL 10 -3.880 3.892 -17.185
54 HG13 VAL 10 3HG1 VAL 10 -4.112 2.840 -18.582
55 HG21 VAL 10 3HG2 VAL 10 -4.012 -0.150 -17.282
56 HG22 VAL 10 1HG2 VAL 10 -3.949 0.230 -15.561
57 HG23 VAL 10 2HG2 VAL 10 -5.256 0.869 -16.558
58 H ARG 11 H ARG 11 -0.594 2.541 -16.050
59 HA ARG 11 HA ARG 11 -0.283 5.100 -17.129
60 HB2 ARG 11 2HB ARG 11 0.296 4.439 -14.799
61 HB3 ARG 11 3HB ARG 11 1.706 3.593 -15.424
62 HG2 ARG 11 2HG ARG 11 2.869 5.498 -15.771
63 HG3 ARG 11 3HG ARG 11 1.430 6.429 -16.192
64 HD2 ARG 11 2HD ARG 11 1.698 5.489 -13.390
65 HD3 ARG 11 3HD ARG 11 2.752 6.800 -13.916
66 HE ARG 11 HE ARG 11 0.030 7.273 -14.617
67 HH11 ARG 11 1HH1 ARG 11 2.313 7.419 -11.993
68 HH12 ARG 11 2HH1 ARG 11 1.458 8.666 -11.147
69 HH21 ARG 11 1HH2 ARG 11 -1.104 8.915 -13.512
70 HH22 ARG 11 2HH2 ARG 11 -0.486 9.515 -12.011
71 H CYS 12 H CYS 12 1.128 2.099 -18.034
72 HA CYS 12 HA CYS 12 3.351 3.310 -19.452
73 HB2 CYS 12 2HB CYS 12 2.401 0.484 -19.055
74 HB3 CYS 12 3HB CYS 12 3.637 0.865 -20.248
75 H LEU 13 H LEU 13 0.441 1.440 -20.296
76 HA LEU 13 HA LEU 13 0.738 1.642 -23.083
77 HB2 LEU 13 2HB LEU 13 -1.234 0.546 -23.211
78 HB3 LEU 13 3HB LEU 13 -0.887 0.243 -21.510
79 HG LEU 13 HG LEU 13 -2.301 2.472 -21.215
80 HD11 LEU 13 1HD1 LEU 13 -3.321 3.178 -23.050
81 HD12 LEU 13 2HD1 LEU 13 -4.181 1.641 -23.142
82 HD13 LEU 13 3HD1 LEU 13 -2.642 1.840 -23.978
83 HD21 LEU 13 3HD2 LEU 13 -4.046 1.138 -20.492
84 HD22 LEU 13 1HD2 LEU 13 -2.682 0.021 -20.451
85 HD23 LEU 13 2HD2 LEU 13 -3.827 -0.035 -21.791
86 H ALA 14 H ALA 14 -0.446 3.872 -20.714
87 HA ALA 14 HA ALA 14 -1.821 5.558 -22.607
88 HB1 ALA 14 1HB ALA 14 -2.717 5.576 -20.428
89 HB2 ALA 14 2HB ALA 14 -1.138 5.860 -19.696
90 HB3 ALA 14 3HB ALA 14 -1.920 7.137 -20.628
91 H GLN 15 H GLN 15 1.385 5.241 -21.369
92 HA GLN 15 HA GLN 15 2.156 7.906 -22.271
93 HB2 GLN 15 2HB GLN 15 3.193 5.976 -20.373
94 HB3 GLN 15 3HB GLN 15 4.453 6.536 -21.465
95 HG2 GLN 15 2HG GLN 15 3.697 8.887 -20.903
96 HG3 GLN 15 3HG GLN 15 2.753 8.161 -19.603
97 HE21 GLN 15 1HE2 GLN 15 3.728 7.728 -17.733
98 HE22 GLN 15 2HE2 GLN 15 5.427 7.845 -17.444
99 H ARG 16 H ARG 16 1.399 5.480 -23.997
100 HA ARG 16 HA ARG 16 1.977 4.668 -26.041
101 HB2 ARG 16 2HB ARG 16 4.159 6.753 -26.073
102 HB3 ARG 16 3HB ARG 16 3.396 5.979 -27.455
103 HG2 ARG 16 2HG ARG 16 1.997 7.818 -25.525
104 HG3 ARG 16 3HG ARG 16 2.640 8.294 -27.098
105 HD2 ARG 16 2HD ARG 16 0.681 7.722 -27.980
106 HD3 ARG 16 3HD ARG 16 1.078 6.045 -27.608
107 HE ARG 16 HE ARG 16 0.031 6.995 -25.288
108 HH11 ARG 16 1HH1 ARG 16 -1.065 6.911 -28.591
109 HH12 ARG 16 2HH1 ARG 16 -2.743 6.824 -28.168
110 HH21 ARG 16 1HH2 ARG 16 -2.175 6.881 -24.719
111 HH22 ARG 16 2HH2 ARG 16 -3.373 6.809 -25.966
112 H ARG 17 H ARG 17 2.873 3.142 -24.072
113 HA ARG 17 HA ARG 17 5.545 2.326 -24.990
114 HB2 ARG 17 2HB ARG 17 4.658 2.126 -22.114
115 HB3 ARG 17 3HB ARG 17 6.267 1.847 -22.768
116 HG2 ARG 17 2HG ARG 17 4.872 4.513 -22.774
117 HG3 ARG 17 3HG ARG 17 6.030 3.990 -21.550
118 HD2 ARG 17 2HD ARG 17 6.719 3.982 -24.470
119 HD3 ARG 17 3HD ARG 17 6.885 5.439 -23.491
120 HE ARG 17 HE ARG 17 8.624 3.188 -23.507
121 HH11 ARG 17 1HH1 ARG 17 7.290 5.660 -21.451
122 HH12 ARG 17 2HH1 ARG 17 8.624 5.645 -20.346
123 HH21 ARG 17 1HH2 ARG 17 10.387 3.158 -22.059
124 HH22 ARG 17 2HH2 ARG 17 10.386 4.222 -20.693
125 H LYS 18 H LYS 18 2.566 1.496 -25.270
126 HA LYS 18 HA LYS 18 1.348 -0.423 -25.435
127 HB2 LYS 18 2HB LYS 18 4.151 -1.444 -25.875
128 HB3 LYS 18 3HB LYS 18 2.735 -2.474 -26.044
129 HG2 LYS 18 2HG LYS 18 1.953 -0.510 -27.637
130 HG3 LYS 18 3HG LYS 18 3.696 -0.263 -27.770
131 HD2 LYS 18 2HD LYS 18 2.715 -3.045 -28.029
132 HD3 LYS 18 3HD LYS 18 2.335 -1.940 -29.352
133 HE2 LYS 18 2HE LYS 18 4.361 -2.653 -30.086
134 HE3 LYS 18 3HE LYS 18 4.913 -1.338 -29.048
135 HZ1 LYS 18 3HZ LYS 18 4.663 -4.139 -28.111
136 HZ2 LYS 18 1HZ LYS 18 5.446 -2.855 -27.336
137 HZ3 LYS 18 2HZ LYS 18 6.094 -3.507 -28.756
138 H GLY 19 H GLY 19 2.201 0.399 -22.755
139 HA2 GLY 19 2HA GLY 19 1.682 -0.467 -20.661
140 HA3 GLY 19 3HA GLY 19 1.512 -2.056 -21.391
141 H GLY 20 H GLY 20 2.665 -2.394 -19.182
142 HA2 GLY 20 2HA GLY 20 5.445 -2.921 -19.822
143 HA3 GLY 20 3HA GLY 20 5.191 -1.788 -18.503
144 H LYS 21 H LYS 21 6.174 -3.185 -17.014
145 HA LYS 21 HA LYS 21 4.368 -5.093 -15.843
146 HB2 LYS 21 2HB LYS 21 6.012 -6.969 -15.886
147 HB3 LYS 21 3HB LYS 21 5.355 -6.565 -17.467
148 HG2 LYS 21 2HG LYS 21 7.621 -5.008 -17.308
149 HG3 LYS 21 3HG LYS 21 8.097 -6.513 -16.519
150 HD2 LYS 21 2HD LYS 21 6.700 -7.364 -18.743
151 HD3 LYS 21 3HD LYS 21 7.589 -5.957 -19.331
152 HE2 LYS 21 2HE LYS 21 8.998 -8.005 -17.678
153 HE3 LYS 21 3HE LYS 21 8.679 -8.337 -19.380
