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 |
|
|
25411 |
2k8j   |
15951 | cing | 1-original | 2 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 H1 ARG 1 HT1 ARG 1 19.675 -4.945 -5.595
2 H2 ARG 1 HT2 ARG 1 19.444 -5.625 -7.134
3 H3 ARG 1 HT3 ARG 1 20.701 -4.522 -6.873
4 HA ARG 1 HA ARG 1 21.398 -6.939 -6.978
5 HB2 ARG 1 HB2 ARG 1 22.491 -4.834 -5.887
6 HB3 ARG 1 HB1 ARG 1 22.023 -5.584 -4.363
7 HG2 ARG 1 HG2 ARG 1 24.142 -6.483 -4.633
8 HG3 ARG 1 HG1 ARG 1 23.171 -7.721 -5.427
9 HD2 ARG 1 HD2 ARG 1 23.574 -6.499 -7.619
10 HD3 ARG 1 HD1 ARG 1 24.755 -5.496 -6.751
11 HE ARG 1 HE ARG 1 24.962 -8.485 -6.868
12 HH11 ARG 1 HH21 ARG 1 26.729 -7.179 -4.892
13 HH12 ARG 1 HH22 ARG 1 28.174 -6.883 -5.793
14 HH21 ARG 1 HH11 ARG 1 26.633 -7.295 -8.891
15 HH22 ARG 1 HH12 ARG 1 28.121 -6.949 -8.078
16 H LEU 2 HN LEU 2 18.637 -7.254 -6.113
17 HA LEU 2 HA LEU 2 17.279 -8.670 -4.846
18 HB2 LEU 2 HB2 LEU 2 20.015 -9.930 -4.754
19 HB3 LEU 2 HB1 LEU 2 18.677 -10.663 -3.872
20 HG LEU 2 HG LEU 2 17.494 -10.183 -6.291
21 HD11 LEU 2 HD11 LEU 2 20.362 -10.989 -6.863
22 HD12 LEU 2 HD12 LEU 2 19.661 -9.415 -7.243
23 HD13 LEU 2 HD13 LEU 2 19.058 -10.866 -8.044
24 HD21 LEU 2 HD21 LEU 2 17.326 -12.294 -5.148
25 HD22 LEU 2 HD22 LEU 2 19.056 -12.593 -5.321
26 HD23 LEU 2 HD23 LEU 2 18.007 -12.632 -6.740
27 H VAL 3 HN VAL 3 16.830 -6.943 -3.310
28 HA VAL 3 HA VAL 3 18.407 -6.490 -0.935
29 HB VAL 3 HB VAL 3 16.373 -5.278 -0.161
30 HG11 VAL 3 HG11 VAL 3 16.607 -3.533 -1.686
31 HG12 VAL 3 HG12 VAL 3 16.743 -4.620 -3.067
32 HG13 VAL 3 HG13 VAL 3 18.091 -4.449 -1.944
33 HG21 VAL 3 HG21 VAL 3 14.849 -5.457 -2.615
34 HG22 VAL 3 HG22 VAL 3 14.316 -5.765 -0.964
35 HG23 VAL 3 HG23 VAL 3 15.032 -7.064 -1.914
36 HA PRO 4 HA PRO 4 16.891 -9.842 1.545
37 HB2 PRO 4 HB2 PRO 4 17.784 -8.978 3.974
38 HB3 PRO 4 HB1 PRO 4 18.862 -9.572 2.698
39 HG2 PRO 4 HG2 PRO 4 18.483 -6.856 3.682
40 HG3 PRO 4 HG1 PRO 4 19.818 -7.546 2.752
41 HD2 PRO 4 HD2 PRO 4 17.639 -5.932 1.812
42 HD3 PRO 4 HD1 PRO 4 19.018 -6.578 0.895
43 H GLY 5 HN GLY 5 14.729 -8.075 0.943
44 HA2 GLY 5 HA2 GLY 5 12.514 -8.042 1.877
45 HA3 GLY 5 HA1 GLY 5 13.210 -8.211 3.484
46 H ALA 6 HN ALA 6 15.192 -5.990 2.931
47 HA ALA 6 HA ALA 6 13.908 -3.801 4.103
48 HB1 ALA 6 HB1 ALA 6 16.329 -4.083 3.901
49 HB2 ALA 6 HB2 ALA 6 15.850 -2.522 3.238
50 HB3 ALA 6 HB3 ALA 6 16.223 -3.862 2.154
51 H ALA 7 HN ALA 7 14.567 -4.187 0.630
52 HA ALA 7 HA ALA 7 12.646 -1.989 0.013
53 HB1 ALA 7 HB1 ALA 7 14.271 -3.430 -2.050
54 HB2 ALA 7 HB2 ALA 7 15.125 -2.428 -0.876
55 HB3 ALA 7 HB3 ALA 7 13.897 -1.711 -1.917
56 H TYR 8 HN TYR 8 11.746 -4.733 0.886
57 HA TYR 8 HA TYR 8 10.325 -5.626 -1.592
58 HB2 TYR 8 HB2 TYR 8 11.772 -6.968 0.530
59 HB3 TYR 8 HB1 TYR 8 10.107 -7.540 0.487
60 HD1 TYR 8 HD1 TYR 8 9.175 -7.975 -1.995
61 HD2 TYR 8 HD2 TYR 8 13.316 -8.027 -0.848
62 HE1 TYR 8 HE1 TYR 8 9.706 -9.367 -3.975
63 HE2 TYR 8 HE2 TYR 8 13.846 -9.422 -2.830
64 HH TYR 8 HH TYR 8 12.205 -11.169 -4.342
65 H ALA 9 HN ALA 9 9.867 -5.549 1.938
66 HA ALA 9 HA ALA 9 6.986 -5.537 1.858
67 HB1 ALA 9 HB1 ALA 9 8.272 -6.226 3.826
68 HB2 ALA 9 HB2 ALA 9 7.251 -4.853 4.253
69 HB3 ALA 9 HB3 ALA 9 8.972 -4.612 3.957
70 H LEU 10 HN LEU 10 9.395 -2.983 2.177
71 HA LEU 10 HA LEU 10 7.733 -0.692 2.494
72 HB2 LEU 10 HB2 LEU 10 10.438 -1.317 2.167
73 HB3 LEU 10 HB1 LEU 10 10.076 -0.314 0.769
74 HG LEU 10 HG LEU 10 9.142 0.551 3.494
75 HD11 LEU 10 HD11 LEU 10 11.244 1.712 3.862
76 HD12 LEU 10 HD12 LEU 10 11.878 1.133 2.321
77 HD13 LEU 10 HD13 LEU 10 11.584 -0.004 3.638
78 HD21 LEU 10 HD21 LEU 10 9.381 2.776 2.452
79 HD22 LEU 10 HD22 LEU 10 8.365 1.736 1.454
80 HD23 LEU 10 HD23 LEU 10 10.043 2.032 0.996
81 H TYR 11 HN TYR 11 8.724 -2.467 -0.404
82 HA TYR 11 HA TYR 11 7.503 -0.567 -2.274
83 HB2 TYR 11 HB2 TYR 11 8.941 -3.211 -2.423
84 HB3 TYR 11 HB1 TYR 11 8.163 -2.539 -3.853
85 HD1 TYR 11 HD1 TYR 11 10.392 -1.384 -1.044
86 HD2 TYR 11 HD2 TYR 11 9.462 -1.185 -5.233
87 HE1 TYR 11 HE1 TYR 11 12.328 0.111 -1.399
88 HE2 TYR 11 HE2 TYR 11 11.405 0.316 -5.587
89 HH TYR 11 HH TYR 11 12.835 2.016 -3.386
90 H GLY 12 HN GLY 12 6.692 -3.673 -0.829
91 HA2 GLY 12 HA2 GLY 12 4.257 -3.977 -2.444
92 HA3 GLY 12 HA1 GLY 12 4.818 -5.086 -1.201
93 H VAL 13 HN VAL 13 4.929 -2.056 0.229
94 HA VAL 13 HA VAL 13 2.271 -2.510 1.486
95 HB VAL 13 HB VAL 13 4.451 -2.466 2.796
96 HG11 VAL 13 HG11 VAL 13 5.200 -0.342 1.429
97 HG12 VAL 13 HG12 VAL 13 5.650 -0.502 3.124
98 HG13 VAL 13 HG13 VAL 13 4.292 0.527 2.665
99 HG21 VAL 13 HG21 VAL 13 2.351 -0.414 3.551
100 HG22 VAL 13 HG22 VAL 13 3.487 -1.190 4.654
101 HG23 VAL 13 HG23 VAL 13 2.241 -2.148 3.855
102 H TRP 14 HN TRP 14 4.054 -0.137 -0.378
103 HA TRP 14 HA TRP 14 2.509 2.194 0.079
104 HB2 TRP 14 HB2 TRP 14 4.654 2.067 -1.159
105 HB3 TRP 14 HB1 TRP 14 3.837 1.258 -2.479
106 HD1 TRP 14 HD1 TRP 14 4.102 3.096 -4.269
107 HE1 TRP 14 HE1 TRP 14 3.148 5.468 -4.556
108 HE3 TRP 14 HE3 TRP 14 2.174 3.865 0.410
109 HZ2 TRP 14 HZ2 TRP 14 1.753 7.433 -3.021
110 HZ3 TRP 14 HZ3 TRP 14 1.042 5.988 0.960
111 HH2 TRP 14 HH2 TRP 14 0.827 7.775 -0.744
112 HA PRO 15 HA PRO 15 -0.312 0.889 -3.603
113 HB2 PRO 15 HB2 PRO 15 -0.380 -1.771 -4.266
114 HB3 PRO 15 HB1 PRO 15 0.694 -0.591 -5.045
115 HG2 PRO 15 HG2 PRO 15 1.296 -2.549 -2.885
116 HG3 PRO 15 HG1 PRO 15 2.268 -2.085 -4.294
117 HD2 PRO 15 HD2 PRO 15 2.759 -1.140 -1.825
118 HD3 PRO 15 HD1 PRO 15 3.080 -0.176 -3.281
119 H LEU 16 HN LEU 16 0.163 -1.207 -0.794
120 HA LEU 16 HA LEU 16 -2.592 -2.101 -0.574
121 HB2 LEU 16 HB2 LEU 16 -0.156 -2.684 0.630
122 HB3 LEU 16 HB1 LEU 16 -1.005 -1.817 1.902
123 HG LEU 16 HG LEU 16 -1.440 -4.211 2.099
124 HD11 LEU 16 HD11 LEU 16 -3.812 -4.138 2.267
125 HD12 LEU 16 HD12 LEU 16 -3.945 -2.951 0.970
126 HD13 LEU 16 HD13 LEU 16 -3.272 -2.479 2.530
127 HD21 LEU 16 HD21 LEU 16 -2.744 -4.083 -0.632
128 HD22 LEU 16 HD22 LEU 16 -2.420 -5.513 0.346
129 HD23 LEU 16 HD23 LEU 16 -1.085 -4.632 -0.393
130 H LEU 17 HN LEU 17 -0.688 0.480 0.937
131 HA LEU 17 HA LEU 17 -2.858 1.663 2.432
132 HB2 LEU 17 HB2 LEU 17 -0.143 1.984 2.314
133 HB3 LEU 17 HB1 LEU 17 -0.664 3.396 1.395
134 HG LEU 17 HG LEU 17 -2.051 2.817 3.983
135 HD11 LEU 17 HD11 LEU 17 -0.286 4.117 5.184
136 HD12 LEU 17 HD12 LEU 17 0.718 4.030 3.737
137 HD13 LEU 17 HD13 LEU 17 0.289 2.555 4.603
138 HD21 LEU 17 HD21 LEU 17 -1.118 5.369 2.624
139 HD22 LEU 17 HD22 LEU 17 -2.149 5.275 4.052
140 HD23 LEU 17 HD23 LEU 17 -2.740 4.691 2.497
141 H LEU 18 HN LEU 18 -1.542 2.127 -0.806
142 HA LEU 18 HA LEU 18 -3.129 4.363 -1.660
143 HB2 LEU 18 HB2 LEU 18 -1.715 2.035 -2.962
144 HB3 LEU 18 HB1 LEU 18 -2.699 3.101 -3.950
145 HG LEU 18 HG LEU 18 -0.437 4.031 -2.154
146 HD11 LEU 18 HD11 LEU 18 0.592 2.801 -3.906
147 HD12 LEU 18 HD12 LEU 18 0.659 4.481 -4.435
148 HD13 LEU 18 HD13 LEU 18 -0.556 3.395 -5.106
149 HD21 LEU 18 HD21 LEU 18 -2.024 5.458 -4.316
150 HD22 LEU 18 HD22 LEU 18 -0.673 6.143 -3.414
151 HD23 LEU 18 HD23 LEU 18 -2.173 5.740 -2.581
152 H LEU 19 HN LEU 19 -3.603 0.825 -1.832
153 HA LEU 19 HA LEU 19 -6.184 0.803 -3.083
154 HB2 LEU 19 HB2 LEU 19 -4.279 -1.022 -2.106
155 HB3 LEU 19 HB1 LEU 19 -5.722 -1.346 -1.160
156 HG LEU 19 HG LEU 19 -6.701 -1.036 -3.750
157 HD11 LEU 19 HD11 LEU 19 -3.964 -2.286 -3.751
158 HD12 LEU 19 HD12 LEU 19 -4.674 -1.164 -4.910
159 HD13 LEU 19 HD13 LEU 19 -5.190 -2.850 -4.886
160 HD21 LEU 19 HD21 LEU 19 -6.005 -3.426 -2.034
161 HD22 LEU 19 HD22 LEU 19 -6.772 -3.628 -3.609
162 HD23 LEU 19 HD23 LEU 19 -7.592 -2.717 -2.341
163 H LEU 20 HN LEU 20 -5.144 0.865 0.286
164 HA LEU 20 HA LEU 20 -7.745 0.733 1.532
165 HB2 LEU 20 HB2 LEU 20 -4.933 1.118 2.229
166 HB3 LEU 20 HB1 LEU 20 -5.977 2.118 3.225
167 HG LEU 20 HG LEU 20 -5.604 -0.073 4.268
168 HD11 LEU 20 HD11 LEU 20 -7.868 -0.577 4.801
169 HD12 LEU 20 HD12 LEU 20 -8.444 -0.003 3.236
170 HD13 LEU 20 HD13 LEU 20 -7.840 1.146 4.429
171 HD21 LEU 20 HD21 LEU 20 -6.845 -2.033 3.037
172 HD22 LEU 20 HD22 LEU 20 -5.208 -1.607 2.550
173 HD23 LEU 20 HD23 LEU 20 -6.581 -1.054 1.594
174 H LEU 21 HN LEU 21 -5.711 3.452 0.433
175 HA LEU 21 HA LEU 21 -7.214 5.602 1.569
176 HB2 LEU 21 HB2 LEU 21 -4.899 5.631 0.550
177 HB3 LEU 21 HB1 LEU 21 -5.664 5.558 -1.035
178 HG LEU 21 HG LEU 21 -6.747 7.657 0.741
179 HD11 LEU 21 HD11 LEU 21 -4.299 7.669 1.314
180 HD12 LEU 21 HD12 LEU 21 -4.851 9.151 0.534
181 HD13 LEU 21 HD13 LEU 21 -3.949 7.952 -0.392
182 HD21 LEU 21 HD21 LEU 21 -6.866 8.871 -1.290
183 HD22 LEU 21 HD22 LEU 21 -7.153 7.204 -1.784
184 HD23 LEU 21 HD23 LEU 21 -5.567 7.934 -2.029
185 H ALA 22 HN ALA 22 -7.531 3.875 -1.497
186 HA ALA 22 HA ALA 22 -10.107 5.321 -2.037
187 HB1 ALA 22 HB1 ALA 22 -9.511 5.331 -4.278
188 HB2 ALA 22 HB2 ALA 22 -8.589 3.834 -4.146
189 HB3 ALA 22 HB3 ALA 22 -7.901 5.348 -3.559
190 H LEU 23 HN LEU 23 -10.047 3.098 -0.252
191 HA LEU 23 HA LEU 23 -10.809 0.678 -1.737
192 HB2 LEU 23 HB2 LEU 23 -9.442 0.780 0.398
193 HB3 LEU 23 HB1 LEU 23 -10.922 1.234 1.231
194 HG LEU 23 HG LEU 23 -11.303 -1.108 -0.474
195 HD11 LEU 23 HD11 LEU 23 -9.929 -2.669 0.696
196 HD12 LEU 23 HD12 LEU 23 -9.452 -1.464 1.891
197 HD13 LEU 23 HD13 LEU 23 -8.864 -1.343 0.232
198 HD21 LEU 23 HD21 LEU 23 -11.615 -0.629 2.511
199 HD22 LEU 23 HD22 LEU 23 -12.287 -1.989 1.612
200 HD23 LEU 23 HD23 LEU 23 -12.864 -0.353 1.296
201 HA PRO 24 HA PRO 24 -15.117 1.826 -1.529
202 HB2 PRO 24 HB2 PRO 24 -16.026 -0.282 -3.004
203 HB3 PRO 24 HB1 PRO 24 -15.201 1.117 -3.716
204 HG2 PRO 24 HG2 PRO 24 -14.244 -1.617 -3.353
205 HG3 PRO 24 HG1 PRO 24 -13.668 -0.352 -4.445
206 HD2 PRO 24 HD2 PRO 24 -12.530 -1.188 -1.960
207 HD3 PRO 24 HD1 PRO 24 -11.949 0.087 -3.048
208 HA PRO 25 HA PRO 25 -16.690 -0.674 1.777
209 HB2 PRO 25 HB2 PRO 25 -19.378 -0.273 1.498
210 HB3 PRO 25 HB1 PRO 25 -18.272 0.969 2.122
211 HG2 PRO 25 HG2 PRO 25 -19.458 0.686 -0.583
212 HG3 PRO 25 HG1 PRO 25 -19.146 2.147 0.367
213 HD2 PRO 25 HD2 PRO 25 -17.566 1.318 -1.691
214 HD3 PRO 25 HD1 PRO 25 -16.985 2.300 -0.329
215 H ARG 26 HN ARG 26 -18.099 -2.601 2.189
216 HA ARG 26 HA ARG 26 -17.802 -4.665 0.248
217 HB2 ARG 26 HB2 ARG 26 -19.110 -5.998 1.811
218 HB3 ARG 26 HB1 ARG 26 -18.018 -4.950 2.710
219 HG2 ARG 26 HG2 ARG 26 -20.079 -3.303 2.733
220 HG3 ARG 26 HG1 ARG 26 -21.004 -4.772 2.419
221 HD2 ARG 26 HD2 ARG 26 -20.120 -5.826 4.434
222 HD3 ARG 26 HD1 ARG 26 -19.056 -4.435 4.729
223 HE ARG 26 HE ARG 26 -21.120 -3.040 4.973
224 HH11 ARG 26 HH11 ARG 26 -22.990 -5.136 3.800
225 HH12 ARG 26 HH12 ARG 26 -23.776 -5.730 5.223
226 HH21 ARG 26 HH21 ARG 26 -21.419 -4.372 7.402
227 HH22 ARG 26 HH22 ARG 26 -22.878 -5.292 7.280
228 H ALA 27 HN ALA 27 -20.511 -2.442 0.800
229 HA ALA 27 HA ALA 27 -22.191 -3.912 -1.166
230 HB1 ALA 27 HB1 ALA 27 -22.826 -1.469 0.506
231 HB2 ALA 27 HB2 ALA 27 -23.011 -3.122 1.092
232 HB3 ALA 27 HB3 ALA 27 -23.972 -2.557 -0.274
233 H TYR 28 HN TYR 28 -19.747 -1.861 -1.598
234 HA TYR 28 HA TYR 28 -19.057 -0.482 -3.309
235 HB2 TYR 28 HB2 TYR 28 -19.929 -1.482 -5.126
236 HB3 TYR 28 HB1 TYR 28 -21.437 -1.849 -4.310
237 HD1 TYR 28 HD2 TYR 28 -19.577 0.885 -6.050
238 HD2 TYR 28 HD1 TYR 28 -23.401 -0.618 -4.794
239 HE1 TYR 28 HE2 TYR 28 -20.706 2.660 -7.360
240 HE2 TYR 28 HE1 TYR 28 -24.528 1.159 -6.104
241 HH TYR 28 HH TYR 28 -23.570 2.640 -8.394
242 H ALA 29 HN ALA 29 -22.450 0.242 -2.462
243 HA ALA 29 HA ALA 29 -23.476 2.186 -1.691
244 HB1 ALA 29 HB1 ALA 29 -20.763 3.499 -1.547
245 HB2 ALA 29 HB2 ALA 29 -21.226 2.249 -0.392
246 HB3 ALA 29 HB3 ALA 29 -22.164 3.736 -0.502
Start of MODEL 2
1 H1 ARG 1 HT1 ARG 1 21.532 1.309 -11.016
2 H2 ARG 1 HT2 ARG 1 20.472 0.010 -11.296
3 H3 ARG 1 HT3 ARG 1 21.773 -0.165 -10.218
4 HA ARG 1 HA ARG 1 20.785 1.449 -8.698
5 HB2 ARG 1 HB2 ARG 1 19.056 1.731 -11.109
6 HB3 ARG 1 HB1 ARG 1 18.248 1.879 -9.549
7 HG2 ARG 1 HG2 ARG 1 19.707 3.671 -8.871
8 HG3 ARG 1 HG1 ARG 1 20.748 3.429 -10.275
9 HD2 ARG 1 HD2 ARG 1 19.155 4.316 -11.771
10 HD3 ARG 1 HD1 ARG 1 17.817 4.087 -10.626
11 HE ARG 1 HE ARG 1 20.014 6.076 -10.157
12 HH11 ARG 1 HH21 ARG 1 17.309 6.825 -11.424
13 HH12 ARG 1 HH22 ARG 1 16.471 7.460 -10.050
14 HH21 ARG 1 HH11 ARG 1 18.704 6.104 -7.744
15 HH22 ARG 1 HH12 ARG 1 17.269 7.048 -7.947
16 H LEU 2 HN LEU 2 20.320 0.012 -7.069
17 HA LEU 2 HA LEU 2 18.006 -1.818 -7.315
18 HB2 LEU 2 HB2 LEU 2 20.203 -2.837 -8.267
19 HB3 LEU 2 HB1 LEU 2 20.704 -2.947 -6.581
20 HG LEU 2 HG LEU 2 17.986 -3.934 -6.939
21 HD11 LEU 2 HD11 LEU 2 20.190 -5.375 -8.441
22 HD12 LEU 2 HD12 LEU 2 18.865 -4.492 -9.199
23 HD13 LEU 2 HD13 LEU 2 18.530 -5.930 -8.237
24 HD21 LEU 2 HD21 LEU 2 19.278 -4.440 -4.960
25 HD22 LEU 2 HD22 LEU 2 20.602 -5.090 -5.927
26 HD23 LEU 2 HD23 LEU 2 19.065 -5.949 -5.845
27 H VAL 3 HN VAL 3 17.347 -2.661 -5.216
28 HA VAL 3 HA VAL 3 18.690 -1.389 -2.857
29 HB VAL 3 HB VAL 3 16.345 -1.144 -1.932
30 HG11 VAL 3 HG11 VAL 3 17.584 0.758 -2.880
31 HG12 VAL 3 HG12 VAL 3 15.860 0.892 -3.225
32 HG13 VAL 3 HG13 VAL 3 16.973 0.360 -4.487
33 HG21 VAL 3 HG21 VAL 3 15.251 -1.206 -4.703
34 HG22 VAL 3 HG22 VAL 3 14.470 -1.610 -3.177
35 HG23 VAL 3 HG23 VAL 3 15.546 -2.772 -3.949
36 HA PRO 4 HA PRO 4 18.353 -5.422 -1.082
37 HB2 PRO 4 HB2 PRO 4 18.480 -4.802 1.576
38 HB3 PRO 4 HB1 PRO 4 19.874 -4.665 0.488
39 HG2 PRO 4 HG2 PRO 4 18.198 -2.556 1.657
40 HG3 PRO 4 HG1 PRO 4 19.876 -2.498 1.104
41 HD2 PRO 4 HD2 PRO 4 17.609 -1.532 -0.259
42 HD3 PRO 4 HD1 PRO 4 19.262 -1.675 -0.892
43 H GLY 5 HN GLY 5 17.048 -6.340 1.150
44 HA2 GLY 5 HA2 GLY 5 14.317 -6.499 0.448
45 HA3 GLY 5 HA1 GLY 5 14.954 -6.898 2.040
46 H ALA 6 HN ALA 6 15.976 -4.084 2.388
47 HA ALA 6 HA ALA 6 13.985 -2.897 3.930
48 HB1 ALA 6 HB1 ALA 6 15.341 -0.830 3.596
49 HB2 ALA 6 HB2 ALA 6 16.188 -1.643 2.281
50 HB3 ALA 6 HB3 ALA 6 16.331 -2.250 3.931
51 H ALA 7 HN ALA 7 14.712 -2.113 0.531
52 HA ALA 7 HA ALA 7 12.192 -0.525 0.366
53 HB1 ALA 7 HB1 ALA 7 14.806 -0.649 -1.062
54 HB2 ALA 7 HB2 ALA 7 13.872 0.753 -0.543
55 HB3 ALA 7 HB3 ALA 7 13.407 -0.124 -1.999
56 H TYR 8 HN TYR 8 12.170 -3.539 0.399
57 HA TYR 8 HA TYR 8 10.971 -4.013 -2.304
58 HB2 TYR 8 HB2 TYR 8 12.734 -5.615 -0.511
59 HB3 TYR 8 HB1 TYR 8 11.483 -6.501 -1.375
60 HD1 TYR 8 HD1 TYR 8 11.361 -4.891 -3.928
61 HD2 TYR 8 HD2 TYR 8 14.704 -6.275 -1.612
62 HE1 TYR 8 HE1 TYR 8 12.778 -4.869 -5.959
63 HE2 TYR 8 HE2 TYR 8 16.119 -6.251 -3.643
64 HH TYR 8 HH TYR 8 15.472 -4.630 -6.316
65 H ALA 9 HN ALA 9 10.810 -5.244 1.031
66 HA ALA 9 HA ALA 9 8.099 -6.192 0.873
67 HB1 ALA 9 HB1 ALA 9 8.309 -6.222 3.370
68 HB2 ALA 9 HB2 ALA 9 9.815 -5.318 3.220
69 HB3 ALA 9 HB3 ALA 9 9.700 -6.954 2.569
70 H LEU 10 HN LEU 10 9.536 -3.140 1.856
71 HA LEU 10 HA LEU 10 7.267 -1.774 2.913
72 HB2 LEU 10 HB2 LEU 10 9.930 -1.253 2.480
73 HB3 LEU 10 HB1 LEU 10 9.187 -0.231 1.256
74 HG LEU 10 HG LEU 10 8.275 -0.218 4.140
75 HD11 LEU 10 HD11 LEU 10 10.651 0.417 4.053
76 HD12 LEU 10 HD12 LEU 10 9.648 1.829 4.389
77 HD13 LEU 10 HD13 LEU 10 10.304 1.577 2.771
78 HD21 LEU 10 HD21 LEU 10 7.966 1.724 1.820
79 HD22 LEU 10 HD22 LEU 10 7.380 2.007 3.459
80 HD23 LEU 10 HD23 LEU 10 6.695 0.702 2.492
81 H TYR 11 HN TYR 11 8.597 -1.829 -0.409
82 HA TYR 11 HA TYR 11 6.501 -0.255 -1.593
83 HB2 TYR 11 HB2 TYR 11 8.824 -1.877 -2.456
84 HB3 TYR 11 HB1 TYR 11 7.564 -1.650 -3.667
85 HD1 TYR 11 HD2 TYR 11 6.826 0.669 -4.286
86 HD2 TYR 11 HD1 TYR 11 10.239 -0.060 -1.781
87 HE1 TYR 11 HE2 TYR 11 7.618 2.984 -4.688
88 HE2 TYR 11 HE1 TYR 11 11.029 2.256 -2.182
89 HH TYR 11 HH TYR 11 9.370 4.638 -3.060
90 H GLY 12 HN GLY 12 6.634 -3.608 -0.713
91 HA2 GLY 12 HA2 GLY 12 4.642 -4.575 -2.581
92 HA3 GLY 12 HA1 GLY 12 5.177 -5.408 -1.119
93 H VAL 13 HN VAL 13 4.563 -3.389 0.785
94 HA VAL 13 HA VAL 13 1.640 -3.722 0.935
95 HB VAL 13 HB VAL 13 1.933 -2.864 3.229
96 HG11 VAL 13 HG11 VAL 13 2.296 -5.250 2.803
97 HG12 VAL 13 HG12 VAL 13 3.381 -4.676 4.069
98 HG13 VAL 13 HG13 VAL 13 3.994 -4.940 2.436
99 HG21 VAL 13 HG21 VAL 13 3.914 -1.976 4.058
100 HG22 VAL 13 HG22 VAL 13 3.979 -1.384 2.400
101 HG23 VAL 13 HG23 VAL 13 4.912 -2.807 2.865
102 H TRP 14 HN TRP 14 3.731 -1.284 -0.219
103 HA TRP 14 HA TRP 14 2.411 1.108 0.553
104 HB2 TRP 14 HB2 TRP 14 4.622 0.941 -0.559
105 HB3 TRP 14 HB1 TRP 14 3.830 0.455 -2.044
106 HD1 TRP 14 HD1 TRP 14 4.401 2.515 -3.484
107 HE1 TRP 14 HE1 TRP 14 3.729 4.997 -3.413
108 HE3 TRP 14 HE3 TRP 14 2.252 2.732 1.155
109 HZ2 TRP 14 HZ2 TRP 14 2.451 6.837 -1.635
110 HZ3 TRP 14 HZ3 TRP 14 1.319 4.855 2.002
111 HH2 TRP 14 HH2 TRP 14 1.414 6.908 0.619
112 HA PRO 15 HA PRO 15 -0.284 0.776 -3.414
113 HB2 PRO 15 HB2 PRO 15 -0.501 -1.671 -4.628
114 HB3 PRO 15 HB1 PRO 15 0.704 -0.452 -5.095
115 HG2 PRO 15 HG2 PRO 15 1.027 -2.858 -3.371
116 HG3 PRO 15 HG1 PRO 15 2.117 -2.194 -4.601
117 HD2 PRO 15 HD2 PRO 15 2.513 -1.826 -1.962
118 HD3 PRO 15 HD1 PRO 15 3.003 -0.620 -3.169
119 H LEU 16 HN LEU 16 -0.085 -2.006 -1.209
120 HA LEU 16 HA LEU 16 -2.913 -2.633 -1.239
121 HB2 LEU 16 HB2 LEU 16 -0.487 -3.306 0.359
122 HB3 LEU 16 HB1 LEU 16 -2.029 -3.494 1.190
123 HG LEU 16 HG LEU 16 -2.809 -4.816 -0.865
124 HD11 LEU 16 HD11 LEU 16 0.187 -4.868 -1.346
125 HD12 LEU 16 HD12 LEU 16 -1.002 -4.081 -2.383
126 HD13 LEU 16 HD13 LEU 16 -1.007 -5.835 -2.209
127 HD21 LEU 16 HD21 LEU 16 -0.625 -5.776 1.000
128 HD22 LEU 16 HD22 LEU 16 -1.460 -6.866 -0.106
129 HD23 LEU 16 HD23 LEU 16 -2.366 -6.021 1.149
130 H LEU 17 HN LEU 17 -0.833 -0.654 0.825
131 HA LEU 17 HA LEU 17 -2.925 0.332 2.568
132 HB2 LEU 17 HB2 LEU 17 -0.092 1.080 1.862
133 HB3 LEU 17 HB1 LEU 17 -1.056 2.214 2.804
134 HG LEU 17 HG LEU 17 -0.752 -0.692 3.590
135 HD11 LEU 17 HD11 LEU 17 0.893 1.698 4.478
136 HD12 LEU 17 HD12 LEU 17 1.480 0.328 3.535
137 HD13 LEU 17 HD13 LEU 17 0.962 0.093 5.205
138 HD21 LEU 17 HD21 LEU 17 -1.352 0.291 5.839
139 HD22 LEU 17 HD22 LEU 17 -2.632 0.439 4.637
140 HD23 LEU 17 HD23 LEU 17 -1.627 1.834 5.031
141 H LEU 18 HN LEU 18 -1.449 1.424 -0.448
142 HA LEU 18 HA LEU 18 -2.757 3.957 -0.746
143 HB2 LEU 18 HB2 LEU 18 -1.538 1.871 -2.544
144 HB3 LEU 18 HB1 LEU 18 -2.418 3.199 -3.281
145 HG LEU 18 HG LEU 18 -0.151 3.568 -1.301
146 HD11 LEU 18 HD11 LEU 18 0.865 2.603 -3.216
147 HD12 LEU 18 HD12 LEU 18 1.068 4.340 -3.433
148 HD13 LEU 18 HD13 LEU 18 -0.191 3.483 -4.322
149 HD21 LEU 18 HD21 LEU 18 -1.467 5.506 -3.234
150 HD22 LEU 18 HD22 LEU 18 -0.186 5.885 -2.082
151 HD23 LEU 18 HD23 LEU 18 -1.791 5.445 -1.501
152 H LEU 19 HN LEU 19 -3.641 0.636 -1.749
153 HA LEU 19 HA LEU 19 -6.171 1.264 -2.970
154 HB2 LEU 19 HB2 LEU 19 -4.568 -0.915 -2.782
155 HB3 LEU 19 HB1 LEU 19 -5.751 -1.330 -1.555
156 HG LEU 19 HG LEU 19 -6.323 -2.237 -3.803
157 HD11 LEU 19 HD11 LEU 19 -8.369 -0.137 -3.137
158 HD12 LEU 19 HD12 LEU 19 -8.026 -1.435 -1.994
159 HD13 LEU 19 HD13 LEU 19 -8.613 -1.817 -3.612
160 HD21 LEU 19 HD21 LEU 19 -5.374 -0.085 -4.946
161 HD22 LEU 19 HD22 LEU 19 -6.983 0.577 -4.660
162 HD23 LEU 19 HD23 LEU 19 -6.787 -0.866 -5.652
163 H LEU 20 HN LEU 20 -5.217 0.235 0.263
164 HA LEU 20 HA LEU 20 -7.788 0.119 1.519
165 HB2 LEU 20 HB2 LEU 20 -4.926 0.244 2.254
166 HB3 LEU 20 HB1 LEU 20 -6.009 0.856 3.496
167 HG LEU 20 HG LEU 20 -6.424 -1.812 2.128
168 HD11 LEU 20 HD11 LEU 20 -5.412 -2.835 4.125
169 HD12 LEU 20 HD12 LEU 20 -5.046 -1.234 4.769
170 HD13 LEU 20 HD13 LEU 20 -4.248 -1.798 3.301
171 HD21 LEU 20 HD21 LEU 20 -7.707 -2.179 4.329
172 HD22 LEU 20 HD22 LEU 20 -8.434 -1.061 3.175
173 HD23 LEU 20 HD23 LEU 20 -7.563 -0.438 4.576
174 H LEU 21 HN LEU 21 -5.496 2.808 1.052
175 HA LEU 21 HA LEU 21 -6.720 4.799 2.663
176 HB2 LEU 21 HB2 LEU 21 -4.478 4.677 1.299
177 HB3 LEU 21 HB1 LEU 21 -5.437 5.362 -0.005
178 HG LEU 21 HG LEU 21 -4.212 7.070 1.350
179 HD11 LEU 21 HD11 LEU 21 -5.931 8.634 1.246
180 HD12 LEU 21 HD12 LEU 21 -7.144 7.492 1.828
181 HD13 LEU 21 HD13 LEU 21 -6.539 7.369 0.176
182 HD21 LEU 21 HD21 LEU 21 -4.698 7.470 3.617
183 HD22 LEU 21 HD22 LEU 21 -4.659 5.709 3.530
184 HD23 LEU 21 HD23 LEU 21 -6.205 6.556 3.553
185 H ALA 22 HN ALA 22 -7.220 4.031 -0.759
186 HA ALA 22 HA ALA 22 -9.796 5.576 -0.714
187 HB1 ALA 22 HB1 ALA 22 -7.749 6.213 -2.214
188 HB2 ALA 22 HB2 ALA 22 -9.343 6.150 -2.965
189 HB3 ALA 22 HB3 ALA 22 -8.217 4.810 -3.174
190 H LEU 23 HN LEU 23 -9.833 3.011 0.337
191 HA LEU 23 HA LEU 23 -10.354 0.954 -1.611
192 HB2 LEU 23 HB2 LEU 23 -10.724 -0.405 0.282
193 HB3 LEU 23 HB1 LEU 23 -9.578 0.800 0.838
194 HG LEU 23 HG LEU 23 -11.830 2.091 1.504
195 HD11 LEU 23 HD11 LEU 23 -13.689 0.831 1.428
196 HD12 LEU 23 HD12 LEU 23 -12.934 -0.370 2.475
197 HD13 LEU 23 HD13 LEU 23 -12.762 -0.494 0.726
198 HD21 LEU 23 HD21 LEU 23 -11.175 -0.106 3.396
199 HD22 LEU 23 HD22 LEU 23 -11.184 1.638 3.655
200 HD23 LEU 23 HD23 LEU 23 -9.810 0.874 2.859
201 HA PRO 24 HA PRO 24 -14.592 1.939 -2.418
202 HB2 PRO 24 HB2 PRO 24 -15.149 -0.254 -3.943
203 HB3 PRO 24 HB1 PRO 24 -14.147 1.097 -4.505
204 HG2 PRO 24 HG2 PRO 24 -13.359 -1.614 -3.772
205 HG3 PRO 24 HG1 PRO 24 -12.497 -0.407 -4.736
206 HD2 PRO 24 HD2 PRO 24 -12.072 -1.122 -1.993
207 HD3 PRO 24 HD1 PRO 24 -11.180 0.066 -2.969
208 HA PRO 25 HA PRO 25 -16.499 -0.460 0.898
209 HB2 PRO 25 HB2 PRO 25 -18.834 0.955 0.997
210 HB3 PRO 25 HB1 PRO 25 -17.323 1.526 1.733
211 HG2 PRO 25 HG2 PRO 25 -18.569 2.299 -0.853
212 HG3 PRO 25 HG1 PRO 25 -17.740 3.305 0.348
213 HD2 PRO 25 HD2 PRO 25 -16.560 2.482 -1.946
214 HD3 PRO 25 HD1 PRO 25 -15.658 2.783 -0.445
215 H ARG 26 HN ARG 26 -18.248 -1.978 1.005
216 HA ARG 26 HA ARG 26 -19.442 -2.700 -1.649
217 HB2 ARG 26 HB2 ARG 26 -18.378 -4.160 0.729
218 HB3 ARG 26 HB1 ARG 26 -19.700 -4.915 -0.155
219 HG2 ARG 26 HG2 ARG 26 -17.691 -3.850 -1.972
220 HG3 ARG 26 HG1 ARG 26 -16.988 -5.002 -0.839
221 HD2 ARG 26 HD2 ARG 26 -19.551 -5.621 -2.329
222 HD3 ARG 26 HD1 ARG 26 -17.955 -6.003 -3.004
223 HE ARG 26 HE ARG 26 -19.030 -7.126 -0.452
224 HH11 ARG 26 HH11 ARG 26 -16.094 -6.992 -0.324
225 HH12 ARG 26 HH12 ARG 26 -15.595 -8.479 -1.054
226 HH21 ARG 26 HH21 ARG 26 -18.681 -9.066 -2.567
227 HH22 ARG 26 HH22 ARG 26 -17.073 -9.665 -2.337
228 H ALA 27 HN ALA 27 -20.645 -0.678 0.173
229 HA ALA 27 HA ALA 27 -23.332 -1.894 0.439
230 HB1 ALA 27 HB1 ALA 27 -23.438 -1.136 2.832
231 HB2 ALA 27 HB2 ALA 27 -21.724 -0.735 2.738
232 HB3 ALA 27 HB3 ALA 27 -22.249 -2.410 2.559
233 H TYR 28 HN TYR 28 -22.928 -0.099 -1.449
234 HA TYR 28 HA TYR 28 -23.609 2.592 -0.330
235 HB2 TYR 28 HB2 TYR 28 -22.940 3.326 -2.718
236 HB3 TYR 28 HB1 TYR 28 -21.670 2.835 -1.614
237 HD1 TYR 28 HD2 TYR 28 -23.855 1.554 -4.381
238 HD2 TYR 28 HD1 TYR 28 -20.169 1.120 -2.215
239 HE1 TYR 28 HE2 TYR 28 -23.088 -0.137 -6.022
240 HE2 TYR 28 HE1 TYR 28 -19.405 -0.570 -3.859
241 HH TYR 28 HH TYR 28 -20.307 -0.944 -6.669
242 H ALA 29 HN ALA 29 -24.842 0.030 -2.406
243 HA ALA 29 HA ALA 29 -27.424 1.485 -2.592
244 HB1 ALA 29 HB1 ALA 29 -25.858 0.399 -4.957
245 HB2 ALA 29 HB2 ALA 29 -26.121 2.105 -4.591
246 HB3 ALA 29 HB3 ALA 29 -27.482 1.079 -5.038
Start of MODEL 3
1 H1 ARG 1 HT1 ARG 1 20.239 -0.113 -10.805
2 H2 ARG 1 HT2 ARG 1 20.459 1.566 -10.940
3 H3 ARG 1 HT3 ARG 1 18.893 0.900 -10.985
4 HA ARG 1 HA ARG 1 20.723 0.814 -8.629
5 HB2 ARG 1 HB2 ARG 1 19.066 2.876 -9.737
6 HB3 ARG 1 HB1 ARG 1 18.308 2.313 -8.251
7 HG2 ARG 1 HG2 ARG 1 19.752 3.873 -7.361
8 HG3 ARG 1 HG1 ARG 1 20.809 2.463 -7.335
9 HD2 ARG 1 HD2 ARG 1 22.106 3.229 -9.102
10 HD3 ARG 1 HD1 ARG 1 20.769 4.145 -9.825
11 HE ARG 1 HE ARG 1 22.312 5.017 -7.414
12 HH11 ARG 1 HH21 ARG 1 22.674 6.614 -9.838
13 HH12 ARG 1 HH22 ARG 1 21.490 7.866 -9.683
14 HH21 ARG 1 HH11 ARG 1 19.647 6.175 -7.257
15 HH22 ARG 1 HH12 ARG 1 19.760 7.616 -8.207
16 H LEU 2 HN LEU 2 20.067 -0.688 -7.130
17 HA LEU 2 HA LEU 2 17.246 -1.637 -7.076
18 HB2 LEU 2 HB2 LEU 2 19.594 -3.069 -8.126
19 HB3 LEU 2 HB1 LEU 2 18.685 -3.992 -6.932
20 HG LEU 2 HG LEU 2 17.262 -2.575 -9.179
21 HD11 LEU 2 HD11 LEU 2 18.497 -5.345 -9.243
22 HD12 LEU 2 HD12 LEU 2 18.943 -3.978 -10.264
23 HD13 LEU 2 HD13 LEU 2 17.355 -4.725 -10.435
24 HD21 LEU 2 HD21 LEU 2 16.653 -5.052 -7.529
25 HD22 LEU 2 HD22 LEU 2 15.598 -4.353 -8.755
26 HD23 LEU 2 HD23 LEU 2 15.945 -3.457 -7.277
27 H VAL 3 HN VAL 3 16.801 -2.914 -5.101
28 HA VAL 3 HA VAL 3 18.834 -2.639 -2.925
29 HB VAL 3 HB VAL 3 16.881 -1.942 -1.441
30 HG11 VAL 3 HG11 VAL 3 16.978 0.404 -2.151
31 HG12 VAL 3 HG12 VAL 3 17.623 -0.086 -3.716
32 HG13 VAL 3 HG13 VAL 3 18.571 -0.348 -2.252
33 HG21 VAL 3 HG21 VAL 3 15.020 -2.624 -2.878
34 HG22 VAL 3 HG22 VAL 3 15.560 -1.526 -4.148
35 HG23 VAL 3 HG23 VAL 3 14.953 -0.882 -2.624
36 HA PRO 4 HA PRO 4 17.604 -6.726 -1.843
37 HB2 PRO 4 HB2 PRO 4 17.783 -6.716 0.885
38 HB3 PRO 4 HB1 PRO 4 19.203 -6.686 -0.179
39 HG2 PRO 4 HG2 PRO 4 17.906 -4.457 1.294
40 HG3 PRO 4 HG1 PRO 4 19.625 -4.776 1.008
41 HD2 PRO 4 HD2 PRO 4 18.185 -2.939 -0.389
42 HD3 PRO 4 HD1 PRO 4 19.608 -3.780 -1.042
43 H GLY 5 HN GLY 5 16.086 -7.829 0.089
44 HA2 GLY 5 HA2 GLY 5 13.395 -7.148 -0.529
45 HA3 GLY 5 HA1 GLY 5 13.893 -8.192 0.796
46 H ALA 6 HN ALA 6 15.539 -5.698 1.779
47 HA ALA 6 HA ALA 6 13.925 -4.821 3.875
48 HB1 ALA 6 HB1 ALA 6 16.108 -3.397 2.339
49 HB2 ALA 6 HB2 ALA 6 16.317 -4.443 3.743
50 HB3 ALA 6 HB3 ALA 6 15.515 -2.883 3.918
51 H ALA 7 HN ALA 7 14.286 -3.261 0.695
52 HA ALA 7 HA ALA 7 12.174 -1.292 1.363
53 HB1 ALA 7 HB1 ALA 7 13.444 -1.483 -1.331
54 HB2 ALA 7 HB2 ALA 7 14.471 -1.034 0.032