154 HZ1 LYS 21 3HZ LYS 21 10.875 -7.288 -18.897
155 HZ2 LYS 21 1HZ LYS 21 10.051 -5.885 -18.432
156 HZ3 LYS 21 2HZ LYS 21 9.930 -6.449 -20.022
157 H CYS 22 H CYS 22 5.283 -6.022 -13.808
158 HA CYS 22 HA CYS 22 6.650 -3.937 -12.357
159 HB2 CYS 22 2HB CYS 22 4.740 -5.778 -11.672
160 HB3 CYS 22 3HB CYS 22 6.190 -6.488 -10.971
161 H LYS 23 H LYS 23 8.659 -4.033 -11.420
162 HA LYS 23 HA LYS 23 10.321 -6.373 -12.080
163 HB2 LYS 23 2HB LYS 23 10.681 -4.241 -13.502
164 HB3 LYS 23 3HB LYS 23 11.423 -3.576 -12.052
165 HG2 LYS 23 2HG LYS 23 12.562 -6.121 -12.458
166 HG3 LYS 23 3HG LYS 23 12.549 -5.302 -14.021
167 HD2 LYS 23 2HD LYS 23 13.712 -3.405 -13.084
168 HD3 LYS 23 3HD LYS 23 13.617 -4.103 -11.466
169 HE2 LYS 23 2HE LYS 23 14.943 -6.049 -12.340
170 HE3 LYS 23 3HE LYS 23 15.180 -5.133 -13.828
171 HZ1 LYS 23 3HZ LYS 23 16.190 -4.526 -11.119
172 HZ2 LYS 23 1HZ LYS 23 16.091 -3.327 -12.308
173 HZ3 LYS 23 2HZ LYS 23 17.062 -4.689 -12.559
174 H ASN 24 H ASN 24 10.094 -7.192 -9.984
175 HA ASN 24 HA ASN 24 10.534 -7.443 -7.762
176 HB2 ASN 24 2HB ASN 24 12.901 -5.697 -8.481
177 HB3 ASN 24 3HB ASN 24 12.761 -6.677 -7.024
178 HD21 ASN 24 1HD2 ASN 24 12.754 -6.873 -10.549
179 HD22 ASN 24 2HD2 ASN 24 13.463 -8.446 -10.640
180 H GLY 25 H GLY 25 8.671 -5.434 -8.310
181 HA2 GLY 25 2HA GLY 25 7.589 -4.119 -6.611
182 HA3 GLY 25 3HA GLY 25 9.177 -3.640 -6.029
183 H ASP 26 H ASP 26 10.107 -3.176 -8.823
184 HA ASP 26 HA ASP 26 9.211 -0.437 -9.002
185 HB2 ASP 26 2HB ASP 26 11.258 -2.049 -10.525
186 HB3 ASP 26 3HB ASP 26 10.861 -0.384 -10.943
187 H CYS 27 H CYS 27 8.988 0.350 -11.441
188 HA CYS 27 HA CYS 27 7.103 -1.447 -12.811
189 HB2 CYS 27 2HB CYS 27 6.675 1.301 -11.807
190 HB3 CYS 27 3HB CYS 27 6.083 0.985 -13.435
191 H VAL 28 H VAL 28 8.084 -1.984 -14.651
192 HA VAL 28 HA VAL 28 9.614 0.067 -16.099
193 HB VAL 28 HB VAL 28 9.641 -2.921 -16.539
194 HG11 VAL 28 1HG1 VAL 28 10.371 -1.969 -18.526
195 HG12 VAL 28 2HG1 VAL 28 11.165 -0.623 -17.707
196 HG13 VAL 28 3HG1 VAL 28 11.875 -2.237 -17.646
197 HG21 VAL 28 3HG2 VAL 28 11.741 -2.964 -15.347
198 HG22 VAL 28 1HG2 VAL 28 11.668 -1.220 -15.090
199 HG23 VAL 28 2HG2 VAL 28 10.494 -2.277 -14.306
200 H CYS 29 H CYS 29 9.074 0.687 -18.128
201 HA CYS 29 HA CYS 29 6.561 -0.393 -19.206
202 HB2 CYS 29 2HB CYS 29 7.913 2.284 -19.477
203 HB3 CYS 29 3HB CYS 29 6.645 1.779 -20.588
204 H ARG 30 H ARG 30 6.659 -1.649 -20.937
205 HA ARG 30 HA ARG 30 8.891 -1.291 -22.822
206 HB2 ARG 30 2HB ARG 30 7.995 -3.739 -21.406
207 HB3 ARG 30 3HB ARG 30 8.419 -3.924 -23.103
208 HG2 ARG 30 2HG ARG 30 10.409 -2.370 -21.722
209 HG3 ARG 30 3HG ARG 30 10.144 -3.918 -20.918
210 HD2 ARG 30 2HD ARG 30 11.680 -4.593 -22.449
211 HD3 ARG 30 3HD ARG 30 10.230 -4.783 -23.433
212 HE ARG 30 HE ARG 30 11.056 -2.210 -23.876
213 HH11 ARG 30 1HH1 ARG 30 12.473 -5.373 -24.208
214 HH12 ARG 30 2HH1 ARG 30 13.496 -4.919 -25.530
215 HH21 ARG 30 1HH2 ARG 30 12.399 -1.600 -25.616
216 HH22 ARG 30 2HH2 ARG 30 13.454 -2.772 -26.330
Start of MODEL 18
1 H1 PHE 1 H PHE 1 1.032 -2.857 0.706
2 HA PHE 1 HA PHE 1 0.837 -1.048 -1.170
3 HB2 PHE 1 2HB PHE 1 3.644 -0.601 -0.148
4 HB3 PHE 1 3HB PHE 1 2.817 0.277 -1.431
5 HD1 PHE 1 HD1 PHE 1 0.314 1.065 -0.407
6 HD2 PHE 1 HD2 PHE 1 4.019 0.745 1.664
7 HE1 PHE 1 HE1 PHE 1 -0.461 2.731 1.230
8 HE2 PHE 1 HE2 PHE 1 3.250 2.409 3.304
9 HZ PHE 1 HZ PHE 1 1.008 3.404 3.090
10 H SER 2 H SER 2 1.378 -1.869 -3.126
11 HA SER 2 HA SER 2 3.618 -3.654 -3.458
12 HB2 SER 2 2HB SER 2 1.046 -4.736 -2.823
13 HB3 SER 2 3HB SER 2 1.435 -5.154 -4.491
14 HG SER 2 HG SER 2 2.318 -6.722 -3.196
15 H CYS 3 H CYS 3 4.413 -3.410 -5.442
16 HA CYS 3 HA CYS 3 3.350 -1.615 -7.293
17 HB2 CYS 3 2HB CYS 3 5.714 -2.187 -7.274
18 HB3 CYS 3 3HB CYS 3 5.344 -3.851 -7.715
19 H ASP 4 H ASP 4 1.314 -1.955 -8.017
20 HA ASP 4 HA ASP 4 0.391 -4.546 -8.847
21 HB2 ASP 4 2HB ASP 4 -0.761 -1.845 -8.549
22 HB3 ASP 4 3HB ASP 4 -1.473 -2.825 -9.828
23 H HIS 5 H HIS 5 0.812 -5.454 -10.737
24 HA HIS 5 HA HIS 5 2.198 -4.223 -12.826
25 HB2 HIS 5 2HB HIS 5 0.503 -6.719 -12.756
26 HB3 HIS 5 3HB HIS 5 1.414 -6.225 -14.181
27 HD1 HIS 5 HD1 HIS 5 2.858 -8.384 -13.991
28 HD2 HIS 5 HD2 HIS 5 3.167 -5.809 -10.745
29 HE1 HIS 5 HE1 HIS 5 4.870 -9.166 -12.701
30 H SER 6 H SER 6 -1.197 -4.359 -12.117
31 HA SER 6 HA SER 6 -2.200 -3.756 -14.685
32 HB2 SER 6 2HB SER 6 -3.403 -3.095 -11.985
33 HB3 SER 6 3HB SER 6 -4.265 -3.120 -13.524
34 HG SER 6 HG SER 6 -3.458 -5.209 -11.909
35 H ALA 7 H ALA 7 -1.693 -1.625 -11.869
36 HA ALA 7 HA ALA 7 -2.337 0.788 -13.040
37 HB1 ALA 7 1HB ALA 7 -1.227 -0.041 -10.622
38 HB2 ALA 7 2HB ALA 7 -0.065 1.105 -11.292
39 HB3 ALA 7 3HB ALA 7 -1.745 1.589 -11.053
40 H CYS 8 H CYS 8 0.878 -0.741 -12.885