55 HB3 ALA 7 HB3 ALA 7 13.060 -0.055 -0.370
56 H TYR 8 HN TYR 8 12.025 -4.429 0.315
57 HA TYR 8 HA TYR 8 10.007 -4.022 -1.797
58 HB2 TYR 8 HB2 TYR 8 11.488 -6.330 -0.564
59 HB3 TYR 8 HB1 TYR 8 10.005 -6.659 -1.455
60 HD1 TYR 8 HD1 TYR 8 13.080 -4.521 -1.849
61 HD2 TYR 8 HD2 TYR 8 10.243 -7.154 -3.713
62 HE1 TYR 8 HE1 TYR 8 14.312 -4.333 -3.989
63 HE2 TYR 8 HE2 TYR 8 11.477 -6.965 -5.852
64 HH TYR 8 HH TYR 8 13.145 -4.974 -6.840
65 H ALA 9 HN ALA 9 10.214 -5.157 1.548
66 HA ALA 9 HA ALA 9 7.335 -5.633 1.768
67 HB1 ALA 9 HB1 ALA 9 9.292 -5.340 4.047
68 HB2 ALA 9 HB2 ALA 9 9.302 -6.774 3.021
69 HB3 ALA 9 HB3 ALA 9 7.863 -6.371 3.957
70 H LEU 10 HN LEU 10 9.269 -2.837 1.817
71 HA LEU 10 HA LEU 10 7.328 -1.314 3.513
72 HB2 LEU 10 HB2 LEU 10 10.035 -1.472 3.689
73 HB3 LEU 10 HB1 LEU 10 9.896 -0.136 2.556
74 HG LEU 10 HG LEU 10 8.588 -0.282 5.290
75 HD11 LEU 10 HD11 LEU 10 11.093 0.122 5.165
76 HD12 LEU 10 HD12 LEU 10 10.166 1.409 5.935
77 HD13 LEU 10 HD13 LEU 10 10.731 1.601 4.276
78 HD21 LEU 10 HD21 LEU 10 7.159 0.978 3.774
79 HD22 LEU 10 HD22 LEU 10 8.546 1.854 3.128
80 HD23 LEU 10 HD23 LEU 10 8.025 2.132 4.790
81 H TYR 11 HN TYR 11 9.408 -0.760 0.643
82 HA TYR 11 HA TYR 11 7.637 1.276 -0.451
83 HB2 TYR 11 HB2 TYR 11 10.292 0.209 -0.869
84 HB3 TYR 11 HB1 TYR 11 9.461 0.390 -2.410
85 HD1 TYR 11 HD1 TYR 11 8.533 2.628 -3.072
86 HD2 TYR 11 HD2 TYR 11 10.965 2.102 0.431
87 HE1 TYR 11 HE1 TYR 11 8.929 5.074 -2.975
88 HE2 TYR 11 HE2 TYR 11 11.361 4.545 0.526
89 HH TYR 11 HH TYR 11 9.654 6.732 -0.702
90 H GLY 12 HN GLY 12 8.013 -2.179 -0.904
91 HA2 GLY 12 HA2 GLY 12 6.606 -2.334 -3.433
92 HA3 GLY 12 HA1 GLY 12 6.958 -3.690 -2.366
93 H VAL 13 HN VAL 13 5.579 -2.259 -0.061
94 HA VAL 13 HA VAL 13 2.836 -3.126 -0.768
95 HB VAL 13 HB VAL 13 2.463 -3.017 1.664
96 HG11 VAL 13 HG11 VAL 13 5.085 -4.374 0.977
97 HG12 VAL 13 HG12 VAL 13 3.485 -5.038 0.643
98 HG13 VAL 13 HG13 VAL 13 4.006 -4.791 2.309
99 HG21 VAL 13 HG21 VAL 13 5.376 -2.264 1.979
100 HG22 VAL 13 HG22 VAL 13 4.112 -2.285 3.208
101 HG23 VAL 13 HG23 VAL 13 4.105 -1.042 1.958
102 H TRP 14 HN TRP 14 4.335 -0.247 -1.174
103 HA TRP 14 HA TRP 14 2.737 1.711 0.116
104 HB2 TRP 14 HB2 TRP 14 4.873 2.102 -1.066
105 HB3 TRP 14 HB1 TRP 14 4.094 1.763 -2.594
106 HD1 TRP 14 HD1 TRP 14 4.417 4.120 -3.616
107 HE1 TRP 14 HE1 TRP 14 3.382 6.427 -3.135
108 HE3 TRP 14 HE3 TRP 14 2.203 3.187 0.902
109 HZ2 TRP 14 HZ2 TRP 14 1.824 7.711 -1.112
110 HZ3 TRP 14 HZ3 TRP 14 0.954 4.966 2.072
111 HH2 TRP 14 HH2 TRP 14 0.759 7.228 1.076
112 HA PRO 15 HA PRO 15 -0.139 1.708 -3.746
113 HB2 PRO 15 HB2 PRO 15 -0.037 -0.442 -5.434
114 HB3 PRO 15 HB1 PRO 15 0.938 1.025 -5.662
115 HG2 PRO 15 HG2 PRO 15 1.725 -1.603 -4.516
116 HG3 PRO 15 HG1 PRO 15 2.634 -0.513 -5.576
117 HD2 PRO 15 HD2 PRO 15 3.067 -0.695 -2.911
118 HD3 PRO 15 HD1 PRO 15 3.366 0.790 -3.836
119 H LEU 16 HN LEU 16 0.601 -1.364 -2.119
120 HA LEU 16 HA LEU 16 -2.039 -2.501 -2.317
121 HB2 LEU 16 HB2 LEU 16 0.509 -3.090 -1.078
122 HB3 LEU 16 HB1 LEU 16 -0.785 -3.356 0.085
123 HG LEU 16 HG LEU 16 -0.316 -5.403 -1.197
124 HD11 LEU 16 HD11 LEU 16 -2.607 -5.882 -1.938
125 HD12 LEU 16 HD12 LEU 16 -2.979 -4.158 -1.944
126 HD13 LEU 16 HD13 LEU 16 -2.621 -4.977 -0.424
127 HD21 LEU 16 HD21 LEU 16 -1.100 -5.318 -3.675
128 HD22 LEU 16 HD22 LEU 16 0.497 -4.679 -3.291
129 HD23 LEU 16 HD23 LEU 16 -0.857 -3.577 -3.540
130 H LEU 17 HN LEU 17 -0.483 -0.392 0.056
131 HA LEU 17 HA LEU 17 -2.714 -0.283 1.902
132 HB2 LEU 17 HB2 LEU 17 -0.120 1.077 1.441
133 HB3 LEU 17 HB1 LEU 17 -1.340 2.091 2.209
134 HG LEU 17 HG LEU 17 -1.728 0.097 3.804
135 HD11 LEU 17 HD11 LEU 17 -0.459 -1.547 2.446
136 HD12 LEU 17 HD12 LEU 17 0.203 -1.400 4.073
137 HD13 LEU 17 HD13 LEU 17 1.015 -0.618 2.716
138 HD21 LEU 17 HD21 LEU 17 -0.595 2.228 4.424
139 HD22 LEU 17 HD22 LEU 17 0.939 1.551 3.875
140 HD23 LEU 17 HD23 LEU 17 0.106 0.842 5.258
141 H LEU 18 HN LEU 18 -1.689 1.591 -0.891
142 HA LEU 18 HA LEU 18 -3.711 3.644 -0.812
143 HB2 LEU 18 HB2 LEU 18 -1.622 2.596 -2.602
144 HB3 LEU 18 HB1 LEU 18 -3.018 3.196 -3.489
145 HG LEU 18 HG LEU 18 -2.870 5.299 -2.053
146 HD11 LEU 18 HD11 LEU 18 -1.022 5.695 -0.702
147 HD12 LEU 18 HD12 LEU 18 -0.014 4.529 -1.558
148 HD13 LEU 18 HD13 LEU 18 -1.254 3.967 -0.437
149 HD21 LEU 18 HD21 LEU 18 -2.107 5.328 -4.360
150 HD22 LEU 18 HD22 LEU 18 -0.587 4.556 -3.908
151 HD23 LEU 18 HD23 LEU 18 -0.933 6.201 -3.378
152 H LEU 19 HN LEU 19 -3.495 0.400 -2.248
153 HA LEU 19 HA LEU 19 -5.993 0.358 -3.657
154 HB2 LEU 19 HB2 LEU 19 -3.789 -1.334 -3.139
155 HB3 LEU 19 HB1 LEU 19 -5.189 -2.198 -2.520
156 HG LEU 19 HG LEU 19 -5.406 -0.914 -5.214
157 HD11 LEU 19 HD11 LEU 19 -4.397 -2.860 -6.289
158 HD12 LEU 19 HD12 LEU 19 -4.050 -3.583 -4.718
159 HD13 LEU 19 HD13 LEU 19 -3.217 -2.109 -5.215
160 HD21 LEU 19 HD21 LEU 19 -6.965 -2.691 -5.591
161 HD22 LEU 19 HD22 LEU 19 -7.275 -2.130 -3.948
162 HD23 LEU 19 HD23 LEU 19 -6.357 -3.613 -4.216
163 H LEU 20 HN LEU 20 -5.052 -0.508 -0.358
164 HA LEU 20 HA LEU 20 -7.635 -1.474 0.522
165 HB2 LEU 20 HB2 LEU 20 -5.044 -1.379 1.483
166 HB3 LEU 20 HB1 LEU 20 -5.853 -0.210 2.513
167 HG LEU 20 HG LEU 20 -5.939 -2.440 3.525
168 HD11 LEU 20 HD11 LEU 20 -8.266 -2.504 4.032
169 HD12 LEU 20 HD12 LEU 20 -8.701 -1.809 2.470
170 HD13 LEU 20 HD13 LEU 20 -7.902 -0.814 3.687
171 HD21 LEU 20 HD21 LEU 20 -7.618 -3.337 1.172
172 HD22 LEU 20 HD22 LEU 20 -6.927 -4.326 2.457
173 HD23 LEU 20 HD23 LEU 20 -5.876 -3.611 1.236
174 H LEU 21 HN LEU 21 -5.955 1.667 0.833
175 HA LEU 21 HA LEU 21 -8.025 3.070 2.225
176 HB2 LEU 21 HB2 LEU 21 -5.445 3.560 1.305
177 HB3 LEU 21 HB1 LEU 21 -6.426 4.670 0.357
178 HG LEU 21 HG LEU 21 -5.657 5.742 2.424
179 HD11 LEU 21 HD11 LEU 21 -7.785 6.559 3.239
180 HD12 LEU 21 HD12 LEU 21 -8.617 5.131 2.626
181 HD13 LEU 21 HD13 LEU 21 -7.919 6.295 1.501
182 HD21 LEU 21 HD21 LEU 21 -6.315 4.922 4.615
183 HD22 LEU 21 HD22 LEU 21 -5.482 3.625 3.758
184 HD23 LEU 21 HD23 LEU 21 -7.240 3.609 3.889
185 H ALA 22 HN ALA 22 -7.554 2.364 -1.179
186 HA ALA 22 HA ALA 22 -9.859 4.079 -1.968
187 HB1 ALA 22 HB1 ALA 22 -7.690 4.160 -3.193
188 HB2 ALA 22 HB2 ALA 22 -9.020 3.650 -4.231
189 HB3 ALA 22 HB3 ALA 22 -7.883 2.456 -3.605
190 H LEU 23 HN LEU 23 -10.359 1.651 -0.378
191 HA LEU 23 HA LEU 23 -12.022 0.124 -2.345
192 HB2 LEU 23 HB2 LEU 23 -9.733 -0.803 -1.470
193 HB3 LEU 23 HB1 LEU 23 -10.690 -1.208 -0.052
194 HG LEU 23 HG LEU 23 -12.132 -1.956 -2.433
195 HD11 LEU 23 HD11 LEU 23 -10.262 -2.373 -3.722
196 HD12 LEU 23 HD12 LEU 23 -10.359 -3.904 -2.851
197 HD13 LEU 23 HD13 LEU 23 -9.227 -2.658 -2.322
198 HD21 LEU 23 HD21 LEU 23 -12.482 -2.886 -0.173
199 HD22 LEU 23 HD22 LEU 23 -10.860 -3.581 -0.203
200 HD23 LEU 23 HD23 LEU 23 -12.092 -4.168 -1.320
201 HA PRO 24 HA PRO 24 -14.471 1.598 1.322
202 HB2 PRO 24 HB2 PRO 24 -16.342 2.910 -0.173
203 HB3 PRO 24 HB1 PRO 24 -14.820 3.657 0.351
204 HG2 PRO 24 HG2 PRO 24 -15.576 2.582 -2.303
205 HG3 PRO 24 HG1 PRO 24 -14.532 3.951 -1.890
206 HD2 PRO 24 HD2 PRO 24 -13.617 1.439 -2.652
207 HD3 PRO 24 HD1 PRO 24 -12.669 2.636 -1.761
208 HA PRO 25 HA PRO 25 -17.082 -1.978 0.465
209 HB2 PRO 25 HB2 PRO 25 -18.240 -2.147 2.929
210 HB3 PRO 25 HB1 PRO 25 -16.602 -2.732 2.581
211 HG2 PRO 25 HG2 PRO 25 -17.463 -0.218 3.903
212 HG3 PRO 25 HG1 PRO 25 -16.080 -1.267 4.255
213 HD2 PRO 25 HD2 PRO 25 -15.888 1.087 2.890
214 HD3 PRO 25 HD1 PRO 25 -14.754 -0.269 2.694
215 H ARG 26 HN ARG 26 -18.418 0.842 2.178
216 HA ARG 26 HA ARG 26 -21.118 0.334 1.072
217 HB2 ARG 26 HB2 ARG 26 -19.940 1.681 3.343
218 HB3 ARG 26 HB1 ARG 26 -20.993 2.797 2.475
219 HG2 ARG 26 HG2 ARG 26 -22.162 0.121 2.747
220 HG3 ARG 26 HG1 ARG 26 -21.830 0.885 4.301
221 HD2 ARG 26 HD2 ARG 26 -23.559 2.324 4.047
222 HD3 ARG 26 HD1 ARG 26 -23.013 2.787 2.424
223 HE ARG 26 HE ARG 26 -24.573 0.275 2.930
224 HH11 ARG 26 HH11 ARG 26 -23.258 0.762 0.238
225 HH12 ARG 26 HH12 ARG 26 -24.566 1.438 -0.671
226 HH21 ARG 26 HH21 ARG 26 -26.488 2.157 2.146
227 HH22 ARG 26 HH22 ARG 26 -26.412 2.234 0.419
228 H ALA 27 HN ALA 27 -18.515 2.769 0.828
229 HA ALA 27 HA ALA 27 -18.058 4.421 -0.754
230 HB1 ALA 27 HB1 ALA 27 -18.386 3.750 -2.972
231 HB2 ALA 27 HB2 ALA 27 -19.939 2.996 -2.619
232 HB3 ALA 27 HB3 ALA 27 -18.444 2.215 -2.105
233 H TYR 28 HN TYR 28 -19.271 5.923 0.595
234 HA TYR 28 HA TYR 28 -22.022 6.605 -0.299
235 HB2 TYR 28 HB2 TYR 28 -22.132 7.890 1.738
236 HB3 TYR 28 HB1 TYR 28 -21.397 6.341 2.123
237 HD1 TYR 28 HD2 TYR 28 -20.794 9.959 1.676
238 HD2 TYR 28 HD1 TYR 28 -19.050 6.191 2.785
239 HE1 TYR 28 HE2 TYR 28 -18.829 11.142 2.613
240 HE2 TYR 28 HE1 TYR 28 -17.087 7.376 3.722
241 HH TYR 28 HH TYR 28 -15.989 9.849 3.169
242 H ALA 29 HN ALA 29 -18.733 7.842 -0.536
243 HA ALA 29 HA ALA 29 -19.772 10.201 -2.072
244 HB1 ALA 29 HB1 ALA 29 -17.627 9.940 0.031
245 HB2 ALA 29 HB2 ALA 29 -18.958 11.095 -0.047
246 HB3 ALA 29 HB3 ALA 29 -17.582 11.259 -1.139
Start of MODEL 4
1 H1 ARG 1 HT1 ARG 1 15.479 -1.020 -7.447
2 H2 ARG 1 HT2 ARG 1 13.970 -1.656 -6.994
3 H3 ARG 1 HT3 ARG 1 14.882 -2.405 -8.215
4 HA ARG 1 HA ARG 1 16.589 -3.043 -6.627
5 HB2 ARG 1 HB2 ARG 1 14.974 -1.122 -5.043
6 HB3 ARG 1 HB1 ARG 1 15.580 -2.516 -4.152
7 HG2 ARG 1 HG2 ARG 1 17.728 -1.803 -4.249
8 HG3 ARG 1 HG1 ARG 1 17.585 -1.293 -5.931
9 HD2 ARG 1 HD2 ARG 1 16.870 0.847 -5.368
10 HD3 ARG 1 HD1 ARG 1 16.167 0.319 -3.827
11 HE ARG 1 HE ARG 1 18.401 0.224 -2.872
12 HH11 ARG 1 HH11 ARG 1 18.385 2.960 -4.127
13 HH12 ARG 1 HH12 ARG 1 19.887 2.972 -4.984
14 HH21 ARG 1 HH21 ARG 1 20.288 -0.487 -4.843
15 HH22 ARG 1 HH22 ARG 1 20.977 1.003 -5.393
16 H LEU 2 HN LEU 2 16.327 -4.978 -5.241
17 HA LEU 2 HA LEU 2 13.567 -6.082 -5.046
18 HB2 LEU 2 HB2 LEU 2 15.270 -6.655 -7.152
19 HB3 LEU 2 HB1 LEU 2 15.569 -7.994 -6.046
20 HG LEU 2 HG LEU 2 12.754 -7.139 -6.707
21 HD11 LEU 2 HD11 LEU 2 14.476 -9.110 -8.239
22 HD12 LEU 2 HD12 LEU 2 13.869 -7.573 -8.852
23 HD13 LEU 2 HD13 LEU 2 12.744 -8.876 -8.471
24 HD21 LEU 2 HD21 LEU 2 13.113 -8.671 -4.802
25 HD22 LEU 2 HD22 LEU 2 14.022 -9.764 -5.845
26 HD23 LEU 2 HD23 LEU 2 12.299 -9.508 -6.123
27 H VAL 3 HN VAL 3 13.680 -6.068 -2.776
28 HA VAL 3 HA VAL 3 15.609 -7.992 -1.553
29 HB VAL 3 HB VAL 3 14.837 -5.328 -0.344
30 HG11 VAL 3 HG11 VAL 3 17.067 -7.272 0.309
31 HG12 VAL 3 HG12 VAL 3 15.562 -7.115 1.216
32 HG13 VAL 3 HG13 VAL 3 16.707 -5.776 1.171
33 HG21 VAL 3 HG21 VAL 3 17.229 -4.673 -0.916
34 HG22 VAL 3 HG22 VAL 3 16.146 -4.785 -2.303
35 HG23 VAL 3 HG23 VAL 3 17.284 -6.089 -1.966
36 HA PRO 4 HA PRO 4 11.733 -9.307 0.180
37 HB2 PRO 4 HB2 PRO 4 12.707 -11.378 1.665
38 HB3 PRO 4 HB1 PRO 4 12.523 -11.443 -0.097
39 HG2 PRO 4 HG2 PRO 4 14.957 -11.172 1.520
40 HG3 PRO 4 HG1 PRO 4 14.742 -11.829 -0.108
41 HD2 PRO 4 HD2 PRO 4 15.746 -9.285 0.578
42 HD3 PRO 4 HD1 PRO 4 15.329 -9.860 -1.046
43 H GLY 5 HN GLY 5 10.679 -8.364 1.856
44 HA2 GLY 5 HA2 GLY 5 10.207 -7.929 4.163
45 HA3 GLY 5 HA1 GLY 5 11.902 -8.232 4.545
46 H ALA 6 HN ALA 6 13.270 -6.545 2.933
47 HA ALA 6 HA ALA 6 12.770 -3.932 4.133
48 HB1 ALA 6 HB1 ALA 6 14.795 -3.423 2.546
49 HB2 ALA 6 HB2 ALA 6 14.812 -5.170 2.309
50 HB3 ALA 6 HB3 ALA 6 15.033 -4.498 3.924
51 H ALA 7 HN ALA 7 13.090 -4.939 0.731
52 HA ALA 7 HA ALA 7 11.860 -2.518 -0.296
53 HB1 ALA 7 HB1 ALA 7 12.069 -5.078 -1.842
54 HB2 ALA 7 HB2 ALA 7 13.545 -4.248 -1.347
55 HB3 ALA 7 HB3 ALA 7 12.378 -3.428 -2.383
56 H TYR 8 HN TYR 8 10.655 -5.717 0.533
57 HA TYR 8 HA TYR 8 8.109 -5.526 -0.812
58 HB2 TYR 8 HB2 TYR 8 9.274 -7.151 1.438
59 HB3 TYR 8 HB1 TYR 8 7.557 -7.268 1.089
60 HD1 TYR 8 HD1 TYR 8 10.432 -6.833 -1.303
61 HD2 TYR 8 HD2 TYR 8 7.277 -9.385 0.117
62 HE1 TYR 8 HE1 TYR 8 10.893 -8.423 -3.138
63 HE2 TYR 8 HE2 TYR 8 7.743 -10.974 -1.725
64 HH TYR 8 HH TYR 8 10.079 -11.439 -3.211
65 H ALA 9 HN ALA 9 9.286 -4.458 2.330
66 HA ALA 9 HA ALA 9 6.661 -3.692 3.347
67 HB1 ALA 9 HB1 ALA 9 8.484 -4.363 4.835
68 HB2 ALA 9 HB2 ALA 9 8.045 -2.689 5.170
69 HB3 ALA 9 HB3 ALA 9 9.491 -3.050 4.227
70 H LEU 10 HN LEU 10 8.686 -2.312 1.020
71 HA LEU 10 HA LEU 10 7.628 0.448 1.519
72 HB2 LEU 10 HB2 LEU 10 10.222 -0.351 1.397
73 HB3 LEU 10 HB1 LEU 10 9.927 -0.088 -0.314
74 HG LEU 10 HG LEU 10 10.817 1.948 0.725
75 HD11 LEU 10 HD11 LEU 10 9.203 3.506 -0.121
76 HD12 LEU 10 HD12 LEU 10 7.880 2.363 0.117
77 HD13 LEU 10 HD13 LEU 10 9.093 2.061 -1.127
78 HD21 LEU 10 HD21 LEU 10 9.654 3.116 2.480
79 HD22 LEU 10 HD22 LEU 10 9.846 1.446 3.012
80 HD23 LEU 10 HD23 LEU 10 8.289 2.003 2.398
81 H TYR 11 HN TYR 11 8.768 -1.634 -1.156
82 HA TYR 11 HA TYR 11 7.063 -0.354 -3.141
83 HB2 TYR 11 HB2 TYR 11 9.149 -2.443 -2.980
84 HB3 TYR 11 HB1 TYR 11 7.988 -2.652 -4.285
85 HD1 TYR 11 HD2 TYR 11 10.604 -0.476 -2.874
86 HD2 TYR 11 HD1 TYR 11 7.817 -1.013 -6.100
87 HE1 TYR 11 HE2 TYR 11 11.762 1.292 -4.165
88 HE2 TYR 11 HE1 TYR 11 8.976 0.757 -7.392
89 HH TYR 11 HH TYR 11 10.628 2.953 -6.430
90 H GLY 12 HN GLY 12 6.776 -3.153 -1.058
91 HA2 GLY 12 HA2 GLY 12 4.503 -4.275 -2.557
92 HA3 GLY 12 HA1 GLY 12 5.187 -4.928 -1.069
93 H VAL 13 HN VAL 13 5.096 -2.348 0.349
94 HA VAL 13 HA VAL 13 2.344 -2.487 1.305
95 HB VAL 13 HB VAL 13 4.791 -0.848 1.997
96 HG11 VAL 13 HG11 VAL 13 3.346 -0.445 4.162
97 HG12 VAL 13 HG12 VAL 13 1.988 -0.698 3.065
98 HG13 VAL 13 HG13 VAL 13 3.138 0.604 2.760
99 HG21 VAL 13 HG21 VAL 13 3.328 -3.033 3.511
100 HG22 VAL 13 HG22 VAL 13 4.860 -2.285 3.962
101 HG23 VAL 13 HG23 VAL 13 4.764 -3.301 2.523
102 H TRP 14 HN TRP 14 4.152 -0.374 -0.833
103 HA TRP 14 HA TRP 14 2.601 1.976 -0.780
104 HB2 TRP 14 HB2 TRP 14 4.738 1.631 -1.995
105 HB3 TRP 14 HB1 TRP 14 3.897 0.652 -3.177
106 HD1 TRP 14 HD1 TRP 14 3.971 2.130 -5.255
107 HE1 TRP 14 HE1 TRP 14 3.111 4.482 -5.850
108 HE3 TRP 14 HE3 TRP 14 2.567 3.774 -0.617
109 HZ2 TRP 14 HZ2 TRP 14 1.978 6.757 -4.544
110 HZ3 TRP 14 HZ3 TRP 14 1.603 6.030 -0.329
111 HH2 TRP 14 HH2 TRP 14 1.306 7.526 -2.283
112 HA PRO 15 HA PRO 15 -0.319 0.205 -4.168
113 HB2 PRO 15 HB2 PRO 15 -0.349 -2.507 -4.563
114 HB3 PRO 15 HB1 PRO 15 0.680 -1.395 -5.492
115 HG2 PRO 15 HG2 PRO 15 1.386 -3.113 -3.165
116 HG3 PRO 15 HG1 PRO 15 2.305 -2.779 -4.643
117 HD2 PRO 15 HD2 PRO 15 2.853 -1.574 -2.298
118 HD3 PRO 15 HD1 PRO 15 3.108 -0.763 -3.856
119 H LEU 16 HN LEU 16 0.307 -1.853 -1.316
120 HA LEU 16 HA LEU 16 -2.469 -2.583 -0.887
121 HB2 LEU 16 HB2 LEU 16 0.139 -2.742 0.552
122 HB3 LEU 16 HB1 LEU 16 -1.292 -2.747 1.576
123 HG LEU 16 HG LEU 16 -0.637 -5.038 1.020
124 HD11 LEU 16 HD11 LEU 16 -2.765 -5.831 0.515
125 HD12 LEU 16 HD12 LEU 16 -3.073 -4.559 -0.666
126 HD13 LEU 16 HD13 LEU 16 -3.124 -4.191 1.058
127 HD21 LEU 16 HD21 LEU 16 0.487 -4.541 -1.131
128 HD22 LEU 16 HD22 LEU 16 -1.080 -4.205 -1.867
129 HD23 LEU 16 HD23 LEU 16 -0.698 -5.833 -1.310
130 H LEU 17 HN LEU 17 -0.332 -0.073 0.388
131 HA LEU 17 HA LEU 17 -2.299 1.233 2.053
132 HB2 LEU 17 HB2 LEU 17 0.183 1.480 2.256
133 HB3 LEU 17 HB1 LEU 17 0.204 2.309 0.701
134 HG LEU 17 HG LEU 17 -1.677 3.397 2.734
135 HD11 LEU 17 HD11 LEU 17 0.432 2.828 4.010
136 HD12 LEU 17 HD12 LEU 17 0.031 4.546 3.985
137 HD13 LEU 17 HD13 LEU 17 1.300 3.921 2.932
138 HD21 LEU 17 HD21 LEU 17 -0.361 5.505 1.768
139 HD22 LEU 17 HD22 LEU 17 -1.619 4.712 0.821
140 HD23 LEU 17 HD23 LEU 17 0.078 4.359 0.501
141 H LEU 18 HN LEU 18 -1.242 1.573 -1.297
142 HA LEU 18 HA LEU 18 -2.706 3.910 -2.051
143 HB2 LEU 18 HB2 LEU 18 -1.547 1.487 -3.379
144 HB3 LEU 18 HB1 LEU 18 -2.673 2.450 -4.322
145 HG LEU 18 HG LEU 18 -0.241 3.586 -2.910
146 HD11 LEU 18 HD11 LEU 18 0.585 3.790 -5.339
147 HD12 LEU 18 HD12 LEU 18 -0.660 2.608 -5.740
148 HD13 LEU 18 HD13 LEU 18 0.631 2.183 -4.615
149 HD21 LEU 18 HD21 LEU 18 -0.682 5.573 -4.222
150 HD22 LEU 18 HD22 LEU 18 -2.178 5.138 -3.398
151 HD23 LEU 18 HD23 LEU 18 -1.971 4.762 -5.110
152 H LEU 19 HN LEU 19 -3.575 0.433 -2.041
153 HA LEU 19 HA LEU 19 -6.275 0.765 -3.020
154 HB2 LEU 19 HB2 LEU 19 -4.637 -1.314 -2.722
155 HB3 LEU 19 HB1 LEU 19 -5.451 -1.452 -1.172
156 HG LEU 19 HG LEU 19 -7.076 -1.131 -3.687
157 HD11 LEU 19 HD11 LEU 19 -7.166 -3.563 -3.929
158 HD12 LEU 19 HD12 LEU 19 -6.054 -3.762 -2.574
159 HD13 LEU 19 HD13 LEU 19 -5.496 -3.013 -4.071
160 HD21 LEU 19 HD21 LEU 19 -8.404 -0.980 -1.740
161 HD22 LEU 19 HD22 LEU 19 -7.472 -2.217 -0.897
162 HD23 LEU 19 HD23 LEU 19 -8.565 -2.673 -2.205
163 H LEU 20 HN LEU 20 -4.827 0.444 0.175
164 HA LEU 20 HA LEU 20 -7.186 0.566 1.793
165 HB2 LEU 20 HB2 LEU 20 -4.256 0.879 2.074
166 HB3 LEU 20 HB1 LEU 20 -5.199 1.690 3.318
167 HG LEU 20 HG LEU 20 -5.707 -1.187 2.540
168 HD11 LEU 20 HD11 LEU 20 -3.986 -0.206 4.836
169 HD12 LEU 20 HD12 LEU 20 -3.338 -0.841 3.323
170 HD13 LEU 20 HD13 LEU 20 -4.295 -1.882 4.378
171 HD21 LEU 20 HD21 LEU 20 -7.509 -0.084 3.772
172 HD22 LEU 20 HD22 LEU 20 -6.363 0.503 4.979
173 HD23 LEU 20 HD23 LEU 20 -6.695 -1.224 4.843
174 H LEU 21 HN LEU 21 -5.099 3.145 0.482
175 HA LEU 21 HA LEU 21 -6.195 5.380 1.858
176 HB2 LEU 21 HB2 LEU 21 -4.112 5.115 0.341
177 HB3 LEU 21 HB1 LEU 21 -5.214 5.377 -1.002
178 HG LEU 21 HG LEU 21 -3.991 7.433 -0.174
179 HD11 LEU 21 HD11 LEU 21 -6.327 7.303 -1.361
180 HD12 LEU 21 HD12 LEU 21 -5.775 8.833 -0.680
181 HD13 LEU 21 HD13 LEU 21 -6.939 7.846 0.201
182 HD21 LEU 21 HD21 LEU 21 -4.286 6.767 2.283
183 HD22 LEU 21 HD22 LEU 21 -5.950 7.330 2.131
184 HD23 LEU 21 HD23 LEU 21 -4.614 8.455 1.892
185 H ALA 22 HN ALA 22 -7.029 4.057 -1.329
186 HA ALA 22 HA ALA 22 -9.652 5.516 -1.230
187 HB1 ALA 22 HB1 ALA 22 -8.426 4.291 -3.695
188 HB2 ALA 22 HB2 ALA 22 -7.781 5.809 -3.072
189 HB3 ALA 22 HB3 ALA 22 -9.472 5.705 -3.564
190 H LEU 23 HN LEU 23 -9.504 3.222 0.295
191 HA LEU 23 HA LEU 23 -10.136 0.792 -1.082
192 HB2 LEU 23 HB2 LEU 23 -10.187 -0.110 1.044
193 HB3 LEU 23 HB1 LEU 23 -9.250 1.343 1.338
194 HG LEU 23 HG LEU 23 -12.255 1.273 1.715
195 HD11 LEU 23 HD11 LEU 23 -11.120 -0.477 3.113
196 HD12 LEU 23 HD12 LEU 23 -11.902 0.792 4.057
197 HD13 LEU 23 HD13 LEU 23 -10.151 0.805 3.844
198 HD21 LEU 23 HD21 LEU 23 -9.990 3.112 2.483
199 HD22 LEU 23 HD22 LEU 23 -11.476 3.097 3.429
200 HD23 LEU 23 HD23 LEU 23 -11.527 3.512 1.717
201 HA PRO 24 HA PRO 24 -14.432 1.520 -1.829
202 HB2 PRO 24 HB2 PRO 24 -15.015 -0.963 -2.797
203 HB3 PRO 24 HB1 PRO 24 -14.088 0.242 -3.709
204 HG2 PRO 24 HG2 PRO 24 -13.179 -2.219 -2.424
205 HG3 PRO 24 HG1 PRO 24 -12.430 -1.273 -3.717
206 HD2 PRO 24 HD2 PRO 24 -11.745 -1.314 -0.947
207 HD3 PRO 24 HD1 PRO 24 -11.011 -0.337 -2.236
208 HA PRO 25 HA PRO 25 -16.636 -0.142 1.644
209 HB2 PRO 25 HB2 PRO 25 -19.203 -0.121 0.720
210 HB3 PRO 25 HB1 PRO 25 -18.315 1.356 1.142
211 HG2 PRO 25 HG2 PRO 25 -18.883 0.196 -1.526
212 HG3 PRO 25 HG1 PRO 25 -18.809 1.891 -1.018
213 HD2 PRO 25 HD2 PRO 25 -16.816 0.597 -2.378
214 HD3 PRO 25 HD1 PRO 25 -16.572 2.029 -1.353
215 H ARG 26 HN ARG 26 -18.538 -1.899 2.044
216 HA ARG 26 HA ARG 26 -17.546 -4.439 1.019
217 HB2 ARG 26 HB2 ARG 26 -18.479 -3.935 3.329
218 HB3 ARG 26 HB1 ARG 26 -20.077 -3.860 2.593
219 HG2 ARG 26 HG2 ARG 26 -19.444 -6.214 1.616
220 HG3 ARG 26 HG1 ARG 26 -18.255 -6.231 2.919
221 HD2 ARG 26 HD2 ARG 26 -21.053 -5.447 3.641
222 HD3 ARG 26 HD1 ARG 26 -20.738 -7.160 3.306
223 HE ARG 26 HE ARG 26 -19.114 -5.605 5.289
224 HH11 ARG 26 HH21 ARG 26 -21.381 -7.050 6.487
225 HH12 ARG 26 HH22 ARG 26 -20.710 -8.600 6.866
226 HH21 ARG 26 HH11 ARG 26 -17.952 -8.198 4.771
227 HH22 ARG 26 HH12 ARG 26 -18.748 -9.256 5.884
228 H ALA 27 HN ALA 27 -20.896 -3.104 0.902
229 HA ALA 27 HA ALA 27 -21.131 -3.606 -1.979
230 HB1 ALA 27 HB1 ALA 27 -22.722 -5.430 -1.781
231 HB2 ALA 27 HB2 ALA 27 -22.700 -5.312 -0.022
232 HB3 ALA 27 HB3 ALA 27 -21.265 -5.864 -0.886
233 H TYR 28 HN TYR 28 -21.579 -1.228 -0.453
234 HA TYR 28 HA TYR 28 -24.395 -0.702 -1.138
235 HB2 TYR 28 HB2 TYR 28 -23.862 -1.678 1.363
236 HB3 TYR 28 HB1 TYR 28 -23.779 0.059 1.650
237 HD1 TYR 28 HD1 TYR 28 -25.934 -2.723 0.538
238 HD2 TYR 28 HD2 TYR 28 -25.733 1.482 1.392
239 HE1 TYR 28 HE1 TYR 28 -28.409 -2.596 0.494
240 HE2 TYR 28 HE2 TYR 28 -28.207 1.608 1.348
241 HH TYR 28 HH TYR 28 -30.168 -0.578 1.782
242 H ALA 29 HN ALA 29 -21.919 0.832 0.996
243 HA ALA 29 HA ALA 29 -21.468 3.026 -0.900
244 HB1 ALA 29 HB1 ALA 29 -23.105 3.395 1.623
245 HB2 ALA 29 HB2 ALA 29 -23.639 3.661 -0.036
246 HB3 ALA 29 HB3 ALA 29 -22.436 4.729 0.685
Start of MODEL 5
1 H1 ARG 1 HT1 ARG 1 24.407 -4.350 -7.612
2 H2 ARG 1 HT2 ARG 1 23.964 -3.230 -6.412
3 H3 ARG 1 HT3 ARG 1 23.569 -2.942 -8.038
4 HA ARG 1 HA ARG 1 22.074 -4.863 -8.043
5 HB2 ARG 1 HB2 ARG 1 23.701 -5.574 -5.910
6 HB3 ARG 1 HB1 ARG 1 22.186 -5.148 -5.118
7 HG2 ARG 1 HG2 ARG 1 21.956 -7.447 -5.621
8 HG3 ARG 1 HG1 ARG 1 21.044 -6.633 -6.892
9 HD2 ARG 1 HD2 ARG 1 22.591 -7.163 -8.535
10 HD3 ARG 1 HD1 ARG 1 23.952 -7.181 -7.396
11 HE ARG 1 HE ARG 1 21.861 -9.329 -7.420
12 HH11 ARG 1 HH11 ARG 1 24.256 -9.948 -9.023
13 HH12 ARG 1 HH12 ARG 1 25.303 -10.726 -7.885
14 HH21 ARG 1 HH21 ARG 1 23.562 -9.567 -5.101
15 HH22 ARG 1 HH22 ARG 1 24.906 -10.509 -5.646
16 H LEU 2 HN LEU 2 19.838 -4.709 -7.043
17 HA LEU 2 HA LEU 2 19.096 -1.901 -6.599
18 HB2 LEU 2 HB2 LEU 2 17.953 -4.124 -7.773
19 HB3 LEU 2 HB1 LEU 2 17.071 -4.019 -6.251
20 HG LEU 2 HG LEU 2 17.027 -1.411 -6.963
21 HD11 LEU 2 HD11 LEU 2 16.970 -2.969 -9.567
22 HD12 LEU 2 HD12 LEU 2 18.240 -1.849 -9.074
23 HD13 LEU 2 HD13 LEU 2 16.609 -1.253 -9.383
24 HD21 LEU 2 HD21 LEU 2 14.745 -1.786 -7.636
25 HD22 LEU 2 HD22 LEU 2 15.118 -3.006 -6.421
26 HD23 LEU 2 HD23 LEU 2 15.098 -3.441 -8.130
27 H VAL 3 HN VAL 3 17.018 -2.013 -4.785
28 HA VAL 3 HA VAL 3 18.311 -1.929 -2.246
29 HB VAL 3 HB VAL 3 16.004 -1.716 -1.358
30 HG11 VAL 3 HG11 VAL 3 15.952 0.409 -2.087
31 HG12 VAL 3 HG12 VAL 3 15.670 -0.087 -3.754
32 HG13 VAL 3 HG13 VAL 3 17.315 -0.014 -3.124
33 HG21 VAL 3 HG21 VAL 3 15.354 -3.101 -3.846
34 HG22 VAL 3 HG22 VAL 3 14.416 -1.618 -3.668
35 HG23 VAL 3 HG23 VAL 3 14.357 -2.853 -2.411
36 HA PRO 4 HA PRO 4 18.296 -6.306 -1.417
37 HB2 PRO 4 HB2 PRO 4 19.501 -6.198 1.029
38 HB3 PRO 4 HB1 PRO 4 20.375 -5.992 -0.500
39 HG2 PRO 4 HG2 PRO 4 19.572 -3.976 1.493
40 HG3 PRO 4 HG1 PRO 4 20.949 -3.990 0.383
41 HD2 PRO 4 HD2 PRO 4 18.583 -2.538 0.062
42 HD3 PRO 4 HD1 PRO 4 19.818 -2.833 -1.182
43 H GLY 5 HN GLY 5 15.750 -5.617 -1.169
44 HA2 GLY 5 HA2 GLY 5 13.889 -6.529 0.021
45 HA3 GLY 5 HA1 GLY 5 14.919 -6.754 1.427
46 H ALA 6 HN ALA 6 15.909 -3.965 1.420
47 HA ALA 6 HA ALA 6 14.238 -2.684 3.217
48 HB1 ALA 6 HB1 ALA 6 15.464 -0.650 2.585
49 HB2 ALA 6 HB2 ALA 6 15.974 -1.424 1.085
50 HB3 ALA 6 HB3 ALA 6 16.544 -2.043 2.635
51 H ALA 7 HN ALA 7 14.241 -2.057 -0.288
52 HA ALA 7 HA ALA 7 11.645 -0.610 -0.015
53 HB1 ALA 7 HB1 ALA 7 14.019 -0.191 -1.463
54 HB2 ALA 7 HB2 ALA 7 12.519 0.721 -1.608
55 HB3 ALA 7 HB3 ALA 7 12.819 -0.654 -2.670
56 H TYR 8 HN TYR 8 11.910 -3.636 0.067
57 HA TYR 8 HA TYR 8 10.358 -4.337 -2.392
58 HB2 TYR 8 HB2 TYR 8 12.364 -5.692 -0.675
59 HB3 TYR 8 HB1 TYR 8 11.031 -6.707 -1.221
60 HD1 TYR 8 HD1 TYR 8 10.517 -6.851 -3.698
61 HD2 TYR 8 HD2 TYR 8 14.088 -5.019 -2.172
62 HE1 TYR 8 HE1 TYR 8 11.566 -7.034 -5.935
63 HE2 TYR 8 HE2 TYR 8 15.138 -5.204 -4.408
64 HH TYR 8 HH TYR 8 14.163 -7.162 -6.745
65 H ALA 9 HN ALA 9 10.547 -5.250 1.044
66 HA ALA 9 HA ALA 9 7.832 -6.205 1.227
67 HB1 ALA 9 HB1 ALA 9 9.557 -6.899 2.798
68 HB2 ALA 9 HB2 ALA 9 8.314 -6.028 3.698
69 HB3 ALA 9 HB3 ALA 9 9.829 -5.227 3.290
70 H LEU 10 HN LEU 10 9.378 -3.129 1.976
71 HA LEU 10 HA LEU 10 7.149 -1.721 3.092
72 HB2 LEU 10 HB2 LEU 10 9.844 -1.255 2.430
73 HB3 LEU 10 HB1 LEU 10 8.945 -0.078 1.479
74 HG LEU 10 HG LEU 10 8.274 -0.465 4.384
75 HD11 LEU 10 HD11 LEU 10 10.346 1.519 3.441
76 HD12 LEU 10 HD12 LEU 10 10.801 -0.091 4.003
77 HD13 LEU 10 HD13 LEU 10 9.972 1.021 5.091
78 HD21 LEU 10 HD21 LEU 10 8.180 1.885 2.459
79 HD22 LEU 10 HD22 LEU 10 7.665 1.938 4.145
80 HD23 LEU 10 HD23 LEU 10 6.800 0.924 2.991
81 H TYR 11 HN TYR 11 8.348 -1.952 -0.276
82 HA TYR 11 HA TYR 11 6.212 -0.311 -1.374
83 HB2 TYR 11 HB2 TYR 11 8.491 -1.956 -2.394
84 HB3 TYR 11 HB1 TYR 11 7.231 -1.484 -3.532
85 HD1 TYR 11 HD2 TYR 11 9.746 -0.200 -1.126
86 HD2 TYR 11 HD1 TYR 11 6.972 0.802 -4.250
87 HE1 TYR 11 HE2 TYR 11 10.714 2.077 -1.253
88 HE2 TYR 11 HE1 TYR 11 7.940 3.078 -4.375
89 HH TYR 11 HH TYR 11 10.704 3.956 -3.462
90 H GLY 12 HN GLY 12 6.087 -3.423 -0.156
91 HA2 GLY 12 HA2 GLY 12 4.172 -4.471 -2.146
92 HA3 GLY 12 HA1 GLY 12 4.801 -5.348 -0.747
93 H VAL 13 HN VAL 13 4.281 -2.990 1.045
94 HA VAL 13 HA VAL 13 1.358 -3.428 1.402
95 HB VAL 13 HB VAL 13 1.788 -2.878 3.751
96 HG11 VAL 13 HG11 VAL 13 3.146 -4.807 4.329
97 HG12 VAL 13 HG12 VAL 13 3.859 -4.834 2.716
98 HG13 VAL 13 HG13 VAL 13 2.148 -5.207 2.932
99 HG21 VAL 13 HG21 VAL 13 3.909 -2.250 4.600
100 HG22 VAL 13 HG22 VAL 13 3.735 -1.272 3.143
101 HG23 VAL 13 HG23 VAL 13 4.742 -2.721 3.119
102 H TRP 14 HN TRP 14 3.652 -0.956 0.610
103 HA TRP 14 HA TRP 14 2.234 1.336 1.589
104 HB2 TRP 14 HB2 TRP 14 4.625 1.252 0.903
105 HB3 TRP 14 HB1 TRP 14 4.125 1.087 -0.766
106 HD1 TRP 14 HD1 TRP 14 5.010 3.341 -1.647
107 HE1 TRP 14 HE1 TRP 14 4.376 5.800 -1.239
108 HE3 TRP 14 HE3 TRP 14 1.974 2.821 2.442
109 HZ2 TRP 14 HZ2 TRP 14 2.792 7.348 0.572
110 HZ3 TRP 14 HZ3 TRP 14 0.923 4.799 3.479
111 HH2 TRP 14 HH2 TRP 14 1.325 7.063 2.554
112 HA PRO 15 HA PRO 15 0.255 1.724 -2.746
113 HB2 PRO 15 HB2 PRO 15 0.402 -0.381 -4.483
114 HB3 PRO 15 HB1 PRO 15 1.608 0.922 -4.435
115 HG2 PRO 15 HG2 PRO 15 1.755 -1.823 -3.320
116 HG3 PRO 15 HG1 PRO 15 3.019 -0.834 -4.065
117 HD2 PRO 15 HD2 PRO 15 2.758 -1.202 -1.375
118 HD3 PRO 15 HD1 PRO 15 3.540 0.213 -2.108
119 H LEU 16 HN LEU 16 0.256 -1.522 -1.282
120 HA LEU 16 HA LEU 16 -2.461 -2.227 -1.959
121 HB2 LEU 16 HB2 LEU 16 -0.318 -3.122 -0.076
122 HB3 LEU 16 HB1 LEU 16 -1.961 -3.613 0.313
123 HG LEU 16 HG LEU 16 -0.787 -5.308 -1.056
124 HD11 LEU 16 HD11 LEU 16 -3.326 -4.697 -1.252
125 HD12 LEU 16 HD12 LEU 16 -2.606 -5.788 -2.435
126 HD13 LEU 16 HD13 LEU 16 -2.873 -4.095 -2.847
127 HD21 LEU 16 HD21 LEU 16 -0.800 -3.212 -3.251
128 HD22 LEU 16 HD22 LEU 16 -0.156 -4.849 -3.352
129 HD23 LEU 16 HD23 LEU 16 0.631 -3.656 -2.321
130 H LEU 17 HN LEU 17 -0.982 -0.685 0.874
131 HA LEU 17 HA LEU 17 -3.419 -0.318 2.370
132 HB2 LEU 17 HB2 LEU 17 -0.954 -0.147 3.131
133 HB3 LEU 17 HB1 LEU 17 -0.972 1.470 2.427
134 HG LEU 17 HG LEU 17 -3.186 1.697 3.897
135 HD11 LEU 17 HD11 LEU 17 -1.591 -0.530 5.171
136 HD12 LEU 17 HD12 LEU 17 -3.322 -0.474 4.839
137 HD13 LEU 17 HD13 LEU 17 -2.640 0.518 6.129
138 HD21 LEU 17 HD21 LEU 17 -0.365 1.849 5.017
139 HD22 LEU 17 HD22 LEU 17 -1.774 2.672 5.685
140 HD23 LEU 17 HD23 LEU 17 -1.173 3.111 4.087
141 H LEU 18 HN LEU 18 -1.713 1.595 -0.047
142 HA LEU 18 HA LEU 18 -3.367 3.959 0.036
143 HB2 LEU 18 HB2 LEU 18 -1.179 2.825 -1.502
144 HB3 LEU 18 HB1 LEU 18 -2.373 3.515 -2.596
145 HG LEU 18 HG LEU 18 -2.327 5.609 -1.169
146 HD11 LEU 18 HD11 LEU 18 0.291 4.544 -0.115
147 HD12 LEU 18 HD12 LEU 18 -1.210 4.282 0.772
148 HD13 LEU 18 HD13 LEU 18 -0.648 5.922 0.456
149 HD21 LEU 18 HD21 LEU 18 -0.259 6.432 -2.186
150 HD22 LEU 18 HD22 LEU 18 -1.089 5.371 -3.324
151 HD23 LEU 18 HD23 LEU 18 0.310 4.780 -2.426
152 H LEU 19 HN LEU 19 -3.468 0.902 -1.792
153 HA LEU 19 HA LEU 19 -5.766 1.494 -3.422
154 HB2 LEU 19 HB2 LEU 19 -3.907 -0.619 -2.972
155 HB3 LEU 19 HB1 LEU 19 -5.509 -1.310 -2.758
156 HG LEU 19 HG LEU 19 -5.711 0.353 -5.026
157 HD11 LEU 19 HD11 LEU 19 -3.311 0.455 -5.253
158 HD12 LEU 19 HD12 LEU 19 -3.913 -0.668 -6.472
159 HD13 LEU 19 HD13 LEU 19 -3.162 -1.283 -5.000
160 HD21 LEU 19 HD21 LEU 19 -5.934 -1.859 -6.207
161 HD22 LEU 19 HD22 LEU 19 -6.917 -1.740 -4.749
162 HD23 LEU 19 HD23 LEU 19 -5.408 -2.654 -4.723
163 H LEU 20 HN LEU 20 -5.330 0.001 -0.250
164 HA LEU 20 HA LEU 20 -8.103 -0.672 0.233
165 HB2 LEU 20 HB2 LEU 20 -5.554 -0.911 1.499
166 HB3 LEU 20 HB1 LEU 20 -6.611 -0.099 2.644
167 HG LEU 20 HG LEU 20 -6.708 -2.539 2.929
168 HD11 LEU 20 HD11 LEU 20 -8.730 -1.446 3.528
169 HD12 LEU 20 HD12 LEU 20 -9.219 -2.819 2.535
170 HD13 LEU 20 HD13 LEU 20 -9.190 -1.198 1.844
171 HD21 LEU 20 HD21 LEU 20 -7.229 -4.037 1.220
172 HD22 LEU 20 HD22 LEU 20 -6.284 -2.835 0.342
173 HD23 LEU 20 HD23 LEU 20 -8.044 -2.810 0.252
174 H LEU 21 HN LEU 21 -6.058 2.139 1.054
175 HA LEU 21 HA LEU 21 -7.965 3.628 2.570
176 HB2 LEU 21 HB2 LEU 21 -5.392 3.897 2.143
177 HB3 LEU 21 HB1 LEU 21 -5.891 4.848 0.752
178 HG LEU 21 HG LEU 21 -5.405 6.190 2.824
179 HD11 LEU 21 HD11 LEU 21 -6.992 7.760 2.295
180 HD12 LEU 21 HD12 LEU 21 -8.308 6.585 2.267
181 HD13 LEU 21 HD13 LEU 21 -7.190 6.690 0.907
182 HD21 LEU 21 HD21 LEU 21 -8.015 5.044 3.854
183 HD22 LEU 21 HD22 LEU 21 -6.909 6.130 4.694
184 HD23 LEU 21 HD23 LEU 21 -6.436 4.460 4.381
185 H ALA 22 HN ALA 22 -7.331 3.427 -0.891
186 HA ALA 22 HA ALA 22 -9.509 5.353 -1.515
187 HB1 ALA 22 HB1 ALA 22 -8.569 5.101 -3.819
188 HB2 ALA 22 HB2 ALA 22 -7.431 3.907 -3.193
189 HB3 ALA 22 HB3 ALA 22 -7.347 5.580 -2.640
190 H LEU 23 HN LEU 23 -10.269 2.796 -0.337
191 HA LEU 23 HA LEU 23 -11.782 1.571 -2.619
192 HB2 LEU 23 HB2 LEU 23 -9.702 0.506 -1.161
193 HB3 LEU 23 HB1 LEU 23 -11.126 -0.170 -0.392
194 HG LEU 23 HG LEU 23 -10.346 -1.655 -2.188
195 HD11 LEU 23 HD11 LEU 23 -12.836 -1.273 -1.726
196 HD12 LEU 23 HD12 LEU 23 -12.427 -1.983 -3.287
197 HD13 LEU 23 HD13 LEU 23 -12.843 -0.273 -3.179
198 HD21 LEU 23 HD21 LEU 23 -11.058 0.337 -4.296
199 HD22 LEU 23 HD22 LEU 23 -9.864 -0.960 -4.333
200 HD23 LEU 23 HD23 LEU 23 -9.507 0.543 -3.482
201 HA PRO 24 HA PRO 24 -14.555 3.099 0.781
202 HB2 PRO 24 HB2 PRO 24 -16.286 4.366 -0.925
203 HB3 PRO 24 HB1 PRO 24 -14.842 5.109 -0.210
204 HG2 PRO 24 HG2 PRO 24 -15.225 3.995 -2.936
205 HG3 PRO 24 HG1 PRO 24 -14.319 5.420 -2.410
206 HD2 PRO 24 HD2 PRO 24 -13.117 3.034 -3.011
207 HD3 PRO 24 HD1 PRO 24 -12.439 4.195 -1.860
208 HA PRO 25 HA PRO 25 -18.068 0.524 -1.292
209 HB2 PRO 25 HB2 PRO 25 -17.364 -1.166 -3.319
210 HB3 PRO 25 HB1 PRO 25 -17.955 0.484 -3.606
211 HG2 PRO 25 HG2 PRO 25 -15.159 -0.540 -3.595
212 HG3 PRO 25 HG1 PRO 25 -15.936 0.615 -4.694
213 HD2 PRO 25 HD2 PRO 25 -14.314 1.402 -2.695
214 HD3 PRO 25 HD1 PRO 25 -15.693 2.371 -3.254
215 H ARG 26 HN ARG 26 -18.409 -2.001 -1.206
216 HA ARG 26 HA ARG 26 -16.766 -3.096 0.923
217 HB2 ARG 26 HB2 ARG 26 -19.277 -3.603 -0.348
218 HB3 ARG 26 HB1 ARG 26 -18.350 -5.101 -0.402
219 HG2 ARG 26 HG2 ARG 26 -17.835 -4.652 2.090
220 HG3 ARG 26 HG1 ARG 26 -19.156 -3.485 2.015
221 HD2 ARG 26 HD2 ARG 26 -20.203 -5.498 2.726
222 HD3 ARG 26 HD1 ARG 26 -20.546 -5.436 0.987
223 HE ARG 26 HE ARG 26 -18.037 -6.812 1.676
224 HH11 ARG 26 HH11 ARG 26 -19.699 -7.353 -0.788
225 HH12 ARG 26 HH12 ARG 26 -20.413 -8.882 -0.404
226 HH21 ARG 26 HH21 ARG 26 -19.705 -8.647 2.999
227 HH22 ARG 26 HH22 ARG 26 -20.419 -9.619 1.758
228 H ALA 27 HN ALA 27 -17.414 -4.564 -2.288
229 HA ALA 27 HA ALA 27 -14.574 -4.934 -2.898
230 HB1 ALA 27 HB1 ALA 27 -16.247 -7.376 -2.254
231 HB2 ALA 27 HB2 ALA 27 -15.158 -6.619 -1.090
232 HB3 ALA 27 HB3 ALA 27 -14.515 -7.317 -2.577
233 H TYR 28 HN TYR 28 -16.987 -3.869 -4.284
234 HA TYR 28 HA TYR 28 -16.687 -5.329 -6.813
235 HB2 TYR 28 HB2 TYR 28 -19.020 -5.975 -7.010
236 HB3 TYR 28 HB1 TYR 28 -18.374 -6.629 -5.512
237 HD1 TYR 28 HD1 TYR 28 -18.919 -5.491 -3.322
238 HD2 TYR 28 HD2 TYR 28 -20.805 -4.394 -7.023
239 HE1 TYR 28 HE1 TYR 28 -20.711 -4.328 -2.065
240 HE2 TYR 28 HE2 TYR 28 -22.596 -3.232 -5.767
241 HH TYR 28 HH TYR 28 -23.299 -3.716 -2.696
242 H ALA 29 HN ALA 29 -18.501 -2.749 -5.091
243 HA ALA 29 HA ALA 29 -19.116 -0.603 -5.733
244 HB1 ALA 29 HB1 ALA 29 -17.523 0.548 -7.065
245 HB2 ALA 29 HB2 ALA 29 -17.101 -0.908 -7.965
246 HB3 ALA 29 HB3 ALA 29 -16.603 -0.737 -6.283
Start of MODEL 6
1 H1 ARG 1 HT1 ARG 1 18.006 4.158 12.691
2 H2 ARG 1 HT2 ARG 1 16.600 3.260 13.022
3 H3 ARG 1 HT3 ARG 1 17.248 3.285 11.453
4 HA ARG 1 HA ARG 1 19.232 2.114 12.216
5 HB2 ARG 1 HB2 ARG 1 18.171 3.080 14.697
6 HB3 ARG 1 HB1 ARG 1 18.275 1.325 14.798
7 HG2 ARG 1 HG2 ARG 1 20.620 2.667 13.578
8 HG3 ARG 1 HG1 ARG 1 20.372 2.981 15.294
9 HD2 ARG 1 HD2 ARG 1 20.714 0.763 15.898
10 HD3 ARG 1 HD1 ARG 1 20.178 0.143 14.324
11 HE ARG 1 HE ARG 1 22.315 0.878 13.361
12 HH11 ARG 1 HH21 ARG 1 23.306 -0.944 15.425
13 HH12 ARG 1 HH22 ARG 1 24.430 0.023 16.318
14 HH21 ARG 1 HH11 ARG 1 23.192 3.043 15.092
15 HH22 ARG 1 HH12 ARG 1 24.365 2.304 16.128
16 H LEU 2 HN LEU 2 19.219 -0.168 12.052
17 HA LEU 2 HA LEU 2 18.397 -2.305 11.602
18 HB2 LEU 2 HB2 LEU 2 16.078 -1.305 13.286
19 HB3 LEU 2 HB1 LEU 2 16.381 -2.987 12.867
20 HG LEU 2 HG LEU 2 18.811 -1.946 13.927
21 HD11 LEU 2 HD11 LEU 2 16.733 -1.662 16.045
22 HD12 LEU 2 HD12 LEU 2 16.909 -0.323 14.912
23 HD13 LEU 2 HD13 LEU 2 18.288 -0.849 15.878
24 HD21 LEU 2 HD21 LEU 2 16.728 -3.815 15.107
25 HD22 LEU 2 HD22 LEU 2 18.398 -3.674 15.657
26 HD23 LEU 2 HD23 LEU 2 18.051 -4.288 14.041
27 H VAL 3 HN VAL 3 16.399 -3.470 10.569
28 HA VAL 3 HA VAL 3 14.945 -1.625 8.718
29 HB VAL 3 HB VAL 3 15.406 -3.414 6.941
30 HG11 VAL 3 HG11 VAL 3 17.496 -2.412 6.318
31 HG12 VAL 3 HG12 VAL 3 17.845 -1.964 7.987
32 HG13 VAL 3 HG13 VAL 3 16.535 -1.168 7.116
33 HG21 VAL 3 HG21 VAL 3 17.056 -5.031 7.262
34 HG22 VAL 3 HG22 VAL 3 16.317 -5.001 8.863
35 HG23 VAL 3 HG23 VAL 3 17.827 -4.138 8.573
36 HA PRO 4 HA PRO 4 11.575 -4.183 10.058
37 HB2 PRO 4 HB2 PRO 4 9.665 -3.245 8.346
38 HB3 PRO 4 HB1 PRO 4 10.215 -2.349 9.776
39 HG2 PRO 4 HG2 PRO 4 10.922 -1.963 6.923
40 HG3 PRO 4 HG1 PRO 4 10.707 -0.768 8.209
41 HD2 PRO 4 HD2 PRO 4 13.143 -1.623 7.292
42 HD3 PRO 4 HD1 PRO 4 12.862 -0.936 8.907
43 H GLY 5 HN GLY 5 11.912 -3.796 6.540
44 HA2 GLY 5 HA2 GLY 5 11.904 -6.742 6.191
45 HA3 GLY 5 HA1 GLY 5 10.666 -5.820 5.345
46 H ALA 6 HN ALA 6 14.002 -4.871 5.943
47 HA ALA 6 HA ALA 6 15.685 -4.103 4.490
48 HB1 ALA 6 HB1 ALA 6 16.237 -5.789 2.792
49 HB2 ALA 6 HB2 ALA 6 14.626 -6.488 2.943
50 HB3 ALA 6 HB3 ALA 6 15.754 -6.573 4.296
51 H ALA 7 HN ALA 7 13.255 -2.663 4.140
52 HA ALA 7 HA ALA 7 12.128 -1.237 2.653
53 HB1 ALA 7 HB1 ALA 7 14.914 -1.238 2.182
54 HB2 ALA 7 HB2 ALA 7 13.763 0.029 1.761
55 HB3 ALA 7 HB3 ALA 7 14.158 -1.226 0.588
56 H TYR 8 HN TYR 8 11.737 -4.194 2.258
57 HA TYR 8 HA TYR 8 11.193 -4.296 -0.677
58 HB2 TYR 8 HB2 TYR 8 12.367 -6.078 1.196
59 HB3 TYR 8 HB1 TYR 8 10.825 -6.791 0.725
60 HD1 TYR 8 HD1 TYR 8 14.118 -5.630 -0.471
61 HD2 TYR 8 HD2 TYR 8 10.402 -7.486 -1.568
62 HE1 TYR 8 HE1 TYR 8 15.104 -6.323 -2.639
63 HE2 TYR 8 HE2 TYR 8 11.389 -8.179 -3.734
64 HH TYR 8 HH TYR 8 14.251 -8.550 -4.415
65 H ALA 9 HN ALA 9 9.756 -5.279 2.421
66 HA ALA 9 HA ALA 9 7.095 -5.698 1.417
67 HB1 ALA 9 HB1 ALA 9 6.511 -5.839 3.764
68 HB2 ALA 9 HB2 ALA 9 7.951 -4.930 4.220
69 HB3 ALA 9 HB3 ALA 9 8.108 -6.563 3.570
70 H LEU 10 HN LEU 10 8.729 -2.910 2.818
71 HA LEU 10 HA LEU 10 6.495 -1.124 3.067
72 HB2 LEU 10 HB2 LEU 10 9.164 -1.120 3.686
73 HB3 LEU 10 HB1 LEU 10 9.154 -0.025 2.311
74 HG LEU 10 HG LEU 10 7.314 0.252 4.706
75 HD11 LEU 10 HD11 LEU 10 9.835 1.795 4.017
76 HD12 LEU 10 HD12 LEU 10 9.712 0.581 5.291
77 HD13 LEU 10 HD13 LEU 10 8.785 2.076 5.407
78 HD21 LEU 10 HD21 LEU 10 6.308 1.366 2.873
79 HD22 LEU 10 HD22 LEU 10 7.862 1.884 2.221
80 HD23 LEU 10 HD23 LEU 10 7.220 2.643 3.678
81 H TYR 11 HN TYR 11 8.901 -1.546 0.451
82 HA TYR 11 HA TYR 11 7.712 0.372 -1.346
83 HB2 TYR 11 HB2 TYR 11 9.842 -1.688 -1.371
84 HB3 TYR 11 HB1 TYR 11 9.148 -1.305 -2.946
85 HD1 TYR 11 HD1 TYR 11 11.025 0.027 -0.065
86 HD2 TYR 11 HD2 TYR 11 9.359 0.919 -3.923
87 HE1 TYR 11 HE1 TYR 11 12.340 2.128 -0.147
88 HE2 TYR 11 HE2 TYR 11 10.673 3.018 -4.004
89 HH TYR 11 HH TYR 11 11.733 4.609 -1.916
90 H GLY 12 HN GLY 12 7.262 -3.082 -0.848
91 HA2 GLY 12 HA2 GLY 12 5.603 -3.486 -3.202
92 HA3 GLY 12 HA1 GLY 12 5.832 -4.637 -1.888
93 H VAL 13 HN VAL 13 4.983 -2.603 0.168
94 HA VAL 13 HA VAL 13 2.101 -3.094 -0.023
95 HB VAL 13 HB VAL 13 3.708 -3.294 1.994
96 HG11 VAL 13 HG11 VAL 13 4.514 -1.451 3.015
97 HG12 VAL 13 HG12 VAL 13 2.984 -0.589 2.858
98 HG13 VAL 13 HG13 VAL 13 4.128 -0.602 1.519
99 HG21 VAL 13 HG21 VAL 13 1.908 -2.864 3.545
100 HG22 VAL 13 HG22 VAL 13 1.214 -3.508 2.057
101 HG23 VAL 13 HG23 VAL 13 1.120 -1.780 2.399
102 H TRP 14 HN TRP 14 3.971 -0.637 -1.297
103 HA TRP 14 HA TRP 14 2.636 1.769 -0.625
104 HB2 TRP 14 HB2 TRP 14 4.768 1.568 -1.860
105 HB3 TRP 14 HB1 TRP 14 3.916 0.912 -3.237
106 HD1 TRP 14 HD1 TRP 14 4.493 2.850 -4.861
107 HE1 TRP 14 HE1 TRP 14 3.730 5.301 -5.047
108 HE3 TRP 14 HE3 TRP 14 2.261 3.445 -0.295
109 HZ2 TRP 14 HZ2 TRP 14 2.358 7.256 -3.480
110 HZ3 TRP 14 HZ3 TRP 14 1.238 5.606 0.322
111 HH2 TRP 14 HH2 TRP 14 1.282 7.514 -1.258
112 HA PRO 15 HA PRO 15 -0.356 1.080 -4.331
113 HB2 PRO 15 HB2 PRO 15 -0.516 -1.422 -5.427
114 HB3 PRO 15 HB1 PRO 15 0.586 -0.166 -6.026
115 HG2 PRO 15 HG2 PRO 15 1.158 -2.477 -4.243
116 HG3 PRO 15 HG1 PRO 15 2.123 -1.808 -5.569
117 HD2 PRO 15 HD2 PRO 15 2.672 -1.317 -2.972
118 HD3 PRO 15 HD1 PRO 15 3.026 -0.147 -4.259
119 H LEU 16 HN LEU 16 0.166 -1.474 -1.941
120 HA LEU 16 HA LEU 16 -2.528 -2.480 -1.801
121 HB2 LEU 16 HB2 LEU 16 -0.027 -2.924 -0.558
122 HB3 LEU 16 HB1 LEU 16 -1.120 -2.471 0.746
123 HG LEU 16 HG LEU 16 -2.593 -4.245 -0.880
124 HD11 LEU 16 HD11 LEU 16 -1.035 -6.267 -0.715
125 HD12 LEU 16 HD12 LEU 16 0.278 -5.111 -0.488
126 HD13 LEU 16 HD13 LEU 16 -0.660 -5.099 -1.981
127 HD21 LEU 16 HD21 LEU 16 -2.328 -5.748 1.130
128 HD22 LEU 16 HD22 LEU 16 -2.815 -4.101 1.533
129 HD23 LEU 16 HD23 LEU 16 -1.141 -4.608 1.762
130 H LEU 17 HN LEU 17 -0.837 0.072 -0.009
131 HA LEU 17 HA LEU 17 -3.090 0.870 1.616
132 HB2 LEU 17 HB2 LEU 17 -0.381 1.862 0.910
133 HB3 LEU 17 HB1 LEU 17 -1.525 3.114 1.384
134 HG LEU 17 HG LEU 17 -1.937 1.070 3.252
135 HD11 LEU 17 HD11 LEU 17 1.027 1.496 2.766
136 HD12 LEU 17 HD12 LEU 17 0.147 -0.010 2.507
137 HD13 LEU 17 HD13 LEU 17 0.327 0.638 4.138
138 HD21 LEU 17 HD21 LEU 17 -1.818 3.637 3.463
139 HD22 LEU 17 HD22 LEU 17 -0.078 3.424 3.658
140 HD23 LEU 17 HD23 LEU 17 -1.191 2.699 4.817
141 H LEU 18 HN LEU 18 -1.910 1.765 -1.569
142 HA LEU 18 HA LEU 18 -3.704 3.972 -2.081
143 HB2 LEU 18 HB2 LEU 18 -1.756 2.266 -3.495
144 HB3 LEU 18 HB1 LEU 18 -3.092 2.764 -4.526
145 HG LEU 18 HG LEU 18 -2.685 5.140 -3.670
146 HD11 LEU 18 HD11 LEU 18 -0.736 5.657 -2.503
147 HD12 LEU 18 HD12 LEU 18 0.085 4.183 -3.013
148 HD13 LEU 18 HD13 LEU 18 -1.168 4.111 -1.775
149 HD21 LEU 18 HD21 LEU 18 -1.986 4.334 -5.919
150 HD22 LEU 18 HD22 LEU 18 -0.452 3.795 -5.232
151 HD23 LEU 18 HD23 LEU 18 -0.850 5.512 -5.262
152 H LEU 19 HN LEU 19 -3.814 0.453 -2.664
153 HA LEU 19 HA LEU 19 -6.379 0.358 -3.977
154 HB2 LEU 19 HB2 LEU 19 -4.286 -1.384 -3.248
155 HB3 LEU 19 HB1 LEU 19 -5.689 -1.986 -2.379
156 HG LEU 19 HG LEU 19 -6.750 -1.461 -4.868
157 HD11 LEU 19 HD11 LEU 19 -5.055 -2.699 -6.374
158 HD12 LEU 19 HD12 LEU 19 -3.859 -2.296 -5.142
159 HD13 LEU 19 HD13 LEU 19 -4.714 -1.010 -5.994
160 HD21 LEU 19 HD21 LEU 19 -6.481 -3.980 -5.188
161 HD22 LEU 19 HD22 LEU 19 -7.226 -3.485 -3.668
162 HD23 LEU 19 HD23 LEU 19 -5.532 -3.980 -3.701
163 H LEU 20 HN LEU 20 -5.297 0.101 -0.632
164 HA LEU 20 HA LEU 20 -7.833 -0.486 0.601
165 HB2 LEU 20 HB2 LEU 20 -5.086 0.199 1.334
166 HB3 LEU 20 HB1 LEU 20 -6.237 0.960 2.418
167 HG LEU 20 HG LEU 20 -5.593 -1.225 3.286
168 HD11 LEU 20 HD11 LEU 20 -8.400 -1.423 2.169
169 HD12 LEU 20 HD12 LEU 20 -7.962 -0.411 3.544
170 HD13 LEU 20 HD13 LEU 20 -7.780 -2.160 3.646
171 HD21 LEU 20 HD21 LEU 20 -4.947 -2.617 1.563
172 HD22 LEU 20 HD22 LEU 20 -6.237 -2.073 0.491
173 HD23 LEU 20 HD23 LEU 20 -6.591 -3.210 1.791
174 H LEU 21 HN LEU 21 -6.079 2.596 0.052
175 HA LEU 21 HA LEU 21 -8.063 4.314 1.219
176 HB2 LEU 21 HB2 LEU 21 -5.535 4.629 0.385
177 HB3 LEU 21 HB1 LEU 21 -6.357 5.233 -1.052
178 HG LEU 21 HG LEU 21 -7.773 6.615 0.691
179 HD11 LEU 21 HD11 LEU 21 -6.663 7.139 2.729
180 HD12 LEU 21 HD12 LEU 21 -5.170 6.357 2.208
181 HD13 LEU 21 HD13 LEU 21 -6.584 5.382 2.605
182 HD21 LEU 21 HD21 LEU 21 -4.907 7.228 -0.094
183 HD22 LEU 21 HD22 LEU 21 -6.020 8.423 0.572
184 HD23 LEU 21 HD23 LEU 21 -6.366 7.665 -0.982
185 H ALA 22 HN ALA 22 -7.757 2.842 -1.937
186 HA ALA 22 HA ALA 22 -9.988 4.446 -3.068
187 HB1 ALA 22 HB1 ALA 22 -9.298 3.370 -5.158
188 HB2 ALA 22 HB2 ALA 22 -8.230 2.282 -4.270
189 HB3 ALA 22 HB3 ALA 22 -7.880 4.009 -4.328
190 H LEU 23 HN LEU 23 -10.471 2.446 -0.862
191 HA LEU 23 HA LEU 23 -12.467 0.738 -2.295
192 HB2 LEU 23 HB2 LEU 23 -10.147 -0.229 -1.562
193 HB3 LEU 23 HB1 LEU 23 -10.907 -0.270 0.024
194 HG LEU 23 HG LEU 23 -12.800 -1.292 -1.841
195 HD11 LEU 23 HD11 LEU 23 -11.226 -1.915 -3.448
196 HD12 LEU 23 HD12 LEU 23 -11.322 -3.369 -2.454
197 HD13 LEU 23 HD13 LEU 23 -9.977 -2.245 -2.246
198 HD21 LEU 23 HD21 LEU 23 -12.592 -1.861 0.559
199 HD22 LEU 23 HD22 LEU 23 -11.075 -2.697 0.224
200 HD23 LEU 23 HD23 LEU 23 -12.587 -3.310 -0.446
201 HA PRO 24 HA PRO 24 -14.067 3.137 1.395
202 HB2 PRO 24 HB2 PRO 24 -15.986 4.504 0.001
203 HB3 PRO 24 HB1 PRO 24 -14.325 5.066 0.255
204 HG2 PRO 24 HG2 PRO 24 -15.535 3.821 -2.146
205 HG3 PRO 24 HG1 PRO 24 -14.316 5.095 -2.021
206 HD2 PRO 24 HD2 PRO 24 -13.712 2.469 -2.586
207 HD3 PRO 24 HD1 PRO 24 -12.578 3.601 -1.842
208 HA PRO 25 HA PRO 25 -18.314 1.024 0.571
209 HB2 PRO 25 HB2 PRO 25 -18.436 -0.902 -1.355
210 HB3 PRO 25 HB1 PRO 25 -18.841 0.798 -1.669
211 HG2 PRO 25 HG2 PRO 25 -16.327 -0.679 -2.266
212 HG3 PRO 25 HG1 PRO 25 -17.195 0.518 -3.244
213 HD2 PRO 25 HD2 PRO 25 -14.992 1.135 -1.816
214 HD3 PRO 25 HD1 PRO 25 -16.305 2.292 -2.120
215 H ARG 26 HN ARG 26 -18.837 -0.830 1.780
216 HA ARG 26 HA ARG 26 -16.607 -2.779 2.279
217 HB2 ARG 26 HB2 ARG 26 -17.340 -2.822 4.574
218 HB3 ARG 26 HB1 ARG 26 -17.155 -1.142 4.083
219 HG2 ARG 26 HG2 ARG 26 -19.799 -1.674 3.438
220 HG3 ARG 26 HG1 ARG 26 -19.567 -2.591 4.925
221 HD2 ARG 26 HD2 ARG 26 -18.751 -0.597 6.083
222 HD3 ARG 26 HD1 ARG 26 -18.872 0.348 4.586
223 HE ARG 26 HE ARG 26 -21.195 -0.751 6.101
224 HH11 ARG 26 HH11 ARG 26 -20.375 2.194 5.329
225 HH12 ARG 26 HH12 ARG 26 -21.609 2.541 4.167
226 HH21 ARG 26 HH21 ARG 26 -22.585 -0.788 3.829
227 HH22 ARG 26 HH22 ARG 26 -22.874 0.840 3.314
228 H ALA 27 HN ALA 27 -19.720 -2.642 0.927
229 HA ALA 27 HA ALA 27 -20.391 -5.421 1.799
230 HB1 ALA 27 HB1 ALA 27 -22.052 -3.291 0.418
231 HB2 ALA 27 HB2 ALA 27 -22.026 -3.582 2.158
232 HB3 ALA 27 HB3 ALA 27 -22.650 -4.819 1.067
233 H TYR 28 HN TYR 28 -18.293 -5.315 -0.017
234 HA TYR 28 HA TYR 28 -19.547 -6.413 -2.507
235 HB2 TYR 28 HB2 TYR 28 -17.495 -4.231 -2.180
236 HB3 TYR 28 HB1 TYR 28 -17.541 -5.198 -3.652
237 HD1 TYR 28 HD2 TYR 28 -19.554 -5.190 -5.109
238 HD2 TYR 28 HD1 TYR 28 -19.237 -2.638 -1.668
239 HE1 TYR 28 HE2 TYR 28 -21.442 -3.821 -5.949
240 HE2 TYR 28 HE1 TYR 28 -21.124 -1.270 -2.509
241 HH TYR 28 HH TYR 28 -22.089 -0.928 -5.194
242 H ALA 29 HN ALA 29 -18.089 -7.574 -0.031
243 HA ALA 29 HA ALA 29 -16.276 -9.360 -1.551
244 HB1 ALA 29 HB1 ALA 29 -15.495 -7.358 0.542
245 HB2 ALA 29 HB2 ALA 29 -14.651 -7.811 -0.939
246 HB3 ALA 29 HB3 ALA 29 -14.616 -8.884 0.460
Start of MODEL 7
1 H1 ARG 1 HT1 ARG 1 23.146 -0.527 -0.711
2 H2 ARG 1 HT2 ARG 1 24.432 -1.150 0.204
3 H3 ARG 1 HT3 ARG 1 23.276 -0.138 0.932
4 HA ARG 1 HA ARG 1 22.693 -2.841 -0.193
5 HB2 ARG 1 HB2 ARG 1 23.359 -1.782 2.556
6 HB3 ARG 1 HB1 ARG 1 22.416 -3.258 2.359
7 HG2 ARG 1 HG2 ARG 1 24.729 -3.309 0.614
8 HG3 ARG 1 HG1 ARG 1 25.223 -3.019 2.283
9 HD2 ARG 1 HD2 ARG 1 23.644 -4.984 2.895
10 HD3 ARG 1 HD1 ARG 1 23.702 -5.380 1.165
11 HE ARG 1 HE ARG 1 25.944 -5.601 3.042
12 HH11 ARG 1 HH11 ARG 1 25.494 -7.633 0.952
13 HH12 ARG 1 HH12 ARG 1 26.682 -7.238 -0.243
14 HH21 ARG 1 HH21 ARG 1 27.235 -4.031 0.999
15 HH22 ARG 1 HH22 ARG 1 27.677 -5.179 -0.217
16 H LEU 2 HN LEU 2 20.497 -3.402 -0.056
17 HA LEU 2 HA LEU 2 18.612 -1.182 0.621
18 HB2 LEU 2 HB2 LEU 2 17.101 -2.305 -0.917
19 HB3 LEU 2 HB1 LEU 2 18.671 -2.137 -1.690
20 HG LEU 2 HG LEU 2 18.666 -4.624 -0.272
21 HD11 LEU 2 HD11 LEU 2 16.162 -4.373 -0.422
22 HD12 LEU 2 HD12 LEU 2 16.798 -5.785 -1.265
23 HD13 LEU 2 HD13 LEU 2 16.326 -4.353 -2.179
24 HD21 LEU 2 HD21 LEU 2 18.443 -4.054 -3.247
25 HD22 LEU 2 HD22 LEU 2 19.068 -5.528 -2.508
26 HD23 LEU 2 HD23 LEU 2 19.951 -4.011 -2.331
27 H VAL 3 HN VAL 3 19.868 -3.094 2.598
28 HA VAL 3 HA VAL 3 19.338 -4.360 4.445
29 HB VAL 3 HB VAL 3 17.594 -3.500 5.712
30 HG11 VAL 3 HG11 VAL 3 19.097 -1.710 4.681
31 HG12 VAL 3 HG12 VAL 3 17.584 -1.175 5.413
32 HG13 VAL 3 HG13 VAL 3 17.717 -1.306 3.659
33 HG21 VAL 3 HG21 VAL 3 15.427 -3.108 5.060
34 HG22 VAL 3 HG22 VAL 3 15.875 -4.211 3.761
35 HG23 VAL 3 HG23 VAL 3 15.901 -2.472 3.489
36 HA PRO 4 HA PRO 4 17.292 -8.118 3.481
37 HB2 PRO 4 HB2 PRO 4 15.793 -8.832 5.656
38 HB3 PRO 4 HB1 PRO 4 17.566 -8.852 5.644
39 HG2 PRO 4 HG2 PRO 4 15.711 -6.889 6.845
40 HG3 PRO 4 HG1 PRO 4 17.300 -7.438 7.399
41 HD2 PRO 4 HD2 PRO 4 16.800 -5.050 6.122
42 HD3 PRO 4 HD1 PRO 4 18.388 -5.839 6.229
43 H GLY 5 HN GLY 5 14.755 -9.226 4.088
44 HA2 GLY 5 HA2 GLY 5 13.057 -8.217 2.095
45 HA3 GLY 5 HA1 GLY 5 12.540 -9.269 3.401
46 H ALA 6 HN ALA 6 13.462 -6.945 5.313
47 HA ALA 6 HA ALA 6 10.968 -5.834 5.936
48 HB1 ALA 6 HB1 ALA 6 12.861 -5.735 7.428
49 HB2 ALA 6 HB2 ALA 6 12.373 -4.077 7.081
50 HB3 ALA 6 HB3 ALA 6 13.780 -4.769 6.272
51 H ALA 7 HN ALA 7 13.421 -4.561 3.724
52 HA ALA 7 HA ALA 7 12.053 -2.087 3.099
53 HB1 ALA 7 HB1 ALA 7 14.369 -3.663 2.079
54 HB2 ALA 7 HB2 ALA 7 14.288 -1.966 2.550
55 HB3 ALA 7 HB3 ALA 7 13.670 -2.473 0.981
56 H TYR 8 HN TYR 8 12.150 -5.283 1.576
57 HA TYR 8 HA TYR 8 10.657 -4.722 -0.779
58 HB2 TYR 8 HB2 TYR 8 11.075 -7.162 0.943
59 HB3 TYR 8 HB1 TYR 8 10.038 -7.237 -0.479
60 HD1 TYR 8 HD1 TYR 8 10.969 -6.779 -2.744
61 HD2 TYR 8 HD2 TYR 8 13.472 -6.983 0.742
62 HE1 TYR 8 HE1 TYR 8 12.968 -7.012 -4.192
63 HE2 TYR 8 HE2 TYR 8 15.468 -7.216 -0.705
64 HH TYR 8 HH TYR 8 15.860 -6.393 -3.450
65 H ALA 9 HN ALA 9 9.596 -5.386 2.509
66 HA ALA 9 HA ALA 9 6.756 -5.570 1.873
67 HB1 ALA 9 HB1 ALA 9 7.723 -6.688 3.821
68 HB2 ALA 9 HB2 ALA 9 6.567 -5.474 4.371
69 HB3 ALA 9 HB3 ALA 9 8.298 -5.142 4.449
70 H LEU 10 HN LEU 10 8.871 -3.100 3.282
71 HA LEU 10 HA LEU 10 6.890 -1.044 3.650
72 HB2 LEU 10 HB2 LEU 10 9.618 -1.456 4.145
73 HB3 LEU 10 HB1 LEU 10 9.583 -0.089 3.038
74 HG LEU 10 HG LEU 10 7.876 -0.256 5.537
75 HD11 LEU 10 HD11 LEU 10 10.241 -0.232 6.171
76 HD12 LEU 10 HD12 LEU 10 9.515 1.339 6.509
77 HD13 LEU 10 HD13 LEU 10 10.538 1.130 5.088
78 HD21 LEU 10 HD21 LEU 10 8.656 2.084 3.762
79 HD22 LEU 10 HD22 LEU 10 7.580 2.150 5.159
80 HD23 LEU 10 HD23 LEU 10 7.095 1.264 3.714
81 H TYR 11 HN TYR 11 9.179 -1.715 0.989
82 HA TYR 11 HA TYR 11 8.104 0.465 -0.676
83 HB2 TYR 11 HB2 TYR 11 10.265 -1.623 -0.891
84 HB3 TYR 11 HB1 TYR 11 9.807 -0.670 -2.297
85 HD1 TYR 11 HD2 TYR 11 10.088 1.795 -2.303
86 HD2 TYR 11 HD1 TYR 11 11.429 -0.622 0.986
87 HE1 TYR 11 HE2 TYR 11 11.461 3.686 -1.470
88 HE2 TYR 11 HE1 TYR 11 12.798 1.266 1.818
89 HH TYR 11 HH TYR 11 13.740 3.749 0.111
90 H GLY 12 HN GLY 12 6.674 -2.348 0.076
91 HA2 GLY 12 HA2 GLY 12 5.756 -2.911 -2.707
92 HA3 GLY 12 HA1 GLY 12 5.830 -4.133 -1.443
93 H VAL 13 HN VAL 13 4.744 -1.541 0.252
94 HA VAL 13 HA VAL 13 1.906 -2.337 -0.159
95 HB VAL 13 HB VAL 13 1.585 -1.335 2.089
96 HG11 VAL 13 HG11 VAL 13 3.549 -3.518 1.555
97 HG12 VAL 13 HG12 VAL 13 1.969 -3.589 2.331
98 HG13 VAL 13 HG13 VAL 13 3.358 -2.967 3.220
99 HG21 VAL 13 HG21 VAL 13 3.686 0.231 1.674
100 HG22 VAL 13 HG22 VAL 13 4.567 -1.114 2.398
101 HG23 VAL 13 HG23 VAL 13 3.287 -0.310 3.304
102 H TRP 14 HN TRP 14 3.840 0.109 -1.294
103 HA TRP 14 HA TRP 14 2.375 2.502 -0.814
104 HB2 TRP 14 HB2 TRP 14 4.656 2.345 -1.771
105 HB3 TRP 14 HB1 TRP 14 3.996 1.647 -3.232
106 HD1 TRP 14 HD1 TRP 14 4.723 3.586 -4.796
107 HE1 TRP 14 HE1 TRP 14 3.908 6.005 -5.116
108 HE3 TRP 14 HE3 TRP 14 1.901 4.156 -0.563
109 HZ2 TRP 14 HZ2 TRP 14 2.282 7.930 -3.771
110 HZ3 TRP 14 HZ3 TRP 14 0.736 6.286 -0.117
111 HH2 TRP 14 HH2 TRP 14 0.921 8.176 -1.710
112 HA PRO 15 HA PRO 15 -0.102 1.600 -4.833
113 HB2 PRO 15 HB2 PRO 15 -0.036 -0.933 -5.869
114 HB3 PRO 15 HB1 PRO 15 1.088 0.349 -6.363
115 HG2 PRO 15 HG2 PRO 15 1.516 -1.911 -4.481
116 HG3 PRO 15 HG1 PRO 15 2.619 -1.206 -5.674
117 HD2 PRO 15 HD2 PRO 15 2.768 -0.687 -3.018
118 HD3 PRO 15 HD1 PRO 15 3.300 0.463 -4.261
119 H LEU 16 HN LEU 16 0.221 -0.877 -2.331
120 HA LEU 16 HA LEU 16 -2.436 -1.973 -2.478
121 HB2 LEU 16 HB2 LEU 16 -0.113 -2.432 -1.041
122 HB3 LEU 16 HB1 LEU 16 -1.180 -1.766 0.186
123 HG LEU 16 HG LEU 16 -1.406 -4.187 0.158
124 HD11 LEU 16 HD11 LEU 16 -3.856 -3.074 -1.220
125 HD12 LEU 16 HD12 LEU 16 -3.453 -2.693 0.454
126 HD13 LEU 16 HD13 LEU 16 -3.775 -4.360 -0.017
127 HD21 LEU 16 HD21 LEU 16 -0.692 -4.358 -2.300
128 HD22 LEU 16 HD22 LEU 16 -2.370 -3.994 -2.704
129 HD23 LEU 16 HD23 LEU 16 -1.980 -5.446 -1.784
130 H LEU 17 HN LEU 17 -1.020 0.656 -0.575
131 HA LEU 17 HA LEU 17 -3.441 1.435 0.787
132 HB2 LEU 17 HB2 LEU 17 -0.905 2.034 1.173
133 HB3 LEU 17 HB1 LEU 17 -1.227 3.337 0.027
134 HG LEU 17 HG LEU 17 -3.342 3.723 1.601
135 HD11 LEU 17 HD11 LEU 17 -2.602 3.342 3.992
136 HD12 LEU 17 HD12 LEU 17 -1.296 2.340 3.359
137 HD13 LEU 17 HD13 LEU 17 -2.975 1.868 3.099
138 HD21 LEU 17 HD21 LEU 17 -0.644 4.613 2.628
139 HD22 LEU 17 HD22 LEU 17 -2.155 5.519 2.575
140 HD23 LEU 17 HD23 LEU 17 -1.265 5.203 1.087
141 H LEU 18 HN LEU 18 -1.962 2.327 -2.280
142 HA LEU 18 HA LEU 18 -3.767 4.449 -3.027
143 HB2 LEU 18 HB2 LEU 18 -1.625 2.798 -4.187
144 HB3 LEU 18 HB1 LEU 18 -2.869 3.197 -5.366
145 HG LEU 18 HG LEU 18 -2.669 5.612 -4.592
146 HD11 LEU 18 HD11 LEU 18 -0.002 4.755 -3.473
147 HD12 LEU 18 HD12 LEU 18 -1.432 4.838 -2.444
148 HD13 LEU 18 HD13 LEU 18 -0.847 6.288 -3.258
149 HD21 LEU 18 HD21 LEU 18 -1.663 4.951 -6.690
150 HD22 LEU 18 HD22 LEU 18 -0.300 4.202 -5.857
151 HD23 LEU 18 HD23 LEU 18 -0.492 5.955 -5.834
152 H LEU 19 HN LEU 19 -3.728 0.918 -3.520
153 HA LEU 19 HA LEU 19 -6.155 0.732 -5.074
154 HB2 LEU 19 HB2 LEU 19 -4.092 -0.939 -4.177
155 HB3 LEU 19 HB1 LEU 19 -5.516 -1.550 -3.345
156 HG LEU 19 HG LEU 19 -6.650 -1.395 -5.701
157 HD11 LEU 19 HD11 LEU 19 -4.808 -1.963 -7.449
158 HD12 LEU 19 HD12 LEU 19 -3.702 -1.194 -6.310
159 HD13 LEU 19 HD13 LEU 19 -5.038 -0.273 -7.003
160 HD21 LEU 19 HD21 LEU 19 -5.833 -3.458 -4.304
161 HD22 LEU 19 HD22 LEU 19 -4.520 -3.515 -5.480
162 HD23 LEU 19 HD23 LEU 19 -6.193 -3.676 -6.015
163 H LEU 20 HN LEU 20 -5.359 0.494 -1.646
164 HA LEU 20 HA LEU 20 -7.946 -0.107 -0.574
165 HB2 LEU 20 HB2 LEU 20 -5.307 0.886 0.331
166 HB3 LEU 20 HB1 LEU 20 -6.648 1.368 1.362
167 HG LEU 20 HG LEU 20 -6.256 -1.491 0.462