41 HA CYS 8 HA CYS 8 2.219 1.250 -14.361
42 HB2 CYS 8 2HB CYS 8 3.228 -0.593 -12.900
43 HB3 CYS 8 3HB CYS 8 3.018 -1.656 -14.288
44 H ALA 9 H ALA 9 0.766 -1.835 -15.340
45 HA ALA 9 HA ALA 9 1.518 -1.913 -17.992
46 HB1 ALA 9 1HB ALA 9 -0.999 -2.837 -16.634
47 HB2 ALA 9 2HB ALA 9 -0.683 -3.133 -18.344
48 HB3 ALA 9 3HB ALA 9 0.403 -3.792 -17.120
49 H VAL 10 H VAL 10 -1.338 -0.313 -16.596
50 HA VAL 10 HA VAL 10 -2.265 0.731 -19.071
51 HB VAL 10 HB VAL 10 -2.866 1.686 -16.268
52 HG11 VAL 10 1HG1 VAL 10 -4.369 2.138 -18.844
53 HG12 VAL 10 2HG1 VAL 10 -4.861 2.687 -17.241
54 HG13 VAL 10 3HG1 VAL 10 -3.406 3.343 -17.991
55 HG21 VAL 10 3HG2 VAL 10 -4.428 -0.213 -18.016
56 HG22 VAL 10 1HG2 VAL 10 -3.399 -0.698 -16.668
57 HG23 VAL 10 2HG2 VAL 10 -4.831 0.288 -16.374
58 H ARG 11 H ARG 11 -0.478 2.178 -16.358
59 HA ARG 11 HA ARG 11 -0.264 4.764 -17.395
60 HB2 ARG 11 2HB ARG 11 0.334 3.866 -15.048
61 HB3 ARG 11 3HB ARG 11 1.904 3.491 -15.747
62 HG2 ARG 11 2HG ARG 11 2.531 5.658 -15.852
63 HG3 ARG 11 3HG ARG 11 0.894 6.230 -16.179
64 HD2 ARG 11 2HD ARG 11 1.504 5.080 -13.501
65 HD3 ARG 11 3HD ARG 11 2.075 6.706 -13.874
66 HE ARG 11 HE ARG 11 -0.658 6.457 -14.542
67 HH11 ARG 11 1HH1 ARG 11 1.467 6.706 -11.796
68 HH12 ARG 11 2HH1 ARG 11 0.276 7.444 -10.776
69 HH21 ARG 11 1HH2 ARG 11 -2.235 7.427 -13.210
70 HH22 ARG 11 2HH2 ARG 11 -1.829 7.852 -11.581
71 H CYS 12 H CYS 12 1.324 1.851 -18.292
72 HA CYS 12 HA CYS 12 3.525 3.191 -19.625
73 HB2 CYS 12 2HB CYS 12 2.707 0.316 -19.292
74 HB3 CYS 12 3HB CYS 12 3.959 0.775 -20.442
75 H LEU 13 H LEU 13 0.740 1.190 -20.582
76 HA LEU 13 HA LEU 13 1.111 1.445 -23.356
77 HB2 LEU 13 2HB LEU 13 -0.798 0.253 -23.559
78 HB3 LEU 13 3HB LEU 13 -0.488 -0.055 -21.852
79 HG LEU 13 HG LEU 13 -2.020 2.095 -21.573
80 HD11 LEU 13 1HD1 LEU 13 -3.015 2.775 -23.432
81 HD12 LEU 13 2HD1 LEU 13 -3.799 1.201 -23.565
82 HD13 LEU 13 3HD1 LEU 13 -2.247 1.482 -24.353
83 HD21 LEU 13 3HD2 LEU 13 -2.286 -0.454 -20.940
84 HD22 LEU 13 1HD2 LEU 13 -3.491 -0.405 -22.226
85 HD23 LEU 13 2HD2 LEU 13 -3.643 0.668 -20.835
86 H ALA 14 H ALA 14 -0.255 3.579 -20.998
87 HA ALA 14 HA ALA 14 -1.655 5.220 -22.913
88 HB1 ALA 14 1HB ALA 14 -1.924 6.758 -20.934
89 HB2 ALA 14 2HB ALA 14 -2.601 5.140 -20.742
90 HB3 ALA 14 3HB ALA 14 -1.063 5.549 -19.981
91 H GLN 15 H GLN 15 1.523 5.047 -21.579
92 HA GLN 15 HA GLN 15 2.185 7.760 -22.424
93 HB2 GLN 15 2HB GLN 15 3.261 5.858 -20.519
94 HB3 GLN 15 3HB GLN 15 4.523 6.495 -21.564
95 HG2 GLN 15 2HG GLN 15 3.632 8.798 -20.997
96 HG3 GLN 15 3HG GLN 15 2.689 8.007 -19.736
97 HE21 GLN 15 1HE2 GLN 15 3.906 6.721 -18.161
98 HE22 GLN 15 2HE2 GLN 15 5.480 7.259 -17.696
99 H ARG 16 H ARG 16 1.605 5.323 -24.202
100 HA ARG 16 HA ARG 16 2.286 4.569 -26.237
101 HB2 ARG 16 2HB ARG 16 4.361 6.759 -26.178
102 HB3 ARG 16 3HB ARG 16 3.675 5.969 -27.591
103 HG2 ARG 16 2HG ARG 16 1.430 6.946 -26.544
104 HG3 ARG 16 3HG ARG 16 2.572 8.123 -25.895
105 HD2 ARG 16 2HD ARG 16 3.187 8.879 -27.991
106 HD3 ARG 16 3HD ARG 16 2.686 7.387 -28.787
107 HE ARG 16 HE ARG 16 0.522 8.884 -27.615
108 HH11 ARG 16 1HH1 ARG 16 2.503 8.417 -30.440
109 HH12 ARG 16 2HH1 ARG 16 1.333 9.083 -31.530
110 HH21 ARG 16 1HH2 ARG 16 -1.026 9.762 -29.041
111 HH22 ARG 16 2HH2 ARG 16 -0.674 9.848 -30.733
112 H ARG 17 H ARG 17 3.197 3.062 -24.260
113 HA ARG 17 HA ARG 17 5.933 2.394 -25.105
114 HB2 ARG 17 2HB ARG 17 4.977 2.099 -22.260
115 HB3 ARG 17 3HB ARG 17 6.617 1.932 -22.872
116 HG2 ARG 17 2HG ARG 17 5.035 4.493 -22.787
117 HG3 ARG 17 3HG ARG 17 6.301 4.022 -21.650
118 HD2 ARG 17 2HD ARG 17 7.363 3.743 -24.254
119 HD3 ARG 17 3HD ARG 17 6.548 5.305 -24.189
120 HE ARG 17 HE ARG 17 8.083 5.090 -21.887
121 HH11 ARG 17 1HH1 ARG 17 8.580 5.208 -25.330
122 HH12 ARG 17 2HH1 ARG 17 10.142 5.949 -25.211
123 HH21 ARG 17 1HH2 ARG 17 10.138 6.065 -21.717
124 HH22 ARG 17 2HH2 ARG 17 11.027 6.435 -23.155
125 H LYS 18 H LYS 18 3.010 1.420 -25.487
126 HA LYS 18 HA LYS 18 1.896 -0.555 -25.713
127 HB2 LYS 18 2HB LYS 18 4.243 -0.804 -26.989
128 HB3 LYS 18 3HB LYS 18 4.433 -2.097 -25.812
129 HG2 LYS 18 2HG LYS 18 3.430 -3.309 -27.420
130 HG3 LYS 18 3HG LYS 18 1.963 -2.656 -26.688
131 HD2 LYS 18 2HD LYS 18 3.103 -0.850 -28.654
132 HD3 LYS 18 3HD LYS 18 2.726 -2.431 -29.343
133 HE2 LYS 18 2HE LYS 18 0.448 -2.272 -28.556
134 HE3 LYS 18 3HE LYS 18 0.806 -0.760 -27.724
135 HZ1 LYS 18 3HZ LYS 18 0.359 -1.259 -30.558
136 HZ2 LYS 18 1HZ LYS 18 1.543 -0.113 -30.176
137 HZ3 LYS 18 2HZ LYS 18 -0.042 0.090 -29.619
138 H GLY 19 H GLY 19 2.625 0.272 -22.998
139 HA2 GLY 19 2HA GLY 19 2.087 -0.647 -20.931
140 HA3 GLY 19 3HA GLY 19 2.020 -2.233 -21.685
141 H GLY 20 H GLY 20 3.125 -2.378 -19.363