168 HD11 LEU 20 HD11 LEU 20 -5.338 -0.263 3.077
169 HD12 LEU 20 HD12 LEU 20 -4.260 -0.635 1.732
170 HD13 LEU 20 HD13 LEU 20 -5.123 -1.934 2.555
171 HD21 LEU 20 HD21 LEU 20 -8.492 -0.626 1.375
172 HD22 LEU 20 HD22 LEU 20 -7.658 -0.385 2.910
173 HD23 LEU 20 HD23 LEU 20 -7.794 -2.004 2.226
174 H LEU 21 HN LEU 21 -6.297 2.986 -1.258
175 HA LEU 21 HA LEU 21 -8.268 4.776 -0.233
176 HB2 LEU 21 HB2 LEU 21 -5.820 5.104 -1.106
177 HB3 LEU 21 HB1 LEU 21 -6.578 5.293 -2.681
178 HG LEU 21 HG LEU 21 -6.128 7.448 -1.451
179 HD11 LEU 21 HD11 LEU 21 -8.122 6.863 -3.136
180 HD12 LEU 21 HD12 LEU 21 -7.961 8.454 -2.391
181 HD13 LEU 21 HD13 LEU 21 -9.089 7.278 -1.721
182 HD21 LEU 21 HD21 LEU 21 -7.502 8.062 0.436
183 HD22 LEU 21 HD22 LEU 21 -6.749 6.513 0.818
184 HD23 LEU 21 HD23 LEU 21 -8.437 6.573 0.310
185 H ALA 22 HN ALA 22 -7.899 3.182 -3.354
186 HA ALA 22 HA ALA 22 -10.397 4.385 -4.420
187 HB1 ALA 22 HB1 ALA 22 -8.395 2.451 -5.635
188 HB2 ALA 22 HB2 ALA 22 -8.270 4.208 -5.739
189 HB3 ALA 22 HB3 ALA 22 -9.622 3.373 -6.506
190 H LEU 23 HN LEU 23 -10.423 2.401 -2.131
191 HA LEU 23 HA LEU 23 -12.220 0.366 -3.361
192 HB2 LEU 23 HB2 LEU 23 -9.899 -0.513 -2.981
193 HB3 LEU 23 HB1 LEU 23 -10.089 -0.138 -1.271
194 HG LEU 23 HG LEU 23 -12.262 -1.595 -1.460
195 HD11 LEU 23 HD11 LEU 23 -11.985 -1.747 -3.992
196 HD12 LEU 23 HD12 LEU 23 -12.234 -3.280 -3.158
197 HD13 LEU 23 HD13 LEU 23 -10.617 -2.818 -3.688
198 HD21 LEU 23 HD21 LEU 23 -10.319 -2.200 -0.101
199 HD22 LEU 23 HD22 LEU 23 -9.463 -2.771 -1.533
200 HD23 LEU 23 HD23 LEU 23 -10.898 -3.624 -0.964
201 HA PRO 24 HA PRO 24 -14.579 1.731 0.180
202 HB2 PRO 24 HB2 PRO 24 -16.838 0.312 -0.404
203 HB3 PRO 24 HB1 PRO 24 -16.360 1.781 -1.274
204 HG2 PRO 24 HG2 PRO 24 -16.321 -0.997 -2.164
205 HG3 PRO 24 HG1 PRO 24 -16.291 0.494 -3.112
206 HD2 PRO 24 HD2 PRO 24 -14.100 -1.229 -2.449
207 HD3 PRO 24 HD1 PRO 24 -14.068 0.255 -3.423
208 HA PRO 25 HA PRO 25 -13.612 -1.905 2.714
209 HB2 PRO 25 HB2 PRO 25 -13.679 -0.620 5.118
210 HB3 PRO 25 HB1 PRO 25 -12.288 -0.544 4.018
211 HG2 PRO 25 HG2 PRO 25 -14.408 1.463 4.518
212 HG3 PRO 25 HG1 PRO 25 -12.690 1.693 4.158
213 HD2 PRO 25 HD2 PRO 25 -14.719 2.011 2.333
214 HD3 PRO 25 HD1 PRO 25 -13.025 1.668 1.919
215 H ARG 26 HN ARG 26 -14.749 -2.887 4.696
216 HA ARG 26 HA ARG 26 -17.663 -2.188 4.794
217 HB2 ARG 26 HB2 ARG 26 -16.961 -4.151 3.269
218 HB3 ARG 26 HB1 ARG 26 -16.596 -5.017 4.760
219 HG2 ARG 26 HG2 ARG 26 -18.826 -5.625 4.302
220 HG3 ARG 26 HG1 ARG 26 -18.985 -4.343 5.503
221 HD2 ARG 26 HD2 ARG 26 -18.963 -2.883 3.172
222 HD3 ARG 26 HD1 ARG 26 -19.811 -4.359 2.665
223 HE ARG 26 HE ARG 26 -21.353 -4.013 4.613
224 HH11 ARG 26 HH11 ARG 26 -19.899 -2.011 6.192
225 HH12 ARG 26 HH12 ARG 26 -20.638 -0.516 5.727
226 HH21 ARG 26 HH21 ARG 26 -22.079 -1.840 2.841
227 HH22 ARG 26 HH22 ARG 26 -21.889 -0.419 3.808
228 H ALA 27 HN ALA 27 -15.187 -4.295 6.355
229 HA ALA 27 HA ALA 27 -16.064 -3.275 9.016
230 HB1 ALA 27 HB1 ALA 27 -16.098 -6.126 8.006
231 HB2 ALA 27 HB2 ALA 27 -17.413 -5.216 8.750
232 HB3 ALA 27 HB3 ALA 27 -16.050 -5.754 9.730
233 H TYR 28 HN TYR 28 -13.728 -2.491 7.845
234 HA TYR 28 HA TYR 28 -11.490 -2.185 8.353
235 HB2 TYR 28 HB2 TYR 28 -11.248 -2.486 10.557
236 HB3 TYR 28 HB1 TYR 28 -12.565 -3.639 10.589
237 HD1 TYR 28 HD1 TYR 28 -8.898 -3.300 9.960
238 HD2 TYR 28 HD2 TYR 28 -12.137 -5.954 10.927
239 HE1 TYR 28 HE1 TYR 28 -7.276 -5.113 10.434
240 HE2 TYR 28 HE2 TYR 28 -10.514 -7.763 11.398
241 HH TYR 28 HH TYR 28 -7.734 -8.047 10.395
242 H ALA 29 HN ALA 29 -12.456 -5.599 7.931
243 HA ALA 29 HA ALA 29 -10.045 -5.950 6.185
244 HB1 ALA 29 HB1 ALA 29 -9.693 -7.101 8.276
245 HB2 ALA 29 HB2 ALA 29 -10.078 -8.321 7.063
246 HB3 ALA 29 HB3 ALA 29 -11.309 -7.807 8.217
Start of MODEL 8
1 H1 ARG 1 HT1 ARG 1 22.995 2.601 -3.920
2 H2 ARG 1 HT2 ARG 1 22.372 4.172 -4.081
3 H3 ARG 1 HT3 ARG 1 21.449 2.833 -4.577
4 HA ARG 1 HA ARG 1 22.224 3.489 -1.771
5 HB2 ARG 1 HB2 ARG 1 20.460 4.850 -3.096
6 HB3 ARG 1 HB1 ARG 1 19.474 3.389 -3.019
7 HG2 ARG 1 HG2 ARG 1 20.223 3.574 -0.420
8 HG3 ARG 1 HG1 ARG 1 20.224 5.282 -0.854
9 HD2 ARG 1 HD2 ARG 1 17.872 3.679 -1.763
10 HD3 ARG 1 HD1 ARG 1 17.982 4.043 -0.031
11 HE ARG 1 HE ARG 1 18.458 6.325 -1.852
12 HH11 ARG 1 HH21 ARG 1 17.688 6.687 1.005
13 HH12 ARG 1 HH22 ARG 1 16.005 7.070 0.896
14 HH21 ARG 1 HH11 ARG 1 15.691 5.896 -2.372
15 HH22 ARG 1 HH12 ARG 1 14.862 6.617 -1.035
16 H LEU 2 HN LEU 2 21.784 1.845 -0.274
17 HA LEU 2 HA LEU 2 20.738 -0.754 -1.365
18 HB2 LEU 2 HB2 LEU 2 23.227 -0.026 -0.148
19 HB3 LEU 2 HB1 LEU 2 22.374 -1.098 0.961
20 HG LEU 2 HG LEU 2 21.950 -2.608 -1.074
21 HD11 LEU 2 HD11 LEU 2 23.615 -2.351 -2.903
22 HD12 LEU 2 HD12 LEU 2 24.153 -0.836 -2.179
23 HD13 LEU 2 HD13 LEU 2 22.514 -0.976 -2.815
24 HD21 LEU 2 HD21 LEU 2 23.631 -3.036 0.745
25 HD22 LEU 2 HD22 LEU 2 24.837 -2.196 -0.229
26 HD23 LEU 2 HD23 LEU 2 24.114 -3.691 -0.819
27 H VAL 3 HN VAL 3 18.947 -1.537 -0.310
28 HA VAL 3 HA VAL 3 18.334 -0.499 2.431
29 HB VAL 3 HB VAL 3 15.897 -0.608 1.658
30 HG11 VAL 3 HG11 VAL 3 16.016 1.603 0.596
31 HG12 VAL 3 HG12 VAL 3 17.738 1.376 0.292
32 HG13 VAL 3 HG13 VAL 3 17.145 1.500 1.948
33 HG21 VAL 3 HG21 VAL 3 16.424 -1.967 -0.423
34 HG22 VAL 3 HG22 VAL 3 17.163 -0.517 -1.103
35 HG23 VAL 3 HG23 VAL 3 15.443 -0.531 -0.717
36 HA PRO 4 HA PRO 4 17.869 -4.833 3.294
37 HB2 PRO 4 HB2 PRO 4 16.932 -4.596 5.849
38 HB3 PRO 4 HB1 PRO 4 18.625 -4.305 5.408
39 HG2 PRO 4 HG2 PRO 4 16.496 -2.381 6.066
40 HG3 PRO 4 HG1 PRO 4 18.247 -2.258 6.286
41 HD2 PRO 4 HD2 PRO 4 16.741 -1.052 4.264
42 HD3 PRO 4 HD1 PRO 4 18.509 -1.210 4.314
43 H GLY 5 HN GLY 5 15.876 -5.991 4.845
44 HA2 GLY 5 HA2 GLY 5 13.659 -6.315 3.164
45 HA3 GLY 5 HA1 GLY 5 13.649 -6.690 4.882
46 H ALA 6 HN ALA 6 14.219 -3.747 5.488
47 HA ALA 6 HA ALA 6 11.644 -2.811 6.085
48 HB1 ALA 6 HB1 ALA 6 14.199 -1.308 5.470
49 HB2 ALA 6 HB2 ALA 6 13.706 -1.930 7.046
50 HB3 ALA 6 HB3 ALA 6 12.806 -0.612 6.296
51 H ALA 7 HN ALA 7 13.422 -2.536 3.066
52 HA ALA 7 HA ALA 7 11.297 -0.786 1.901
53 HB1 ALA 7 HB1 ALA 7 14.019 -1.543 0.806
54 HB2 ALA 7 HB2 ALA 7 13.741 -0.153 1.857
55 HB3 ALA 7 HB3 ALA 7 12.984 -0.220 0.266
56 H TYR 8 HN TYR 8 11.240 -3.891 2.310
57 HA TYR 8 HA TYR 8 10.813 -4.650 -0.556
58 HB2 TYR 8 HB2 TYR 8 11.723 -6.104 1.914
59 HB3 TYR 8 HB1 TYR 8 10.912 -7.014 0.640
60 HD1 TYR 8 HD1 TYR 8 13.838 -4.898 1.436
61 HD2 TYR 8 HD2 TYR 8 11.973 -7.419 -1.492
62 HE1 TYR 8 HE1 TYR 8 15.945 -4.931 0.132
63 HE2 TYR 8 HE2 TYR 8 14.079 -7.455 -2.800
64 HH TYR 8 HH TYR 8 16.344 -5.421 -2.692
65 H ALA 9 HN ALA 9 9.579 -5.537 2.660
66 HA ALA 9 HA ALA 9 6.971 -6.341 1.779
67 HB1 ALA 9 HB1 ALA 9 6.441 -6.251 4.179
68 HB2 ALA 9 HB2 ALA 9 7.875 -5.266 4.470
69 HB3 ALA 9 HB3 ALA 9 8.047 -6.943 3.949
70 H LEU 10 HN LEU 10 8.247 -3.296 2.998
71 HA LEU 10 HA LEU 10 5.864 -1.728 3.145
72 HB2 LEU 10 HB2 LEU 10 8.628 -1.431 3.510
73 HB3 LEU 10 HB1 LEU 10 8.242 -0.297 2.222
74 HG LEU 10 HG LEU 10 6.596 -0.420 4.749
75 HD11 LEU 10 HD11 LEU 10 8.108 1.728 5.209
76 HD12 LEU 10 HD12 LEU 10 9.276 0.816 4.255
77 HD13 LEU 10 HD13 LEU 10 8.616 0.124 5.736
78 HD21 LEU 10 HD21 LEU 10 7.162 1.887 2.863
79 HD22 LEU 10 HD22 LEU 10 5.881 1.768 4.069
80 HD23 LEU 10 HD23 LEU 10 5.819 0.771 2.616
81 H TYR 11 HN TYR 11 8.209 -2.167 0.486
82 HA TYR 11 HA TYR 11 6.990 -0.440 -1.431
83 HB2 TYR 11 HB2 TYR 11 8.880 -2.771 -1.477
84 HB3 TYR 11 HB1 TYR 11 8.278 -2.129 -3.000
85 HD1 TYR 11 HD2 TYR 11 9.148 -0.310 0.180
86 HD2 TYR 11 HD1 TYR 11 10.094 -0.994 -3.958
87 HE1 TYR 11 HE2 TYR 11 10.836 1.497 0.268
88 HE2 TYR 11 HE1 TYR 11 11.783 0.815 -3.864
89 HH TYR 11 HH TYR 11 11.986 3.061 -2.156
90 H GLY 12 HN GLY 12 6.351 -3.799 -0.591
91 HA2 GLY 12 HA2 GLY 12 4.627 -4.376 -2.848
92 HA3 GLY 12 HA1 GLY 12 4.733 -5.325 -1.364
93 H VAL 13 HN VAL 13 4.093 -3.243 0.486
94 HA VAL 13 HA VAL 13 1.182 -3.210 0.218
95 HB VAL 13 HB VAL 13 3.104 -2.093 2.283
96 HG11 VAL 13 HG11 VAL 13 1.099 -0.874 2.611
97 HG12 VAL 13 HG12 VAL 13 0.971 -2.222 3.740
98 HG13 VAL 13 HG13 VAL 13 0.088 -2.264 2.214
99 HG21 VAL 13 HG21 VAL 13 2.167 -4.089 3.595
100 HG22 VAL 13 HG22 VAL 13 3.256 -4.482 2.266
101 HG23 VAL 13 HG23 VAL 13 1.514 -4.662 2.060
102 H TRP 14 HN TRP 14 3.713 -1.037 -0.686
103 HA TRP 14 HA TRP 14 2.490 1.490 -0.329
104 HB2 TRP 14 HB2 TRP 14 4.858 1.015 -1.017
105 HB3 TRP 14 HB1 TRP 14 4.274 0.620 -2.623
106 HD1 TRP 14 HD1 TRP 14 4.775 2.582 -4.153
107 HE1 TRP 14 HE1 TRP 14 4.499 5.141 -4.023
108 HE3 TRP 14 HE3 TRP 14 3.118 3.048 0.653
109 HZ2 TRP 14 HZ2 TRP 14 3.683 7.126 -2.127
110 HZ3 TRP 14 HZ3 TRP 14 2.600 5.278 1.595
111 HH2 TRP 14 HH2 TRP 14 2.879 7.316 0.214
112 HA PRO 15 HA PRO 15 0.444 1.159 -4.637
113 HB2 PRO 15 HB2 PRO 15 0.402 -1.253 -5.924
114 HB3 PRO 15 HB1 PRO 15 1.698 -0.058 -6.146
115 HG2 PRO 15 HG2 PRO 15 1.669 -2.522 -4.486
116 HG3 PRO 15 HG1 PRO 15 2.979 -1.822 -5.453
117 HD2 PRO 15 HD2 PRO 15 2.821 -1.584 -2.750
118 HD3 PRO 15 HD1 PRO 15 3.625 -0.393 -3.792
119 H LEU 16 HN LEU 16 0.235 -1.763 -2.589
120 HA LEU 16 HA LEU 16 -2.551 -2.321 -3.127
121 HB2 LEU 16 HB2 LEU 16 -0.449 -3.136 -1.175
122 HB3 LEU 16 HB1 LEU 16 -2.115 -3.376 -0.664
123 HG LEU 16 HG LEU 16 -1.246 -5.391 -1.756
124 HD11 LEU 16 HD11 LEU 16 -3.673 -4.424 -2.121
125 HD12 LEU 16 HD12 LEU 16 -3.132 -5.836 -3.027
126 HD13 LEU 16 HD13 LEU 16 -3.126 -4.247 -3.789
127 HD21 LEU 16 HD21 LEU 16 0.406 -4.239 -3.223
128 HD22 LEU 16 HD22 LEU 16 -0.923 -3.645 -4.219
129 HD23 LEU 16 HD23 LEU 16 -0.603 -5.376 -4.117
130 H LEU 17 HN LEU 17 -0.908 -0.593 -0.495
131 HA LEU 17 HA LEU 17 -3.306 0.243 0.869
132 HB2 LEU 17 HB2 LEU 17 -0.970 0.180 1.811
133 HB3 LEU 17 HB1 LEU 17 -0.570 1.560 0.790
134 HG LEU 17 HG LEU 17 -3.011 2.025 2.330
135 HD11 LEU 17 HD11 LEU 17 -0.445 1.716 3.913
136 HD12 LEU 17 HD12 LEU 17 -1.728 0.506 3.904
137 HD13 LEU 17 HD13 LEU 17 -2.045 2.123 4.532
138 HD21 LEU 17 HD21 LEU 17 -0.316 3.428 2.204
139 HD22 LEU 17 HD22 LEU 17 -1.793 4.104 2.891
140 HD23 LEU 17 HD23 LEU 17 -1.700 3.768 1.163
141 H LEU 18 HN LEU 18 -1.360 1.624 -1.727
142 HA LEU 18 HA LEU 18 -2.656 4.191 -1.892
143 HB2 LEU 18 HB2 LEU 18 -0.737 2.574 -3.382
144 HB3 LEU 18 HB1 LEU 18 -1.827 3.405 -4.479
145 HG LEU 18 HG LEU 18 -1.286 5.556 -3.490
146 HD11 LEU 18 HD11 LEU 18 0.652 5.536 -1.750
147 HD12 LEU 18 HD12 LEU 18 0.175 3.863 -1.466
148 HD13 LEU 18 HD13 LEU 18 -0.977 5.167 -1.186
149 HD21 LEU 18 HD21 LEU 18 1.222 3.915 -3.966
150 HD22 LEU 18 HD22 LEU 18 1.116 5.673 -4.044
151 HD23 LEU 18 HD23 LEU 18 0.249 4.687 -5.219
152 H LEU 19 HN LEU 19 -3.364 0.983 -3.285
153 HA LEU 19 HA LEU 19 -5.619 1.875 -4.904
154 HB2 LEU 19 HB2 LEU 19 -4.029 -0.283 -4.914
155 HB3 LEU 19 HB1 LEU 19 -5.312 -0.932 -3.902
156 HG LEU 19 HG LEU 19 -6.035 0.473 -6.460
157 HD11 LEU 19 HD11 LEU 19 -4.297 -1.167 -7.087
158 HD12 LEU 19 HD12 LEU 19 -5.884 -1.671 -7.664
159 HD13 LEU 19 HD13 LEU 19 -5.185 -2.432 -6.236
160 HD21 LEU 19 HD21 LEU 19 -7.214 -1.742 -4.756
161 HD22 LEU 19 HD22 LEU 19 -7.863 -1.295 -6.332
162 HD23 LEU 19 HD23 LEU 19 -7.866 -0.124 -5.015
163 H LEU 20 HN LEU 20 -5.183 0.283 -1.786
164 HA LEU 20 HA LEU 20 -7.931 -0.042 -1.048
165 HB2 LEU 20 HB2 LEU 20 -5.274 -0.249 0.139
166 HB3 LEU 20 HB1 LEU 20 -6.438 0.374 1.298
167 HG LEU 20 HG LEU 20 -6.359 -2.064 1.422
168 HD11 LEU 20 HD11 LEU 20 -8.658 -2.448 1.447
169 HD12 LEU 20 HD12 LEU 20 -8.935 -1.508 -0.017
170 HD13 LEU 20 HD13 LEU 20 -8.590 -0.688 1.506
171 HD21 LEU 20 HD21 LEU 20 -6.786 -3.494 -0.433
172 HD22 LEU 20 HD22 LEU 20 -5.646 -2.291 -1.036
173 HD23 LEU 20 HD23 LEU 20 -7.359 -2.159 -1.431
174 H LEU 21 HN LEU 21 -5.693 2.707 -0.631
175 HA LEU 21 HA LEU 21 -7.255 4.311 1.116
176 HB2 LEU 21 HB2 LEU 21 -4.843 4.592 0.325
177 HB3 LEU 21 HB1 LEU 21 -5.506 5.304 -1.144
178 HG LEU 21 HG LEU 21 -6.737 6.962 0.311
179 HD11 LEU 21 HD11 LEU 21 -5.111 5.539 2.421
180 HD12 LEU 21 HD12 LEU 21 -6.829 5.934 2.440
181 HD13 LEU 21 HD13 LEU 21 -5.631 7.211 2.638
182 HD21 LEU 21 HD21 LEU 21 -4.707 8.312 0.793
183 HD22 LEU 21 HD22 LEU 21 -4.628 7.563 -0.801
184 HD23 LEU 21 HD23 LEU 21 -3.710 6.881 0.541
185 H ALA 22 HN ALA 22 -7.423 3.924 -2.390
186 HA ALA 22 HA ALA 22 -9.623 5.922 -2.582
187 HB1 ALA 22 HB1 ALA 22 -9.142 5.913 -4.895
188 HB2 ALA 22 HB2 ALA 22 -8.412 4.310 -4.826
189 HB3 ALA 22 HB3 ALA 22 -7.562 5.695 -4.143
190 H LEU 23 HN LEU 23 -9.758 2.981 -1.430
191 HA LEU 23 HA LEU 23 -12.134 2.136 -3.030
192 HB2 LEU 23 HB2 LEU 23 -9.888 0.832 -3.195
193 HB3 LEU 23 HB1 LEU 23 -10.287 0.254 -1.580
194 HG LEU 23 HG LEU 23 -12.469 0.092 -3.589
195 HD11 LEU 23 HD11 LEU 23 -10.554 -0.595 -4.954
196 HD12 LEU 23 HD12 LEU 23 -11.541 -2.000 -4.548
197 HD13 LEU 23 HD13 LEU 23 -10.029 -1.707 -3.689
198 HD21 LEU 23 HD21 LEU 23 -11.484 -2.173 -1.893
199 HD22 LEU 23 HD22 LEU 23 -13.139 -1.705 -2.285
200 HD23 LEU 23 HD23 LEU 23 -12.228 -0.795 -1.080
201 HA PRO 24 HA PRO 24 -13.960 2.344 1.022
202 HB2 PRO 24 HB2 PRO 24 -16.482 1.615 0.264
203 HB3 PRO 24 HB1 PRO 24 -15.794 3.218 -0.051
204 HG2 PRO 24 HG2 PRO 24 -16.300 1.009 -1.905
205 HG3 PRO 24 HG1 PRO 24 -16.137 2.741 -2.223
206 HD2 PRO 24 HD2 PRO 24 -14.193 0.713 -2.640
207 HD3 PRO 24 HD1 PRO 24 -13.983 2.462 -2.853
208 HA PRO 25 HA PRO 25 -13.670 -1.931 2.265
209 HB2 PRO 25 HB2 PRO 25 -14.510 -1.659 4.847
210 HB3 PRO 25 HB1 PRO 25 -12.901 -1.152 4.294
211 HG2 PRO 25 HG2 PRO 25 -15.316 0.489 4.823
212 HG3 PRO 25 HG1 PRO 25 -13.611 0.853 5.130
213 HD2 PRO 25 HD2 PRO 25 -15.027 1.856 3.023
214 HD3 PRO 25 HD1 PRO 25 -13.262 1.637 3.022
215 H ARG 26 HN ARG 26 -15.189 -3.572 3.467
216 HA ARG 26 HA ARG 26 -17.987 -3.155 2.477
217 HB2 ARG 26 HB2 ARG 26 -16.077 -5.430 2.601
218 HB3 ARG 26 HB1 ARG 26 -17.775 -5.821 2.863
219 HG2 ARG 26 HG2 ARG 26 -16.895 -4.111 0.532
220 HG3 ARG 26 HG1 ARG 26 -16.920 -5.872 0.430
221 HD2 ARG 26 HD2 ARG 26 -19.358 -5.748 1.226
222 HD3 ARG 26 HD1 ARG 26 -19.265 -4.009 0.889
223 HE ARG 26 HE ARG 26 -19.144 -6.160 -1.132
224 HH11 ARG 26 HH21 ARG 26 -20.705 -3.449 -1.071
225 HH12 ARG 26 HH22 ARG 26 -19.900 -2.608 -2.350
226 HH21 ARG 26 HH11 ARG 26 -17.225 -4.839 -2.480
227 HH22 ARG 26 HH12 ARG 26 -17.918 -3.410 -3.166
228 H ALA 27 HN ALA 27 -16.230 -3.238 5.400
229 HA ALA 27 HA ALA 27 -18.696 -4.001 6.928
230 HB1 ALA 27 HB1 ALA 27 -16.985 -5.739 7.065
231 HB2 ALA 27 HB2 ALA 27 -17.070 -4.904 8.617
232 HB3 ALA 27 HB3 ALA 27 -15.760 -4.544 7.493
233 H TYR 28 HN TYR 28 -18.635 -1.437 6.333
234 HA TYR 28 HA TYR 28 -17.347 -0.015 8.639
235 HB2 TYR 28 HB2 TYR 28 -17.197 1.921 7.164
236 HB3 TYR 28 HB1 TYR 28 -16.452 0.525 6.397
237 HD1 TYR 28 HD2 TYR 28 -19.441 2.723 6.424
238 HD2 TYR 28 HD1 TYR 28 -17.371 -0.438 4.383
239 HE1 TYR 28 HE2 TYR 28 -20.940 3.002 4.470
240 HE2 TYR 28 HE1 TYR 28 -18.871 -0.159 2.431
241 HH TYR 28 HH TYR 28 -20.576 2.390 1.768
242 H ALA 29 HN ALA 29 -20.410 -0.888 7.334
243 HA ALA 29 HA ALA 29 -21.758 1.419 8.673
244 HB1 ALA 29 HB1 ALA 29 -22.129 0.725 6.213
245 HB2 ALA 29 HB2 ALA 29 -23.568 0.978 7.201
246 HB3 ALA 29 HB3 ALA 29 -23.005 -0.659 6.867
Start of MODEL 9
1 H1 ARG 1 HT1 ARG 1 23.407 0.948 -0.268
2 H2 ARG 1 HT2 ARG 1 22.855 2.039 -1.441
3 H3 ARG 1 HT3 ARG 1 21.823 0.823 -0.856
4 HA ARG 1 HA ARG 1 22.956 2.910 0.936
5 HB2 ARG 1 HB2 ARG 1 20.905 3.049 -1.178
6 HB3 ARG 1 HB1 ARG 1 20.359 3.649 0.386
7 HG2 ARG 1 HG2 ARG 1 22.798 4.820 0.288
8 HG3 ARG 1 HG1 ARG 1 22.438 4.740 -1.436
9 HD2 ARG 1 HD2 ARG 1 21.539 6.836 -0.702
10 HD3 ARG 1 HD1 ARG 1 20.138 5.755 -0.827
11 HE ARG 1 HE ARG 1 21.301 5.555 1.806
12 HH11 ARG 1 HH11 ARG 1 21.111 8.546 1.359
13 HH12 ARG 1 HH12 ARG 1 19.521 8.887 1.951
14 HH21 ARG 1 HH21 ARG 1 18.506 5.552 1.882
15 HH22 ARG 1 HH22 ARG 1 18.030 7.174 2.251
16 H LEU 2 HN LEU 2 22.589 0.116 1.499
17 HA LEU 2 HA LEU 2 21.646 -1.317 3.080
18 HB2 LEU 2 HB2 LEU 2 21.007 1.445 4.067
19 HB3 LEU 2 HB1 LEU 2 20.334 0.056 4.914
20 HG LEU 2 HG LEU 2 22.894 -0.780 4.656
21 HD11 LEU 2 HD11 LEU 2 24.405 1.100 5.089
22 HD12 LEU 2 HD12 LEU 2 23.057 2.232 4.984
23 HD13 LEU 2 HD13 LEU 2 23.573 1.341 3.552
24 HD21 LEU 2 HD21 LEU 2 21.686 -0.736 6.757
25 HD22 LEU 2 HD22 LEU 2 21.719 1.027 6.791
26 HD23 LEU 2 HD23 LEU 2 23.214 0.112 6.991
27 H VAL 3 HN VAL 3 20.145 -2.572 1.968
28 HA VAL 3 HA VAL 3 17.452 -1.438 1.423
29 HB VAL 3 HB VAL 3 17.161 -3.557 0.115
30 HG11 VAL 3 HG11 VAL 3 19.712 -2.191 -0.717
31 HG12 VAL 3 HG12 VAL 3 18.168 -1.339 -0.743
32 HG13 VAL 3 HG13 VAL 3 18.394 -2.785 -1.727
33 HG21 VAL 3 HG21 VAL 3 19.344 -4.475 1.607
34 HG22 VAL 3 HG22 VAL 3 20.019 -4.177 0.006
35 HG23 VAL 3 HG23 VAL 3 18.645 -5.264 0.194
36 HA PRO 4 HA PRO 4 16.133 -3.611 5.131
37 HB2 PRO 4 HB2 PRO 4 13.666 -2.449 5.280
38 HB3 PRO 4 HB1 PRO 4 15.149 -1.632 5.811
39 HG2 PRO 4 HG2 PRO 4 13.554 -1.231 3.360
40 HG3 PRO 4 HG1 PRO 4 14.516 -0.074 4.290
41 HD2 PRO 4 HD2 PRO 4 15.287 -1.268 1.906
42 HD3 PRO 4 HD1 PRO 4 16.370 -0.464 3.061
43 H GLY 5 HN GLY 5 16.004 -5.696 4.056
44 HA2 GLY 5 HA2 GLY 5 14.809 -7.598 3.329
45 HA3 GLY 5 HA1 GLY 5 13.338 -6.691 3.627
46 H ALA 6 HN ALA 6 15.890 -5.625 1.451
47 HA ALA 6 HA ALA 6 15.812 -5.040 -0.831
48 HB1 ALA 6 HB1 ALA 6 16.042 -7.405 -1.100
49 HB2 ALA 6 HB2 ALA 6 14.755 -6.928 -2.206
50 HB3 ALA 6 HB3 ALA 6 14.357 -7.691 -0.668
51 H ALA 7 HN ALA 7 13.870 -3.710 0.754
52 HA ALA 7 HA ALA 7 11.973 -2.362 0.545
53 HB1 ALA 7 HB1 ALA 7 11.841 -3.162 -2.349
54 HB2 ALA 7 HB2 ALA 7 13.189 -2.192 -1.756
55 HB3 ALA 7 HB3 ALA 7 11.539 -1.587 -1.614
56 H TYR 8 HN TYR 8 11.676 -5.474 0.891
57 HA TYR 8 HA TYR 8 9.185 -6.194 -0.374
58 HB2 TYR 8 HB2 TYR 8 11.037 -7.289 1.641
59 HB3 TYR 8 HB1 TYR 8 9.363 -7.763 1.891
60 HD1 TYR 8 HD1 TYR 8 8.105 -8.276 -0.502
61 HD2 TYR 8 HD2 TYR 8 12.291 -8.763 0.336
62 HE1 TYR 8 HE1 TYR 8 8.288 -9.915 -2.353
63 HE2 TYR 8 HE2 TYR 8 12.470 -10.398 -1.512
64 HH TYR 8 HH TYR 8 10.956 -10.741 -3.808
65 H ALA 9 HN ALA 9 9.977 -4.671 2.702
66 HA ALA 9 HA ALA 9 7.170 -4.640 3.609
67 HB1 ALA 9 HB1 ALA 9 9.189 -4.890 5.100
68 HB2 ALA 9 HB2 ALA 9 8.112 -3.579 5.579
69 HB3 ALA 9 HB3 ALA 9 9.609 -3.220 4.719
70 H LEU 10 HN LEU 10 8.578 -2.984 1.192
71 HA LEU 10 HA LEU 10 7.262 -0.360 1.793
72 HB2 LEU 10 HB2 LEU 10 9.876 -0.842 1.345
73 HB3 LEU 10 HB1 LEU 10 9.345 -0.719 -0.325
74 HG LEU 10 HG LEU 10 8.781 1.378 1.792
75 HD11 LEU 10 HD11 LEU 10 11.243 0.961 1.038
76 HD12 LEU 10 HD12 LEU 10 10.617 2.610 0.995
77 HD13 LEU 10 HD13 LEU 10 10.724 1.669 -0.493
78 HD21 LEU 10 HD21 LEU 10 7.149 1.604 0.090
79 HD22 LEU 10 HD22 LEU 10 8.287 1.156 -1.182
80 HD23 LEU 10 HD23 LEU 10 8.414 2.732 -0.401
81 H TYR 11 HN TYR 11 8.174 -2.587 -0.849
82 HA TYR 11 HA TYR 11 6.532 -1.570 -2.912
83 HB2 TYR 11 HB2 TYR 11 7.979 -4.062 -2.259
84 HB3 TYR 11 HB1 TYR 11 6.703 -4.237 -3.460
85 HD1 TYR 11 HD1 TYR 11 9.875 -2.527 -2.651
86 HD2 TYR 11 HD2 TYR 11 6.857 -3.171 -5.636
87 HE1 TYR 11 HE1 TYR 11 11.351 -1.502 -4.359
88 HE2 TYR 11 HE2 TYR 11 8.332 -2.146 -7.345
89 HH TYR 11 HH TYR 11 10.545 -0.253 -6.968
90 H GLY 12 HN GLY 12 5.608 -3.496 -0.157
91 HA2 GLY 12 HA2 GLY 12 2.948 -4.101 -1.341
92 HA3 GLY 12 HA1 GLY 12 3.598 -4.815 0.136
93 H VAL 13 HN VAL 13 4.462 -2.345 1.371
94 HA VAL 13 HA VAL 13 1.985 -1.518 2.593
95 HB VAL 13 HB VAL 13 4.435 -1.679 3.492
96 HG11 VAL 13 HG11 VAL 13 5.290 0.012 1.796
97 HG12 VAL 13 HG12 VAL 13 5.722 0.335 3.473
98 HG13 VAL 13 HG13 VAL 13 4.417 1.244 2.708
99 HG21 VAL 13 HG21 VAL 13 2.832 0.753 4.297
100 HG22 VAL 13 HG22 VAL 13 3.856 -0.261 5.315
101 HG23 VAL 13 HG23 VAL 13 2.330 -0.891 4.695
102 H TRP 14 HN TRP 14 4.002 -0.090 0.084
103 HA TRP 14 HA TRP 14 2.882 2.534 0.036
104 HB2 TRP 14 HB2 TRP 14 4.964 1.823 -1.086
105 HB3 TRP 14 HB1 TRP 14 4.042 0.846 -2.203
106 HD1 TRP 14 HD1 TRP 14 4.731 2.171 -4.327
107 HE1 TRP 14 HE1 TRP 14 4.121 4.498 -5.241
108 HE3 TRP 14 HE3 TRP 14 2.597 4.244 -0.163
109 HZ2 TRP 14 HZ2 TRP 14 2.894 6.916 -4.339
110 HZ3 TRP 14 HZ3 TRP 14 1.719 6.549 -0.226
111 HH2 TRP 14 HH2 TRP 14 1.865 7.893 -2.303
112 HA PRO 15 HA PRO 15 -0.234 0.986 -3.293
113 HB2 PRO 15 HB2 PRO 15 -0.582 -1.714 -3.584
114 HB3 PRO 15 HB1 PRO 15 0.580 -0.772 -4.543
115 HG2 PRO 15 HG2 PRO 15 1.053 -2.466 -2.142
116 HG3 PRO 15 HG1 PRO 15 2.018 -2.306 -3.620
117 HD2 PRO 15 HD2 PRO 15 2.695 -1.083 -1.320
118 HD3 PRO 15 HD1 PRO 15 3.051 -0.374 -2.908
119 H LEU 16 HN LEU 16 0.175 -0.749 -0.239
120 HA LEU 16 HA LEU 16 -2.590 -1.459 0.187
121 HB2 LEU 16 HB2 LEU 16 -0.044 -1.456 1.621
122 HB3 LEU 16 HB1 LEU 16 -1.367 -0.984 2.679
123 HG LEU 16 HG LEU 16 -0.919 -3.455 2.633
124 HD11 LEU 16 HD11 LEU 16 -3.319 -4.088 2.345
125 HD12 LEU 16 HD12 LEU 16 -3.622 -2.492 1.656
126 HD13 LEU 16 HD13 LEU 16 -3.096 -2.644 3.333
127 HD21 LEU 16 HD21 LEU 16 -0.767 -3.097 -0.117
128 HD22 LEU 16 HD22 LEU 16 -2.348 -3.847 0.096
129 HD23 LEU 16 HD23 LEU 16 -0.902 -4.651 0.705
130 H LEU 17 HN LEU 17 -0.643 1.368 1.056
131 HA LEU 17 HA LEU 17 -2.728 2.827 2.427
132 HB2 LEU 17 HB2 LEU 17 -0.097 3.487 1.094
133 HB3 LEU 17 HB1 LEU 17 -1.129 4.789 1.682
134 HG LEU 17 HG LEU 17 -0.378 2.465 3.457
135 HD11 LEU 17 HD11 LEU 17 1.397 4.026 4.378
136 HD12 LEU 17 HD12 LEU 17 1.158 5.027 2.945
137 HD13 LEU 17 HD13 LEU 17 1.744 3.373 2.776
138 HD21 LEU 17 HD21 LEU 17 -2.243 3.934 4.156
139 HD22 LEU 17 HD22 LEU 17 -1.195 5.343 3.992
140 HD23 LEU 17 HD23 LEU 17 -0.855 4.130 5.226
141 H LEU 18 HN LEU 18 -1.634 2.610 -0.909
142 HA LEU 18 HA LEU 18 -3.356 4.628 -2.056
143 HB2 LEU 18 HB2 LEU 18 -1.556 2.434 -2.895
144 HB3 LEU 18 HB1 LEU 18 -2.884 2.708 -4.016
145 HG LEU 18 HG LEU 18 -2.275 5.186 -3.930
146 HD11 LEU 18 HD11 LEU 18 -0.833 4.738 -1.802
147 HD12 LEU 18 HD12 LEU 18 -0.222 5.866 -3.011
148 HD13 LEU 18 HD13 LEU 18 0.404 4.219 -2.946
149 HD21 LEU 18 HD21 LEU 18 -1.689 3.913 -5.884
150 HD22 LEU 18 HD22 LEU 18 -0.364 3.113 -5.039
151 HD23 LEU 18 HD23 LEU 18 -0.251 4.828 -5.432
152 H LEU 19 HN LEU 19 -3.627 1.122 -1.497
153 HA LEU 19 HA LEU 19 -6.235 0.730 -2.653
154 HB2 LEU 19 HB2 LEU 19 -4.186 -0.739 -1.225
155 HB3 LEU 19 HB1 LEU 19 -5.762 -1.134 -0.562
156 HG LEU 19 HG LEU 19 -5.150 -2.656 -2.405
157 HD11 LEU 19 HD11 LEU 19 -7.548 -1.955 -1.985
158 HD12 LEU 19 HD12 LEU 19 -7.216 -2.538 -3.615
159 HD13 LEU 19 HD13 LEU 19 -7.369 -0.807 -3.313
160 HD21 LEU 19 HD21 LEU 19 -3.858 -0.681 -3.577
161 HD22 LEU 19 HD22 LEU 19 -5.413 -0.378 -4.351
162 HD23 LEU 19 HD23 LEU 19 -4.614 -1.935 -4.560
163 H LEU 20 HN LEU 20 -5.071 1.749 0.485
164 HA LEU 20 HA LEU 20 -7.628 1.567 1.884
165 HB2 LEU 20 HB2 LEU 20 -4.829 2.216 2.403
166 HB3 LEU 20 HB1 LEU 20 -5.884 3.377 3.189
167 HG LEU 20 HG LEU 20 -5.434 1.526 4.704
168 HD11 LEU 20 HD11 LEU 20 -7.773 2.573 4.528
169 HD12 LEU 20 HD12 LEU 20 -7.651 1.020 5.354
170 HD13 LEU 20 HD13 LEU 20 -8.245 1.090 3.696
171 HD21 LEU 20 HD21 LEU 20 -6.194 -0.101 2.303
172 HD22 LEU 20 HD22 LEU 20 -6.565 -0.746 3.901
173 HD23 LEU 20 HD23 LEU 20 -4.899 -0.361 3.471
174 H LEU 21 HN LEU 21 -5.710 4.149 0.314
175 HA LEU 21 HA LEU 21 -7.425 6.361 0.937
176 HB2 LEU 21 HB2 LEU 21 -5.031 6.344 0.035
177 HB3 LEU 21 HB1 LEU 21 -5.724 5.973 -1.542
178 HG LEU 21 HG LEU 21 -7.023 8.247 -0.190
179 HD11 LEU 21 HD11 LEU 21 -4.659 8.556 0.545
180 HD12 LEU 21 HD12 LEU 21 -5.198 9.822 -0.558
181 HD13 LEU 21 HD13 LEU 21 -4.158 8.525 -1.146
182 HD21 LEU 21 HD21 LEU 21 -5.705 7.960 -2.912
183 HD22 LEU 21 HD22 LEU 21 -6.861 9.201 -2.429
184 HD23 LEU 21 HD23 LEU 21 -7.378 7.520 -2.567
185 H ALA 22 HN ALA 22 -7.247 4.198 -1.856
186 HA ALA 22 HA ALA 22 -9.925 5.161 -2.804
187 HB1 ALA 22 HB1 ALA 22 -9.115 4.133 -4.968
188 HB2 ALA 22 HB2 ALA 22 -7.585 3.778 -4.165
189 HB3 ALA 22 HB3 ALA 22 -8.095 5.452 -4.390
190 H LEU 23 HN LEU 23 -9.987 3.471 -0.623
191 HA LEU 23 HA LEU 23 -10.021 0.674 -1.257
192 HB2 LEU 23 HB2 LEU 23 -10.515 0.427 0.988
193 HB3 LEU 23 HB1 LEU 23 -9.811 2.032 0.990
194 HG LEU 23 HG LEU 23 -12.798 1.609 0.737
195 HD11 LEU 23 HD11 LEU 23 -12.185 0.517 2.796
196 HD12 LEU 23 HD12 LEU 23 -12.850 2.098 3.209
197 HD13 LEU 23 HD13 LEU 23 -11.106 1.841 3.236
198 HD21 LEU 23 HD21 LEU 23 -12.572 3.939 1.961
199 HD22 LEU 23 HD22 LEU 23 -12.322 3.843 0.219
200 HD23 LEU 23 HD23 LEU 23 -10.936 3.904 1.307
201 HA PRO 24 HA PRO 24 -14.056 0.422 -3.060
202 HB2 PRO 24 HB2 PRO 24 -14.134 -2.300 -3.254
203 HB3 PRO 24 HB1 PRO 24 -13.124 -1.280 -4.293
204 HG2 PRO 24 HG2 PRO 24 -12.343 -3.070 -2.129
205 HG3 PRO 24 HG1 PRO 24 -11.376 -2.401 -3.449
206 HD2 PRO 24 HD2 PRO 24 -11.486 -1.542 -0.720
207 HD3 PRO 24 HD1 PRO 24 -10.488 -0.890 -2.038
208 HA PRO 25 HA PRO 25 -17.088 -0.581 0.011
209 HB2 PRO 25 HB2 PRO 25 -18.956 -2.116 -1.269
210 HB3 PRO 25 HB1 PRO 25 -18.765 -0.373 -1.557
211 HG2 PRO 25 HG2 PRO 25 -17.759 -2.669 -3.162
212 HG3 PRO 25 HG1 PRO 25 -18.482 -1.144 -3.704
213 HD2 PRO 25 HD2 PRO 25 -15.824 -1.579 -3.759
214 HD3 PRO 25 HD1 PRO 25 -16.524 0.030 -3.474
215 H ARG 26 HN ARG 26 -18.284 -2.489 1.127
216 HA ARG 26 HA ARG 26 -16.347 -4.635 1.659
217 HB2 ARG 26 HB2 ARG 26 -18.954 -3.662 2.785
218 HB3 ARG 26 HB1 ARG 26 -18.359 -5.257 3.246
219 HG2 ARG 26 HG2 ARG 26 -16.516 -4.410 4.358
220 HG3 ARG 26 HG1 ARG 26 -16.440 -2.963 3.355
221 HD2 ARG 26 HD2 ARG 26 -18.940 -3.082 4.867
222 HD3 ARG 26 HD1 ARG 26 -17.518 -3.096 5.928
223 HE ARG 26 HE ARG 26 -16.846 -0.969 5.029
224 HH11 ARG 26 HH11 ARG 26 -19.873 -0.588 5.279
225 HH12 ARG 26 HH12 ARG 26 -20.246 0.147 3.758
226 HH21 ARG 26 HH21 ARG 26 -17.207 -0.758 2.301
227 HH22 ARG 26 HH22 ARG 26 -18.719 0.049 2.050
228 H ALA 27 HN ALA 27 -19.146 -4.268 -0.381
229 HA ALA 27 HA ALA 27 -19.006 -7.140 -1.122
230 HB1 ALA 27 HB1 ALA 27 -21.443 -7.344 -0.868
231 HB2 ALA 27 HB2 ALA 27 -21.549 -5.659 -0.358
232 HB3 ALA 27 HB3 ALA 27 -20.729 -6.840 0.664
233 H TYR 28 HN TYR 28 -17.909 -5.837 -2.915
234 HA TYR 28 HA TYR 28 -19.445 -4.074 -4.607
235 HB2 TYR 28 HB2 TYR 28 -17.503 -4.092 -5.999
236 HB3 TYR 28 HB1 TYR 28 -16.923 -4.221 -4.346
237 HD1 TYR 28 HD1 TYR 28 -16.121 -6.457 -3.479
238 HD2 TYR 28 HD2 TYR 28 -17.174 -5.830 -7.594
239 HE1 TYR 28 HE1 TYR 28 -14.930 -8.536 -4.101
240 HE2 TYR 28 HE2 TYR 28 -15.983 -7.908 -8.215
241 HH TYR 28 HH TYR 28 -13.822 -9.280 -6.797
242 H ALA 29 HN ALA 29 -18.766 -7.582 -4.807
243 HA ALA 29 HA ALA 29 -19.690 -9.277 -6.131
244 HB1 ALA 29 HB1 ALA 29 -22.061 -7.398 -6.080
245 HB2 ALA 29 HB2 ALA 29 -21.570 -8.407 -4.719
246 HB3 ALA 29 HB3 ALA 29 -22.100 -9.155 -6.226
Start of MODEL 10
1 H1 ARG 1 HT1 ARG 1 14.784 2.772 -2.703
2 H2 ARG 1 HT2 ARG 1 15.636 3.031 -1.255
3 H3 ARG 1 HT3 ARG 1 14.993 1.499 -1.606
4 HA ARG 1 HA ARG 1 16.527 1.209 -3.444
5 HB2 ARG 1 HB2 ARG 1 16.397 3.767 -3.829
6 HB3 ARG 1 HB1 ARG 1 17.699 3.877 -2.643
7 HG2 ARG 1 HG2 ARG 1 19.028 2.265 -4.028
8 HG3 ARG 1 HG1 ARG 1 17.757 2.327 -5.249
9 HD2 ARG 1 HD2 ARG 1 18.789 4.139 -6.127
10 HD3 ARG 1 HD1 ARG 1 18.369 5.028 -4.652
11 HE ARG 1 HE ARG 1 20.810 3.314 -4.628
12 HH11 ARG 1 HH11 ARG 1 20.146 5.206 -2.387
13 HH12 ARG 1 HH12 ARG 1 21.151 6.568 -2.752
14 HH21 ARG 1 HH21 ARG 1 21.734 5.581 -6.042
15 HH22 ARG 1 HH22 ARG 1 22.056 6.782 -4.839
16 H LEU 2 HN LEU 2 18.326 -0.001 -2.890
17 HA LEU 2 HA LEU 2 19.877 -1.104 -1.517
18 HB2 LEU 2 HB2 LEU 2 20.238 1.831 -0.871
19 HB3 LEU 2 HB1 LEU 2 21.319 0.592 -0.237
20 HG LEU 2 HG LEU 2 20.730 0.783 -3.192
21 HD11 LEU 2 HD11 LEU 2 22.985 2.159 -1.702
22 HD12 LEU 2 HD12 LEU 2 21.585 2.983 -2.388
23 HD13 LEU 2 HD13 LEU 2 22.730 2.160 -3.447
24 HD21 LEU 2 HD21 LEU 2 21.798 -1.275 -2.357
25 HD22 LEU 2 HD22 LEU 2 23.046 -0.317 -1.560
26 HD23 LEU 2 HD23 LEU 2 22.942 -0.342 -3.320
27 H VAL 3 HN VAL 3 17.685 -1.833 -0.409
28 HA VAL 3 HA VAL 3 18.029 -1.437 2.519
29 HB VAL 3 HB VAL 3 15.415 -1.277 2.553
30 HG11 VAL 3 HG11 VAL 3 17.035 1.091 1.587
31 HG12 VAL 3 HG12 VAL 3 17.028 0.498 3.248
32 HG13 VAL 3 HG13 VAL 3 15.549 1.140 2.535
33 HG21 VAL 3 HG21 VAL 3 15.955 -0.060 -0.174
34 HG22 VAL 3 HG22 VAL 3 14.399 -0.256 0.624
35 HG23 VAL 3 HG23 VAL 3 15.268 -1.671 0.037
36 HA PRO 4 HA PRO 4 16.984 -5.740 2.502
37 HB2 PRO 4 HB2 PRO 4 16.429 -6.074 5.153
38 HB3 PRO 4 HB1 PRO 4 18.067 -5.800 4.534
39 HG2 PRO 4 HG2 PRO 4 16.304 -3.990 6.011
40 HG3 PRO 4 HG1 PRO 4 18.065 -3.983 5.855
41 HD2 PRO 4 HD2 PRO 4 16.200 -2.332 4.496
42 HD3 PRO 4 HD1 PRO 4 17.960 -2.406 4.264
43 H GLY 5 HN GLY 5 15.118 -7.115 4.009
44 HA2 GLY 5 HA2 GLY 5 12.671 -6.847 2.668
45 HA3 GLY 5 HA1 GLY 5 12.855 -7.656 4.221
46 H ALA 6 HN ALA 6 13.758 -5.174 5.588
47 HA ALA 6 HA ALA 6 11.410 -4.188 6.724
48 HB1 ALA 6 HB1 ALA 6 12.879 -2.214 7.316
49 HB2 ALA 6 HB2 ALA 6 14.099 -2.892 6.237
50 HB3 ALA 6 HB3 ALA 6 13.591 -3.790 7.668
51 H ALA 7 HN ALA 7 13.070 -2.994 3.845
52 HA ALA 7 HA ALA 7 10.936 -0.960 3.392
53 HB1 ALA 7 HB1 ALA 7 13.426 -0.411 3.429
54 HB2 ALA 7 HB2 ALA 7 12.553 0.117 1.989
55 HB3 ALA 7 HB3 ALA 7 13.548 -1.337 1.933
56 H TYR 8 HN TYR 8 12.454 -3.803 1.933
57 HA TYR 8 HA TYR 8 11.287 -3.738 -0.655
58 HB2 TYR 8 HB2 TYR 8 12.543 -5.689 1.145
59 HB3 TYR 8 HB1 TYR 8 11.382 -6.417 0.039
60 HD1 TYR 8 HD1 TYR 8 11.638 -6.076 -2.440
61 HD2 TYR 8 HD2 TYR 8 14.640 -4.847 0.375
62 HE1 TYR 8 HE1 TYR 8 13.301 -5.928 -4.275
63 HE2 TYR 8 HE2 TYR 8 16.300 -4.700 -1.459
64 HH TYR 8 HH TYR 8 15.796 -4.334 -4.370
65 H ALA 9 HN ALA 9 10.058 -5.233 2.318
66 HA ALA 9 HA ALA 9 7.579 -6.221 1.282
67 HB1 ALA 9 HB1 ALA 9 8.417 -5.272 4.042
68 HB2 ALA 9 HB2 ALA 9 8.492 -6.926 3.432
69 HB3 ALA 9 HB3 ALA 9 6.928 -6.160 3.720
70 H LEU 10 HN LEU 10 8.523 -3.135 2.664
71 HA LEU 10 HA LEU 10 5.990 -1.815 2.782
72 HB2 LEU 10 HB2 LEU 10 8.721 -1.280 3.273
73 HB3 LEU 10 HB1 LEU 10 8.210 -0.066 2.107
74 HG LEU 10 HG LEU 10 6.464 -0.649 4.481
75 HD11 LEU 10 HD11 LEU 10 8.841 1.239 4.477
76 HD12 LEU 10 HD12 LEU 10 8.755 -0.282 5.368
77 HD13 LEU 10 HD13 LEU 10 7.668 1.044 5.780
78 HD21 LEU 10 HD21 LEU 10 7.079 1.885 2.919
79 HD22 LEU 10 HD22 LEU 10 5.814 1.684 4.132
80 HD23 LEU 10 HD23 LEU 10 5.710 0.819 2.598
81 H TYR 11 HN TYR 11 8.436 -2.039 0.183
82 HA TYR 11 HA TYR 11 7.224 -0.275 -1.707
83 HB2 TYR 11 HB2 TYR 11 8.913 -2.762 -2.092
84 HB3 TYR 11 HB1 TYR 11 8.588 -1.585 -3.352
85 HD1 TYR 11 HD1 TYR 11 8.749 0.907 -1.455
86 HD2 TYR 11 HD2 TYR 11 11.290 -2.506 -2.065
87 HE1 TYR 11 HE1 TYR 11 10.703 2.218 -0.685
88 HE2 TYR 11 HE2 TYR 11 13.240 -1.192 -1.293
89 HH TYR 11 HH TYR 11 12.983 1.683 0.361
90 H GLY 12 HN GLY 12 6.692 -3.692 -1.029
91 HA2 GLY 12 HA2 GLY 12 4.909 -4.188 -3.256
92 HA3 GLY 12 HA1 GLY 12 5.110 -5.229 -1.846
93 H VAL 13 HN VAL 13 4.459 -3.147 0.111
94 HA VAL 13 HA VAL 13 1.531 -3.313 -0.036
95 HB VAL 13 HB VAL 13 3.451 -2.150 2.008
96 HG11 VAL 13 HG11 VAL 13 1.327 -1.126 2.412
97 HG12 VAL 13 HG12 VAL 13 1.435 -2.468 3.550
98 HG13 VAL 13 HG13 VAL 13 0.462 -2.629 2.088
99 HG21 VAL 13 HG21 VAL 13 3.553 -4.653 1.542
100 HG22 VAL 13 HG22 VAL 13 1.887 -4.746 2.110
101 HG23 VAL 13 HG23 VAL 13 3.162 -4.217 3.205
102 H TRP 14 HN TRP 14 3.878 -0.993 -0.999
103 HA TRP 14 HA TRP 14 2.636 1.483 -0.479
104 HB2 TRP 14 HB2 TRP 14 4.919 1.109 -1.391
105 HB3 TRP 14 HB1 TRP 14 4.219 0.633 -2.921
106 HD1 TRP 14 HD1 TRP 14 5.225 2.608 -4.278
107 HE1 TRP 14 HE1 TRP 14 4.707 5.127 -4.386
108 HE3 TRP 14 HE3 TRP 14 2.354 3.121 -0.071
109 HZ2 TRP 14 HZ2 TRP 14 3.272 7.099 -2.897
110 HZ3 TRP 14 HZ3 TRP 14 1.429 5.322 0.550
111 HH2 TRP 14 HH2 TRP 14 1.883 7.315 -0.852
112 HA PRO 15 HA PRO 15 0.217 1.168 -4.624
113 HB2 PRO 15 HB2 PRO 15 0.020 -1.284 -5.828
114 HB3 PRO 15 HB1 PRO 15 1.300 -0.111 -6.210
115 HG2 PRO 15 HG2 PRO 15 1.403 -2.504 -4.440
116 HG3 PRO 15 HG1 PRO 15 2.605 -1.899 -5.593
117 HD2 PRO 15 HD2 PRO 15 2.824 -1.505 -2.937
118 HD3 PRO 15 HD1 PRO 15 3.434 -0.330 -4.122
119 H LEU 16 HN LEU 16 0.169 -1.543 -2.339
120 HA LEU 16 HA LEU 16 -2.608 -2.248 -2.594
121 HB2 LEU 16 HB2 LEU 16 -0.391 -2.608 -0.618
122 HB3 LEU 16 HB1 LEU 16 -2.032 -2.887 -0.038
123 HG LEU 16 HG LEU 16 -1.171 -4.139 -2.628
124 HD11 LEU 16 HD11 LEU 16 0.629 -4.713 -1.066
125 HD12 LEU 16 HD12 LEU 16 -0.385 -6.124 -1.362
126 HD13 LEU 16 HD13 LEU 16 -0.554 -5.217 0.141
127 HD21 LEU 16 HD21 LEU 16 -2.907 -5.661 -2.160
128 HD22 LEU 16 HD22 LEU 16 -3.548 -4.137 -1.549
129 HD23 LEU 16 HD23 LEU 16 -2.867 -5.319 -0.430
130 H LEU 17 HN LEU 17 -0.890 0.030 -0.497
131 HA LEU 17 HA LEU 17 -3.192 1.006 0.935
132 HB2 LEU 17 HB2 LEU 17 -0.463 1.315 1.079
133 HB3 LEU 17 HB1 LEU 17 -0.934 2.862 0.386
134 HG LEU 17 HG LEU 17 -0.857 3.018 2.823
135 HD11 LEU 17 HD11 LEU 17 -2.663 4.210 1.465
136 HD12 LEU 17 HD12 LEU 17 -2.979 4.028 3.190
137 HD13 LEU 17 HD13 LEU 17 -3.771 2.961 2.031
138 HD21 LEU 17 HD21 LEU 17 -1.323 0.591 3.248
139 HD22 LEU 17 HD22 LEU 17 -3.014 0.884 2.844
140 HD23 LEU 17 HD23 LEU 17 -2.293 1.670 4.248
141 H LEU 18 HN LEU 18 -1.567 1.963 -2.034
142 HA LEU 18 HA LEU 18 -3.090 4.313 -2.672
143 HB2 LEU 18 HB2 LEU 18 -1.195 2.437 -3.931
144 HB3 LEU 18 HB1 LEU 18 -2.335 3.127 -5.078
145 HG LEU 18 HG LEU 18 -1.751 5.406 -4.206
146 HD11 LEU 18 HD11 LEU 18 0.493 3.943 -2.786
147 HD12 LEU 18 HD12 LEU 18 -0.935 4.585 -1.974
148 HD13 LEU 18 HD13 LEU 18 0.189 5.679 -2.778
149 HD21 LEU 18 HD21 LEU 18 0.560 5.428 -5.225
150 HD22 LEU 18 HD22 LEU 18 -0.659 4.641 -6.227
151 HD23 LEU 18 HD23 LEU 18 0.482 3.668 -5.297
152 H LEU 19 HN LEU 19 -3.555 0.839 -3.346
153 HA LEU 19 HA LEU 19 -5.946 1.137 -4.959
154 HB2 LEU 19 HB2 LEU 19 -4.145 -0.858 -4.341
155 HB3 LEU 19 HB1 LEU 19 -5.550 -1.351 -3.410
156 HG LEU 19 HG LEU 19 -5.657 -2.386 -5.602
157 HD11 LEU 19 HD11 LEU 19 -7.853 -1.741 -6.256
158 HD12 LEU 19 HD12 LEU 19 -7.626 -0.094 -5.671
159 HD13 LEU 19 HD13 LEU 19 -7.765 -1.425 -4.524
160 HD21 LEU 19 HD21 LEU 19 -4.414 -1.142 -7.107
161 HD22 LEU 19 HD22 LEU 19 -5.043 0.398 -6.523
162 HD23 LEU 19 HD23 LEU 19 -6.036 -0.623 -7.562
163 H LEU 20 HN LEU 20 -5.286 0.451 -1.556
164 HA LEU 20 HA LEU 20 -7.975 0.072 -0.639
165 HB2 LEU 20 HB2 LEU 20 -5.349 0.191 0.418
166 HB3 LEU 20 HB1 LEU 20 -6.281 1.381 1.315
167 HG LEU 20 HG LEU 20 -6.424 -0.779 2.437
168 HD11 LEU 20 HD11 LEU 20 -8.809 -0.944 2.639
169 HD12 LEU 20 HD12 LEU 20 -9.055 -0.285 1.022
170 HD13 LEU 20 HD13 LEU 20 -8.444 0.750 2.311
171 HD21 LEU 20 HD21 LEU 20 -7.865 -1.945 0.068
172 HD22 LEU 20 HD22 LEU 20 -7.055 -2.777 1.395
173 HD23 LEU 20 HD23 LEU 20 -6.103 -2.000 0.130
174 H LEU 21 HN LEU 21 -5.997 3.010 -1.026
175 HA LEU 21 HA LEU 21 -7.636 4.924 0.253
176 HB2 LEU 21 HB2 LEU 21 -5.332 5.219 -0.698
177 HB3 LEU 21 HB1 LEU 21 -6.047 5.246 -2.307
178 HG LEU 21 HG LEU 21 -7.390 7.095 -0.478
179 HD11 LEU 21 HD11 LEU 21 -5.622 8.662 -0.144
180 HD12 LEU 21 HD12 LEU 21 -4.524 7.758 -1.186
181 HD13 LEU 21 HD13 LEU 21 -4.985 7.106 0.388
182 HD21 LEU 21 HD21 LEU 21 -7.669 7.125 -2.918
183 HD22 LEU 21 HD22 LEU 21 -5.940 7.409 -3.131
184 HD23 LEU 21 HD23 LEU 21 -6.951 8.644 -2.380
185 H ALA 22 HN ALA 22 -7.864 3.608 -3.024
186 HA ALA 22 HA ALA 22 -10.285 5.229 -3.612
187 HB1 ALA 22 HB1 ALA 22 -9.928 4.483 -5.865
188 HB2 ALA 22 HB2 ALA 22 -8.890 3.161 -5.328
189 HB3 ALA 22 HB3 ALA 22 -8.330 4.829 -5.201
190 H LEU 23 HN LEU 23 -10.071 2.730 -1.679
191 HA LEU 23 HA LEU 23 -12.355 1.191 -2.832
192 HB2 LEU 23 HB2 LEU 23 -9.757 0.460 -1.695
193 HB3 LEU 23 HB1 LEU 23 -11.082 -0.390 -0.923
194 HG LEU 23 HG LEU 23 -10.063 -1.573 -2.909
195 HD11 LEU 23 HD11 LEU 23 -12.953 -0.877 -3.418
196 HD12 LEU 23 HD12 LEU 23 -12.458 -1.867 -2.044
197 HD13 LEU 23 HD13 LEU 23 -12.131 -2.414 -3.688
198 HD21 LEU 23 HD21 LEU 23 -10.451 -0.786 -5.127
199 HD22 LEU 23 HD22 LEU 23 -9.816 0.601 -4.242
200 HD23 LEU 23 HD23 LEU 23 -11.545 0.479 -4.567
201 HA PRO 24 HA PRO 24 -14.351 2.442 0.937
202 HB2 PRO 24 HB2 PRO 24 -16.591 0.905 0.665
203 HB3 PRO 24 HB1 PRO 24 -16.274 2.348 -0.316
204 HG2 PRO 24 HG2 PRO 24 -16.207 -0.464 -1.084
205 HG3 PRO 24 HG1 PRO 24 -16.341 0.980 -2.093
206 HD2 PRO 24 HD2 PRO 24 -14.018 -0.622 -1.588
207 HD3 PRO 24 HD1 PRO 24 -14.150 0.810 -2.628
208 HA PRO 25 HA PRO 25 -13.438 -0.626 4.003
209 HB2 PRO 25 HB2 PRO 25 -15.179 0.056 5.987
210 HB3 PRO 25 HB1 PRO 25 -13.739 1.020 5.597
211 HG2 PRO 25 HG2 PRO 25 -16.576 1.483 4.844
212 HG3 PRO 25 HG1 PRO 25 -15.328 2.647 5.322
213 HD2 PRO 25 HD2 PRO 25 -16.076 2.241 2.744
214 HD3 PRO 25 HD1 PRO 25 -14.448 2.777 3.220
215 H ARG 26 HN ARG 26 -14.189 -2.656 4.661
216 HA ARG 26 HA ARG 26 -15.535 -4.588 4.709
217 HB2 ARG 26 HB2 ARG 26 -16.938 -2.510 5.798
218 HB3 ARG 26 HB1 ARG 26 -18.040 -3.021 4.524
219 HG2 ARG 26 HG2 ARG 26 -17.148 -5.410 5.710
220 HG3 ARG 26 HG1 ARG 26 -17.447 -4.313 7.058
221 HD2 ARG 26 HD2 ARG 26 -19.439 -4.818 4.817
222 HD3 ARG 26 HD1 ARG 26 -19.492 -5.617 6.400
223 HE ARG 26 HE ARG 26 -19.694 -2.644 6.057
224 HH11 ARG 26 HH21 ARG 26 -22.223 -4.114 6.521
225 HH12 ARG 26 HH22 ARG 26 -22.399 -4.047 8.242
226 HH21 ARG 26 HH11 ARG 26 -19.064 -3.189 8.796
227 HH22 ARG 26 HH12 ARG 26 -20.590 -3.518 9.544
228 H ALA 27 HN ALA 27 -14.636 -3.617 2.143
229 HA ALA 27 HA ALA 27 -16.907 -4.425 0.352
230 HB1 ALA 27 HB1 ALA 27 -16.077 -2.038 0.255
231 HB2 ALA 27 HB2 ALA 27 -15.957 -2.906 -1.275
232 HB3 ALA 27 HB3 ALA 27 -14.519 -2.665 -0.283
233 H TYR 28 HN TYR 28 -15.550 -6.507 1.403
234 HA TYR 28 HA TYR 28 -14.022 -7.593 -0.895
235 HB2 TYR 28 HB2 TYR 28 -12.816 -6.518 1.472
236 HB3 TYR 28 HB1 TYR 28 -12.584 -8.264 1.490
237 HD1 TYR 28 HD2 TYR 28 -11.609 -9.389 -0.586
238 HD2 TYR 28 HD1 TYR 28 -11.565 -5.134 0.012
239 HE1 TYR 28 HE2 TYR 28 -9.821 -9.167 -2.288
240 HE2 TYR 28 HE1 TYR 28 -9.777 -4.914 -1.690
241 HH TYR 28 HH TYR 28 -9.103 -6.682 -3.885
242 H ALA 29 HN ALA 29 -14.894 -8.302 2.521
243 HA ALA 29 HA ALA 29 -16.208 -10.835 1.639
244 HB1 ALA 29 HB1 ALA 29 -13.873 -11.322 2.254
245 HB2 ALA 29 HB2 ALA 29 -14.984 -12.024 3.431
246 HB3 ALA 29 HB3 ALA 29 -14.116 -10.538 3.817
Start of MODEL 11
1 H1 ARG 1 HT1 ARG 1 18.567 3.158 -10.423
2 H2 ARG 1 HT2 ARG 1 20.239 2.872 -10.517
3 H3 ARG 1 HT3 ARG 1 19.603 3.823 -9.259
4 HA ARG 1 HA ARG 1 19.140 0.905 -9.653
5 HB2 ARG 1 HB2 ARG 1 21.371 2.158 -8.756
6 HB3 ARG 1 HB1 ARG 1 20.448 2.085 -7.255
7 HG2 ARG 1 HG2 ARG 1 20.055 -0.412 -7.887
8 HG3 ARG 1 HG1 ARG 1 21.423 -0.186 -8.977
9 HD2 ARG 1 HD2 ARG 1 22.931 0.208 -7.219
10 HD3 ARG 1 HD1 ARG 1 21.640 0.656 -6.085
11 HE ARG 1 HE ARG 1 20.952 -1.725 -6.042
12 HH11 ARG 1 HH21 ARG 1 23.738 -1.722 -4.987
13 HH12 ARG 1 HH22 ARG 1 24.503 -2.958 -5.926
14 HH21 ARG 1 HH11 ARG 1 22.014 -2.989 -8.369
15 HH22 ARG 1 HH12 ARG 1 23.516 -3.682 -7.862
16 H LEU 2 HN LEU 2 17.937 -0.038 -7.814
17 HA LEU 2 HA LEU 2 15.950 1.876 -6.631
18 HB2 LEU 2 HB2 LEU 2 15.659 -0.396 -8.207
19 HB3 LEU 2 HB1 LEU 2 15.354 -1.000 -6.579
20 HG LEU 2 HG LEU 2 14.003 1.488 -6.775
21 HD11 LEU 2 HD11 LEU 2 13.394 -0.342 -9.116
22 HD12 LEU 2 HD12 LEU 2 14.201 1.221 -9.242
23 HD13 LEU 2 HD13 LEU 2 12.528 1.135 -8.693
24 HD21 LEU 2 HD21 LEU 2 13.446 -0.682 -5.518
25 HD22 LEU 2 HD22 LEU 2 12.764 -1.263 -7.036
26 HD23 LEU 2 HD23 LEU 2 12.086 0.165 -6.253
27 H VAL 3 HN VAL 3 14.992 0.719 -4.482
28 HA VAL 3 HA VAL 3 17.202 0.593 -2.586
29 HB VAL 3 HB VAL 3 15.394 0.208 -0.929
30 HG11 VAL 3 HG11 VAL 3 14.383 2.318 -2.815
31 HG12 VAL 3 HG12 VAL 3 15.955 2.502 -2.035
32 HG13 VAL 3 HG13 VAL 3 14.495 2.358 -1.057
33 HG21 VAL 3 HG21 VAL 3 13.955 -0.682 -3.282
34 HG22 VAL 3 HG22 VAL 3 13.064 0.615 -2.485
35 HG23 VAL 3 HG23 VAL 3 13.507 -0.834 -1.584
36 HA PRO 4 HA PRO 4 17.704 -3.798 -2.489
37 HB2 PRO 4 HB2 PRO 4 18.674 -4.140 0.042
38 HB3 PRO 4 HB1 PRO 4 19.619 -3.387 -1.255
39 HG2 PRO 4 HG2 PRO 4 18.291 -2.148 1.058
40 HG3 PRO 4 HG1 PRO 4 19.713 -1.621 0.150
41 HD2 PRO 4 HD2 PRO 4 17.115 -0.594 -0.071
42 HD3 PRO 4 HD1 PRO 4 18.477 -0.282 -1.167
43 H GLY 5 HN GLY 5 17.270 -5.649 -0.512
44 HA2 GLY 5 HA2 GLY 5 14.492 -6.076 -0.410
45 HA3 GLY 5 HA1 GLY 5 15.642 -6.829 0.690
46 H ALA 6 HN ALA 6 16.538 -4.260 1.824
47 HA ALA 6 HA ALA 6 15.032 -3.973 4.134
48 HB1 ALA 6 HB1 ALA 6 16.116 -1.733 4.262
49 HB2 ALA 6 HB2 ALA 6 16.563 -1.888 2.563
50 HB3 ALA 6 HB3 ALA 6 17.236 -2.998 3.757
51 H ALA 7 HN ALA 7 14.737 -1.831 1.301
52 HA ALA 7 HA ALA 7 12.073 -0.928 2.304
53 HB1 ALA 7 HB1 ALA 7 13.363 0.957 1.934
54 HB2 ALA 7 HB2 ALA 7 12.588 0.800 0.358
55 HB3 ALA 7 HB3 ALA 7 14.237 0.224 0.591
56 H TYR 8 HN TYR 8 13.106 -3.327 0.290
57 HA TYR 8 HA TYR 8 11.448 -2.856 -2.054
58 HB2 TYR 8 HB2 TYR 8 13.424 -4.707 -1.182
59 HB3 TYR 8 HB1 TYR 8 11.983 -5.649 -1.552
60 HD1 TYR 8 HD2 TYR 8 10.701 -4.511 -3.774
61 HD2 TYR 8 HD1 TYR 8 14.918 -4.608 -2.960
62 HE1 TYR 8 HE2 TYR 8 11.177 -4.282 -6.195
63 HE2 TYR 8 HE1 TYR 8 15.391 -4.380 -5.381
64 HH TYR 8 HH TYR 8 13.734 -3.261 -7.481
65 H ALA 9 HN ALA 9 11.108 -4.695 0.943
66 HA ALA 9 HA ALA 9 8.461 -5.743 0.329
67 HB1 ALA 9 HB1 ALA 9 8.588 -6.655 2.529
68 HB2 ALA 9 HB2 ALA 9 9.695 -5.392 3.067
69 HB3 ALA 9 HB3 ALA 9 10.256 -6.641 1.956
70 H LEU 10 HN LEU 10 9.725 -3.010 2.172
71 HA LEU 10 HA LEU 10 7.270 -2.037 3.289
72 HB2 LEU 10 HB2 LEU 10 10.016 -1.314 3.173
73 HB3 LEU 10 HB1 LEU 10 9.112 0.085 2.610
74 HG LEU 10 HG LEU 10 9.396 0.220 5.025
75 HD11 LEU 10 HD11 LEU 10 6.531 -0.632 4.733
76 HD12 LEU 10 HD12 LEU 10 7.118 0.755 3.816
77 HD13 LEU 10 HD13 LEU 10 7.202 0.764 5.577
78 HD21 LEU 10 HD21 LEU 10 7.878 -2.397 5.199
79 HD22 LEU 10 HD22 LEU 10 8.603 -1.493 6.528
80 HD23 LEU 10 HD23 LEU 10 9.632 -2.276 5.329
81 H TYR 11 HN TYR 11 8.888 -1.407 0.182
82 HA TYR 11 HA TYR 11 6.869 0.538 -0.683
83 HB2 TYR 11 HB2 TYR 11 9.376 -0.706 -1.756
84 HB3 TYR 11 HB1 TYR 11 8.300 0.124 -2.873
85 HD1 TYR 11 HD1 TYR 11 9.763 0.656 0.556
86 HD2 TYR 11 HD2 TYR 11 8.669 2.401 -3.215
87 HE1 TYR 11 HE1 TYR 11 10.657 2.833 1.311
88 HE2 TYR 11 HE2 TYR 11 9.566 4.581 -2.455
89 HH TYR 11 HH TYR 11 11.615 5.070 -0.266
90 H GLY 12 HN GLY 12 6.689 -2.769 -0.407
91 HA2 GLY 12 HA2 GLY 12 5.184 -3.187 -2.936
92 HA3 GLY 12 HA1 GLY 12 5.753 -4.463 -1.859
93 H VAL 13 HN VAL 13 4.834 -3.350 0.611
94 HA VAL 13 HA VAL 13 2.009 -4.102 0.465
95 HB VAL 13 HB VAL 13 2.103 -3.939 2.904
96 HG11 VAL 13 HG11 VAL 13 3.551 -5.723 3.271
97 HG12 VAL 13 HG12 VAL 13 4.768 -5.103 2.156
98 HG13 VAL 13 HG13 VAL 13 3.288 -5.831 1.530
99 HG21 VAL 13 HG21 VAL 13 4.130 -3.172 4.059
100 HG22 VAL 13 HG22 VAL 13 3.488 -1.876 3.052
101 HG23 VAL 13 HG23 VAL 13 4.895 -2.795 2.515
102 H TRP 14 HN TRP 14 3.802 -1.117 0.653
103 HA TRP 14 HA TRP 14 1.853 0.660 1.688
104 HB2 TRP 14 HB2 TRP 14 4.248 1.159 1.303
105 HB3 TRP 14 HB1 TRP 14 3.969 1.147 -0.423
106 HD1 TRP 14 HD1 TRP 14 4.450 3.631 -0.904
107 HE1 TRP 14 HE1 TRP 14 3.275 5.837 -0.289
108 HE3 TRP 14 HE3 TRP 14 1.187 1.953 2.666
109 HZ2 TRP 14 HZ2 TRP 14 1.229 6.775 1.473
110 HZ3 TRP 14 HZ3 TRP 14 -0.354 3.522 3.787
111 HH2 TRP 14 HH2 TRP 14 -0.341 5.929 3.200
112 HA PRO 15 HA PRO 15 0.400 1.518 -2.834
113 HB2 PRO 15 HB2 PRO 15 0.926 -0.404 -4.717
114 HB3 PRO 15 HB1 PRO 15 1.980 0.994 -4.415
115 HG2 PRO 15 HG2 PRO 15 2.246 -1.807 -3.437
116 HG3 PRO 15 HG1 PRO 15 3.489 -0.707 -4.056
117 HD2 PRO 15 HD2 PRO 15 3.161 -1.149 -1.434
118 HD3 PRO 15 HD1 PRO 15 3.680 0.433 -2.049
119 H LEU 16 HN LEU 16 0.394 -1.792 -1.539
120 HA LEU 16 HA LEU 16 -2.176 -2.537 -2.668
121 HB2 LEU 16 HB2 LEU 16 -0.107 -3.773 -1.246
122 HB3 LEU 16 HB1 LEU 16 -1.450 -3.771 -0.106
123 HG LEU 16 HG LEU 16 -2.894 -4.722 -1.970
124 HD11 LEU 16 HD11 LEU 16 -1.476 -5.965 -3.723
125 HD12 LEU 16 HD12 LEU 16 -0.167 -4.878 -3.263
126 HD13 LEU 16 HD13 LEU 16 -1.660 -4.224 -3.936
127 HD21 LEU 16 HD21 LEU 16 -2.125 -6.990 -1.588
128 HD22 LEU 16 HD22 LEU 16 -1.860 -6.071 -0.106
129 HD23 LEU 16 HD23 LEU 16 -0.507 -6.421 -1.181
130 H LEU 17 HN LEU 17 -1.081 -1.190 0.404
131 HA LEU 17 HA LEU 17 -3.701 -0.941 1.615
132 HB2 LEU 17 HB2 LEU 17 -0.996 -0.555 2.332
133 HB3 LEU 17 HB1 LEU 17 -1.735 1.039 2.475
134 HG LEU 17 HG LEU 17 -3.608 -0.113 3.795
135 HD11 LEU 17 HD11 LEU 17 -2.863 -2.238 4.919
136 HD12 LEU 17 HD12 LEU 17 -1.516 -2.308 3.783
137 HD13 LEU 17 HD13 LEU 17 -3.174 -2.418 3.193
138 HD21 LEU 17 HD21 LEU 17 -0.778 -0.081 4.898
139 HD22 LEU 17 HD22 LEU 17 -2.243 -0.121 5.878
140 HD23 LEU 17 HD23 LEU 17 -1.896 1.283 4.869
141 H LEU 18 HN LEU 18 -1.654 1.114 -0.383
142 HA LEU 18 HA LEU 18 -3.171 3.549 -0.325
143 HB2 LEU 18 HB2 LEU 18 -1.237 2.185 -2.189
144 HB3 LEU 18 HB1 LEU 18 -2.070 3.622 -2.756
145 HG LEU 18 HG LEU 18 -0.481 3.497 -0.176
146 HD11 LEU 18 HD11 LEU 18 1.125 3.233 -1.906
147 HD12 LEU 18 HD12 LEU 18 1.129 4.960 -1.548
148 HD13 LEU 18 HD13 LEU 18 0.283 4.357 -2.973
149 HD21 LEU 18 HD21 LEU 18 -2.196 5.251 -0.206
150 HD22 LEU 18 HD22 LEU 18 -1.635 5.803 -1.784
151 HD23 LEU 18 HD23 LEU 18 -0.599 5.979 -0.368
152 H LEU 19 HN LEU 19 -3.288 0.653 -2.424
153 HA LEU 19 HA LEU 19 -5.471 1.484 -4.114
154 HB2 LEU 19 HB2 LEU 19 -3.678 -0.506 -4.153
155 HB3 LEU 19 HB1 LEU 19 -4.990 -1.382 -3.379
156 HG LEU 19 HG LEU 19 -5.562 0.219 -5.856
157 HD11 LEU 19 HD11 LEU 19 -4.442 -2.601 -5.811
158 HD12 LEU 19 HD12 LEU 19 -3.582 -1.174 -6.389
159 HD13 LEU 19 HD13 LEU 19 -5.021 -1.740 -7.236
160 HD21 LEU 19 HD21 LEU 19 -6.710 -2.166 -4.408
161 HD22 LEU 19 HD22 LEU 19 -7.105 -1.874 -6.101
162 HD23 LEU 19 HD23 LEU 19 -7.514 -0.670 -4.881
163 H LEU 20 HN LEU 20 -5.250 -0.487 -1.203
164 HA LEU 20 HA LEU 20 -7.996 -1.161 -0.822
165 HB2 LEU 20 HB2 LEU 20 -5.473 -1.111 0.694
166 HB3 LEU 20 HB1 LEU 20 -6.897 -0.930 1.711
167 HG LEU 20 HG LEU 20 -6.754 -3.084 -0.398
168 HD11 LEU 20 HD11 LEU 20 -4.796 -3.411 1.021
169 HD12 LEU 20 HD12 LEU 20 -6.015 -4.621 1.423
170 HD13 LEU 20 HD13 LEU 20 -5.780 -3.222 2.473
171 HD21 LEU 20 HD21 LEU 20 -8.308 -2.695 2.181
172 HD22 LEU 20 HD22 LEU 20 -8.364 -4.164 1.208
173 HD23 LEU 20 HD23 LEU 20 -8.956 -2.642 0.542
174 H LEU 21 HN LEU 21 -6.142 1.719 0.158
175 HA LEU 21 HA LEU 21 -8.102 2.937 1.837
176 HB2 LEU 21 HB2 LEU 21 -5.577 3.428 1.383
177 HB3 LEU 21 HB1 LEU 21 -6.186 4.478 0.106
178 HG LEU 21 HG LEU 21 -7.784 5.336 2.059
179 HD11 LEU 21 HD11 LEU 21 -6.713 3.574 3.604
180 HD12 LEU 21 HD12 LEU 21 -6.840 5.218 4.230
181 HD13 LEU 21 HD13 LEU 21 -5.296 4.625 3.618
182 HD21 LEU 21 HD21 LEU 21 -5.984 7.044 2.602
183 HD22 LEU 21 HD22 LEU 21 -6.293 6.818 0.881
184 HD23 LEU 21 HD23 LEU 21 -4.876 6.079 1.628
185 H ALA 22 HN ALA 22 -7.874 2.770 -1.649
186 HA ALA 22 HA ALA 22 -10.072 4.781 -1.942
187 HB1 ALA 22 HB1 ALA 22 -9.244 5.106 -4.143
188 HB2 ALA 22 HB2 ALA 22 -8.355 3.583 -4.117
189 HB3 ALA 22 HB3 ALA 22 -7.804 4.943 -3.138
190 H LEU 23 HN LEU 23 -10.205 1.685 -1.270
191 HA LEU 23 HA LEU 23 -12.247 1.047 -3.379
192 HB2 LEU 23 HB2 LEU 23 -9.796 -0.047 -3.099
193 HB3 LEU 23 HB1 LEU 23 -10.744 -1.115 -2.078
194 HG LEU 23 HG LEU 23 -10.671 -2.033 -4.340
195 HD11 LEU 23 HD11 LEU 23 -13.402 -0.787 -3.955
196 HD12 LEU 23 HD12 LEU 23 -12.821 -2.161 -3.014
197 HD13 LEU 23 HD13 LEU 23 -13.018 -2.308 -4.761
198 HD21 LEU 23 HD21 LEU 23 -11.419 -0.809 -6.275
199 HD22 LEU 23 HD22 LEU 23 -10.252 0.212 -5.436
200 HD23 LEU 23 HD23 LEU 23 -11.979 0.535 -5.282
201 HA PRO 24 HA PRO 24 -13.821 0.639 1.089
202 HB2 PRO 24 HB2 PRO 24 -15.623 2.692 0.994
203 HB3 PRO 24 HB1 PRO 24 -13.934 2.907 1.501
204 HG2 PRO 24 HG2 PRO 24 -15.201 3.502 -1.126
205 HG3 PRO 24 HG1 PRO 24 -13.980 4.419 -0.227
206 HD2 PRO 24 HD2 PRO 24 -13.355 2.806 -2.340
207 HD3 PRO 24 HD1 PRO 24 -12.244 3.123 -0.997
208 HA PRO 25 HA PRO 25 -17.200 -1.533 -0.871
209 HB2 PRO 25 HB2 PRO 25 -18.057 -2.923 1.314
210 HB3 PRO 25 HB1 PRO 25 -16.606 -3.347 0.387
211 HG2 PRO 25 HG2 PRO 25 -16.833 -2.078 3.028
212 HG3 PRO 25 HG1 PRO 25 -15.527 -3.052 2.345
213 HD2 PRO 25 HD2 PRO 25 -15.580 -0.254 2.600
214 HD3 PRO 25 HD1 PRO 25 -14.395 -1.223 1.698
215 H ARG 26 HN ARG 26 -18.353 -0.889 2.428
216 HA ARG 26 HA ARG 26 -20.698 0.565 1.262
217 HB2 ARG 26 HB2 ARG 26 -20.391 -1.615 3.111
218 HB3 ARG 26 HB1 ARG 26 -21.171 -0.270 3.939
219 HG2 ARG 26 HG2 ARG 26 -23.095 -0.898 2.957
220 HG3 ARG 26 HG1 ARG 26 -22.411 -0.342 1.431
221 HD2 ARG 26 HD2 ARG 26 -21.411 -2.998 2.137
222 HD3 ARG 26 HD1 ARG 26 -23.181 -2.966 2.006
223 HE ARG 26 HE ARG 26 -21.346 -1.998 -0.156
224 HH11 ARG 26 HH21 ARG 26 -22.676 -4.667 -0.455
225 HH12 ARG 26 HH22 ARG 26 -24.082 -4.276 -1.385
226 HH21 ARG 26 HH11 ARG 26 -23.876 -0.858 -0.724
227 HH22 ARG 26 HH12 ARG 26 -24.768 -2.097 -1.539
228 H ALA 27 HN ALA 27 -18.040 0.821 3.556
229 HA ALA 27 HA ALA 27 -19.142 3.277 4.798
230 HB1 ALA 27 HB1 ALA 27 -16.556 1.742 5.217
231 HB2 ALA 27 HB2 ALA 27 -18.045 1.489 6.128
232 HB3 ALA 27 HB3 ALA 27 -17.179 3.019 6.261
233 H TYR 28 HN TYR 28 -18.677 3.595 2.048
234 HA TYR 28 HA TYR 28 -16.043 4.839 1.623
235 HB2 TYR 28 HB2 TYR 28 -16.876 5.147 -0.669
236 HB3 TYR 28 HB1 TYR 28 -17.156 3.500 -0.126
237 HD1 TYR 28 HD1 TYR 28 -18.794 6.814 -0.647
238 HD2 TYR 28 HD2 TYR 28 -19.362 2.602 0.003
239 HE1 TYR 28 HE1 TYR 28 -21.208 7.061 -1.139
240 HE2 TYR 28 HE2 TYR 28 -21.777 2.855 -0.489
241 HH TYR 28 HH TYR 28 -23.367 5.727 -0.482
242 H ALA 29 HN ALA 29 -19.244 5.898 2.538
243 HA ALA 29 HA ALA 29 -20.074 7.971 3.179
244 HB1 ALA 29 HB1 ALA 29 -17.291 9.085 2.788
245 HB2 ALA 29 HB2 ALA 29 -17.675 8.029 4.148
246 HB3 ALA 29 HB3 ALA 29 -18.513 9.569 3.963
Start of MODEL 12
1 H1 ARG 1 HT1 ARG 1 15.282 2.955 -0.272
2 H2 ARG 1 HT2 ARG 1 16.085 3.259 -1.736
3 H3 ARG 1 HT3 ARG 1 16.466 4.165 -0.349
4 HA ARG 1 HA ARG 1 16.861 1.224 -0.549
5 HB2 ARG 1 HB2 ARG 1 19.310 1.938 -0.831
6 HB3 ARG 1 HB1 ARG 1 18.260 2.152 -2.225
7 HG2 ARG 1 HG2 ARG 1 18.030 4.539 -1.728
8 HG3 ARG 1 HG1 ARG 1 18.976 4.349 -0.250
9 HD2 ARG 1 HD2 ARG 1 20.971 3.831 -1.479
10 HD3 ARG 1 HD1 ARG 1 20.066 3.656 -2.997
11 HE ARG 1 HE ARG 1 20.520 6.246 -1.577
12 HH11 ARG 1 HH21 ARG 1 21.515 5.334 -4.387
13 HH12 ARG 1 HH22 ARG 1 20.474 6.275 -5.400
14 HH21 ARG 1 HH11 ARG 1 18.266 7.078 -2.827
15 HH22 ARG 1 HH12 ARG 1 18.620 7.269 -4.509
16 H LEU 2 HN LEU 2 16.685 0.577 1.544
17 HA LEU 2 HA LEU 2 18.411 1.815 3.603
18 HB2 LEU 2 HB2 LEU 2 16.029 2.923 3.330
19 HB3 LEU 2 HB1 LEU 2 15.476 1.496 4.203
20 HG LEU 2 HG LEU 2 17.515 2.140 5.806
21 HD11 LEU 2 HD11 LEU 2 16.672 4.775 4.561
22 HD12 LEU 2 HD12 LEU 2 18.269 4.037 4.452
23 HD13 LEU 2 HD13 LEU 2 17.667 4.610 6.007
24 HD21 LEU 2 HD21 LEU 2 14.818 3.540 5.792
25 HD22 LEU 2 HD22 LEU 2 15.885 3.403 7.190
26 HD23 LEU 2 HD23 LEU 2 15.157 1.957 6.492
27 H VAL 3 HN VAL 3 16.349 0.243 5.487
28 HA VAL 3 HA VAL 3 17.877 -2.113 5.843
29 HB VAL 3 HB VAL 3 15.866 -2.894 7.139
30 HG11 VAL 3 HG11 VAL 3 15.818 -0.584 8.516
31 HG12 VAL 3 HG12 VAL 3 17.227 -0.277 7.499
32 HG13 VAL 3 HG13 VAL 3 17.191 -1.690 8.553
33 HG21 VAL 3 HG21 VAL 3 14.023 -1.167 7.406