142 HA2 GLY 20 2HA GLY 20 5.898 -2.961 -19.932
143 HA3 GLY 20 3HA GLY 20 5.666 -1.671 -18.761
144 H LYS 21 H LYS 21 6.668 -2.907 -17.135
145 HA LYS 21 HA LYS 21 4.849 -4.618 -15.709
146 HB2 LYS 21 2HB LYS 21 6.516 -6.501 -15.542
147 HB3 LYS 21 3HB LYS 21 5.740 -6.326 -17.110
148 HG2 LYS 21 2HG LYS 21 8.157 -4.784 -17.035
149 HG3 LYS 21 3HG LYS 21 8.479 -6.452 -16.557
150 HD2 LYS 21 2HD LYS 21 6.746 -6.000 -18.928
151 HD3 LYS 21 3HD LYS 21 8.474 -5.685 -19.101
152 HE2 LYS 21 2HE LYS 21 8.665 -8.038 -17.922
153 HE3 LYS 21 3HE LYS 21 7.044 -8.245 -18.584
154 HZ1 LYS 21 3HZ LYS 21 7.886 -8.593 -20.590
155 HZ2 LYS 21 1HZ LYS 21 9.432 -8.613 -19.903
156 HZ3 LYS 21 2HZ LYS 21 8.806 -7.174 -20.534
157 H CYS 22 H CYS 22 5.703 -5.234 -13.573
158 HA CYS 22 HA CYS 22 7.233 -3.055 -12.454
159 HB2 CYS 22 2HB CYS 22 5.572 -5.280 -11.395
160 HB3 CYS 22 3HB CYS 22 6.837 -4.659 -10.339
161 H LYS 23 H LYS 23 9.152 -3.269 -11.240
162 HA LYS 23 HA LYS 23 10.630 -5.781 -11.556
163 HB2 LYS 23 2HB LYS 23 11.205 -4.109 -13.387
164 HB3 LYS 23 3HB LYS 23 11.900 -3.104 -12.122
165 HG2 LYS 23 2HG LYS 23 12.938 -5.740 -11.855
166 HG3 LYS 23 3HG LYS 23 13.102 -5.231 -13.537
167 HD2 LYS 23 2HD LYS 23 13.906 -2.986 -12.282
168 HD3 LYS 23 3HD LYS 23 14.411 -4.197 -11.102
169 HE2 LYS 23 2HE LYS 23 15.655 -5.378 -12.840
170 HE3 LYS 23 3HE LYS 23 15.130 -4.191 -14.033
171 HZ1 LYS 23 3HZ LYS 23 17.434 -4.012 -12.768
172 HZ2 LYS 23 1HZ LYS 23 16.476 -3.166 -11.660
173 HZ3 LYS 23 2HZ LYS 23 16.570 -2.646 -13.267
174 H ASN 24 H ASN 24 10.569 -6.260 -9.397
175 HA ASN 24 HA ASN 24 11.044 -6.152 -7.172
176 HB2 ASN 24 2HB ASN 24 13.355 -4.651 -8.391
177 HB3 ASN 24 3HB ASN 24 13.255 -4.943 -6.657
178 HD21 ASN 24 1HD2 ASN 24 14.545 -6.537 -6.118
179 HD22 ASN 24 2HD2 ASN 24 14.761 -8.015 -6.987
180 H GLY 25 H GLY 25 9.096 -4.335 -7.959
181 HA2 GLY 25 2HA GLY 25 7.980 -2.793 -6.511
182 HA3 GLY 25 3HA GLY 25 9.550 -2.207 -5.982
183 H ASP 26 H ASP 26 10.574 -2.057 -8.738
184 HA ASP 26 HA ASP 26 9.660 0.600 -9.317
185 HB2 ASP 26 2HB ASP 26 11.607 -1.215 -10.753
186 HB3 ASP 26 3HB ASP 26 11.293 0.456 -11.210
187 H CYS 27 H CYS 27 9.327 1.103 -11.782
188 HA CYS 27 HA CYS 27 7.469 -0.870 -12.925
189 HB2 CYS 27 2HB CYS 27 6.100 0.817 -11.861
190 HB3 CYS 27 3HB CYS 27 7.011 2.105 -12.641
191 H VAL 28 H VAL 28 8.709 -1.544 -14.600
192 HA VAL 28 HA VAL 28 10.066 0.416 -16.280
193 HB VAL 28 HB VAL 28 10.048 -2.588 -16.576
194 HG11 VAL 28 1HG1 VAL 28 11.237 -2.240 -18.417
195 HG12 VAL 28 2HG1 VAL 28 11.047 -0.498 -18.206
196 HG13 VAL 28 3HG1 VAL 28 12.429 -1.328 -17.491
197 HG21 VAL 28 3HG2 VAL 28 12.209 -2.561 -15.420
198 HG22 VAL 28 1HG2 VAL 28 12.025 -0.832 -15.124
199 HG23 VAL 28 2HG2 VAL 28 10.910 -1.978 -14.379
200 H CYS 29 H CYS 29 9.438 0.982 -18.286
201 HA CYS 29 HA CYS 29 6.959 -0.234 -19.307
202 HB2 CYS 29 2HB CYS 29 8.115 2.534 -19.594
203 HB3 CYS 29 3HB CYS 29 6.846 1.944 -20.662
204 H ARG 30 H ARG 30 7.165 -1.517 -21.006
205 HA ARG 30 HA ARG 30 9.547 -1.962 -22.390
206 HB2 ARG 30 2HB ARG 30 6.680 -2.580 -23.090
207 HB3 ARG 30 3HB ARG 30 8.028 -3.088 -24.098
208 HG2 ARG 30 2HG ARG 30 8.956 -4.216 -22.017
209 HG3 ARG 30 3HG ARG 30 7.365 -3.946 -21.302
210 HD2 ARG 30 2HD ARG 30 7.700 -5.306 -23.958
211 HD3 ARG 30 3HD ARG 30 7.800 -6.198 -22.441
212 HE ARG 30 HE ARG 30 5.446 -4.713 -22.388
213 HH11 ARG 30 1HH1 ARG 30 6.844 -7.334 -24.204
214 HH12 ARG 30 2HH1 ARG 30 5.317 -8.063 -24.577
215 HH21 ARG 30 1HH2 ARG 30 3.430 -5.664 -22.871
216 HH22 ARG 30 2HH2 ARG 30 3.376 -7.111 -23.819
Start of MODEL 19
1 H1 PHE 1 H PHE 1 3.559 -2.382 0.072
2 HA PHE 1 HA PHE 1 1.604 -2.953 -1.595
3 HB2 PHE 1 2HB PHE 1 2.942 -0.533 -2.822
4 HB3 PHE 1 3HB PHE 1 1.662 -1.499 -3.548
5 HD1 PHE 1 HD2 PHE 1 -0.445 -1.767 -1.842
6 HD2 PHE 1 HD1 PHE 1 2.290 1.491 -1.993
7 HE1 PHE 1 HE2 PHE 1 -2.134 -0.307 -0.809
8 HE2 PHE 1 HE1 PHE 1 0.605 2.957 -0.959
9 HZ PHE 1 HZ PHE 1 -1.610 2.059 -0.367
10 H SER 2 H SER 2 2.222 -3.965 -3.647
11 HA SER 2 HA SER 2 5.099 -4.603 -3.710
12 HB2 SER 2 2HB SER 2 2.908 -6.449 -4.657
13 HB3 SER 2 3HB SER 2 4.590 -6.844 -4.305
14 HG SER 2 HG SER 2 2.884 -7.371 -2.669
15 H CYS 3 H CYS 3 4.060 -2.424 -5.123
16 HA CYS 3 HA CYS 3 3.975 -1.480 -7.194
17 HB2 CYS 3 2HB CYS 3 6.289 -2.663 -7.104
18 HB3 CYS 3 3HB CYS 3 5.568 -3.805 -8.233
19 H ASP 4 H ASP 4 1.755 -1.794 -7.532
20 HA ASP 4 HA ASP 4 0.532 -4.110 -8.481
21 HB2 ASP 4 2HB ASP 4 -0.204 -1.381 -8.051
22 HB3 ASP 4 3HB ASP 4 -0.799 -1.878 -9.633
23 H HIS 5 H HIS 5 0.480 -5.111 -10.390
24 HA HIS 5 HA HIS 5 2.145 -4.191 -12.530
25 HB2 HIS 5 2HB HIS 5 0.501 -6.609 -11.976
26 HB3 HIS 5 3HB HIS 5 0.880 -6.257 -13.660
27 HD1 HIS 5 HD1 HIS 5 2.592 -8.025 -14.125
28 HD2 HIS 5 HD2 HIS 5 3.427 -5.870 -10.672
29 HE1 HIS 5 HE1 HIS 5 4.884 -8.770 -13.405
30 H SER 6 H SER 6 -1.244 -4.056 -11.785
31 HA SER 6 HA SER 6 -2.169 -3.526 -14.425
32 HB2 SER 6 2HB SER 6 -3.407 -3.003 -11.716
33 HB3 SER 6 3HB SER 6 -4.241 -2.723 -13.244
34 HG SER 6 HG SER 6 -4.636 -4.775 -13.343
35 H ALA 7 H ALA 7 -1.554 -1.430 -11.614
36 HA ALA 7 HA ALA 7 -2.208 1.011 -12.741
37 HB1 ALA 7 1HB ALA 7 -0.075 0.371 -10.710
38 HB2 ALA 7 2HB ALA 7 -0.642 1.999 -11.088
39 HB3 ALA 7 3HB ALA 7 -1.751 0.818 -10.391
40 H CYS 8 H CYS 8 0.951 -0.628 -12.741
41 HA CYS 8 HA CYS 8 2.290 1.368 -14.235
42 HB2 CYS 8 2HB CYS 8 3.365 -0.423 -12.809
43 HB3 CYS 8 3HB CYS 8 3.019 -1.561 -14.107
44 H ALA 9 H ALA 9 0.783 -1.708 -15.165
45 HA ALA 9 HA ALA 9 1.450 -1.790 -17.839
46 HB1 ALA 9 1HB ALA 9 0.281 -3.594 -16.664
47 HB2 ALA 9 2HB ALA 9 -1.184 -2.612 -16.623
48 HB3 ALA 9 3HB ALA 9 -0.533 -3.159 -18.168
49 H VAL 10 H VAL 10 -1.351 -0.176 -16.353
50 HA VAL 10 HA VAL 10 -2.351 0.873 -18.798
51 HB VAL 10 HB VAL 10 -2.859 1.807 -15.970
52 HG11 VAL 10 1HG1 VAL 10 -5.011 2.652 -17.064
53 HG12 VAL 10 2HG1 VAL 10 -3.534 3.573 -17.353
54 HG13 VAL 10 3HG1 VAL 10 -4.152 2.482 -18.594
55 HG21 VAL 10 3HG2 VAL 10 -3.589 -0.585 -17.255
56 HG22 VAL 10 1HG2 VAL 10 -4.172 0.035 -15.711
57 HG23 VAL 10 2HG2 VAL 10 -5.041 0.413 -17.198
58 H ARG 11 H ARG 11 -0.472 2.312 -16.143
59 HA ARG 11 HA ARG 11 -0.279 4.896 -17.188
60 HB2 ARG 11 2HB ARG 11 0.325 4.310 -14.875
61 HB3 ARG 11 3HB ARG 11 1.720 3.418 -15.467
62 HG2 ARG 11 2HG ARG 11 2.929 5.288 -15.851
63 HG3 ARG 11 3HG ARG 11 1.514 6.244 -16.298
64 HD2 ARG 11 2HD ARG 11 2.000 7.212 -14.292
65 HD3 ARG 11 3HD ARG 11 0.937 5.919 -13.738
66 HE ARG 11 HE ARG 11 2.733 4.912 -12.721
67 HH11 ARG 11 1HH1 ARG 11 3.858 7.416 -14.861
68 HH12 ARG 11 2HH1 ARG 11 5.493 7.348 -14.293
69 HH21 ARG 11 1HH2 ARG 11 4.883 4.812 -11.964
70 HH22 ARG 11 2HH2 ARG 11 6.075 5.866 -12.646
71 H CYS 12 H CYS 12 1.267 1.975 -18.134
72 HA CYS 12 HA CYS 12 3.431 3.305 -19.536
73 HB2 CYS 12 2HB CYS 12 2.610 0.433 -19.176
74 HB3 CYS 12 3HB CYS 12 3.827 0.887 -20.365
75 H LEU 13 H LEU 13 0.608 1.315 -20.404
76 HA LEU 13 HA LEU 13 0.892 1.568 -23.188
77 HB2 LEU 13 2HB LEU 13 -1.027 0.385 -23.330
78 HB3 LEU 13 3HB LEU 13 -0.666 0.076 -21.633
79 HG LEU 13 HG LEU 13 -2.179 2.233 -21.308
80 HD11 LEU 13 1HD1 LEU 13 -3.231 2.916 -23.134
81 HD12 LEU 13 2HD1 LEU 13 -4.022 1.344 -23.244
82 HD13 LEU 13 3HD1 LEU 13 -2.494 1.622 -24.079
83 HD21 LEU 13 3HD2 LEU 13 -2.448 -0.240 -20.574
84 HD22 LEU 13 1HD2 LEU 13 -3.588 -0.333 -21.917
85 HD23 LEU 13 2HD2 LEU 13 -3.864 0.813 -20.605
86 H ALA 14 H ALA 14 -0.388 3.710 -20.789
87 HA ALA 14 HA ALA 14 -1.841 5.356 -22.659
88 HB1 ALA 14 1HB ALA 14 -2.314 6.779 -20.781
89 HB2 ALA 14 2HB ALA 14 -2.525 5.099 -20.288
90 HB3 ALA 14 3HB ALA 14 -1.075 5.982 -19.812
91 H GLN 15 H GLN 15 1.377 5.169 -21.427
92 HA GLN 15 HA GLN 15 2.024 7.878 -22.293
93 HB2 GLN 15 2HB GLN 15 3.151 5.973 -20.422
94 HB3 GLN 15 3HB GLN 15 4.382 6.603 -21.507
95 HG2 GLN 15 2HG GLN 15 3.519 8.910 -20.914
96 HG3 GLN 15 3HG GLN 15 2.614 8.124 -19.622
97 HE21 GLN 15 1HE2 GLN 15 3.617 7.676 -17.765
98 HE22 GLN 15 2HE2 GLN 15 5.308 7.881 -17.476
99 H ARG 16 H ARG 16 1.377 5.444 -24.051
100 HA ARG 16 HA ARG 16 1.990 4.686 -26.106
101 HB2 ARG 16 2HB ARG 16 4.084 6.858 -26.121
102 HB3 ARG 16 3HB ARG 16 3.329 6.081 -27.507
103 HG2 ARG 16 2HG ARG 16 1.868 7.811 -25.524
104 HG3 ARG 16 3HG ARG 16 2.509 8.375 -27.068
105 HD2 ARG 16 2HD ARG 16 1.121 6.467 -28.096
106 HD3 ARG 16 3HD ARG 16 0.281 6.437 -26.546
107 HE ARG 16 HE ARG 16 0.226 9.059 -27.317
108 HH11 ARG 16 1HH1 ARG 16 -0.804 6.043 -28.718
109 HH12 ARG 16 2HH1 ARG 16 -2.115 6.752 -29.602
110 HH21 ARG 16 1HH2 ARG 16 -1.496 10.004 -28.475
111 HH22 ARG 16 2HH2 ARG 16 -2.507 9.005 -29.464
112 H ARG 17 H ARG 17 2.956 3.176 -24.158
113 HA ARG 17 HA ARG 17 5.661 2.494 -25.089
114 HB2 ARG 17 2HB ARG 17 4.763 2.273 -22.213
115 HB3 ARG 17 3HB ARG 17 6.373 1.971 -22.851
116 HG2 ARG 17 2HG ARG 17 4.984 4.643 -22.819
117 HG3 ARG 17 3HG ARG 17 6.224 4.114 -21.681
118 HD2 ARG 17 2HD ARG 17 7.114 3.735 -24.389
119 HD3 ARG 17 3HD ARG 17 6.594 5.402 -24.142
120 HE ARG 17 HE ARG 17 8.161 4.914 -21.991
121 HH11 ARG 17 1HH1 ARG 17 8.616 4.540 -25.422
122 HH12 ARG 17 2HH1 ARG 17 10.324 4.819 -25.358
123 HH21 ARG 17 1HH2 ARG 17 10.410 5.283 -21.893
124 HH22 ARG 17 2HH2 ARG 17 11.344 5.241 -23.350
125 H LYS 18 H LYS 18 2.723 1.534 -25.378
126 HA LYS 18 HA LYS 18 1.593 -0.436 -25.568
127 HB2 LYS 18 2HB LYS 18 3.876 -0.696 -26.933
128 HB3 LYS 18 3HB LYS 18 4.137 -1.969 -25.747
129 HG2 LYS 18 2HG LYS 18 2.662 -3.331 -26.717
130 HG3 LYS 18 3HG LYS 18 1.483 -2.039 -26.952