34 HG22 VAL 3 HG22 VAL 3 14.035 -2.001 5.855
35 HG23 VAL 3 HG23 VAL 3 14.660 -0.360 5.975
36 HA PRO 4 HA PRO 4 16.558 -4.800 2.638
37 HB2 PRO 4 HB2 PRO 4 16.800 -7.250 3.820
38 HB3 PRO 4 HB1 PRO 4 18.181 -6.260 3.310
39 HG2 PRO 4 HG2 PRO 4 17.042 -6.642 6.024
40 HG3 PRO 4 HG1 PRO 4 18.729 -6.467 5.516
41 HD2 PRO 4 HD2 PRO 4 17.256 -4.460 6.641
42 HD3 PRO 4 HD1 PRO 4 18.647 -4.196 5.567
43 H GLY 5 HN GLY 5 15.235 -7.017 4.994
44 HA2 GLY 5 HA2 GLY 5 12.752 -7.350 3.748
45 HA3 GLY 5 HA1 GLY 5 13.065 -7.745 5.430
46 H ALA 6 HN ALA 6 13.499 -5.106 6.441
47 HA ALA 6 HA ALA 6 10.800 -4.244 6.864
48 HB1 ALA 6 HB1 ALA 6 12.162 -3.713 8.621
49 HB2 ALA 6 HB2 ALA 6 12.226 -2.169 7.772
50 HB3 ALA 6 HB3 ALA 6 13.535 -3.335 7.583
51 H ALA 7 HN ALA 7 12.844 -3.538 4.196
52 HA ALA 7 HA ALA 7 11.091 -1.214 3.468
53 HB1 ALA 7 HB1 ALA 7 13.884 -1.479 2.417
54 HB2 ALA 7 HB2 ALA 7 13.669 -0.957 4.087
55 HB3 ALA 7 HB3 ALA 7 12.956 -0.023 2.774
56 H TYR 8 HN TYR 8 11.038 -4.242 2.810
57 HA TYR 8 HA TYR 8 11.139 -4.015 -0.174
58 HB2 TYR 8 HB2 TYR 8 12.097 -5.986 1.752
59 HB3 TYR 8 HB1 TYR 8 10.999 -6.722 0.588
60 HD1 TYR 8 HD2 TYR 8 11.410 -5.710 -1.944
61 HD2 TYR 8 HD1 TYR 8 14.344 -6.061 1.173
62 HE1 TYR 8 HE2 TYR 8 13.214 -5.709 -3.641
63 HE2 TYR 8 HE1 TYR 8 16.149 -6.060 -0.526
64 HH TYR 8 HH TYR 8 15.947 -6.791 -3.421
65 H ALA 9 HN ALA 9 9.461 -5.774 2.417
66 HA ALA 9 HA ALA 9 7.053 -6.278 0.903
67 HB1 ALA 9 HB1 ALA 9 7.470 -6.163 3.909
68 HB2 ALA 9 HB2 ALA 9 7.869 -7.561 2.909
69 HB3 ALA 9 HB3 ALA 9 6.193 -7.035 3.063
70 H LEU 10 HN LEU 10 8.028 -3.807 3.224
71 HA LEU 10 HA LEU 10 5.558 -2.365 3.465
72 HB2 LEU 10 HB2 LEU 10 8.212 -2.218 4.406
73 HB3 LEU 10 HB1 LEU 10 7.960 -0.707 3.545
74 HG LEU 10 HG LEU 10 7.344 -0.497 5.923
75 HD11 LEU 10 HD11 LEU 10 4.919 0.242 5.539
76 HD12 LEU 10 HD12 LEU 10 5.125 -0.318 3.880
77 HD13 LEU 10 HD13 LEU 10 6.145 0.976 4.507
78 HD21 LEU 10 HD21 LEU 10 5.591 -1.772 6.919
79 HD22 LEU 10 HD22 LEU 10 6.612 -2.948 6.091
80 HD23 LEU 10 HD23 LEU 10 5.087 -2.435 5.365
81 H TYR 11 HN TYR 11 8.262 -2.127 1.173
82 HA TYR 11 HA TYR 11 7.186 0.180 -0.246
83 HB2 TYR 11 HB2 TYR 11 9.450 -1.773 -0.599
84 HB3 TYR 11 HB1 TYR 11 9.051 -0.644 -1.892
85 HD1 TYR 11 HD1 TYR 11 9.544 -0.639 1.839
86 HD2 TYR 11 HD2 TYR 11 10.097 1.436 -1.879
87 HE1 TYR 11 HE1 TYR 11 10.754 1.158 3.030
88 HE2 TYR 11 HE2 TYR 11 11.312 3.238 -0.686
89 HH TYR 11 HH TYR 11 11.136 3.903 2.303
90 H GLY 12 HN GLY 12 6.914 -3.296 -0.521
91 HA2 GLY 12 HA2 GLY 12 5.861 -3.370 -3.214
92 HA3 GLY 12 HA1 GLY 12 5.762 -4.675 -2.032
93 H VAL 13 HN VAL 13 4.415 -2.905 -0.010
94 HA VAL 13 HA VAL 13 1.679 -3.228 -1.050
95 HB VAL 13 HB VAL 13 1.030 -2.722 1.283
96 HG11 VAL 13 HG11 VAL 13 3.249 -4.748 0.919
97 HG12 VAL 13 HG12 VAL 13 1.516 -5.022 0.744
98 HG13 VAL 13 HG13 VAL 13 2.197 -4.678 2.333
99 HG21 VAL 13 HG21 VAL 13 3.118 -1.174 1.598
100 HG22 VAL 13 HG22 VAL 13 3.951 -2.667 2.025
101 HG23 VAL 13 HG23 VAL 13 2.560 -2.135 2.966
102 H TRP 14 HN TRP 14 3.795 -0.757 -1.469
103 HA TRP 14 HA TRP 14 2.486 1.619 -0.654
104 HB2 TRP 14 HB2 TRP 14 4.770 1.483 -1.564
105 HB3 TRP 14 HB1 TRP 14 4.141 1.026 -3.128
106 HD1 TRP 14 HD1 TRP 14 5.046 3.106 -4.395
107 HE1 TRP 14 HE1 TRP 14 4.391 5.597 -4.413
108 HE3 TRP 14 HE3 TRP 14 2.089 3.290 -0.224
109 HZ2 TRP 14 HZ2 TRP 14 2.828 7.426 -2.873
110 HZ3 TRP 14 HZ3 TRP 14 1.035 5.412 0.469
111 HH2 TRP 14 HH2 TRP 14 1.398 7.482 -0.844
112 HA PRO 15 HA PRO 15 0.099 1.617 -4.844
113 HB2 PRO 15 HB2 PRO 15 -0.006 -0.720 -6.266
114 HB3 PRO 15 HB1 PRO 15 1.241 0.518 -6.522
115 HG2 PRO 15 HG2 PRO 15 1.397 -2.028 -4.992
116 HG3 PRO 15 HG1 PRO 15 2.600 -1.268 -6.048
117 HD2 PRO 15 HD2 PRO 15 2.726 -1.147 -3.352
118 HD3 PRO 15 HD1 PRO 15 3.363 0.139 -4.397
119 H LEU 16 HN LEU 16 0.116 -1.253 -2.782
120 HA LEU 16 HA LEU 16 -2.621 -2.064 -3.143
121 HB2 LEU 16 HB2 LEU 16 -0.401 -2.496 -1.198
122 HB3 LEU 16 HB1 LEU 16 -2.026 -2.823 -0.606
123 HG LEU 16 HG LEU 16 -2.360 -4.226 -2.725
124 HD11 LEU 16 HD11 LEU 16 0.653 -3.871 -2.781
125 HD12 LEU 16 HD12 LEU 16 -0.492 -3.419 -4.044
126 HD13 LEU 16 HD13 LEU 16 -0.211 -5.121 -3.676
127 HD21 LEU 16 HD21 LEU 16 -1.870 -5.087 -0.372
128 HD22 LEU 16 HD22 LEU 16 -0.181 -5.215 -0.865
129 HD23 LEU 16 HD23 LEU 16 -1.415 -6.172 -1.686
130 H LEU 17 HN LEU 17 -1.041 0.184 -0.906
131 HA LEU 17 HA LEU 17 -3.417 0.931 0.568
132 HB2 LEU 17 HB2 LEU 17 -0.711 1.374 0.788
133 HB3 LEU 17 HB1 LEU 17 -1.251 2.932 0.172
134 HG LEU 17 HG LEU 17 -1.232 2.957 2.615
135 HD11 LEU 17 HD11 LEU 17 -4.127 2.777 1.773
136 HD12 LEU 17 HD12 LEU 17 -3.084 4.112 1.279
137 HD13 LEU 17 HD13 LEU 17 -3.405 3.831 2.990
138 HD21 LEU 17 HD21 LEU 17 -3.220 0.669 2.437
139 HD22 LEU 17 HD22 LEU 17 -2.672 1.457 3.916
140 HD23 LEU 17 HD23 LEU 17 -1.538 0.515 2.949
141 H LEU 18 HN LEU 18 -1.802 2.120 -2.321
142 HA LEU 18 HA LEU 18 -3.456 4.422 -2.855
143 HB2 LEU 18 HB2 LEU 18 -1.423 2.730 -4.185
144 HB3 LEU 18 HB1 LEU 18 -2.568 3.457 -5.303
145 HG LEU 18 HG LEU 18 -2.113 5.677 -4.139
146 HD11 LEU 18 HD11 LEU 18 -1.013 4.360 -2.152
147 HD12 LEU 18 HD12 LEU 18 -0.321 5.902 -2.653
148 HD13 LEU 18 HD13 LEU 18 0.427 4.392 -3.170
149 HD21 LEU 18 HD21 LEU 18 -0.137 6.098 -5.447
150 HD22 LEU 18 HD22 LEU 18 -1.089 4.906 -6.332
151 HD23 LEU 18 HD23 LEU 18 0.323 4.396 -5.406
152 H LEU 19 HN LEU 19 -3.613 0.981 -3.733
153 HA LEU 19 HA LEU 19 -5.984 1.093 -5.379
154 HB2 LEU 19 HB2 LEU 19 -4.075 -0.819 -4.340
155 HB3 LEU 19 HB1 LEU 19 -5.699 -1.442 -4.098
156 HG LEU 19 HG LEU 19 -6.180 -0.962 -6.518
157 HD11 LEU 19 HD11 LEU 19 -3.287 -0.133 -6.390
158 HD12 LEU 19 HD12 LEU 19 -4.638 0.682 -7.176
159 HD13 LEU 19 HD13 LEU 19 -3.957 -0.778 -7.889
160 HD21 LEU 19 HD21 LEU 19 -4.647 -2.827 -7.360
161 HD22 LEU 19 HD22 LEU 19 -5.621 -3.221 -5.946
162 HD23 LEU 19 HD23 LEU 19 -3.914 -2.824 -5.757
163 H LEU 20 HN LEU 20 -5.328 0.488 -1.974
164 HA LEU 20 HA LEU 20 -7.964 -0.134 -1.041
165 HB2 LEU 20 HB2 LEU 20 -5.317 0.619 0.009
166 HB3 LEU 20 HB1 LEU 20 -6.637 1.165 1.034
167 HG LEU 20 HG LEU 20 -6.568 -1.662 -0.010
168 HD11 LEU 20 HD11 LEU 20 -4.419 -1.313 1.104
169 HD12 LEU 20 HD12 LEU 20 -5.464 -2.299 2.129
170 HD13 LEU 20 HD13 LEU 20 -5.231 -0.589 2.494
171 HD21 LEU 20 HD21 LEU 20 -7.621 -0.679 2.640
172 HD22 LEU 20 HD22 LEU 20 -8.119 -2.089 1.707
173 HD23 LEU 20 HD23 LEU 20 -8.581 -0.473 1.174
174 H LEU 21 HN LEU 21 -6.253 2.951 -1.534
175 HA LEU 21 HA LEU 21 -8.058 4.744 -0.290
176 HB2 LEU 21 HB2 LEU 21 -5.719 5.100 -1.281
177 HB3 LEU 21 HB1 LEU 21 -6.521 5.263 -2.841
178 HG LEU 21 HG LEU 21 -7.993 7.046 -1.722
179 HD11 LEU 21 HD11 LEU 21 -5.874 6.601 0.381
180 HD12 LEU 21 HD12 LEU 21 -7.622 6.714 0.588
181 HD13 LEU 21 HD13 LEU 21 -6.682 8.160 0.217
182 HD21 LEU 21 HD21 LEU 21 -6.095 7.510 -3.299
183 HD22 LEU 21 HD22 LEU 21 -5.016 7.620 -1.908
184 HD23 LEU 21 HD23 LEU 21 -6.327 8.784 -2.102
185 H ALA 22 HN ALA 22 -8.148 3.285 -3.507
186 HA ALA 22 HA ALA 22 -10.650 4.740 -4.206
187 HB1 ALA 22 HB1 ALA 22 -10.219 3.893 -6.422
188 HB2 ALA 22 HB2 ALA 22 -9.071 2.704 -5.804
189 HB3 ALA 22 HB3 ALA 22 -8.668 4.421 -5.767
190 H LEU 23 HN LEU 23 -10.298 2.371 -2.158
191 HA LEU 23 HA LEU 23 -12.438 0.589 -3.239
192 HB2 LEU 23 HB2 LEU 23 -9.799 0.159 -2.036
193 HB3 LEU 23 HB1 LEU 23 -11.055 -0.756 -1.226
194 HG LEU 23 HG LEU 23 -9.872 -1.934 -3.143
195 HD11 LEU 23 HD11 LEU 23 -12.830 -1.650 -3.647
196 HD12 LEU 23 HD12 LEU 23 -12.204 -2.460 -2.210
197 HD13 LEU 23 HD13 LEU 23 -11.819 -3.085 -3.813
198 HD21 LEU 23 HD21 LEU 23 -10.429 -1.363 -5.406
199 HD22 LEU 23 HD22 LEU 23 -9.888 0.128 -4.635
200 HD23 LEU 23 HD23 LEU 23 -11.610 -0.162 -4.882
201 HA PRO 24 HA PRO 24 -14.573 1.849 0.449
202 HB2 PRO 24 HB2 PRO 24 -16.571 -0.016 0.390
203 HB3 PRO 24 HB1 PRO 24 -16.478 1.352 -0.735
204 HG2 PRO 24 HG2 PRO 24 -16.000 -1.487 -1.220
205 HG3 PRO 24 HG1 PRO 24 -16.371 -0.190 -2.363
206 HD2 PRO 24 HD2 PRO 24 -13.830 -1.367 -1.790
207 HD3 PRO 24 HD1 PRO 24 -14.187 -0.065 -2.942
208 HA PRO 25 HA PRO 25 -12.611 -0.968 3.380
209 HB2 PRO 25 HB2 PRO 25 -12.963 0.603 5.587
210 HB3 PRO 25 HB1 PRO 25 -11.690 0.884 4.383
211 HG2 PRO 25 HG2 PRO 25 -14.295 2.264 4.729
212 HG3 PRO 25 HG1 PRO 25 -12.716 2.921 4.269
213 HD2 PRO 25 HD2 PRO 25 -14.722 2.425 2.493
214 HD3 PRO 25 HD1 PRO 25 -12.996 2.420 2.066
215 H ARG 26 HN ARG 26 -13.394 -1.510 5.854
216 HA ARG 26 HA ARG 26 -14.982 -2.492 7.267
217 HB2 ARG 26 HB2 ARG 26 -16.271 -0.332 6.072
218 HB3 ARG 26 HB1 ARG 26 -17.375 -1.678 5.797
219 HG2 ARG 26 HG2 ARG 26 -17.257 -2.236 8.218
220 HG3 ARG 26 HG1 ARG 26 -16.226 -0.829 8.474
221 HD2 ARG 26 HD2 ARG 26 -19.009 -0.662 7.266
222 HD3 ARG 26 HD1 ARG 26 -18.661 -0.389 8.984
223 HE ARG 26 HE ARG 26 -16.838 1.245 7.636
224 HH11 ARG 26 HH11 ARG 26 -18.877 1.576 5.518
225 HH12 ARG 26 HH12 ARG 26 -19.836 2.891 6.103
226 HH21 ARG 26 HH21 ARG 26 -18.665 2.620 9.375
227 HH22 ARG 26 HH22 ARG 26 -19.715 3.489 8.309
228 H ALA 27 HN ALA 27 -14.001 -3.756 4.681
229 HA ALA 27 HA ALA 27 -16.024 -5.950 4.575
230 HB1 ALA 27 HB1 ALA 27 -15.738 -5.932 2.082
231 HB2 ALA 27 HB2 ALA 27 -14.761 -4.471 2.240
232 HB3 ALA 27 HB3 ALA 27 -16.466 -4.446 2.695
233 H TYR 28 HN TYR 28 -14.051 -6.515 6.106
234 HA TYR 28 HA TYR 28 -12.186 -7.861 6.524
235 HB2 TYR 28 HB2 TYR 28 -13.062 -8.764 3.767
236 HB3 TYR 28 HB1 TYR 28 -11.750 -9.552 4.637
237 HD1 TYR 28 HD1 TYR 28 -12.169 -10.772 6.735
238 HD2 TYR 28 HD2 TYR 28 -15.370 -8.951 4.523
239 HE1 TYR 28 HE1 TYR 28 -13.819 -12.078 8.047
240 HE2 TYR 28 HE2 TYR 28 -17.018 -10.256 5.834
241 HH TYR 28 HH TYR 28 -16.593 -12.810 7.299
242 H ALA 29 HN ALA 29 -11.044 -5.718 6.443
243 HA ALA 29 HA ALA 29 -9.137 -4.469 5.920
244 HB1 ALA 29 HB1 ALA 29 -8.275 -6.648 4.044
245 HB2 ALA 29 HB2 ALA 29 -8.400 -6.999 5.767
246 HB3 ALA 29 HB3 ALA 29 -7.316 -5.729 5.203
Start of MODEL 13
1 H1 ARG 1 HT1 ARG 1 16.629 -3.804 -5.577
2 H2 ARG 1 HT2 ARG 1 16.919 -2.430 -6.530
3 H3 ARG 1 HT3 ARG 1 17.175 -2.374 -4.850
4 HA ARG 1 HA ARG 1 18.720 -4.074 -6.756
5 HB2 ARG 1 HB2 ARG 1 19.011 -1.309 -5.654
6 HB3 ARG 1 HB1 ARG 1 20.475 -2.277 -5.823
7 HG2 ARG 1 HG2 ARG 1 20.112 -2.574 -8.182
8 HG3 ARG 1 HG1 ARG 1 18.490 -1.889 -8.079
9 HD2 ARG 1 HD2 ARG 1 19.789 -0.092 -8.914
10 HD3 ARG 1 HD1 ARG 1 19.704 0.252 -7.177
11 HE ARG 1 HE ARG 1 22.002 -1.355 -8.193
12 HH11 ARG 1 HH11 ARG 1 22.012 -0.407 -5.389
13 HH12 ARG 1 HH12 ARG 1 22.956 1.041 -5.471
14 HH21 ARG 1 HH21 ARG 1 22.652 1.345 -8.930
15 HH22 ARG 1 HH22 ARG 1 23.322 2.042 -7.496
16 H LEU 2 HN LEU 2 18.733 -5.907 -5.387
17 HA LEU 2 HA LEU 2 19.310 -7.275 -3.574
18 HB2 LEU 2 HB2 LEU 2 21.482 -6.343 -4.437
19 HB3 LEU 2 HB1 LEU 2 21.396 -5.111 -3.179
20 HG LEU 2 HG LEU 2 21.137 -7.100 -1.534
21 HD11 LEU 2 HD11 LEU 2 20.731 -8.876 -3.125
22 HD12 LEU 2 HD12 LEU 2 22.303 -9.169 -2.382
23 HD13 LEU 2 HD13 LEU 2 22.209 -8.489 -4.007
24 HD21 LEU 2 HD21 LEU 2 23.633 -7.416 -1.503
25 HD22 LEU 2 HD22 LEU 2 23.142 -5.725 -1.592
26 HD23 LEU 2 HD23 LEU 2 23.715 -6.554 -3.039
27 H VAL 3 HN VAL 3 17.227 -6.599 -2.498
28 HA VAL 3 HA VAL 3 17.786 -5.103 0.038
29 HB VAL 3 HB VAL 3 15.409 -4.298 -0.137
30 HG11 VAL 3 HG11 VAL 3 17.462 -3.012 -0.918
31 HG12 VAL 3 HG12 VAL 3 15.932 -2.515 -1.639
32 HG13 VAL 3 HG13 VAL 3 17.052 -3.523 -2.555
33 HG21 VAL 3 HG21 VAL 3 14.272 -4.425 -2.308
34 HG22 VAL 3 HG22 VAL 3 14.587 -6.055 -1.714
35 HG23 VAL 3 HG23 VAL 3 15.605 -5.365 -2.979
36 HA PRO 4 HA PRO 4 16.258 -9.060 1.536
37 HB2 PRO 4 HB2 PRO 4 17.371 -8.862 4.017
38 HB3 PRO 4 HB1 PRO 4 18.294 -9.312 2.572
39 HG2 PRO 4 HG2 PRO 4 18.321 -6.815 4.095
40 HG3 PRO 4 HG1 PRO 4 19.543 -7.498 3.018
41 HD2 PRO 4 HD2 PRO 4 17.685 -5.418 2.446
42 HD3 PRO 4 HD1 PRO 4 18.866 -6.162 1.347
43 H GLY 5 HN GLY 5 14.083 -7.643 1.418
44 HA2 GLY 5 HA2 GLY 5 12.035 -7.561 2.652
45 HA3 GLY 5 HA1 GLY 5 12.953 -7.651 4.150
46 H ALA 6 HN ALA 6 14.768 -5.413 3.428
47 HA ALA 6 HA ALA 6 13.491 -3.218 4.595
48 HB1 ALA 6 HB1 ALA 6 15.665 -3.166 2.489
49 HB2 ALA 6 HB2 ALA 6 15.930 -3.539 4.192
50 HB3 ALA 6 HB3 ALA 6 15.369 -1.937 3.718
51 H ALA 7 HN ALA 7 13.847 -3.836 1.119
52 HA ALA 7 HA ALA 7 11.776 -1.737 0.574
53 HB1 ALA 7 HB1 ALA 7 14.136 -2.846 -0.945
54 HB2 ALA 7 HB2 ALA 7 13.793 -1.171 -0.519
55 HB3 ALA 7 HB3 ALA 7 12.857 -1.968 -1.784
56 H TYR 8 HN TYR 8 11.181 -4.507 1.427
57 HA TYR 8 HA TYR 8 9.916 -5.616 -1.049
58 HB2 TYR 8 HB2 TYR 8 11.585 -6.755 0.926
59 HB3 TYR 8 HB1 TYR 8 9.972 -7.386 1.254
60 HD1 TYR 8 HD2 TYR 8 8.657 -8.432 -0.670
61 HD2 TYR 8 HD1 TYR 8 12.858 -7.558 -0.904
62 HE1 TYR 8 HE2 TYR 8 8.876 -9.990 -2.584
63 HE2 TYR 8 HE1 TYR 8 13.075 -9.118 -2.819
64 HH TYR 8 HH TYR 8 10.793 -10.071 -4.678
65 H ALA 9 HN ALA 9 9.418 -5.260 2.449
66 HA ALA 9 HA ALA 9 6.526 -5.622 2.290
67 HB1 ALA 9 HB1 ALA 9 8.337 -4.538 4.476
68 HB2 ALA 9 HB2 ALA 9 7.878 -6.230 4.277
69 HB3 ALA 9 HB3 ALA 9 6.657 -5.028 4.698
70 H LEU 10 HN LEU 10 8.741 -2.906 2.713
71 HA LEU 10 HA LEU 10 6.868 -0.769 2.985
72 HB2 LEU 10 HB2 LEU 10 9.644 -1.143 2.835
73 HB3 LEU 10 HB1 LEU 10 9.275 -0.117 1.451
74 HG LEU 10 HG LEU 10 8.136 0.506 4.171
75 HD11 LEU 10 HD11 LEU 10 10.041 1.777 4.759
76 HD12 LEU 10 HD12 LEU 10 10.711 1.691 3.130
77 HD13 LEU 10 HD13 LEU 10 10.709 0.259 4.159
78 HD21 LEU 10 HD21 LEU 10 8.860 2.208 1.759
79 HD22 LEU 10 HD22 LEU 10 8.058 2.778 3.224
80 HD23 LEU 10 HD23 LEU 10 7.234 1.646 2.151
81 H TYR 11 HN TYR 11 8.481 -2.076 0.071
82 HA TYR 11 HA TYR 11 7.098 -0.369 -1.808
83 HB2 TYR 11 HB2 TYR 11 8.897 -2.752 -1.864
84 HB3 TYR 11 HB1 TYR 11 8.010 -2.365 -3.335
85 HD1 TYR 11 HD1 TYR 11 10.312 -0.922 -0.774
86 HD2 TYR 11 HD2 TYR 11 8.673 -0.559 -4.729
87 HE1 TYR 11 HE1 TYR 11 11.924 0.892 -1.276
88 HE2 TYR 11 HE2 TYR 11 10.286 1.255 -5.228
89 HH TYR 11 HH TYR 11 11.638 3.040 -3.516
90 H GLY 12 HN GLY 12 6.431 -3.564 -0.488
91 HA2 GLY 12 HA2 GLY 12 4.310 -4.204 -2.370
92 HA3 GLY 12 HA1 GLY 12 4.667 -5.075 -0.881
93 H VAL 13 HN VAL 13 4.437 -2.803 0.903
94 HA VAL 13 HA VAL 13 1.533 -2.749 1.215
95 HB VAL 13 HB VAL 13 3.895 -1.607 2.718
96 HG11 VAL 13 HG11 VAL 13 0.956 -1.183 3.165
97 HG12 VAL 13 HG12 VAL 13 2.294 -0.054 3.377
98 HG13 VAL 13 HG13 VAL 13 2.027 -1.334 4.559
99 HG21 VAL 13 HG21 VAL 13 3.195 -4.135 2.655
100 HG22 VAL 13 HG22 VAL 13 1.896 -3.615 3.728
101 HG23 VAL 13 HG23 VAL 13 3.578 -3.385 4.204
102 H TRP 14 HN TRP 14 3.869 -0.611 -0.237
103 HA TRP 14 HA TRP 14 2.576 1.893 0.079
104 HB2 TRP 14 HB2 TRP 14 4.841 0.930 -1.189
105 HB3 TRP 14 HB1 TRP 14 3.858 1.526 -2.529
106 HD1 TRP 14 HD1 TRP 14 6.067 2.697 0.215
107 HE1 TRP 14 HE1 TRP 14 5.998 5.275 0.374
108 HE3 TRP 14 HE3 TRP 14 2.082 3.660 -2.823
109 HZ2 TRP 14 HZ2 TRP 14 4.435 7.453 -0.664
110 HZ3 TRP 14 HZ3 TRP 14 1.336 5.984 -3.216
111 HH2 TRP 14 HH2 TRP 14 2.502 7.877 -2.145
112 HA PRO 15 HA PRO 15 0.101 1.209 -3.936
113 HB2 PRO 15 HB2 PRO 15 -0.049 -1.289 -5.023
114 HB3 PRO 15 HB1 PRO 15 1.207 -0.114 -5.466
115 HG2 PRO 15 HG2 PRO 15 1.371 -2.460 -3.657
116 HG3 PRO 15 HG1 PRO 15 2.574 -1.808 -4.780
117 HD2 PRO 15 HD2 PRO 15 2.634 -1.412 -2.078
118 HD3 PRO 15 HD1 PRO 15 3.378 -0.318 -3.264
119 H LEU 16 HN LEU 16 0.086 -1.115 -1.311
120 HA LEU 16 HA LEU 16 -2.673 -1.989 -1.732
121 HB2 LEU 16 HB2 LEU 16 -0.405 -2.606 0.005
122 HB3 LEU 16 HB1 LEU 16 -1.941 -2.616 0.874
123 HG LEU 16 HG LEU 16 -2.760 -3.983 -1.246
124 HD11 LEU 16 HD11 LEU 16 -1.094 -5.254 -2.337
125 HD12 LEU 16 HD12 LEU 16 0.126 -4.857 -1.128
126 HD13 LEU 16 HD13 LEU 16 -0.411 -3.629 -2.274
127 HD21 LEU 16 HD21 LEU 16 -0.966 -5.459 0.677
128 HD22 LEU 16 HD22 LEU 16 -2.545 -5.933 0.050
129 HD23 LEU 16 HD23 LEU 16 -2.424 -4.660 1.264
130 H LEU 17 HN LEU 17 -1.177 -0.031 0.884
131 HA LEU 17 HA LEU 17 -3.719 0.741 1.952
132 HB2 LEU 17 HB2 LEU 17 -2.506 1.955 3.501
133 HB3 LEU 17 HB1 LEU 17 -1.285 0.839 2.942
134 HG LEU 17 HG LEU 17 -0.332 3.040 3.163
135 HD11 LEU 17 HD11 LEU 17 0.911 2.438 1.424
136 HD12 LEU 17 HD12 LEU 17 -0.134 3.451 0.432
137 HD13 LEU 17 HD13 LEU 17 -0.462 1.728 0.583
138 HD21 LEU 17 HD21 LEU 17 -1.895 4.338 1.019
139 HD22 LEU 17 HD22 LEU 17 -1.284 4.999 2.534
140 HD23 LEU 17 HD23 LEU 17 -2.775 4.060 2.523
141 H LEU 18 HN LEU 18 -1.923 1.979 -0.733
142 HA LEU 18 HA LEU 18 -3.312 4.516 -1.004
143 HB2 LEU 18 HB2 LEU 18 -1.158 3.119 -2.182
144 HB3 LEU 18 HB1 LEU 18 -2.328 3.314 -3.480
145 HG LEU 18 HG LEU 18 -2.471 5.781 -2.772
146 HD11 LEU 18 HD11 LEU 18 -0.307 6.569 -1.673
147 HD12 LEU 18 HD12 LEU 18 -0.012 4.887 -1.241
148 HD13 LEU 18 HD13 LEU 18 -1.427 5.724 -0.607
149 HD21 LEU 18 HD21 LEU 18 0.109 4.630 -3.880
150 HD22 LEU 18 HD22 LEU 18 -0.364 6.325 -4.007
151 HD23 LEU 18 HD23 LEU 18 -1.321 5.081 -4.809
152 H LEU 19 HN LEU 19 -3.757 1.194 -2.213
153 HA LEU 19 HA LEU 19 -5.997 1.713 -3.962
154 HB2 LEU 19 HB2 LEU 19 -4.345 -0.336 -3.614
155 HB3 LEU 19 HB1 LEU 19 -5.584 -0.873 -2.489
156 HG LEU 19 HG LEU 19 -7.175 -0.227 -4.559
157 HD11 LEU 19 HD11 LEU 19 -4.532 -1.052 -5.799
158 HD12 LEU 19 HD12 LEU 19 -5.357 0.490 -6.022
159 HD13 LEU 19 HD13 LEU 19 -6.070 -0.990 -6.661
160 HD21 LEU 19 HD21 LEU 19 -5.768 -2.710 -3.720
161 HD22 LEU 19 HD22 LEU 19 -6.540 -2.758 -5.304
162 HD23 LEU 19 HD23 LEU 19 -7.497 -2.390 -3.869
163 H LEU 20 HN LEU 20 -5.693 0.567 -0.640
164 HA LEU 20 HA LEU 20 -8.429 0.200 0.047
165 HB2 LEU 20 HB2 LEU 20 -5.898 0.137 1.273
166 HB3 LEU 20 HB1 LEU 20 -6.816 1.307 2.207
167 HG LEU 20 HG LEU 20 -7.115 -0.916 3.160
168 HD11 LEU 20 HD11 LEU 20 -9.066 0.780 2.910
169 HD12 LEU 20 HD12 LEU 20 -9.450 -0.878 3.373
170 HD13 LEU 20 HD13 LEU 20 -9.691 -0.349 1.708
171 HD21 LEU 20 HD21 LEU 20 -6.766 -2.490 1.482
172 HD22 LEU 20 HD22 LEU 20 -7.749 -1.617 0.308
173 HD23 LEU 20 HD23 LEU 20 -8.524 -2.527 1.602
174 H LEU 21 HN LEU 21 -6.416 3.129 0.168
175 HA LEU 21 HA LEU 21 -8.167 4.915 1.484
176 HB2 LEU 21 HB2 LEU 21 -5.748 5.208 0.862
177 HB3 LEU 21 HB1 LEU 21 -6.268 5.513 -0.793
178 HG LEU 21 HG LEU 21 -7.688 7.122 1.238
179 HD11 LEU 21 HD11 LEU 21 -5.350 7.011 2.163
180 HD12 LEU 21 HD12 LEU 21 -5.850 8.633 1.685
181 HD13 LEU 21 HD13 LEU 21 -4.771 7.701 0.647
182 HD21 LEU 21 HD21 LEU 21 -7.118 8.905 -0.457
183 HD22 LEU 21 HD22 LEU 21 -8.003 7.537 -1.131
184 HD23 LEU 21 HD23 LEU 21 -6.263 7.672 -1.385
185 H ALA 22 HN ALA 22 -8.132 3.914 -1.903
186 HA ALA 22 HA ALA 22 -10.490 5.687 -2.453
187 HB1 ALA 22 HB1 ALA 22 -9.723 5.766 -4.676
188 HB2 ALA 22 HB2 ALA 22 -8.774 4.291 -4.496
189 HB3 ALA 22 HB3 ALA 22 -8.235 5.786 -3.729
190 H LEU 23 HN LEU 23 -10.522 2.854 -1.185
191 HA LEU 23 HA LEU 23 -12.212 1.533 -3.275
192 HB2 LEU 23 HB2 LEU 23 -10.046 0.436 -2.610
193 HB3 LEU 23 HB1 LEU 23 -10.717 0.261 -0.990
194 HG LEU 23 HG LEU 23 -12.729 -0.878 -2.208
195 HD11 LEU 23 HD11 LEU 23 -11.628 -0.183 -4.474
196 HD12 LEU 23 HD12 LEU 23 -12.339 -1.792 -4.335
197 HD13 LEU 23 HD13 LEU 23 -10.593 -1.585 -4.209
198 HD21 LEU 23 HD21 LEU 23 -10.666 -1.844 -0.796
199 HD22 LEU 23 HD22 LEU 23 -10.266 -2.570 -2.354
200 HD23 LEU 23 HD23 LEU 23 -11.822 -2.910 -1.593
201 HA PRO 24 HA PRO 24 -15.377 2.179 -0.252
202 HB2 PRO 24 HB2 PRO 24 -17.447 1.280 -1.807
203 HB3 PRO 24 HB1 PRO 24 -16.706 2.885 -1.919
204 HG2 PRO 24 HG2 PRO 24 -16.472 0.602 -3.735
205 HG3 PRO 24 HG1 PRO 24 -16.192 2.317 -4.027
206 HD2 PRO 24 HD2 PRO 24 -14.230 0.310 -3.599
207 HD3 PRO 24 HD1 PRO 24 -13.964 2.048 -3.784
208 HA PRO 25 HA PRO 25 -16.960 -2.194 0.575
209 HB2 PRO 25 HB2 PRO 25 -16.293 -4.314 -1.010
210 HB3 PRO 25 HB1 PRO 25 -17.725 -3.304 -1.298
211 HG2 PRO 25 HG2 PRO 25 -15.090 -3.275 -2.656
212 HG3 PRO 25 HG1 PRO 25 -16.712 -3.022 -3.322
213 HD2 PRO 25 HD2 PRO 25 -14.952 -1.012 -2.781
214 HD3 PRO 25 HD1 PRO 25 -16.717 -0.813 -2.819
215 H ARG 26 HN ARG 26 -15.811 -4.547 1.069
216 HA ARG 26 HA ARG 26 -14.086 -5.646 2.195
217 HB2 ARG 26 HB2 ARG 26 -12.659 -4.015 0.106
218 HB3 ARG 26 HB1 ARG 26 -11.762 -5.045 1.214
219 HG2 ARG 26 HG2 ARG 26 -12.308 -6.884 0.039
220 HG3 ARG 26 HG1 ARG 26 -14.024 -6.500 0.161
221 HD2 ARG 26 HD2 ARG 26 -13.566 -6.503 -2.182
222 HD3 ARG 26 HD1 ARG 26 -13.583 -4.785 -1.738
223 HE ARG 26 HE ARG 26 -11.056 -4.987 -1.508
224 HH11 ARG 26 HH21 ARG 26 -11.746 -4.960 -4.390
225 HH12 ARG 26 HH22 ARG 26 -10.931 -6.362 -4.996
226 HH21 ARG 26 HH11 ARG 26 -10.489 -7.775 -1.838
227 HH22 ARG 26 HH12 ARG 26 -10.212 -7.973 -3.535
228 H ALA 27 HN ALA 27 -15.066 -3.833 3.818
229 HA ALA 27 HA ALA 27 -12.787 -2.211 4.909
230 HB1 ALA 27 HB1 ALA 27 -14.629 -0.911 5.979
231 HB2 ALA 27 HB2 ALA 27 -15.801 -1.995 5.232
232 HB3 ALA 27 HB3 ALA 27 -14.789 -0.961 4.223
233 H TYR 28 HN TYR 28 -12.757 -4.966 5.441
234 HA TYR 28 HA TYR 28 -12.917 -5.020 8.361
235 HB2 TYR 28 HB2 TYR 28 -14.545 -6.898 8.441
236 HB3 TYR 28 HB1 TYR 28 -15.250 -5.426 7.790
237 HD1 TYR 28 HD1 TYR 28 -15.639 -5.209 5.324
238 HD2 TYR 28 HD2 TYR 28 -14.317 -8.885 7.109
239 HE1 TYR 28 HE1 TYR 28 -16.286 -6.438 3.271
240 HE2 TYR 28 HE2 TYR 28 -14.965 -10.114 5.055
241 HH TYR 28 HH TYR 28 -16.891 -9.425 3.033
242 H ALA 29 HN ALA 29 -12.445 -6.962 5.375
243 HA ALA 29 HA ALA 29 -10.471 -8.656 6.863
244 HB1 ALA 29 HB1 ALA 29 -12.004 -9.115 4.285
245 HB2 ALA 29 HB2 ALA 29 -12.403 -9.806 5.857
246 HB3 ALA 29 HB3 ALA 29 -10.911 -10.272 5.042
Start of MODEL 14
1 H1 ARG 1 HT1 ARG 1 22.724 4.735 -0.967
2 H2 ARG 1 HT2 ARG 1 21.122 5.200 -0.649
3 H3 ARG 1 HT3 ARG 1 22.139 6.215 -1.553
4 HA ARG 1 HA ARG 1 20.520 4.988 -2.959
5 HB2 ARG 1 HB2 ARG 1 23.497 4.901 -3.125
6 HB3 ARG 1 HB1 ARG 1 22.609 3.931 -4.300
7 HG2 ARG 1 HG2 ARG 1 21.295 5.921 -4.954
8 HG3 ARG 1 HG1 ARG 1 22.202 6.896 -3.797
9 HD2 ARG 1 HD2 ARG 1 23.674 5.309 -5.899
10 HD3 ARG 1 HD1 ARG 1 22.992 6.900 -6.289
11 HE ARG 1 HE ARG 1 24.988 6.427 -4.106
12 HH11 ARG 1 HH21 ARG 1 25.929 7.784 -6.560
13 HH12 ARG 1 HH22 ARG 1 25.753 9.460 -6.170
14 HH21 ARG 1 HH11 ARG 1 23.612 8.873 -3.484
15 HH22 ARG 1 HH12 ARG 1 24.428 10.083 -4.412
16 H LEU 2 HN LEU 2 19.643 2.999 -3.530
17 HA LEU 2 HA LEU 2 19.101 0.730 -3.435
18 HB2 LEU 2 HB2 LEU 2 21.767 0.873 -3.914
19 HB3 LEU 2 HB1 LEU 2 21.784 -0.025 -2.397
20 HG LEU 2 HG LEU 2 19.992 -0.810 -4.704
21 HD11 LEU 2 HD11 LEU 2 22.175 -0.959 -5.643
22 HD12 LEU 2 HD12 LEU 2 21.794 -2.591 -5.096
23 HD13 LEU 2 HD13 LEU 2 22.864 -1.567 -4.139
24 HD21 LEU 2 HD21 LEU 2 20.271 -3.061 -3.495
25 HD22 LEU 2 HD22 LEU 2 19.326 -1.837 -2.648
26 HD23 LEU 2 HD23 LEU 2 20.997 -2.144 -2.175
27 H VAL 3 HN VAL 3 17.630 0.697 -1.746
28 HA VAL 3 HA VAL 3 18.285 0.960 1.046
29 HB VAL 3 HB VAL 3 15.964 0.066 1.367
30 HG11 VAL 3 HG11 VAL 3 14.957 1.878 -0.324
31 HG12 VAL 3 HG12 VAL 3 16.657 2.332 -0.437
32 HG13 VAL 3 HG13 VAL 3 15.844 2.340 1.127
33 HG21 VAL 3 HG21 VAL 3 14.922 -1.135 -0.235
34 HG22 VAL 3 HG22 VAL 3 16.419 -1.110 -1.164
35 HG23 VAL 3 HG23 VAL 3 15.195 0.131 -1.431
36 HA PRO 4 HA PRO 4 19.516 -3.216 1.917
37 HB2 PRO 4 HB2 PRO 4 19.333 -3.133 4.635
38 HB3 PRO 4 HB1 PRO 4 20.581 -2.268 3.721
39 HG2 PRO 4 HG2 PRO 4 18.272 -1.214 5.151
40 HG3 PRO 4 HG1 PRO 4 19.740 -0.391 4.613
41 HD2 PRO 4 HD2 PRO 4 17.139 -0.377 3.398
42 HD3 PRO 4 HD1 PRO 4 18.600 0.505 2.902
43 H GLY 5 HN GLY 5 16.599 -2.965 1.249
44 HA2 GLY 5 HA2 GLY 5 14.968 -4.732 1.262
45 HA3 GLY 5 HA1 GLY 5 15.641 -5.315 2.782
46 H ALA 6 HN ALA 6 15.625 -2.765 4.162
47 HA ALA 6 HA ALA 6 13.184 -2.715 5.480
48 HB1 ALA 6 HB1 ALA 6 15.187 -0.535 4.894
49 HB2 ALA 6 HB2 ALA 6 15.097 -1.562 6.325
50 HB3 ALA 6 HB3 ALA 6 13.866 -0.332 6.044
51 H ALA 7 HN ALA 7 14.054 -0.549 2.791
52 HA ALA 7 HA ALA 7 11.180 0.216 2.499
53 HB1 ALA 7 HB1 ALA 7 13.841 1.424 1.853
54 HB2 ALA 7 HB2 ALA 7 12.425 2.163 2.599
55 HB3 ALA 7 HB3 ALA 7 12.462 1.891 0.858
56 H TYR 8 HN TYR 8 12.326 -2.409 1.534
57 HA TYR 8 HA TYR 8 11.942 -2.093 -1.416
58 HB2 TYR 8 HB2 TYR 8 14.030 -3.188 -0.050
59 HB3 TYR 8 HB1 TYR 8 13.010 -4.609 -0.247
60 HD1 TYR 8 HD1 TYR 8 14.139 -1.664 -2.305
61 HD2 TYR 8 HD2 TYR 8 13.354 -5.885 -2.155
62 HE1 TYR 8 HE1 TYR 8 14.889 -1.888 -4.657
63 HE2 TYR 8 HE2 TYR 8 14.104 -6.106 -4.506
64 HH TYR 8 HH TYR 8 15.900 -4.341 -6.036
65 H ALA 9 HN ALA 9 11.391 -4.488 1.145
66 HA ALA 9 HA ALA 9 9.204 -5.829 -0.173
67 HB1 ALA 9 HB1 ALA 9 10.065 -5.669 2.732
68 HB2 ALA 9 HB2 ALA 9 10.567 -6.889 1.561
69 HB3 ALA 9 HB3 ALA 9 8.891 -6.827 2.108
70 H LEU 10 HN LEU 10 9.380 -3.318 2.294
71 HA LEU 10 HA LEU 10 6.599 -2.993 2.876
72 HB2 LEU 10 HB2 LEU 10 9.057 -1.855 3.608
73 HB3 LEU 10 HB1 LEU 10 8.162 -0.520 2.889
74 HG LEU 10 HG LEU 10 6.946 -2.345 4.974
75 HD11 LEU 10 HD11 LEU 10 9.054 -1.066 5.722
76 HD12 LEU 10 HD12 LEU 10 7.590 -0.822 6.673
77 HD13 LEU 10 HD13 LEU 10 8.096 0.398 5.505
78 HD21 LEU 10 HD21 LEU 10 5.320 -0.553 5.190
79 HD22 LEU 10 HD22 LEU 10 5.459 -0.952 3.479
80 HD23 LEU 10 HD23 LEU 10 6.256 0.487 4.117
81 H TYR 11 HN TYR 11 8.708 -1.392 0.483
82 HA TYR 11 HA TYR 11 6.728 0.361 -0.633
83 HB2 TYR 11 HB2 TYR 11 9.410 -0.724 -1.426
84 HB3 TYR 11 HB1 TYR 11 8.469 0.163 -2.620
85 HD1 TYR 11 HD1 TYR 11 8.967 0.613 1.092
86 HD2 TYR 11 HD2 TYR 11 9.289 2.330 -2.836
87 HE1 TYR 11 HE1 TYR 11 9.698 2.756 2.089
88 HE2 TYR 11 HE2 TYR 11 10.021 4.475 -1.832
89 HH TYR 11 HH TYR 11 11.255 4.885 0.932
90 H GLY 12 HN GLY 12 7.497 -3.007 -1.217
91 HA2 GLY 12 HA2 GLY 12 6.149 -3.299 -3.744
92 HA3 GLY 12 HA1 GLY 12 6.546 -4.615 -2.638