131 HD2 LYS 18 2HD LYS 18 3.820 -1.759 -28.665
132 HD3 LYS 18 3HD LYS 18 2.959 -3.277 -28.929
133 HE2 LYS 18 2HE LYS 18 0.904 -2.100 -29.339
134 HE3 LYS 18 3HE LYS 18 1.643 -0.564 -28.890
135 HZ1 LYS 18 3HZ LYS 18 2.933 -2.036 -31.042
136 HZ2 LYS 18 1HZ LYS 18 2.667 -0.374 -30.873
137 HZ3 LYS 18 2HZ LYS 18 1.414 -1.382 -31.396
138 H GLY 19 H GLY 19 2.411 0.389 -22.878
139 HA2 GLY 19 2HA GLY 19 1.934 -0.527 -20.795
140 HA3 GLY 19 3HA GLY 19 1.835 -2.113 -21.545
141 H GLY 20 H GLY 20 3.014 -2.234 -19.246
142 HA2 GLY 20 2HA GLY 20 5.764 -2.843 -19.905
143 HA3 GLY 20 3HA GLY 20 5.575 -1.548 -18.731
144 H LYS 21 H LYS 21 6.522 -2.676 -17.048
145 HA LYS 21 HA LYS 21 4.766 -4.514 -15.681
146 HB2 LYS 21 2HB LYS 21 6.649 -6.195 -15.372
147 HB3 LYS 21 3HB LYS 21 5.874 -6.170 -16.951
148 HG2 LYS 21 2HG LYS 21 8.130 -4.371 -16.865
149 HG3 LYS 21 3HG LYS 21 8.592 -6.015 -16.418
150 HD2 LYS 21 2HD LYS 21 6.956 -5.382 -18.865
151 HD3 LYS 21 3HD LYS 21 8.720 -5.451 -18.882
152 HE2 LYS 21 2HE LYS 21 6.932 -7.705 -17.979
153 HE3 LYS 21 3HE LYS 21 7.611 -7.563 -19.600
154 HZ1 LYS 21 3HZ LYS 21 9.260 -8.777 -18.723
155 HZ2 LYS 21 1HZ LYS 21 8.884 -8.361 -17.127
156 HZ3 LYS 21 2HZ LYS 21 9.797 -7.306 -18.083
157 H CYS 22 H CYS 22 5.544 -5.019 -13.487
158 HA CYS 22 HA CYS 22 7.043 -2.746 -12.411
159 HB2 CYS 22 2HB CYS 22 4.759 -4.245 -11.537
160 HB3 CYS 22 3HB CYS 22 6.025 -4.362 -10.318
161 H LYS 23 H LYS 23 8.828 -2.981 -11.090
162 HA LYS 23 HA LYS 23 9.902 -5.689 -10.737
163 HB2 LYS 23 2HB LYS 23 10.995 -3.580 -12.417
164 HB3 LYS 23 3HB LYS 23 12.147 -4.112 -11.199
165 HG2 LYS 23 2HG LYS 23 12.677 -5.684 -12.692
166 HG3 LYS 23 3HG LYS 23 11.212 -6.489 -12.126
167 HD2 LYS 23 2HD LYS 23 9.974 -5.810 -13.966
168 HD3 LYS 23 3HD LYS 23 11.058 -4.464 -14.323
169 HE2 LYS 23 2HE LYS 23 12.648 -6.744 -14.525
170 HE3 LYS 23 3HE LYS 23 11.119 -7.190 -15.282
171 HZ1 LYS 23 3HZ LYS 23 13.156 -5.708 -16.401
172 HZ2 LYS 23 1HZ LYS 23 11.920 -4.594 -16.094
173 HZ3 LYS 23 2HZ LYS 23 11.611 -5.960 -17.042
174 H ASN 24 H ASN 24 9.418 -5.604 -8.542
175 HA ASN 24 HA ASN 24 9.678 -5.084 -6.339
176 HB2 ASN 24 2HB ASN 24 12.116 -5.608 -7.318
177 HB3 ASN 24 3HB ASN 24 12.381 -3.939 -6.820
178 HD21 ASN 24 1HD2 ASN 24 12.010 -7.179 -5.817
179 HD22 ASN 24 2HD2 ASN 24 12.188 -6.915 -4.119
180 H GLY 25 H GLY 25 8.391 -3.089 -7.843
181 HA2 GLY 25 2HA GLY 25 7.550 -1.045 -6.895
182 HA3 GLY 25 3HA GLY 25 9.161 -0.720 -6.272
183 H ASP 26 H ASP 26 10.476 -1.435 -8.785
184 HA ASP 26 HA ASP 26 10.301 1.131 -10.047
185 HB2 ASP 26 2HB ASP 26 11.947 -1.340 -10.498
186 HB3 ASP 26 3HB ASP 26 11.948 -0.044 -11.691
187 H CYS 27 H CYS 27 8.642 1.606 -11.330
188 HA CYS 27 HA CYS 27 7.256 -0.425 -12.837
189 HB2 CYS 27 2HB CYS 27 5.996 1.405 -11.816
190 HB3 CYS 27 3HB CYS 27 6.903 2.579 -12.764
191 H VAL 28 H VAL 28 8.431 -1.221 -14.497
192 HA VAL 28 HA VAL 28 9.918 0.572 -16.240
193 HB VAL 28 HB VAL 28 9.602 -2.420 -16.489
194 HG11 VAL 28 1HG1 VAL 28 11.805 -2.155 -17.700
195 HG12 VAL 28 2HG1 VAL 28 10.385 -1.517 -18.531
196 HG13 VAL 28 3HG1 VAL 28 11.492 -0.420 -17.705
197 HG21 VAL 28 3HG2 VAL 28 11.320 -0.766 -14.732
198 HG22 VAL 28 1HG2 VAL 28 10.665 -2.385 -14.483
199 HG23 VAL 28 2HG2 VAL 28 12.075 -2.154 -15.517
200 H CYS 29 H CYS 29 9.483 0.922 -18.399
201 HA CYS 29 HA CYS 29 6.907 -0.097 -19.399
202 HB2 CYS 29 2HB CYS 29 7.999 2.708 -19.475
203 HB3 CYS 29 3HB CYS 29 6.778 2.166 -20.622
204 H ARG 30 H ARG 30 7.106 -1.202 -21.222
205 HA ARG 30 HA ARG 30 9.588 -1.272 -22.654
206 HB2 ARG 30 2HB ARG 30 6.981 -2.500 -23.540
207 HB3 ARG 30 3HB ARG 30 8.612 -3.008 -23.956
208 HG2 ARG 30 2HG ARG 30 8.680 -3.244 -21.261
209 HG3 ARG 30 3HG ARG 30 6.987 -3.617 -21.592
210 HD2 ARG 30 2HD ARG 30 7.483 -5.558 -22.627
211 HD3 ARG 30 3HD ARG 30 8.934 -4.901 -23.384
212 HE ARG 30 HE ARG 30 8.804 -6.408 -20.979
213 HH11 ARG 30 1HH1 ARG 30 10.512 -3.801 -22.530
214 HH12 ARG 30 2HH1 ARG 30 11.972 -4.048 -21.630
215 HH21 ARG 30 1HH2 ARG 30 10.720 -6.744 -19.788
216 HH22 ARG 30 2HH2 ARG 30 12.090 -5.723 -20.071
Start of MODEL 20
1 H1 PHE 1 H PHE 1 0.978 0.670 0.245
2 HA PHE 1 HA PHE 1 1.520 1.417 -1.952
3 HB2 PHE 1 2HB PHE 1 4.043 1.837 -0.613
4 HB3 PHE 1 3HB PHE 1 4.294 1.005 -2.144
5 HD1 PHE 1 HD1 PHE 1 2.585 2.069 -4.044
6 HD2 PHE 1 HD2 PHE 1 4.354 4.095 -0.745
7 HE1 PHE 1 HE1 PHE 1 2.366 4.207 -5.244
8 HE2 PHE 1 HE2 PHE 1 4.137 6.235 -1.938
9 HZ PHE 1 HZ PHE 1 3.141 6.293 -4.190
10 H SER 2 H SER 2 1.931 0.108 -3.782
11 HA SER 2 HA SER 2 3.133 -2.476 -3.540
12 HB2 SER 2 2HB SER 2 0.169 -2.190 -3.354
13 HB3 SER 2 3HB SER 2 0.812 -3.536 -4.295
14 HG SER 2 HG SER 2 0.692 -3.222 -1.610