93 H VAL 13 HN VAL 13 5.101 -3.752 -0.354
94 HA VAL 13 HA VAL 13 2.350 -4.380 -1.240
95 HB VAL 13 HB VAL 13 1.947 -4.753 1.168
96 HG11 VAL 13 HG11 VAL 13 3.396 -6.680 1.425
97 HG12 VAL 13 HG12 VAL 13 4.540 -6.024 0.254
98 HG13 VAL 13 HG13 VAL 13 2.935 -6.535 -0.271
99 HG21 VAL 13 HG21 VAL 13 3.754 -2.921 1.772
100 HG22 VAL 13 HG22 VAL 13 4.869 -4.287 1.723
101 HG23 VAL 13 HG23 VAL 13 3.509 -4.299 2.845
102 H TRP 14 HN TRP 14 4.051 -1.530 -0.694
103 HA TRP 14 HA TRP 14 2.326 0.137 0.792
104 HB2 TRP 14 HB2 TRP 14 4.608 0.696 -0.020
105 HB3 TRP 14 HB1 TRP 14 3.982 0.837 -1.650
106 HD1 TRP 14 HD1 TRP 14 3.894 3.312 -2.198
107 HE1 TRP 14 HE1 TRP 14 2.990 5.427 -1.038
108 HE3 TRP 14 HE3 TRP 14 2.505 1.333 2.300
109 HZ2 TRP 14 HZ2 TRP 14 1.832 6.184 1.466
110 HZ3 TRP 14 HZ3 TRP 14 1.505 2.770 4.048
111 HH2 TRP 14 HH2 TRP 14 1.167 5.189 3.641
112 HA PRO 15 HA PRO 15 0.000 1.260 -3.256
113 HB2 PRO 15 HB2 PRO 15 0.214 -0.431 -5.393
114 HB3 PRO 15 HB1 PRO 15 1.270 0.975 -5.146
115 HG2 PRO 15 HG2 PRO 15 1.796 -1.899 -4.593
116 HG3 PRO 15 HG1 PRO 15 2.876 -0.656 -5.248
117 HD2 PRO 15 HD2 PRO 15 2.964 -1.490 -2.675
118 HD3 PRO 15 HD1 PRO 15 3.433 0.148 -3.172
119 H LEU 16 HN LEU 16 0.336 -2.095 -2.217
120 HA LEU 16 HA LEU 16 -2.284 -2.987 -3.058
121 HB2 LEU 16 HB2 LEU 16 -0.070 -3.933 -1.288
122 HB3 LEU 16 HB1 LEU 16 -1.661 -4.642 -1.020
123 HG LEU 16 HG LEU 16 -1.677 -4.980 -3.614
124 HD11 LEU 16 HD11 LEU 16 0.373 -3.633 -4.014
125 HD12 LEU 16 HD12 LEU 16 0.557 -5.292 -4.578
126 HD13 LEU 16 HD13 LEU 16 1.301 -4.790 -3.061
127 HD21 LEU 16 HD21 LEU 16 -1.512 -6.754 -1.813
128 HD22 LEU 16 HD22 LEU 16 0.243 -6.637 -1.949
129 HD23 LEU 16 HD23 LEU 16 -0.715 -7.177 -3.328
130 H LEU 17 HN LEU 17 -1.029 -1.904 0.103
131 HA LEU 17 HA LEU 17 -3.670 -1.898 1.310
132 HB2 LEU 17 HB2 LEU 17 -2.558 -1.024 3.243
133 HB3 LEU 17 HB1 LEU 17 -1.411 -2.119 2.486
134 HG LEU 17 HG LEU 17 -0.873 0.340 1.279
135 HD11 LEU 17 HD11 LEU 17 -0.591 1.894 3.171
136 HD12 LEU 17 HD12 LEU 17 -1.329 0.716 4.256
137 HD13 LEU 17 HD13 LEU 17 -2.289 1.457 2.975
138 HD21 LEU 17 HD21 LEU 17 1.014 0.206 3.221
139 HD22 LEU 17 HD22 LEU 17 1.025 -0.835 1.799
140 HD23 LEU 17 HD23 LEU 17 0.366 -1.431 3.320
141 H LEU 18 HN LEU 18 -1.791 0.382 -0.528
142 HA LEU 18 HA LEU 18 -3.299 2.788 0.056
143 HB2 LEU 18 HB2 LEU 18 -1.334 1.781 -1.974
144 HB3 LEU 18 HB1 LEU 18 -2.281 3.186 -2.422
145 HG LEU 18 HG LEU 18 0.080 3.370 -1.157
146 HD11 LEU 18 HD11 LEU 18 -1.008 5.546 -0.087
147 HD12 LEU 18 HD12 LEU 18 -2.357 5.080 -1.122
148 HD13 LEU 18 HD13 LEU 18 -0.768 5.385 -1.826
149 HD21 LEU 18 HD21 LEU 18 -1.803 3.680 1.177
150 HD22 LEU 18 HD22 LEU 18 -0.047 3.542 1.180
151 HD23 LEU 18 HD23 LEU 18 -1.037 2.126 0.852
152 H LEU 19 HN LEU 19 -3.478 0.189 -2.396
153 HA LEU 19 HA LEU 19 -5.677 1.251 -3.921
154 HB2 LEU 19 HB2 LEU 19 -3.951 -0.740 -4.278
155 HB3 LEU 19 HB1 LEU 19 -5.222 -1.691 -3.526
156 HG LEU 19 HG LEU 19 -6.816 -0.597 -5.233
157 HD11 LEU 19 HD11 LEU 19 -5.880 0.362 -7.198
158 HD12 LEU 19 HD12 LEU 19 -4.252 -0.172 -6.781
159 HD13 LEU 19 HD13 LEU 19 -5.014 1.129 -5.867
160 HD21 LEU 19 HD21 LEU 19 -5.942 -2.967 -5.294
161 HD22 LEU 19 HD22 LEU 19 -4.643 -2.401 -6.345
162 HD23 LEU 19 HD23 LEU 19 -6.320 -2.298 -6.881
163 H LEU 20 HN LEU 20 -5.458 -1.010 -1.215
164 HA LEU 20 HA LEU 20 -8.244 -1.615 -0.907
165 HB2 LEU 20 HB2 LEU 20 -5.815 -2.245 0.336
166 HB3 LEU 20 HB1 LEU 20 -6.724 -1.423 1.596
167 HG LEU 20 HG LEU 20 -7.191 -3.800 1.718
168 HD11 LEU 20 HD11 LEU 20 -9.562 -3.740 1.708
169 HD12 LEU 20 HD12 LEU 20 -9.608 -2.569 0.391
170 HD13 LEU 20 HD13 LEU 20 -9.069 -2.071 1.994
171 HD21 LEU 20 HD21 LEU 20 -6.628 -4.187 -0.745
172 HD22 LEU 20 HD22 LEU 20 -8.270 -3.654 -1.108
173 HD23 LEU 20 HD23 LEU 20 -8.007 -5.092 -0.123
174 H LEU 21 HN LEU 21 -6.213 0.933 0.563
175 HA LEU 21 HA LEU 21 -8.221 2.165 2.185
176 HB2 LEU 21 HB2 LEU 21 -5.658 2.465 2.131
177 HB3 LEU 21 HB1 LEU 21 -5.941 3.587 0.802
178 HG LEU 21 HG LEU 21 -7.660 4.031 3.168
179 HD11 LEU 21 HD11 LEU 21 -5.539 3.398 4.271
180 HD12 LEU 21 HD12 LEU 21 -5.876 5.118 4.469
181 HD13 LEU 21 HD13 LEU 21 -4.678 4.585 3.290
182 HD21 LEU 21 HD21 LEU 21 -7.345 5.460 1.025
183 HD22 LEU 21 HD22 LEU 21 -5.825 5.976 1.757
184 HD23 LEU 21 HD23 LEU 21 -7.353 6.304 2.573
185 H ALA 22 HN ALA 22 -7.354 2.544 -1.200
186 HA ALA 22 HA ALA 22 -9.181 4.794 -1.669
187 HB1 ALA 22 HB1 ALA 22 -8.327 4.582 -3.963
188 HB2 ALA 22 HB2 ALA 22 -7.586 3.035 -3.552
189 HB3 ALA 22 HB3 ALA 22 -6.996 4.521 -2.807
190 H LEU 23 HN LEU 23 -9.717 1.503 -1.275
191 HA LEU 23 HA LEU 23 -12.116 1.544 -3.075
192 HB2 LEU 23 HB2 LEU 23 -9.825 0.010 -3.173
193 HB3 LEU 23 HB1 LEU 23 -10.974 -1.030 -2.356
194 HG LEU 23 HG LEU 23 -10.992 -1.354 -4.825
195 HD11 LEU 23 HD11 LEU 23 -13.038 -1.737 -3.448
196 HD12 LEU 23 HD12 LEU 23 -13.398 -1.277 -5.112
197 HD13 LEU 23 HD13 LEU 23 -13.554 -0.090 -3.817
198 HD21 LEU 23 HD21 LEU 23 -11.660 0.369 -6.325
199 HD22 LEU 23 HD22 LEU 23 -10.477 1.130 -5.262
200 HD23 LEU 23 HD23 LEU 23 -12.199 1.415 -5.012
201 HA PRO 24 HA PRO 24 -13.083 0.587 1.507
202 HB2 PRO 24 HB2 PRO 24 -14.368 2.919 2.122
203 HB3 PRO 24 HB1 PRO 24 -12.620 2.686 2.340
204 HG2 PRO 24 HG2 PRO 24 -14.075 4.080 0.152
205 HG3 PRO 24 HG1 PRO 24 -12.556 4.513 0.957
206 HD2 PRO 24 HD2 PRO 24 -12.641 3.309 -1.498
207 HD3 PRO 24 HD1 PRO 24 -11.304 3.110 -0.356
208 HA PRO 25 HA PRO 25 -17.176 -0.581 0.264
209 HB2 PRO 25 HB2 PRO 25 -18.333 -1.012 2.700
210 HB3 PRO 25 HB1 PRO 25 -17.137 -2.111 1.983
211 HG2 PRO 25 HG2 PRO 25 -16.770 -0.033 4.076
212 HG3 PRO 25 HG1 PRO 25 -16.058 -1.651 3.950
213 HD2 PRO 25 HD2 PRO 25 -14.711 0.615 3.311
214 HD3 PRO 25 HD1 PRO 25 -14.391 -0.961 2.551
215 H ARG 26 HN ARG 26 -19.593 -0.042 0.956
216 HA ARG 26 HA ARG 26 -19.941 2.760 1.881
217 HB2 ARG 26 HB2 ARG 26 -19.598 2.181 -0.786
218 HB3 ARG 26 HB1 ARG 26 -21.353 2.140 -0.636
219 HG2 ARG 26 HG2 ARG 26 -21.489 4.378 -0.373
220 HG3 ARG 26 HG1 ARG 26 -20.169 4.404 0.794
221 HD2 ARG 26 HD2 ARG 26 -19.576 3.987 -2.136
222 HD3 ARG 26 HD1 ARG 26 -19.814 5.621 -1.491
223 HE ARG 26 HE ARG 26 -18.048 4.350 0.297
224 HH11 ARG 26 HH11 ARG 26 -17.731 6.743 -1.794
225 HH12 ARG 26 HH12 ARG 26 -16.219 6.278 -2.497
226 HH21 ARG 26 HH21 ARG 26 -16.271 3.066 -1.143
227 HH22 ARG 26 HH22 ARG 26 -15.389 4.182 -2.129
228 H ALA 27 HN ALA 27 -21.751 0.040 0.347
229 HA ALA 27 HA ALA 27 -23.760 0.239 2.553
230 HB1 ALA 27 HB1 ALA 27 -24.117 0.313 -0.430
231 HB2 ALA 27 HB2 ALA 27 -24.836 1.354 0.798
232 HB3 ALA 27 HB3 ALA 27 -25.412 -0.300 0.599
233 H TYR 28 HN TYR 28 -23.424 -1.814 -0.337
234 HA TYR 28 HA TYR 28 -22.867 -4.188 1.361
235 HB2 TYR 28 HB2 TYR 28 -25.460 -3.446 0.449
236 HB3 TYR 28 HB1 TYR 28 -24.966 -4.848 -0.497
237 HD1 TYR 28 HD1 TYR 28 -24.084 -6.904 0.735
238 HD2 TYR 28 HD2 TYR 28 -26.122 -3.679 2.713
239 HE1 TYR 28 HE1 TYR 28 -24.538 -8.379 2.675
240 HE2 TYR 28 HE2 TYR 28 -26.575 -5.156 4.652
241 HH TYR 28 HH TYR 28 -25.193 -7.480 5.549
242 H ALA 29 HN ALA 29 -23.877 -3.472 -2.018
243 HA ALA 29 HA ALA 29 -22.961 -4.088 -4.081
244 HB1 ALA 29 HB1 ALA 29 -21.206 -2.602 -3.123
245 HB2 ALA 29 HB2 ALA 29 -20.533 -3.829 -4.195
246 HB3 ALA 29 HB3 ALA 29 -20.404 -4.021 -2.448
Start of MODEL 15
1 H1 ARG 1 HT1 ARG 1 26.803 -3.463 3.278
2 H2 ARG 1 HT2 ARG 1 27.269 -2.051 2.458
3 H3 ARG 1 HT3 ARG 1 26.793 -3.430 1.584
4 HA ARG 1 HA ARG 1 25.044 -1.741 3.310
5 HB2 ARG 1 HB2 ARG 1 25.986 -1.283 0.791
6 HB3 ARG 1 HB1 ARG 1 24.538 -2.218 0.427
7 HG2 ARG 1 HG2 ARG 1 23.487 -0.547 2.250
8 HG3 ARG 1 HG1 ARG 1 24.791 0.485 1.658
9 HD2 ARG 1 HD2 ARG 1 23.933 0.546 -0.528
10 HD3 ARG 1 HD1 ARG 1 22.985 -0.937 -0.301
11 HE ARG 1 HE ARG 1 21.477 0.346 1.195
12 HH11 ARG 1 HH11 ARG 1 21.195 1.689 -1.435
13 HH12 ARG 1 HH12 ARG 1 21.452 3.356 -1.046
14 HH21 ARG 1 HH21 ARG 1 22.925 2.673 2.038
15 HH22 ARG 1 HH22 ARG 1 22.441 3.918 0.939
16 H LEU 2 HN LEU 2 22.744 -2.418 3.131
17 HA LEU 2 HA LEU 2 22.059 -5.049 2.093
18 HB2 LEU 2 HB2 LEU 2 21.809 -6.221 4.151
19 HB3 LEU 2 HB1 LEU 2 23.397 -5.490 4.194
20 HG LEU 2 HG LEU 2 22.479 -5.205 6.356
21 HD11 LEU 2 HD11 LEU 2 21.787 -2.536 5.159
22 HD12 LEU 2 HD12 LEU 2 23.455 -3.103 5.239
23 HD13 LEU 2 HD13 LEU 2 22.523 -2.895 6.719
24 HD21 LEU 2 HD21 LEU 2 20.035 -3.724 5.609
25 HD22 LEU 2 HD22 LEU 2 20.287 -4.936 6.862
26 HD23 LEU 2 HD23 LEU 2 20.026 -5.439 5.194
27 H VAL 3 HN VAL 3 19.732 -5.589 2.517
28 HA VAL 3 HA VAL 3 18.092 -3.194 3.268
29 HB VAL 3 HB VAL 3 17.529 -5.034 0.928
30 HG11 VAL 3 HG11 VAL 3 16.474 -2.301 1.703
31 HG12 VAL 3 HG12 VAL 3 15.594 -3.825 1.821
32 HG13 VAL 3 HG13 VAL 3 16.035 -3.181 0.239
33 HG21 VAL 3 HG21 VAL 3 19.552 -3.925 0.293
34 HG22 VAL 3 HG22 VAL 3 19.034 -2.406 1.023
35 HG23 VAL 3 HG23 VAL 3 18.257 -2.986 -0.449
36 HA PRO 4 HA PRO 4 15.970 -6.364 5.549
37 HB2 PRO 4 HB2 PRO 4 13.921 -4.835 6.510
38 HB3 PRO 4 HB1 PRO 4 15.582 -4.737 7.121
39 HG2 PRO 4 HG2 PRO 4 14.104 -2.864 5.419
40 HG3 PRO 4 HG1 PRO 4 15.479 -2.579 6.492
41 HD2 PRO 4 HD2 PRO 4 15.521 -2.827 3.677
42 HD3 PRO 4 HD1 PRO 4 16.918 -2.702 4.762
43 H GLY 5 HN GLY 5 15.402 -7.461 3.456
44 HA2 GLY 5 HA2 GLY 5 13.605 -8.716 2.487
45 HA3 GLY 5 HA1 GLY 5 12.480 -7.506 3.081
46 H ALA 6 HN ALA 6 15.318 -6.472 1.335
47 HA ALA 6 HA ALA 6 15.523 -5.245 -0.664
48 HB1 ALA 6 HB1 ALA 6 14.317 -6.477 -2.575
49 HB2 ALA 6 HB2 ALA 6 13.725 -7.580 -1.335
50 HB3 ALA 6 HB3 ALA 6 15.458 -7.421 -1.618
51 H ALA 7 HN ALA 7 13.682 -4.041 1.093
52 HA ALA 7 HA ALA 7 12.051 -2.368 1.145
53 HB1 ALA 7 HB1 ALA 7 12.099 -0.996 -0.685
54 HB2 ALA 7 HB2 ALA 7 11.844 -2.320 -1.821
55 HB3 ALA 7 HB3 ALA 7 13.445 -2.042 -1.135
56 H TYR 8 HN TYR 8 11.191 -5.337 0.836
57 HA TYR 8 HA TYR 8 8.712 -5.217 -0.701
58 HB2 TYR 8 HB2 TYR 8 10.218 -7.172 0.933
59 HB3 TYR 8 HB1 TYR 8 8.474 -7.392 0.960
60 HD1 TYR 8 HD2 TYR 8 11.270 -6.764 -1.473
61 HD2 TYR 8 HD1 TYR 8 7.452 -8.597 -0.752
62 HE1 TYR 8 HE2 TYR 8 11.353 -7.820 -3.713
63 HE2 TYR 8 HE1 TYR 8 7.537 -9.654 -2.992
64 HH TYR 8 HH TYR 8 10.139 -10.109 -4.712
65 H ALA 9 HN ALA 9 9.604 -4.831 2.687
66 HA ALA 9 HA ALA 9 6.804 -4.567 3.568
67 HB1 ALA 9 HB1 ALA 9 8.637 -5.671 4.896
68 HB2 ALA 9 HB2 ALA 9 7.805 -4.389 5.775
69 HB3 ALA 9 HB3 ALA 9 9.394 -4.087 5.071
70 H LEU 10 HN LEU 10 8.641 -2.518 1.829
71 HA LEU 10 HA LEU 10 7.575 -0.057 3.169
72 HB2 LEU 10 HB2 LEU 10 10.190 -0.740 3.099
73 HB3 LEU 10 HB1 LEU 10 10.068 0.014 1.514
74 HG LEU 10 HG LEU 10 9.151 1.336 4.084
75 HD11 LEU 10 HD11 LEU 10 11.746 1.526 2.538
76 HD12 LEU 10 HD12 LEU 10 11.531 1.122 4.240
77 HD13 LEU 10 HD13 LEU 10 11.222 2.765 3.678
78 HD21 LEU 10 HD21 LEU 10 9.526 2.306 1.229
79 HD22 LEU 10 HD22 LEU 10 9.272 3.387 2.600
80 HD23 LEU 10 HD23 LEU 10 8.017 2.238 2.140
81 H TYR 11 HN TYR 11 9.069 -1.190 0.132
82 HA TYR 11 HA TYR 11 7.480 0.594 -1.547
83 HB2 TYR 11 HB2 TYR 11 9.767 -1.220 -1.740
84 HB3 TYR 11 HB1 TYR 11 8.714 -1.329 -3.147
85 HD1 TYR 11 HD1 TYR 11 10.609 1.040 -0.992
86 HD2 TYR 11 HD2 TYR 11 8.674 0.421 -4.777
87 HE1 TYR 11 HE1 TYR 11 11.552 3.177 -1.820
88 HE2 TYR 11 HE2 TYR 11 9.617 2.560 -5.606
89 HH TYR 11 HH TYR 11 10.633 4.912 -3.881
90 H GLY 12 HN GLY 12 7.257 -2.723 -0.447
91 HA2 GLY 12 HA2 GLY 12 5.294 -3.547 -2.444
92 HA3 GLY 12 HA1 GLY 12 5.779 -4.470 -1.021
93 H VAL 13 HN VAL 13 5.231 -2.317 0.887
94 HA VAL 13 HA VAL 13 2.343 -2.741 1.170
95 HB VAL 13 HB VAL 13 2.666 -1.648 3.345
96 HG11 VAL 13 HG11 VAL 13 3.192 -3.952 3.403
97 HG12 VAL 13 HG12 VAL 13 4.555 -3.163 4.196
98 HG13 VAL 13 HG13 VAL 13 4.707 -3.717 2.530
99 HG21 VAL 13 HG21 VAL 13 5.583 -1.281 2.622
100 HG22 VAL 13 HG22 VAL 13 4.724 -0.658 4.029
101 HG23 VAL 13 HG23 VAL 13 4.402 0.015 2.432
102 H TRP 14 HN TRP 14 4.306 -0.259 -0.181
103 HA TRP 14 HA TRP 14 2.797 2.081 0.326
104 HB2 TRP 14 HB2 TRP 14 5.068 1.931 -0.677
105 HB3 TRP 14 HB1 TRP 14 4.358 1.315 -2.152
106 HD1 TRP 14 HD1 TRP 14 5.066 3.327 -3.627
107 HE1 TRP 14 HE1 TRP 14 4.260 5.765 -3.803
108 HE3 TRP 14 HE3 TRP 14 2.349 3.697 0.699
109 HZ2 TRP 14 HZ2 TRP 14 2.681 7.627 -2.320
110 HZ3 TRP 14 HZ3 TRP 14 1.212 5.808 1.281
111 HH2 TRP 14 HH2 TRP 14 1.371 7.775 -0.217
112 HA PRO 15 HA PRO 15 0.301 1.276 -3.703
113 HB2 PRO 15 HB2 PRO 15 0.306 -1.249 -4.756
114 HB3 PRO 15 HB1 PRO 15 1.452 0.018 -5.246
115 HG2 PRO 15 HG2 PRO 15 1.845 -2.252 -3.362
116 HG3 PRO 15 HG1 PRO 15 2.951 -1.585 -4.575
117 HD2 PRO 15 HD2 PRO 15 3.171 -1.043 -1.940
118 HD3 PRO 15 HD1 PRO 15 3.663 0.111 -3.196
119 H LEU 16 HN LEU 16 0.535 -1.432 -1.384
120 HA LEU 16 HA LEU 16 -2.228 -2.234 -1.537
121 HB2 LEU 16 HB2 LEU 16 0.123 -2.672 0.223
122 HB3 LEU 16 HB1 LEU 16 -1.446 -2.903 0.992
123 HG LEU 16 HG LEU 16 -1.952 -4.254 -1.250
124 HD11 LEU 16 HD11 LEU 16 0.041 -5.461 -2.020
125 HD12 LEU 16 HD12 LEU 16 1.049 -4.546 -0.897
126 HD13 LEU 16 HD13 LEU 16 0.257 -3.724 -2.243
127 HD21 LEU 16 HD21 LEU 16 -2.052 -5.179 1.036
128 HD22 LEU 16 HD22 LEU 16 -0.296 -5.335 1.059
129 HD23 LEU 16 HD23 LEU 16 -1.254 -6.312 -0.054
130 H LEU 17 HN LEU 17 -0.506 0.084 0.511
131 HA LEU 17 HA LEU 17 -2.780 0.859 2.122
132 HB2 LEU 17 HB2 LEU 17 -0.078 2.006 1.431
133 HB3 LEU 17 HB1 LEU 17 -1.235 3.009 2.302
134 HG LEU 17 HG LEU 17 -0.513 0.222 3.230
135 HD11 LEU 17 HD11 LEU 17 0.794 2.871 3.920
136 HD12 LEU 17 HD12 LEU 17 1.567 1.462 3.197
137 HD13 LEU 17 HD13 LEU 17 1.003 1.397 4.866
138 HD21 LEU 17 HD21 LEU 17 -2.545 1.104 4.209
139 HD22 LEU 17 HD22 LEU 17 -1.779 2.662 4.518
140 HD23 LEU 17 HD23 LEU 17 -1.275 1.236 5.425
141 H LEU 18 HN LEU 18 -1.428 1.967 -0.936
142 HA LEU 18 HA LEU 18 -3.149 4.244 -1.364
143 HB2 LEU 18 HB2 LEU 18 -1.079 2.744 -2.714
144 HB3 LEU 18 HB1 LEU 18 -2.417 2.980 -3.833
145 HG LEU 18 HG LEU 18 -2.388 5.430 -3.239
146 HD11 LEU 18 HD11 LEU 18 0.064 4.515 -1.716
147 HD12 LEU 18 HD12 LEU 18 -1.305 5.446 -1.110
148 HD13 LEU 18 HD13 LEU 18 -0.160 6.188 -2.224
149 HD21 LEU 18 HD21 LEU 18 0.182 4.247 -4.347
150 HD22 LEU 18 HD22 LEU 18 -0.351 5.912 -4.570
151 HD23 LEU 18 HD23 LEU 18 -1.280 4.589 -5.274
152 H LEU 19 HN LEU 19 -3.329 0.782 -2.202
153 HA LEU 19 HA LEU 19 -5.829 0.857 -3.632
154 HB2 LEU 19 HB2 LEU 19 -3.834 -1.006 -2.899
155 HB3 LEU 19 HB1 LEU 19 -5.316 -1.610 -2.169
156 HG LEU 19 HG LEU 19 -6.295 -0.986 -4.590
157 HD11 LEU 19 HD11 LEU 19 -3.348 -1.560 -5.009
158 HD12 LEU 19 HD12 LEU 19 -4.243 -0.131 -5.530
159 HD13 LEU 19 HD13 LEU 19 -4.558 -1.693 -6.285
160 HD21 LEU 19 HD21 LEU 19 -4.799 -3.521 -4.702
161 HD22 LEU 19 HD22 LEU 19 -6.538 -3.241 -4.751
162 HD23 LEU 19 HD23 LEU 19 -5.701 -3.303 -3.202
163 H LEU 20 HN LEU 20 -4.929 0.306 -0.268
164 HA LEU 20 HA LEU 20 -7.535 -0.232 0.830
165 HB2 LEU 20 HB2 LEU 20 -4.783 0.336 1.709
166 HB3 LEU 20 HB1 LEU 20 -5.992 0.934 2.834
167 HG LEU 20 HG LEU 20 -6.110 -1.874 1.730
168 HD11 LEU 20 HD11 LEU 20 -3.952 -1.725 2.791
169 HD12 LEU 20 HD12 LEU 20 -5.037 -2.543 3.917
170 HD13 LEU 20 HD13 LEU 20 -4.626 -0.845 4.163
171 HD21 LEU 20 HD21 LEU 20 -7.359 -2.205 3.904
172 HD22 LEU 20 HD22 LEU 20 -8.154 -1.101 2.783
173 HD23 LEU 20 HD23 LEU 20 -7.257 -0.463 4.161
174 H LEU 21 HN LEU 21 -5.621 2.774 0.508
175 HA LEU 21 HA LEU 21 -7.427 4.560 1.814
176 HB2 LEU 21 HB2 LEU 21 -4.987 4.876 1.112
177 HB3 LEU 21 HB1 LEU 21 -5.597 5.192 -0.510
178 HG LEU 21 HG LEU 21 -6.929 6.716 1.657
179 HD11 LEU 21 HD11 LEU 21 -4.583 6.761 2.427
180 HD12 LEU 21 HD12 LEU 21 -5.089 8.343 1.834
181 HD13 LEU 21 HD13 LEU 21 -4.070 7.310 0.831
182 HD21 LEU 21 HD21 LEU 21 -5.658 7.666 -0.925
183 HD22 LEU 21 HD22 LEU 21 -6.956 8.434 -0.011
184 HD23 LEU 21 HD23 LEU 21 -7.260 6.929 -0.878
185 H ALA 22 HN ALA 22 -7.225 3.433 -1.519
186 HA ALA 22 HA ALA 22 -9.635 5.029 -2.273
187 HB1 ALA 22 HB1 ALA 22 -8.875 4.484 -4.569
188 HB2 ALA 22 HB2 ALA 22 -7.589 3.480 -3.899
189 HB3 ALA 22 HB3 ALA 22 -7.580 5.222 -3.627
190 H LEU 23 HN LEU 23 -9.971 2.678 -0.553
191 HA LEU 23 HA LEU 23 -11.185 0.692 -2.421
192 HB2 LEU 23 HB2 LEU 23 -9.356 0.169 -0.643
193 HB3 LEU 23 HB1 LEU 23 -10.678 0.271 0.511
194 HG LEU 23 HG LEU 23 -11.921 -1.390 -0.997
195 HD11 LEU 23 HD11 LEU 23 -10.686 -1.320 -3.023
196 HD12 LEU 23 HD12 LEU 23 -10.229 -2.857 -2.288
197 HD13 LEU 23 HD13 LEU 23 -9.142 -1.472 -2.183
198 HD21 LEU 23 HD21 LEU 23 -10.654 -3.326 -0.047
199 HD22 LEU 23 HD22 LEU 23 -10.952 -2.062 1.147
200 HD23 LEU 23 HD23 LEU 23 -9.358 -2.219 0.406
201 HA PRO 24 HA PRO 24 -15.073 2.174 -0.827
202 HB2 PRO 24 HB2 PRO 24 -16.636 0.654 -2.470
203 HB3 PRO 24 HB1 PRO 24 -15.771 2.103 -3.017
204 HG2 PRO 24 HG2 PRO 24 -15.217 -0.715 -3.569
205 HG3 PRO 24 HG1 PRO 24 -14.725 0.731 -4.460
206 HD2 PRO 24 HD2 PRO 24 -13.158 -0.831 -2.659
207 HD3 PRO 24 HD1 PRO 24 -12.677 0.653 -3.505
208 HA PRO 25 HA PRO 25 -16.240 -0.989 2.063
209 HB2 PRO 25 HB2 PRO 25 -18.769 -0.179 2.698
210 HB3 PRO 25 HB1 PRO 25 -17.314 0.672 3.252
211 HG2 PRO 25 HG2 PRO 25 -19.180 1.366 1.057
212 HG3 PRO 25 HG1 PRO 25 -18.314 2.421 2.184
213 HD2 PRO 25 HD2 PRO 25 -17.563 1.988 -0.415
214 HD3 PRO 25 HD1 PRO 25 -16.460 2.508 0.878
215 H ARG 26 HN ARG 26 -18.455 -2.387 2.498
216 HA ARG 26 HA ARG 26 -19.011 -3.759 -0.081
217 HB2 ARG 26 HB2 ARG 26 -18.192 -4.891 2.048
218 HB3 ARG 26 HB1 ARG 26 -19.768 -4.543 2.753
219 HG2 ARG 26 HG2 ARG 26 -20.898 -5.930 1.193
220 HG3 ARG 26 HG1 ARG 26 -19.494 -6.006 0.126
221 HD2 ARG 26 HD2 ARG 26 -18.265 -7.152 2.079
222 HD3 ARG 26 HD1 ARG 26 -19.871 -7.363 2.806
223 HE ARG 26 HE ARG 26 -20.534 -8.682 0.850
224 HH11 ARG 26 HH21 ARG 26 -18.787 -7.622 -1.257
225 HH12 ARG 26 HH22 ARG 26 -17.565 -8.837 -1.418
226 HH21 ARG 26 HH11 ARG 26 -18.284 -10.321 1.655
227 HH22 ARG 26 HH12 ARG 26 -17.277 -10.380 0.249
228 H ALA 27 HN ALA 27 -21.033 -3.026 2.798
229 HA ALA 27 HA ALA 27 -23.060 -1.624 1.191
230 HB1 ALA 27 HB1 ALA 27 -23.459 -4.405 2.336
231 HB2 ALA 27 HB2 ALA 27 -23.609 -3.910 0.649
232 HB3 ALA 27 HB3 ALA 27 -24.796 -3.370 1.837
233 H TYR 28 HN TYR 28 -21.774 -0.435 3.159
234 HA TYR 28 HA TYR 28 -22.090 0.841 5.065
235 HB2 TYR 28 HB2 TYR 28 -24.292 1.326 4.846
236 HB3 TYR 28 HB1 TYR 28 -24.754 -0.334 4.543
237 HD1 TYR 28 HD2 TYR 28 -24.029 2.181 7.156
238 HD2 TYR 28 HD1 TYR 28 -25.454 -1.791 6.346
239 HE1 TYR 28 HE2 TYR 28 -24.878 2.011 9.477
240 HE2 TYR 28 HE1 TYR 28 -26.304 -1.960 8.668
241 HH TYR 28 HH TYR 28 -26.998 0.306 10.538
242 H ALA 29 HN ALA 29 -22.374 -2.671 5.293
243 HA ALA 29 HA ALA 29 -21.597 -2.556 8.172
244 HB1 ALA 29 HB1 ALA 29 -22.271 -5.089 6.735
245 HB2 ALA 29 HB2 ALA 29 -23.575 -3.934 7.006
246 HB3 ALA 29 HB3 ALA 29 -22.677 -4.587 8.376
Start of MODEL 16
1 H1 ARG 1 HT1 ARG 1 12.312 1.404 -8.744
2 H2 ARG 1 HT2 ARG 1 13.016 2.949 -8.689
3 H3 ARG 1 HT3 ARG 1 12.991 1.970 -7.298
4 HA ARG 1 HA ARG 1 14.534 1.453 -9.799
5 HB2 ARG 1 HB2 ARG 1 15.024 2.734 -7.176
6 HB3 ARG 1 HB1 ARG 1 16.259 1.574 -7.666
7 HG2 ARG 1 HG2 ARG 1 16.656 2.738 -9.731
8 HG3 ARG 1 HG1 ARG 1 15.255 3.780 -9.484
9 HD2 ARG 1 HD2 ARG 1 17.253 3.823 -7.285
10 HD3 ARG 1 HD1 ARG 1 17.789 4.529 -8.821
11 HE ARG 1 HE ARG 1 15.157 5.329 -7.645
12 HH11 ARG 1 HH11 ARG 1 16.171 6.513 -10.225
13 HH12 ARG 1 HH12 ARG 1 16.866 8.003 -9.689
14 HH21 ARG 1 HH21 ARG 1 16.979 7.042 -6.340
15 HH22 ARG 1 HH22 ARG 1 17.327 8.306 -7.469
16 H LEU 2 HN LEU 2 16.047 -0.441 -9.456
17 HA LEU 2 HA LEU 2 14.603 -2.770 -8.495
18 HB2 LEU 2 HB2 LEU 2 16.504 -2.338 -10.354
19 HB3 LEU 2 HB1 LEU 2 17.539 -2.853 -9.023
20 HG LEU 2 HG LEU 2 15.706 -4.771 -8.801
21 HD11 LEU 2 HD11 LEU 2 14.347 -3.735 -10.667
22 HD12 LEU 2 HD12 LEU 2 14.765 -5.430 -10.919
23 HD13 LEU 2 HD13 LEU 2 15.655 -4.167 -11.771
24 HD21 LEU 2 HD21 LEU 2 17.135 -6.165 -10.298
25 HD22 LEU 2 HD22 LEU 2 18.090 -5.158 -9.210
26 HD23 LEU 2 HD23 LEU 2 17.899 -4.695 -10.902
27 H VAL 3 HN VAL 3 14.606 -3.570 -6.434
28 HA VAL 3 HA VAL 3 16.931 -3.000 -4.648
29 HB VAL 3 HB VAL 3 15.252 -2.517 -2.821
30 HG11 VAL 3 HG11 VAL 3 14.894 -0.547 -5.065
31 HG12 VAL 3 HG12 VAL 3 16.482 -0.796 -4.339
32 HG13 VAL 3 HG13 VAL 3 15.135 -0.241 -3.346
33 HG21 VAL 3 HG21 VAL 3 13.310 -2.206 -5.139
34 HG22 VAL 3 HG22 VAL 3 12.971 -1.936 -3.430
35 HG23 VAL 3 HG23 VAL 3 13.292 -3.567 -4.017
36 HA PRO 4 HA PRO 4 16.320 -7.238 -3.545
37 HB2 PRO 4 HB2 PRO 4 17.748 -7.306 -1.214
38 HB3 PRO 4 HB1 PRO 4 18.511 -7.188 -2.810
39 HG2 PRO 4 HG2 PRO 4 18.115 -5.110 -0.755
40 HG3 PRO 4 HG1 PRO 4 19.398 -5.287 -1.960
41 HD2 PRO 4 HD2 PRO 4 17.237 -3.539 -2.116
42 HD3 PRO 4 HD1 PRO 4 18.307 -4.006 -3.456
43 H GLY 5 HN GLY 5 16.014 -8.310 -0.964
44 HA2 GLY 5 HA2 GLY 5 13.288 -7.921 -0.349
45 HA3 GLY 5 HA1 GLY 5 14.458 -8.644 0.750
46 H ALA 6 HN ALA 6 16.133 -6.230 0.889
47 HA ALA 6 HA ALA 6 15.285 -4.934 3.183
48 HB1 ALA 6 HB1 ALA 6 16.847 -3.846 0.833
49 HB2 ALA 6 HB2 ALA 6 17.506 -4.743 2.201
50 HB3 ALA 6 HB3 ALA 6 16.836 -3.130 2.444
51 H ALA 7 HN ALA 7 14.745 -3.715 -0.120
52 HA ALA 7 HA ALA 7 12.675 -1.831 0.956
53 HB1 ALA 7 HB1 ALA 7 14.814 -1.693 -1.011
54 HB2 ALA 7 HB2 ALA 7 13.888 -0.385 -0.277
55 HB3 ALA 7 HB3 ALA 7 13.274 -1.198 -1.713
56 H TYR 8 HN TYR 8 12.231 -4.760 0.339
57 HA TYR 8 HA TYR 8 10.437 -4.663 -2.029
58 HB2 TYR 8 HB2 TYR 8 12.220 -6.513 -1.135
59 HB3 TYR 8 HB1 TYR 8 10.749 -7.113 -0.377
60 HD1 TYR 8 HD1 TYR 8 8.731 -7.617 -1.791
61 HD2 TYR 8 HD2 TYR 8 12.570 -6.709 -3.496
62 HE1 TYR 8 HE1 TYR 8 7.998 -8.577 -3.954
63 HE2 TYR 8 HE2 TYR 8 11.834 -7.671 -5.659
64 HH TYR 8 HH TYR 8 9.676 -9.658 -6.148
65 H ALA 9 HN ALA 9 10.361 -5.640 1.374
66 HA ALA 9 HA ALA 9 7.520 -5.975 1.603
67 HB1 ALA 9 HB1 ALA 9 8.114 -5.660 4.097
68 HB2 ALA 9 HB2 ALA 9 9.776 -5.458 3.545
69 HB3 ALA 9 HB3 ALA 9 8.924 -6.974 3.246
70 H LEU 10 HN LEU 10 9.648 -3.214 2.122
71 HA LEU 10 HA LEU 10 7.742 -1.371 3.231
72 HB2 LEU 10 HB2 LEU 10 10.428 -1.420 2.765
73 HB3 LEU 10 HB1 LEU 10 9.911 -0.354 1.464
74 HG LEU 10 HG LEU 10 8.996 0.062 4.316
75 HD11 LEU 10 HD11 LEU 10 10.821 1.593 4.655
76 HD12 LEU 10 HD12 LEU 10 11.358 1.414 2.986
77 HD13 LEU 10 HD13 LEU 10 11.522 0.068 4.114
78 HD21 LEU 10 HD21 LEU 10 9.242 1.888 1.897
79 HD22 LEU 10 HD22 LEU 10 8.665 2.381 3.489
80 HD23 LEU 10 HD23 LEU 10 7.739 1.223 2.537
81 H TYR 11 HN TYR 11 8.978 -1.694 -0.120
82 HA TYR 11 HA TYR 11 7.094 0.150 -1.285
83 HB2 TYR 11 HB2 TYR 11 9.128 -1.820 -2.178
84 HB3 TYR 11 HB1 TYR 11 7.893 -1.399 -3.360
85 HD1 TYR 11 HD1 TYR 11 7.483 1.061 -3.887
86 HD2 TYR 11 HD2 TYR 11 10.896 -0.310 -1.665
87 HE1 TYR 11 HE1 TYR 11 8.646 3.202 -4.344
88 HE2 TYR 11 HE2 TYR 11 12.057 1.828 -2.123
89 HH TYR 11 HH TYR 11 10.749 4.500 -2.892
90 H GLY 12 HN GLY 12 6.899 -3.243 -0.499
91 HA2 GLY 12 HA2 GLY 12 4.750 -3.989 -2.245
92 HA3 GLY 12 HA1 GLY 12 5.214 -4.839 -0.773
93 H VAL 13 HN VAL 13 4.794 -2.673 1.083
94 HA VAL 13 HA VAL 13 1.871 -2.824 1.284
95 HB VAL 13 HB VAL 13 2.227 -1.778 3.485
96 HG11 VAL 13 HG11 VAL 13 4.404 -3.664 3.713
97 HG12 VAL 13 HG12 VAL 13 3.164 -4.291 2.627
98 HG13 VAL 13 HG13 VAL 13 2.737 -3.812 4.269
99 HG21 VAL 13 HG21 VAL 13 5.203 -1.832 2.997
100 HG22 VAL 13 HG22 VAL 13 4.297 -0.965 4.237
101 HG23 VAL 13 HG23 VAL 13 4.262 -0.403 2.566
102 H TRP 14 HN TRP 14 4.011 -0.577 -0.143
103 HA TRP 14 HA TRP 14 2.710 1.890 0.467
104 HB2 TRP 14 HB2 TRP 14 4.951 1.279 -0.821
105 HB3 TRP 14 HB1 TRP 14 3.914 1.452 -2.235
106 HD1 TRP 14 HD1 TRP 14 5.427 3.446 0.632
107 HE1 TRP 14 HE1 TRP 14 5.024 5.960 0.196
108 HE3 TRP 14 HE3 TRP 14 2.335 3.130 -3.390
109 HZ2 TRP 14 HZ2 TRP 14 3.548 7.613 -1.654
110 HZ3 TRP 14 HZ3 TRP 14 1.452 5.164 -4.457
111 HH2 TRP 14 HH2 TRP 14 2.052 7.406 -3.608
112 HA PRO 15 HA PRO 15 -0.018 1.255 -3.424
113 HB2 PRO 15 HB2 PRO 15 -0.231 -1.268 -4.468
114 HB3 PRO 15 HB1 PRO 15 0.968 -0.085 -5.032
115 HG2 PRO 15 HG2 PRO 15 1.314 -2.382 -3.177
116 HG3 PRO 15 HG1 PRO 15 2.397 -1.777 -4.442
117 HD2 PRO 15 HD2 PRO 15 2.774 -1.273 -1.808
118 HD3 PRO 15 HD1 PRO 15 3.302 -0.163 -3.089
119 H LEU 16 HN LEU 16 0.271 -1.137 -0.856
120 HA LEU 16 HA LEU 16 -2.478 -2.043 -0.859
121 HB2 LEU 16 HB2 LEU 16 -0.044 -2.295 0.787
122 HB3 LEU 16 HB1 LEU 16 -1.534 -2.326 1.727
123 HG LEU 16 HG LEU 16 -2.381 -4.040 -0.007
124 HD11 LEU 16 HD11 LEU 16 -0.824 -5.150 -1.371
125 HD12 LEU 16 HD12 LEU 16 0.555 -4.559 -0.446
126 HD13 LEU 16 HD13 LEU 16 -0.326 -3.465 -1.513
127 HD21 LEU 16 HD21 LEU 16 -1.758 -4.623 2.312
128 HD22 LEU 16 HD22 LEU 16 -0.067 -4.758 1.828
129 HD23 LEU 16 HD23 LEU 16 -1.260 -5.891 1.194
130 H LEU 17 HN LEU 17 -0.736 0.504 0.933
131 HA LEU 17 HA LEU 17 -3.071 1.398 2.404
132 HB2 LEU 17 HB2 LEU 17 -1.646 3.156 3.171
133 HB3 LEU 17 HB1 LEU 17 -0.560 1.801 2.904
134 HG LEU 17 HG LEU 17 -0.595 3.092 0.435
135 HD11 LEU 17 HD11 LEU 17 -0.053 5.455 1.016
136 HD12 LEU 17 HD12 LEU 17 -0.587 5.139 2.667
137 HD13 LEU 17 HD13 LEU 17 -1.736 5.037 1.331
138 HD21 LEU 17 HD21 LEU 17 1.685 3.583 0.894
139 HD22 LEU 17 HD22 LEU 17 1.329 2.131 1.830
140 HD23 LEU 17 HD23 LEU 17 1.390 3.703 2.629
141 H LEU 18 HN LEU 18 -1.748 2.047 -0.746
142 HA LEU 18 HA LEU 18 -3.377 4.362 -1.425
143 HB2 LEU 18 HB2 LEU 18 -1.694 2.293 -2.853
144 HB3 LEU 18 HB1 LEU 18 -2.621 3.445 -3.782
145 HG LEU 18 HG LEU 18 -0.072 3.779 -2.460
146 HD11 LEU 18 HD11 LEU 18 -1.770 5.401 -4.342
147 HD12 LEU 18 HD12 LEU 18 -0.286 4.505 -4.679
148 HD13 LEU 18 HD13 LEU 18 -0.222 5.996 -3.741