15 H CYS 3 H CYS 3 3.984 -2.931 -5.455
16 HA CYS 3 HA CYS 3 3.291 -1.373 -7.768
17 HB2 CYS 3 2HB CYS 3 5.622 -1.970 -7.333
18 HB3 CYS 3 3HB CYS 3 5.220 -3.681 -7.442
19 H ASP 4 H ASP 4 1.113 -1.997 -8.127
20 HA ASP 4 HA ASP 4 0.439 -4.733 -8.674
21 HB2 ASP 4 2HB ASP 4 -0.973 -2.307 -8.209
22 HB3 ASP 4 3HB ASP 4 -1.502 -2.944 -9.765
23 H HIS 5 H HIS 5 0.609 -5.791 -10.538
24 HA HIS 5 HA HIS 5 1.960 -4.812 -12.753
25 HB2 HIS 5 2HB HIS 5 1.197 -7.262 -12.012
26 HB3 HIS 5 3HB HIS 5 -0.064 -6.949 -13.201
27 HD1 HIS 5 HD1 HIS 5 2.869 -8.708 -13.111
28 HD2 HIS 5 HD2 HIS 5 1.543 -5.686 -15.636
29 HE1 HIS 5 HE1 HIS 5 4.229 -8.943 -15.214
30 H SER 6 H SER 6 -1.450 -4.718 -11.984
31 HA SER 6 HA SER 6 -2.383 -4.023 -14.569
32 HB2 SER 6 2HB SER 6 -3.519 -4.479 -12.001
33 HB3 SER 6 3HB SER 6 -4.082 -2.904 -12.559
34 HG SER 6 HG SER 6 -4.795 -5.369 -13.399
35 H ALA 7 H ALA 7 -1.844 -2.027 -11.663
36 HA ALA 7 HA ALA 7 -2.411 0.452 -12.734
37 HB1 ALA 7 1HB ALA 7 -0.304 0.957 -11.018
38 HB2 ALA 7 2HB ALA 7 -2.011 0.868 -10.582
39 HB3 ALA 7 3HB ALA 7 -0.984 -0.556 -10.419
40 H CYS 8 H CYS 8 0.664 -1.315 -12.788
41 HA CYS 8 HA CYS 8 2.130 0.731 -14.099
42 HB2 CYS 8 2HB CYS 8 2.610 -2.232 -13.780
43 HB3 CYS 8 3HB CYS 8 3.746 -1.162 -14.595
44 H ALA 9 H ALA 9 0.558 -2.234 -15.262
45 HA ALA 9 HA ALA 9 1.279 -2.149 -17.922
46 HB1 ALA 9 1HB ALA 9 -0.839 -3.367 -18.367
47 HB2 ALA 9 2HB ALA 9 0.091 -4.032 -17.024
48 HB3 ALA 9 3HB ALA 9 -1.331 -3.039 -16.705
49 H VAL 10 H VAL 10 -1.516 -0.574 -16.383
50 HA VAL 10 HA VAL 10 -2.442 0.660 -18.770
51 HB VAL 10 HB VAL 10 -2.988 1.497 -15.919
52 HG11 VAL 10 1HG1 VAL 10 -3.565 3.155 -17.670
53 HG12 VAL 10 2HG1 VAL 10 -4.619 1.951 -18.414
54 HG13 VAL 10 3HG1 VAL 10 -4.969 2.549 -16.791
55 HG21 VAL 10 3HG2 VAL 10 -3.851 -0.819 -17.459
56 HG22 VAL 10 1HG2 VAL 10 -3.973 -0.499 -15.729
57 HG23 VAL 10 2HG2 VAL 10 -5.197 0.132 -16.830
58 H ARG 11 H ARG 11 -0.588 1.871 -15.986
59 HA ARG 11 HA ARG 11 -0.318 4.516 -16.847
60 HB2 ARG 11 2HB ARG 11 0.283 3.441 -14.575
61 HB3 ARG 11 3HB ARG 11 1.835 3.079 -15.318
62 HG2 ARG 11 2HG ARG 11 2.502 5.245 -15.312
63 HG3 ARG 11 3HG ARG 11 0.863 5.866 -15.518
64 HD2 ARG 11 2HD ARG 11 1.160 4.493 -12.993
65 HD3 ARG 11 3HD ARG 11 2.350 5.783 -13.163
66 HE ARG 11 HE ARG 11 -0.500 6.074 -12.863
67 HH11 ARG 11 1HH1 ARG 11 2.448 7.567 -13.959
68 HH12 ARG 11 2HH1 ARG 11 1.839 9.182 -13.810
69 HH21 ARG 11 1HH2 ARG 11 -1.313 8.195 -12.662
70 HH22 ARG 11 2HH2 ARG 11 -0.300 9.538 -13.071
71 H CYS 12 H CYS 12 1.183 1.631 -17.962
72 HA CYS 12 HA CYS 12 3.404 3.004 -19.227
73 HB2 CYS 12 2HB CYS 12 2.516 0.133 -19.080
74 HB3 CYS 12 3HB CYS 12 3.767 0.639 -20.212
75 H LEU 13 H LEU 13 0.559 1.142 -20.283
76 HA LEU 13 HA LEU 13 0.906 1.576 -23.037
77 HB2 LEU 13 2HB LEU 13 -1.034 0.449 -23.297
78 HB3 LEU 13 3HB LEU 13 -0.715 0.017 -21.619
79 HG LEU 13 HG LEU 13 -2.188 2.181 -21.176
80 HD11 LEU 13 1HD1 LEU 13 -4.010 1.471 -23.202
81 HD12 LEU 13 2HD1 LEU 13 -2.460 1.765 -23.989
82 HD13 LEU 13 3HD1 LEU 13 -3.184 3.012 -22.973
83 HD21 LEU 13 3HD2 LEU 13 -3.862 0.750 -20.541
84 HD22 LEU 13 1HD2 LEU 13 -2.514 -0.378 -20.686
85 HD23 LEU 13 2HD2 LEU 13 -3.703 -0.254 -21.983
86 H ALA 14 H ALA 14 -0.378 3.579 -20.523
87 HA ALA 14 HA ALA 14 -1.757 5.381 -22.304
88 HB1 ALA 14 1HB ALA 14 -1.024 5.934 -19.443
89 HB2 ALA 14 2HB ALA 14 -2.355 6.607 -20.384
90 HB3 ALA 14 3HB ALA 14 -2.390 4.913 -19.892
91 H GLN 15 H GLN 15 1.430 5.038 -21.025
92 HA GLN 15 HA GLN 15 2.153 7.784 -21.692
93 HB2 GLN 15 2HB GLN 15 3.199 5.731 -19.934
94 HB3 GLN 15 3HB GLN 15 4.466 6.407 -20.949
95 HG2 GLN 15 2HG GLN 15 3.641 8.687 -20.216
96 HG3 GLN 15 3HG GLN 15 2.690 7.835 -19.000
97 HE21 GLN 15 1HE2 GLN 15 4.035 6.180 -17.736
98 HE22 GLN 15 2HE2 GLN 15 5.571 6.737 -17.175
99 H ARG 16 H ARG 16 1.492 5.490 -23.624
100 HA ARG 16 HA ARG 16 2.131 4.859 -25.714
101 HB2 ARG 16 2HB ARG 16 4.267 6.984 -25.535
102 HB3 ARG 16 3HB ARG 16 3.535 6.315 -26.988
103 HG2 ARG 16 2HG ARG 16 2.133 8.012 -24.933
104 HG3 ARG 16 3HG ARG 16 2.703 8.552 -26.514
105 HD2 ARG 16 2HD ARG 16 1.224 6.575 -27.383
106 HD3 ARG 16 3HD ARG 16 0.421 6.756 -25.825
107 HE ARG 16 HE ARG 16 0.520 9.286 -26.856
108 HH11 ARG 16 1HH1 ARG 16 -0.738 6.222 -27.927
109 HH12 ARG 16 2HH1 ARG 16 -2.021 6.926 -28.856
110 HH21 ARG 16 1HH2 ARG 16 -1.164 10.225 -28.075
111 HH22 ARG 16 2HH2 ARG 16 -2.261 9.203 -28.940
112 H ARG 17 H ARG 17 3.024 3.199 -23.855
113 HA ARG 17 HA ARG 17 5.732 2.522 -24.777
114 HB2 ARG 17 2HB ARG 17 4.789 2.079 -21.945
115 HB3 ARG 17 3HB ARG 17 6.415 1.872 -22.582
116 HG2 ARG 17 2HG ARG 17 4.978 4.511 -22.404
117 HG3 ARG 17 3HG ARG 17 6.133 3.910 -21.212
118 HD2 ARG 17 2HD ARG 17 6.896 4.078 -24.099
119 HD3 ARG 17 3HD ARG 17 6.933 5.522 -23.089
120 HE ARG 17 HE ARG 17 8.797 3.364 -23.062
121 HH11 ARG 17 1HH1 ARG 17 7.281 5.786 -21.073
122 HH12 ARG 17 2HH1 ARG 17 8.583 5.850 -19.931
123 HH21 ARG 17 1HH2 ARG 17 10.518 3.440 -21.567
124 HH22 ARG 17 2HH2 ARG 17 10.424 4.516 -20.214
125 H LYS 18 H LYS 18 2.782 1.649 -25.189
126 HA LYS 18 HA LYS 18 1.614 -0.277 -25.534
127 HB2 LYS 18 2HB LYS 18 3.947 -0.497 -26.848
128 HB3 LYS 18 3HB LYS 18 4.105 -1.877 -25.768
129 HG2 LYS 18 2HG LYS 18 2.274 -2.968 -26.687
130 HG3 LYS 18 3HG LYS 18 1.623 -1.486 -27.393
131 HD2 LYS 18 2HD LYS 18 4.282 -2.102 -28.384
132 HD3 LYS 18 3HD LYS 18 3.135 -3.406 -28.696
133 HE2 LYS 18 2HE LYS 18 1.573 -1.594 -29.577
134 HE3 LYS 18 3HE LYS 18 2.980 -0.531 -29.559
135 HZ1 LYS 18 3HZ LYS 18 2.302 -2.643 -31.391
136 HZ2 LYS 18 1HZ LYS 18 3.900 -2.725 -30.839
137 HZ3 LYS 18 2HZ LYS 18 3.339 -1.322 -31.599
138 H GLY 19 H GLY 19 2.393 0.345 -22.779
139 HA2 GLY 19 2HA GLY 19 1.853 -0.699 -20.773
140 HA3 GLY 19 3HA GLY 19 1.736 -2.228 -21.632
141 H GLY 20 H GLY 20 2.867 -2.504 -19.309
142 HA2 GLY 20 2HA GLY 20 5.626 -3.112 -19.962
143 HA3 GLY 20 3HA GLY 20 5.415 -1.927 -18.681
144 H LYS 21 H LYS 21 6.302 -3.210 -17.079
145 HA LYS 21 HA LYS 21 4.492 -5.108 -15.897
146 HB2 LYS 21 2HB LYS 21 6.225 -6.926 -15.777
147 HB3 LYS 21 3HB LYS 21 5.552 -6.651 -17.378
148 HG2 LYS 21 2HG LYS 21 7.948 -5.078 -16.862
149 HG3 LYS 21 3HG LYS 21 8.216 -6.820 -16.759
150 HD2 LYS 21 2HD LYS 21 6.636 -5.790 -19.055
151 HD3 LYS 21 3HD LYS 21 8.377 -5.504 -19.058
152 HE2 LYS 21 2HE LYS 21 8.354 -7.531 -20.088
153 HE3 LYS 21 3HE LYS 21 8.411 -8.080 -18.413
154 HZ1 LYS 21 3HZ LYS 21 6.720 -9.222 -19.779
155 HZ2 LYS 21 1HZ LYS 21 5.907 -7.751 -19.974
156 HZ3 LYS 21 2HZ LYS 21 6.062 -8.434 -18.435
157 H CYS 22 H CYS 22 5.293 -5.883 -13.775
158 HA CYS 22 HA CYS 22 6.850 -3.766 -12.488
159 HB2 CYS 22 2HB CYS 22 4.675 -5.561 -11.666
160 HB3 CYS 22 3HB CYS 22 5.945 -5.381 -10.460
161 H LYS 23 H LYS 23 8.703 -4.134 -11.339
162 HA LYS 23 HA LYS 23 9.743 -6.882 -11.274
163 HB2 LYS 23 2HB LYS 23 10.861 -4.550 -12.668
164 HB3 LYS 23 3HB LYS 23 12.014 -5.391 -11.640
165 HG2 LYS 23 2HG LYS 23 11.573 -7.473 -12.805
166 HG3 LYS 23 3HG LYS 23 10.357 -6.674 -13.804
167 HD2 LYS 23 2HD LYS 23 11.902 -5.730 -15.142
168 HD3 LYS 23 3HD LYS 23 12.990 -5.372 -13.798
169 HE2 LYS 23 2HE LYS 23 12.892 -8.191 -14.127
170 HE3 LYS 23 3HE LYS 23 13.153 -7.469 -15.713
171 HZ1 LYS 23 3HZ LYS 23 14.971 -6.142 -14.633
172 HZ2 LYS 23 1HZ LYS 23 15.268 -7.803 -14.767
173 HZ3 LYS 23 2HZ LYS 23 14.809 -7.143 -13.279
174 H ASN 24 H ASN 24 9.430 -7.109 -9.086
175 HA ASN 24 HA ASN 24 9.783 -6.862 -6.849
176 HB2 ASN 24 2HB ASN 24 12.180 -7.138 -7.958
177 HB3 ASN 24 3HB ASN 24 12.387 -5.495 -7.358
178 HD21 ASN 24 1HD2 ASN 24 11.935 -8.826 -6.504
179 HD22 ASN 24 2HD2 ASN 24 12.327 -8.662 -4.830
180 H GLY 25 H GLY 25 8.450 -4.676 -8.237
181 HA2 GLY 25 2HA GLY 25 7.477 -2.855 -6.943
182 HA3 GLY 25 3HA GLY 25 9.087 -2.522 -6.321
183 H ASP 26 H ASP 26 10.414 -2.792 -8.876
184 HA ASP 26 HA ASP 26 9.997 -0.121 -9.831
185 HB2 ASP 26 2HB ASP 26 11.865 -2.354 -10.589
186 HB3 ASP 26 3HB ASP 26 11.767 -0.885 -11.555
187 H CYS 27 H CYS 27 8.341 0.362 -11.109
188 HA CYS 27 HA CYS 27 7.127 -1.608 -12.829
189 HB2 CYS 27 2HB CYS 27 6.520 1.186 -12.002
190 HB3 CYS 27 3HB CYS 27 5.848 0.630 -13.532
191 H VAL 28 H VAL 28 8.421 -2.152 -14.513
192 HA VAL 28 HA VAL 28 9.795 -0.108 -16.048
193 HB VAL 28 HB VAL 28 9.640 -3.067 -16.625
194 HG11 VAL 28 1HG1 VAL 28 10.555 -2.270 -18.535
195 HG12 VAL 28 2HG1 VAL 28 11.111 -0.777 -17.775
196 HG13 VAL 28 3HG1 VAL 28 12.024 -2.271 -17.560
197 HG21 VAL 28 3HG2 VAL 28 10.561 -2.972 -14.472
198 HG22 VAL 28 1HG2 VAL 28 11.959 -3.040 -15.546
199 HG23 VAL 28 2HG2 VAL 28 11.471 -1.504 -14.829
200 H CYS 29 H CYS 29 9.364 0.456 -18.160
201 HA CYS 29 HA CYS 29 6.813 -0.524 -19.264
202 HB2 CYS 29 2HB CYS 29 7.948 2.266 -19.193
203 HB3 CYS 29 3HB CYS 29 6.706 1.801 -20.351
204 H ARG 30 H ARG 30 6.989 -1.505 -21.161
205 HA ARG 30 HA ARG 30 9.049 -0.643 -23.050
206 HB2 ARG 30 2HB ARG 30 8.743 -3.406 -21.912
207 HB3 ARG 30 3HB ARG 30 9.410 -3.170 -23.522
208 HG2 ARG 30 2HG ARG 30 10.540 -1.688 -21.186
209 HG3 ARG 30 3HG ARG 30 11.008 -3.359 -21.508
210 HD2 ARG 30 2HD ARG 30 12.439 -2.671 -23.059
211 HD3 ARG 30 3HD ARG 30 11.121 -1.912 -23.952
212 HE ARG 30 HE ARG 30 12.029 -0.310 -21.766
213 HH11 ARG 30 1HH1 ARG 30 12.682 -1.214 -25.064
214 HH12 ARG 30 2HH1 ARG 30 13.527 0.251 -25.436
215 HH21 ARG 30 1HH2 ARG 30 13.140 1.624 -22.243
216 HH22 ARG 30 2HH2 ARG 30 13.788 1.865 -23.831
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