149 HD21 LEU 18 HD21 LEU 18 -0.391 5.933 -1.386
150 HD22 LEU 18 HD22 LEU 18 -1.469 4.771 -0.620
151 HD23 LEU 18 HD23 LEU 18 -2.109 5.929 -1.786
152 H LEU 19 HN LEU 19 -3.519 0.845 -1.956
153 HA LEU 19 HA LEU 19 -5.999 0.733 -3.398
154 HB2 LEU 19 HB2 LEU 19 -4.024 -1.034 -2.306
155 HB3 LEU 19 HB1 LEU 19 -5.585 -1.576 -1.718
156 HG LEU 19 HG LEU 19 -5.080 -2.693 -3.818
157 HD11 LEU 19 HD11 LEU 19 -7.147 -2.413 -4.799
158 HD12 LEU 19 HD12 LEU 19 -7.075 -0.654 -4.706
159 HD13 LEU 19 HD13 LEU 19 -7.441 -1.599 -3.264
160 HD21 LEU 19 HD21 LEU 19 -3.550 -0.805 -4.611
161 HD22 LEU 19 HD22 LEU 19 -5.010 0.029 -5.143
162 HD23 LEU 19 HD23 LEU 19 -4.579 -1.530 -5.845
163 H LEU 20 HN LEU 20 -5.148 0.708 0.014
164 HA LEU 20 HA LEU 20 -7.792 0.237 1.108
165 HB2 LEU 20 HB2 LEU 20 -5.057 0.949 1.992
166 HB3 LEU 20 HB1 LEU 20 -6.330 1.555 3.042
167 HG LEU 20 HG LEU 20 -6.232 -1.323 2.116
168 HD11 LEU 20 HD11 LEU 20 -4.172 -0.920 3.330
169 HD12 LEU 20 HD12 LEU 20 -5.278 -1.792 4.393
170 HD13 LEU 20 HD13 LEU 20 -5.039 -0.057 4.600
171 HD21 LEU 20 HD21 LEU 20 -7.609 0.098 4.423
172 HD22 LEU 20 HD22 LEU 20 -7.674 -1.638 4.120
173 HD23 LEU 20 HD23 LEU 20 -8.397 -0.516 2.969
174 H LEU 21 HN LEU 21 -5.835 3.172 0.505
175 HA LEU 21 HA LEU 21 -7.599 5.132 1.561
176 HB2 LEU 21 HB2 LEU 21 -5.224 5.442 0.857
177 HB3 LEU 21 HB1 LEU 21 -5.732 5.295 -0.824
178 HG LEU 21 HG LEU 21 -7.307 7.277 0.658
179 HD11 LEU 21 HD11 LEU 21 -5.093 7.516 1.806
180 HD12 LEU 21 HD12 LEU 21 -5.553 8.945 0.880
181 HD13 LEU 21 HD13 LEU 21 -4.354 7.825 0.234
182 HD21 LEU 21 HD21 LEU 21 -7.032 6.816 -1.894
183 HD22 LEU 21 HD22 LEU 21 -5.535 7.738 -1.743
184 HD23 LEU 21 HD23 LEU 21 -7.079 8.493 -1.350
185 H ALA 22 HN ALA 22 -7.442 3.644 -1.639
186 HA ALA 22 HA ALA 22 -9.967 5.037 -2.445
187 HB1 ALA 22 HB1 ALA 22 -8.194 5.423 -3.983
188 HB2 ALA 22 HB2 ALA 22 -9.155 4.149 -4.735
189 HB3 ALA 22 HB3 ALA 22 -7.651 3.747 -3.905
190 H LEU 23 HN LEU 23 -10.049 2.779 -0.587
191 HA LEU 23 HA LEU 23 -10.888 0.447 -2.199
192 HB2 LEU 23 HB2 LEU 23 -9.460 0.409 -0.079
193 HB3 LEU 23 HB1 LEU 23 -10.941 0.769 0.798
194 HG LEU 23 HG LEU 23 -11.869 -1.276 -0.632
195 HD11 LEU 23 HD11 LEU 23 -9.511 -1.385 -1.739
196 HD12 LEU 23 HD12 LEU 23 -10.273 -2.892 -1.230
197 HD13 LEU 23 HD13 LEU 23 -9.017 -2.159 -0.233
198 HD21 LEU 23 HD21 LEU 23 -10.040 -1.805 1.724
199 HD22 LEU 23 HD22 LEU 23 -11.517 -2.666 1.285
200 HD23 LEU 23 HD23 LEU 23 -11.609 -1.016 1.900
201 HA PRO 24 HA PRO 24 -15.135 1.757 -1.781
202 HB2 PRO 24 HB2 PRO 24 -16.154 -0.153 -3.444
203 HB3 PRO 24 HB1 PRO 24 -15.291 1.283 -4.024
204 HG2 PRO 24 HG2 PRO 24 -14.430 -1.505 -3.975
205 HG3 PRO 24 HG1 PRO 24 -13.825 -0.152 -4.937
206 HD2 PRO 24 HD2 PRO 24 -12.677 -1.289 -2.573
207 HD3 PRO 24 HD1 PRO 24 -12.066 0.068 -3.540
208 HA PRO 25 HA PRO 25 -16.172 -1.214 1.460
209 HB2 PRO 25 HB2 PRO 25 -18.344 0.125 2.432
210 HB3 PRO 25 HB1 PRO 25 -16.671 0.586 2.811
211 HG2 PRO 25 HG2 PRO 25 -18.560 1.782 0.855
212 HG3 PRO 25 HG1 PRO 25 -17.380 2.569 1.918
213 HD2 PRO 25 HD2 PRO 25 -16.958 2.150 -0.735
214 HD3 PRO 25 HD1 PRO 25 -15.652 2.247 0.467
215 H ARG 26 HN ARG 26 -18.009 -2.652 1.885
216 HA ARG 26 HA ARG 26 -19.558 -3.314 -0.537
217 HB2 ARG 26 HB2 ARG 26 -19.065 -4.588 2.161
218 HB3 ARG 26 HB1 ARG 26 -20.214 -5.264 1.011
219 HG2 ARG 26 HG2 ARG 26 -18.536 -6.261 -0.101
220 HG3 ARG 26 HG1 ARG 26 -17.798 -4.690 -0.410
221 HD2 ARG 26 HD2 ARG 26 -16.190 -5.032 1.156
222 HD3 ARG 26 HD1 ARG 26 -17.368 -5.604 2.353
223 HE ARG 26 HE ARG 26 -16.224 -7.332 0.187
224 HH11 ARG 26 HH21 ARG 26 -15.207 -7.757 2.930
225 HH12 ARG 26 HH22 ARG 26 -16.235 -9.008 3.540
226 HH21 ARG 26 HH11 ARG 26 -18.667 -8.549 1.085
227 HH22 ARG 26 HH12 ARG 26 -18.215 -9.461 2.484
228 H ALA 27 HN ALA 27 -20.434 -0.881 0.468
229 HA ALA 27 HA ALA 27 -22.335 0.307 1.138
230 HB1 ALA 27 HB1 ALA 27 -23.192 -1.244 -0.641
231 HB2 ALA 27 HB2 ALA 27 -24.419 -0.772 0.533
232 HB3 ALA 27 HB3 ALA 27 -23.673 -2.366 0.632
233 H TYR 28 HN TYR 28 -20.999 -0.190 3.353
234 HA TYR 28 HA TYR 28 -23.080 -1.049 5.308
235 HB2 TYR 28 HB2 TYR 28 -21.548 -2.474 6.463
236 HB3 TYR 28 HB1 TYR 28 -21.431 -2.885 4.759
237 HD1 TYR 28 HD2 TYR 28 -19.440 -2.229 3.440
238 HD2 TYR 28 HD1 TYR 28 -19.721 -1.422 7.649
239 HE1 TYR 28 HE2 TYR 28 -17.001 -1.789 3.521
240 HE2 TYR 28 HE1 TYR 28 -17.285 -0.985 7.729
241 HH TYR 28 HH TYR 28 -15.489 -0.229 6.010
242 H ALA 29 HN ALA 29 -20.007 0.736 4.838
243 HA ALA 29 HA ALA 29 -19.164 2.647 5.851
244 HB1 ALA 29 HB1 ALA 29 -20.785 4.234 6.668
245 HB2 ALA 29 HB2 ALA 29 -21.963 2.958 6.972
246 HB3 ALA 29 HB3 ALA 29 -21.524 3.376 5.316
Start of MODEL 17
1 H1 ARG 1 HT1 ARG 1 12.024 -6.879 -6.550
2 H2 ARG 1 HT2 ARG 1 10.581 -6.850 -7.443
3 H3 ARG 1 HT3 ARG 1 12.041 -7.295 -8.192
4 HA ARG 1 HA ARG 1 10.511 -8.826 -6.146
5 HB2 ARG 1 HB2 ARG 1 10.999 -8.904 -9.081
6 HB3 ARG 1 HB1 ARG 1 10.995 -10.460 -8.253
7 HG2 ARG 1 HG2 ARG 1 8.779 -10.137 -7.433
8 HG3 ARG 1 HG1 ARG 1 8.790 -8.427 -7.861
9 HD2 ARG 1 HD2 ARG 1 7.678 -9.146 -9.732
10 HD3 ARG 1 HD1 ARG 1 9.299 -9.580 -10.304
11 HE ARG 1 HE ARG 1 8.771 -11.827 -8.997
12 HH11 ARG 1 HH21 ARG 1 5.890 -11.158 -8.595
13 HH12 ARG 1 HH22 ARG 1 5.141 -11.880 -9.977
14 HH21 ARG 1 HH11 ARG 1 8.127 -12.199 -11.747
15 HH22 ARG 1 HH12 ARG 1 6.418 -12.475 -11.779
16 H LEU 2 HN LEU 2 11.543 -10.945 -5.655
17 HA LEU 2 HA LEU 2 13.309 -12.280 -4.918
18 HB2 LEU 2 HB2 LEU 2 13.886 -11.430 -7.520
19 HB3 LEU 2 HB1 LEU 2 15.373 -11.124 -6.633
20 HG LEU 2 HG LEU 2 15.478 -13.364 -7.521
21 HD11 LEU 2 HD11 LEU 2 16.164 -12.881 -5.067
22 HD12 LEU 2 HD12 LEU 2 16.010 -14.563 -5.572
23 HD13 LEU 2 HD13 LEU 2 14.723 -13.803 -4.637
24 HD21 LEU 2 HD21 LEU 2 12.764 -13.703 -6.211
25 HD22 LEU 2 HD22 LEU 2 13.735 -15.058 -6.785
26 HD23 LEU 2 HD23 LEU 2 13.158 -13.843 -7.925
27 H VAL 3 HN VAL 3 12.848 -10.246 -3.217
28 HA VAL 3 HA VAL 3 15.585 -9.362 -2.409
29 HB VAL 3 HB VAL 3 14.255 -7.550 -3.514
30 HG11 VAL 3 HG11 VAL 3 12.202 -6.822 -2.759
31 HG12 VAL 3 HG12 VAL 3 12.499 -7.357 -1.105
32 HG13 VAL 3 HG13 VAL 3 12.066 -8.529 -2.344
33 HG21 VAL 3 HG21 VAL 3 15.985 -7.104 -1.762
34 HG22 VAL 3 HG22 VAL 3 14.700 -7.085 -0.554
35 HG23 VAL 3 HG23 VAL 3 14.729 -5.869 -1.831
36 HA PRO 4 HA PRO 4 14.239 -11.238 1.376
37 HB2 PRO 4 HB2 PRO 4 16.397 -10.598 2.914
38 HB3 PRO 4 HB1 PRO 4 16.429 -11.839 1.649
39 HG2 PRO 4 HG2 PRO 4 17.585 -9.142 1.653
40 HG3 PRO 4 HG1 PRO 4 18.068 -10.581 0.750
41 HD2 PRO 4 HD2 PRO 4 16.598 -8.378 -0.218
42 HD3 PRO 4 HD1 PRO 4 16.912 -9.912 -1.057
43 H GLY 5 HN GLY 5 12.633 -9.081 1.225
44 HA2 GLY 5 HA2 GLY 5 11.403 -7.856 2.874
45 HA3 GLY 5 HA1 GLY 5 12.798 -7.918 3.936
46 H ALA 6 HN ALA 6 14.697 -6.863 1.968
47 HA ALA 6 HA ALA 6 14.769 -4.156 2.487
48 HB1 ALA 6 HB1 ALA 6 15.609 -4.954 -0.238
49 HB2 ALA 6 HB2 ALA 6 16.273 -5.906 1.089
50 HB3 ALA 6 HB3 ALA 6 16.531 -4.164 1.038
51 H ALA 7 HN ALA 7 13.102 -5.622 -0.275
52 HA ALA 7 HA ALA 7 11.773 -2.981 -0.808
53 HB1 ALA 7 HB1 ALA 7 12.562 -3.230 -2.902
54 HB2 ALA 7 HB2 ALA 7 11.655 -4.732 -3.064
55 HB3 ALA 7 HB3 ALA 7 13.308 -4.762 -2.451
56 H TYR 8 HN TYR 8 10.926 -5.341 0.980
57 HA TYR 8 HA TYR 8 8.428 -6.209 -0.405
58 HB2 TYR 8 HB2 TYR 8 10.218 -7.223 1.727
59 HB3 TYR 8 HB1 TYR 8 8.505 -7.460 2.043
60 HD1 TYR 8 HD1 TYR 8 10.095 -7.438 -1.337
61 HD2 TYR 8 HD2 TYR 8 8.390 -9.820 1.806
62 HE1 TYR 8 HE1 TYR 8 10.085 -9.415 -2.835
63 HE2 TYR 8 HE2 TYR 8 8.379 -11.792 0.308
64 HH TYR 8 HH TYR 8 8.313 -12.028 -2.424
65 H ALA 9 HN ALA 9 9.571 -4.799 2.644
66 HA ALA 9 HA ALA 9 6.969 -4.095 3.666
67 HB1 ALA 9 HB1 ALA 9 9.740 -3.013 4.255
68 HB2 ALA 9 HB2 ALA 9 8.963 -4.370 5.073
69 HB3 ALA 9 HB3 ALA 9 8.317 -2.740 5.261
70 H LEU 10 HN LEU 10 8.963 -2.662 1.238
71 HA LEU 10 HA LEU 10 7.666 0.005 1.457
72 HB2 LEU 10 HB2 LEU 10 10.218 -0.777 0.897
73 HB3 LEU 10 HB1 LEU 10 9.571 -0.687 -0.732
74 HG LEU 10 HG LEU 10 10.589 1.453 -0.076
75 HD11 LEU 10 HD11 LEU 10 8.551 1.368 -1.565
76 HD12 LEU 10 HD12 LEU 10 8.785 2.899 -0.723
77 HD13 LEU 10 HD13 LEU 10 7.578 1.751 -0.145
78 HD21 LEU 10 HD21 LEU 10 8.421 1.676 2.031
79 HD22 LEU 10 HD22 LEU 10 9.788 2.759 1.766
80 HD23 LEU 10 HD23 LEU 10 10.059 1.136 2.402
81 H TYR 11 HN TYR 11 8.321 -2.392 -1.135
82 HA TYR 11 HA TYR 11 6.325 -1.372 -2.940
83 HB2 TYR 11 HB2 TYR 11 8.053 -3.792 -2.706
84 HB3 TYR 11 HB1 TYR 11 6.753 -3.822 -3.884
85 HD1 TYR 11 HD2 TYR 11 6.693 -2.188 -5.746
86 HD2 TYR 11 HD1 TYR 11 9.963 -2.310 -2.960
87 HE1 TYR 11 HE2 TYR 11 8.056 -0.800 -7.283
88 HE2 TYR 11 HE1 TYR 11 11.324 -0.921 -4.498
89 HH TYR 11 HH TYR 11 11.214 -0.552 -7.232
90 H GLY 12 HN GLY 12 6.092 -3.579 -0.253
91 HA2 GLY 12 HA2 GLY 12 3.498 -4.662 -1.147
92 HA3 GLY 12 HA1 GLY 12 4.354 -5.108 0.325
93 H VAL 13 HN VAL 13 4.558 -1.890 0.595
94 HA VAL 13 HA VAL 13 1.965 -1.698 2.058
95 HB VAL 13 HB VAL 13 4.711 -0.510 2.416
96 HG11 VAL 13 HG11 VAL 13 2.086 0.455 3.529
97 HG12 VAL 13 HG12 VAL 13 3.450 1.397 2.923
98 HG13 VAL 13 HG13 VAL 13 3.560 0.595 4.490
99 HG21 VAL 13 HG21 VAL 13 2.895 -1.949 4.367
100 HG22 VAL 13 HG22 VAL 13 4.617 -1.616 4.550
101 HG23 VAL 13 HG23 VAL 13 4.068 -2.783 3.348
102 H TRP 14 HN TRP 14 4.066 0.088 -0.178
103 HA TRP 14 HA TRP 14 2.699 2.529 -0.365
104 HB2 TRP 14 HB2 TRP 14 4.852 1.951 -1.450
105 HB3 TRP 14 HB1 TRP 14 3.997 0.963 -2.615
106 HD1 TRP 14 HD1 TRP 14 4.089 2.254 -4.802
107 HE1 TRP 14 HE1 TRP 14 3.508 4.647 -5.551
108 HE3 TRP 14 HE3 TRP 14 3.063 4.386 -0.269
109 HZ2 TRP 14 HZ2 TRP 14 2.712 7.136 -4.391
110 HZ3 TRP 14 HZ3 TRP 14 2.398 6.763 -0.126
111 HH2 TRP 14 HH2 TRP 14 2.221 8.142 -2.176
112 HA PRO 15 HA PRO 15 -0.227 0.831 -3.760
113 HB2 PRO 15 HB2 PRO 15 -0.422 -1.877 -4.098
114 HB3 PRO 15 HB1 PRO 15 0.713 -0.860 -5.010
115 HG2 PRO 15 HG2 PRO 15 1.214 -2.578 -2.633
116 HG3 PRO 15 HG1 PRO 15 2.213 -2.323 -4.074
117 HD2 PRO 15 HD2 PRO 15 2.723 -1.127 -1.704
118 HD3 PRO 15 HD1 PRO 15 3.132 -0.378 -3.261
119 H LEU 16 HN LEU 16 0.176 -1.163 -0.828
120 HA LEU 16 HA LEU 16 -2.628 -1.803 -0.498
121 HB2 LEU 16 HB2 LEU 16 -0.151 -2.388 0.749
122 HB3 LEU 16 HB1 LEU 16 -1.138 -1.619 1.989
123 HG LEU 16 HG LEU 16 -2.895 -3.378 0.699
124 HD11 LEU 16 HD11 LEU 16 -1.156 -4.588 -0.408
125 HD12 LEU 16 HD12 LEU 16 -1.604 -5.558 0.995
126 HD13 LEU 16 HD13 LEU 16 -0.138 -4.578 1.032
127 HD21 LEU 16 HD21 LEU 16 -2.713 -4.639 2.852
128 HD22 LEU 16 HD22 LEU 16 -2.867 -2.900 3.096
129 HD23 LEU 16 HD23 LEU 16 -1.293 -3.678 3.261
130 H LEU 17 HN LEU 17 -0.539 0.728 0.879
131 HA LEU 17 HA LEU 17 -2.665 2.042 2.347
132 HB2 LEU 17 HB2 LEU 17 0.045 2.216 2.329
133 HB3 LEU 17 HB1 LEU 17 -0.337 3.611 1.320
134 HG LEU 17 HG LEU 17 -1.894 3.270 3.850
135 HD11 LEU 17 HD11 LEU 17 0.893 4.457 3.828
136 HD12 LEU 17 HD12 LEU 17 0.527 2.841 4.433
137 HD13 LEU 17 HD13 LEU 17 -0.176 4.256 5.217
138 HD21 LEU 17 HD21 LEU 17 -0.665 5.673 2.454
139 HD22 LEU 17 HD22 LEU 17 -1.791 5.723 3.808
140 HD23 LEU 17 HD23 LEU 17 -2.326 5.121 2.240
141 H LEU 18 HN LEU 18 -1.334 2.316 -0.902
142 HA LEU 18 HA LEU 18 -2.769 4.641 -1.811
143 HB2 LEU 18 HB2 LEU 18 -1.461 2.214 -3.026
144 HB3 LEU 18 HB1 LEU 18 -2.448 3.226 -4.063
145 HG LEU 18 HG LEU 18 -0.114 4.210 -2.392
146 HD11 LEU 18 HD11 LEU 18 0.855 2.919 -4.109
147 HD12 LEU 18 HD12 LEU 18 0.847 4.550 -4.778
148 HD13 LEU 18 HD13 LEU 18 -0.377 3.384 -5.281
149 HD21 LEU 18 HD21 LEU 18 -1.827 5.561 -4.505
150 HD22 LEU 18 HD22 LEU 18 -0.356 6.249 -3.816
151 HD23 LEU 18 HD23 LEU 18 -1.762 5.970 -2.790
152 H LEU 19 HN LEU 19 -3.465 1.139 -1.846
153 HA LEU 19 HA LEU 19 -6.057 1.269 -3.091
154 HB2 LEU 19 HB2 LEU 19 -4.236 -0.668 -2.074
155 HB3 LEU 19 HB1 LEU 19 -5.764 -0.947 -1.255
156 HG LEU 19 HG LEU 19 -6.619 -0.547 -3.824
157 HD11 LEU 19 HD11 LEU 19 -3.970 -2.021 -3.973
158 HD12 LEU 19 HD12 LEU 19 -4.281 -0.417 -4.636
159 HD13 LEU 19 HD13 LEU 19 -5.117 -1.821 -5.297
160 HD21 LEU 19 HD21 LEU 19 -5.713 -3.139 -2.522
161 HD22 LEU 19 HD22 LEU 19 -6.773 -3.041 -3.927
162 HD23 LEU 19 HD23 LEU 19 -7.307 -2.397 -2.376
163 H LEU 20 HN LEU 20 -4.944 1.277 0.256
164 HA LEU 20 HA LEU 20 -7.489 1.226 1.587
165 HB2 LEU 20 HB2 LEU 20 -4.649 1.715 2.175
166 HB3 LEU 20 HB1 LEU 20 -5.723 2.647 3.209
167 HG LEU 20 HG LEU 20 -6.301 -0.263 2.749
168 HD11 LEU 20 HD11 LEU 20 -3.964 -0.305 3.367
169 HD12 LEU 20 HD12 LEU 20 -4.906 -0.746 4.791
170 HD13 LEU 20 HD13 LEU 20 -4.230 0.877 4.649
171 HD21 LEU 20 HD21 LEU 20 -6.644 1.601 5.124
172 HD22 LEU 20 HD22 LEU 20 -7.237 -0.055 5.018
173 HD23 LEU 20 HD23 LEU 20 -7.908 1.188 3.965
174 H LEU 21 HN LEU 21 -5.479 3.912 0.352
175 HA LEU 21 HA LEU 21 -6.889 6.120 1.444
176 HB2 LEU 21 HB2 LEU 21 -4.684 6.070 0.202
177 HB3 LEU 21 HB1 LEU 21 -5.601 5.912 -1.294
178 HG LEU 21 HG LEU 21 -6.355 8.142 0.550
179 HD11 LEU 21 HD11 LEU 21 -3.842 8.139 0.459
180 HD12 LEU 21 HD12 LEU 21 -4.576 9.573 -0.259
181 HD13 LEU 21 HD13 LEU 21 -3.952 8.289 -1.294
182 HD21 LEU 21 HD21 LEU 21 -6.358 9.221 -1.868
183 HD22 LEU 21 HD22 LEU 21 -7.657 8.129 -1.390
184 HD23 LEU 21 HD23 LEU 21 -6.336 7.538 -2.396
185 H ALA 22 HN ALA 22 -7.407 4.360 -1.582
186 HA ALA 22 HA ALA 22 -10.138 5.590 -1.819
187 HB1 ALA 22 HB1 ALA 22 -9.801 5.663 -4.154
188 HB2 ALA 22 HB2 ALA 22 -8.543 4.428 -4.104
189 HB3 ALA 22 HB3 ALA 22 -8.200 6.061 -3.530
190 H LEU 23 HN LEU 23 -9.911 3.421 -0.165
191 HA LEU 23 HA LEU 23 -10.165 0.884 -1.528
192 HB2 LEU 23 HB2 LEU 23 -10.358 0.004 0.669
193 HB3 LEU 23 HB1 LEU 23 -9.296 1.394 0.817
194 HG LEU 23 HG LEU 23 -11.704 2.590 1.247
195 HD11 LEU 23 HD11 LEU 23 -12.646 0.831 3.047
196 HD12 LEU 23 HD12 LEU 23 -11.992 -0.315 1.877
197 HD13 LEU 23 HD13 LEU 23 -13.212 0.854 1.377
198 HD21 LEU 23 HD21 LEU 23 -10.872 1.524 3.761
199 HD22 LEU 23 HD22 LEU 23 -10.512 3.111 3.082
200 HD23 LEU 23 HD23 LEU 23 -9.426 1.756 2.779
201 HA PRO 24 HA PRO 24 -14.526 1.149 -2.297
202 HB2 PRO 24 HB2 PRO 24 -14.787 -1.352 -3.360
203 HB3 PRO 24 HB1 PRO 24 -14.005 -0.010 -4.216
204 HG2 PRO 24 HG2 PRO 24 -12.818 -2.396 -3.045
205 HG3 PRO 24 HG1 PRO 24 -12.156 -1.275 -4.240
206 HD2 PRO 24 HD2 PRO 24 -11.608 -1.412 -1.422
207 HD3 PRO 24 HD1 PRO 24 -10.879 -0.337 -2.635
208 HA PRO 25 HA PRO 25 -16.649 -0.894 1.007
209 HB2 PRO 25 HB2 PRO 25 -19.023 -1.668 -0.101
210 HB3 PRO 25 HB1 PRO 25 -18.626 0.025 0.266
211 HG2 PRO 25 HG2 PRO 25 -18.523 -1.413 -2.336
212 HG3 PRO 25 HG1 PRO 25 -19.067 0.235 -1.975
213 HD2 PRO 25 HD2 PRO 25 -16.641 -0.312 -3.047
214 HD3 PRO 25 HD1 PRO 25 -16.943 1.089 -1.993
215 H ARG 26 HN ARG 26 -17.573 -3.014 1.726
216 HA ARG 26 HA ARG 26 -16.424 -5.298 0.170
217 HB2 ARG 26 HB2 ARG 26 -16.236 -6.411 2.384
218 HB3 ARG 26 HB1 ARG 26 -15.344 -4.899 2.322
219 HG2 ARG 26 HG2 ARG 26 -17.121 -3.756 3.557
220 HG3 ARG 26 HG1 ARG 26 -18.118 -5.208 3.518
221 HD2 ARG 26 HD2 ARG 26 -17.179 -5.510 5.602
222 HD3 ARG 26 HD1 ARG 26 -15.891 -6.255 4.638
223 HE ARG 26 HE ARG 26 -15.721 -3.666 5.997
224 HH11 ARG 26 HH21 ARG 26 -13.657 -5.944 5.189
225 HH12 ARG 26 HH22 ARG 26 -12.570 -5.000 4.230
226 HH21 ARG 26 HH11 ARG 26 -14.735 -2.287 3.969
227 HH22 ARG 26 HH12 ARG 26 -13.183 -2.918 3.534
228 H ALA 27 HN ALA 27 -19.237 -4.363 2.181
229 HA ALA 27 HA ALA 27 -21.101 -5.861 0.524
230 HB1 ALA 27 HB1 ALA 27 -20.027 -7.710 1.711
231 HB2 ALA 27 HB2 ALA 27 -21.676 -7.520 2.304
232 HB3 ALA 27 HB3 ALA 27 -20.322 -6.922 3.261
233 H TYR 28 HN TYR 28 -20.847 -3.136 1.703
234 HA TYR 28 HA TYR 28 -23.411 -3.077 3.246
235 HB2 TYR 28 HB2 TYR 28 -22.452 -1.376 4.696
236 HB3 TYR 28 HB1 TYR 28 -21.416 -2.794 4.693
237 HD1 TYR 28 HD1 TYR 28 -21.794 0.681 3.462
238 HD2 TYR 28 HD2 TYR 28 -19.170 -2.705 3.790
239 HE1 TYR 28 HE1 TYR 28 -19.882 2.095 2.770
240 HE2 TYR 28 HE2 TYR 28 -17.260 -1.287 3.096
241 HH TYR 28 HH TYR 28 -17.272 1.978 3.150
242 H ALA 29 HN ALA 29 -21.334 -1.396 0.883
243 HA ALA 29 HA ALA 29 -23.567 0.531 0.381
244 HB1 ALA 29 HB1 ALA 29 -21.622 1.786 -0.766
245 HB2 ALA 29 HB2 ALA 29 -20.566 0.613 0.020
246 HB3 ALA 29 HB3 ALA 29 -21.579 1.679 0.993
Start of MODEL 18
1 H1 ARG 1 HT1 ARG 1 25.707 -2.136 2.063
2 H2 ARG 1 HT2 ARG 1 26.231 -3.620 1.428
3 H3 ARG 1 HT3 ARG 1 25.445 -3.564 2.934
4 HA ARG 1 HA ARG 1 24.150 -2.721 0.390
5 HB2 ARG 1 HB2 ARG 1 23.109 -4.971 0.415
6 HB3 ARG 1 HB1 ARG 1 24.857 -5.063 0.245
7 HG2 ARG 1 HG2 ARG 1 25.004 -6.334 2.095
8 HG3 ARG 1 HG1 ARG 1 24.189 -5.099 3.051
9 HD2 ARG 1 HD2 ARG 1 22.154 -6.297 1.496
10 HD3 ARG 1 HD1 ARG 1 23.145 -7.633 2.115
11 HE ARG 1 HE ARG 1 21.686 -5.658 3.778
12 HH11 ARG 1 HH11 ARG 1 21.513 -8.684 4.039
13 HH12 ARG 1 HH12 ARG 1 22.463 -8.960 5.457
14 HH21 ARG 1 HH21 ARG 1 23.964 -5.821 5.390
15 HH22 ARG 1 HH22 ARG 1 23.860 -7.331 6.229
16 H LEU 2 HN LEU 2 22.059 -1.967 0.719
17 HA LEU 2 HA LEU 2 20.789 -2.322 3.400
18 HB2 LEU 2 HB2 LEU 2 22.287 -0.145 2.887
19 HB3 LEU 2 HB1 LEU 2 20.766 0.400 2.182
20 HG LEU 2 HG LEU 2 19.847 -0.634 4.515
21 HD11 LEU 2 HD11 LEU 2 22.116 -1.195 5.307
22 HD12 LEU 2 HD12 LEU 2 21.388 0.053 6.318
23 HD13 LEU 2 HD13 LEU 2 22.602 0.490 5.116
24 HD21 LEU 2 HD21 LEU 2 19.393 1.624 3.631
25 HD22 LEU 2 HD22 LEU 2 21.008 2.144 4.111
26 HD23 LEU 2 HD23 LEU 2 19.822 1.703 5.340
27 H VAL 3 HN VAL 3 18.659 -2.857 3.105
28 HA VAL 3 HA VAL 3 17.158 -1.731 0.793
29 HB VAL 3 HB VAL 3 16.173 -4.126 0.551
30 HG11 VAL 3 HG11 VAL 3 17.668 -2.908 -1.073
31 HG12 VAL 3 HG12 VAL 3 17.793 -4.667 -1.129
32 HG13 VAL 3 HG13 VAL 3 19.040 -3.719 -0.318
33 HG21 VAL 3 HG21 VAL 3 17.482 -4.885 2.669
34 HG22 VAL 3 HG22 VAL 3 18.883 -4.959 1.599
35 HG23 VAL 3 HG23 VAL 3 17.469 -5.963 1.273
36 HA PRO 4 HA PRO 4 14.140 -1.306 4.016
37 HB2 PRO 4 HB2 PRO 4 12.017 -0.554 2.467
38 HB3 PRO 4 HB1 PRO 4 13.370 0.527 2.848
39 HG2 PRO 4 HG2 PRO 4 12.783 -0.947 0.354
40 HG3 PRO 4 HG1 PRO 4 13.560 0.625 0.588
41 HD2 PRO 4 HD2 PRO 4 14.881 -1.732 0.026
42 HD3 PRO 4 HD1 PRO 4 15.621 -0.284 0.741
43 H GLY 5 HN GLY 5 14.216 -3.715 4.358
44 HA2 GLY 5 HA2 GLY 5 13.137 -5.792 4.611
45 HA3 GLY 5 HA1 GLY 5 11.650 -4.937 4.226
46 H ALA 6 HN ALA 6 14.483 -5.267 2.145
47 HA ALA 6 HA ALA 6 14.683 -6.057 -0.070
48 HB1 ALA 6 HB1 ALA 6 14.389 -8.132 1.407
49 HB2 ALA 6 HB2 ALA 6 13.992 -8.345 -0.298
50 HB3 ALA 6 HB3 ALA 6 12.702 -8.145 0.887
51 H ALA 7 HN ALA 7 12.856 -3.964 0.219
52 HA ALA 7 HA ALA 7 11.191 -2.834 -0.947
53 HB1 ALA 7 HB1 ALA 7 11.036 -5.227 -2.779
54 HB2 ALA 7 HB2 ALA 7 12.401 -4.112 -2.826
55 HB3 ALA 7 HB3 ALA 7 10.772 -3.527 -3.168
56 H TYR 8 HN TYR 8 10.529 -5.342 1.006
57 HA TYR 8 HA TYR 8 7.733 -5.788 0.169
58 HB2 TYR 8 HB2 TYR 8 9.639 -6.912 2.173
59 HB3 TYR 8 HB1 TYR 8 7.937 -6.991 2.591
60 HD1 TYR 8 HD1 TYR 8 6.342 -8.239 1.170
61 HD2 TYR 8 HD2 TYR 8 10.556 -8.202 0.339
62 HE1 TYR 8 HE1 TYR 8 6.059 -10.180 -0.345
63 HE2 TYR 8 HE2 TYR 8 10.273 -10.142 -1.177
64 HH TYR 8 HH TYR 8 8.064 -11.055 -2.606
65 H ALA 9 HN ALA 9 9.573 -4.148 2.696
66 HA ALA 9 HA ALA 9 7.194 -3.103 4.038
67 HB1 ALA 9 HB1 ALA 9 10.058 -2.170 4.325
68 HB2 ALA 9 HB2 ALA 9 9.483 -3.666 5.060
69 HB3 ALA 9 HB3 ALA 9 8.779 -2.122 5.540
70 H LEU 10 HN LEU 10 8.814 -2.274 1.186
71 HA LEU 10 HA LEU 10 7.897 0.575 1.322
72 HB2 LEU 10 HB2 LEU 10 10.424 -0.315 0.935
73 HB3 LEU 10 HB1 LEU 10 9.851 -0.398 -0.725
74 HG LEU 10 HG LEU 10 9.628 2.075 1.016
75 HD11 LEU 10 HD11 LEU 10 11.724 1.108 -0.903
76 HD12 LEU 10 HD12 LEU 10 11.922 1.948 0.635
77 HD13 LEU 10 HD13 LEU 10 11.389 2.836 -0.792
78 HD21 LEU 10 HD21 LEU 10 9.204 3.153 -1.226
79 HD22 LEU 10 HD22 LEU 10 7.942 2.024 -0.739
80 HD23 LEU 10 HD23 LEU 10 9.143 1.541 -1.936
81 H TYR 11 HN TYR 11 8.616 -1.907 -1.165
82 HA TYR 11 HA TYR 11 6.559 -0.945 -2.968
83 HB2 TYR 11 HB2 TYR 11 8.752 -2.852 -2.922
84 HB3 TYR 11 HB1 TYR 11 7.349 -3.519 -3.748
85 HD1 TYR 11 HD1 TYR 11 6.326 -2.260 -5.677
86 HD2 TYR 11 HD2 TYR 11 10.026 -1.059 -3.853
87 HE1 TYR 11 HE1 TYR 11 6.842 -0.845 -7.647
88 HE2 TYR 11 HE2 TYR 11 10.541 0.354 -5.822
89 HH TYR 11 HH TYR 11 9.487 0.094 -8.595
90 H GLY 12 HN GLY 12 6.592 -3.299 -0.393
91 HA2 GLY 12 HA2 GLY 12 4.077 -4.556 -1.321
92 HA3 GLY 12 HA1 GLY 12 5.019 -5.046 0.086
93 H VAL 13 HN VAL 13 4.973 -1.830 0.510
94 HA VAL 13 HA VAL 13 2.459 -1.885 2.118
95 HB VAL 13 HB VAL 13 5.134 -0.503 2.417
96 HG11 VAL 13 HG11 VAL 13 2.531 -0.046 3.863
97 HG12 VAL 13 HG12 VAL 13 3.674 1.143 3.240
98 HG13 VAL 13 HG13 VAL 13 4.072 0.211 4.683
99 HG21 VAL 13 HG21 VAL 13 3.684 -2.386 4.298
100 HG22 VAL 13 HG22 VAL 13 5.366 -1.864 4.382
101 HG23 VAL 13 HG23 VAL 13 4.841 -2.940 3.086
102 H TRP 14 HN TRP 14 4.440 0.155 -0.005
103 HA TRP 14 HA TRP 14 2.998 2.553 -0.021
104 HB2 TRP 14 HB2 TRP 14 5.160 2.148 -1.126
105 HB3 TRP 14 HB1 TRP 14 4.367 1.163 -2.336
106 HD1 TRP 14 HD1 TRP 14 4.397 2.529 -4.475
107 HE1 TRP 14 HE1 TRP 14 3.697 4.915 -5.146
108 HE3 TRP 14 HE3 TRP 14 3.250 4.448 0.123
109 HZ2 TRP 14 HZ2 TRP 14 2.775 7.320 -3.904
110 HZ3 TRP 14 HZ3 TRP 14 2.466 6.783 0.345
111 HH2 TRP 14 HH2 TRP 14 2.227 8.223 -1.657
112 HA PRO 15 HA PRO 15 0.162 1.045 -3.593
113 HB2 PRO 15 HB2 PRO 15 0.001 -1.640 -4.093
114 HB3 PRO 15 HB1 PRO 15 1.146 -0.560 -4.917
115 HG2 PRO 15 HG2 PRO 15 1.609 -2.409 -2.632
116 HG3 PRO 15 HG1 PRO 15 2.637 -2.062 -4.032
117 HD2 PRO 15 HD2 PRO 15 3.086 -1.000 -1.590
118 HD3 PRO 15 HD1 PRO 15 3.515 -0.153 -3.090
119 H LEU 16 HN LEU 16 0.515 -1.037 -0.735
120 HA LEU 16 HA LEU 16 -2.262 -1.791 -0.510
121 HB2 LEU 16 HB2 LEU 16 0.216 -1.844 1.137
122 HB3 LEU 16 HB1 LEU 16 -1.297 -1.881 2.038
123 HG LEU 16 HG LEU 16 -2.048 -3.784 0.573
124 HD11 LEU 16 HD11 LEU 16 -0.704 -3.552 -1.377
125 HD12 LEU 16 HD12 LEU 16 -0.099 -5.001 -0.576
126 HD13 LEU 16 HD13 LEU 16 0.786 -3.483 -0.438
127 HD21 LEU 16 HD21 LEU 16 0.573 -4.354 1.985
128 HD22 LEU 16 HD22 LEU 16 -0.795 -5.446 1.779
129 HD23 LEU 16 HD23 LEU 16 -0.936 -4.051 2.846
130 H LEU 17 HN LEU 17 -0.341 0.858 0.847
131 HA LEU 17 HA LEU 17 -2.467 2.104 2.358
132 HB2 LEU 17 HB2 LEU 17 0.283 2.709 1.436
133 HB3 LEU 17 HB1 LEU 17 -0.731 4.133 1.640
134 HG LEU 17 HG LEU 17 -0.655 2.043 3.800
135 HD11 LEU 17 HD11 LEU 17 1.247 3.120 4.833
136 HD12 LEU 17 HD12 LEU 17 1.293 4.355 3.574
137 HD13 LEU 17 HD13 LEU 17 1.709 2.685 3.187
138 HD21 LEU 17 HD21 LEU 17 -1.117 5.041 3.679
139 HD22 LEU 17 HD22 LEU 17 -1.043 4.122 5.182
140 HD23 LEU 17 HD23 LEU 17 -2.322 3.797 4.012
141 H LEU 18 HN LEU 18 -1.201 2.518 -0.911
142 HA LEU 18 HA LEU 18 -2.898 4.652 -1.801
143 HB2 LEU 18 HB2 LEU 18 -1.071 2.610 -2.890
144 HB3 LEU 18 HB1 LEU 18 -2.365 3.024 -4.006
145 HG LEU 18 HG LEU 18 -1.792 5.416 -3.796
146 HD11 LEU 18 HD11 LEU 18 -0.860 5.174 -1.437
147 HD12 LEU 18 HD12 LEU 18 0.102 6.169 -2.527
148 HD13 LEU 18 HD13 LEU 18 0.602 4.517 -2.172
149 HD21 LEU 18 HD21 LEU 18 -0.692 4.035 -5.536
150 HD22 LEU 18 HD22 LEU 18 0.611 3.666 -4.407
151 HD23 LEU 18 HD23 LEU 18 0.372 5.321 -4.968
152 H LEU 19 HN LEU 19 -3.249 1.101 -1.791
153 HA LEU 19 HA LEU 19 -5.813 0.963 -3.102
154 HB2 LEU 19 HB2 LEU 19 -3.844 -0.775 -2.046
155 HB3 LEU 19 HB1 LEU 19 -5.324 -1.155 -1.179
156 HG LEU 19 HG LEU 19 -5.355 -0.854 -4.175
157 HD11 LEU 19 HD11 LEU 19 -3.559 -2.510 -3.375
158 HD12 LEU 19 HD12 LEU 19 -4.778 -3.136 -4.485
159 HD13 LEU 19 HD13 LEU 19 -4.896 -3.485 -2.760
160 HD21 LEU 19 HD21 LEU 19 -7.469 -0.980 -2.783
161 HD22 LEU 19 HD22 LEU 19 -6.973 -2.602 -2.292
162 HD23 LEU 19 HD23 LEU 19 -7.317 -2.260 -3.987
163 H LEU 20 HN LEU 20 -4.762 1.199 0.248
164 HA LEU 20 HA LEU 20 -7.338 0.934 1.522
165 HB2 LEU 20 HB2 LEU 20 -4.550 1.496 2.178
166 HB3 LEU 20 HB1 LEU 20 -5.631 2.487 3.142
167 HG LEU 20 HG LEU 20 -5.121 0.344 4.255
168 HD11 LEU 20 HD11 LEU 20 -7.439 1.534 4.333
169 HD12 LEU 20 HD12 LEU 20 -7.299 -0.101 4.976
170 HD13 LEU 20 HD13 LEU 20 -7.990 0.159 3.376
171 HD21 LEU 20 HD21 LEU 20 -6.124 -0.751 1.643
172 HD22 LEU 20 HD22 LEU 20 -6.390 -1.680 3.115
173 HD23 LEU 20 HD23 LEU 20 -4.751 -1.268 2.619
174 H LEU 21 HN LEU 21 -5.490 3.736 0.302
175 HA LEU 21 HA LEU 21 -7.071 5.836 1.394
176 HB2 LEU 21 HB2 LEU 21 -4.808 5.868 0.166
177 HB3 LEU 21 HB1 LEU 21 -5.752 5.858 -1.324
178 HG LEU 21 HG LEU 21 -7.034 7.849 -0.051
179 HD11 LEU 21 HD11 LEU 21 -4.189 7.930 1.002
180 HD12 LEU 21 HD12 LEU 21 -5.649 7.713 1.967
181 HD13 LEU 21 HD13 LEU 21 -5.358 9.243 1.140
182 HD21 LEU 21 HD21 LEU 21 -5.725 9.385 -1.385
183 HD22 LEU 21 HD22 LEU 21 -5.846 7.874 -2.286
184 HD23 LEU 21 HD23 LEU 21 -4.360 8.269 -1.423
185 H ALA 22 HN ALA 22 -7.424 3.991 -1.594
186 HA ALA 22 HA ALA 22 -10.170 5.151 -1.969
187 HB1 ALA 22 HB1 ALA 22 -8.162 5.617 -3.611
188 HB2 ALA 22 HB2 ALA 22 -9.744 5.214 -4.278
189 HB3 ALA 22 HB3 ALA 22 -8.488 3.979 -4.178
190 H LEU 23 HN LEU 23 -9.700 2.906 -0.282
191 HA LEU 23 HA LEU 23 -9.986 0.403 -1.671
192 HB2 LEU 23 HB2 LEU 23 -10.011 -0.518 0.485
193 HB3 LEU 23 HB1 LEU 23 -9.114 0.973 0.705
194 HG LEU 23 HG LEU 23 -11.584 1.914 1.211
195 HD11 LEU 23 HD11 LEU 23 -12.336 -0.601 0.832
196 HD12 LEU 23 HD12 LEU 23 -13.061 0.364 2.116
197 HD13 LEU 23 HD13 LEU 23 -11.784 -0.791 2.496
198 HD21 LEU 23 HD21 LEU 23 -10.293 0.355 3.423
199 HD22 LEU 23 HD22 LEU 23 -10.904 2.009 3.430
200 HD23 LEU 23 HD23 LEU 23 -9.367 1.641 2.651
201 HA PRO 24 HA PRO 24 -14.364 0.585 -2.337
202 HB2 PRO 24 HB2 PRO 24 -14.621 -1.924 -3.384
203 HB3 PRO 24 HB1 PRO 24 -13.885 -0.572 -4.262
204 HG2 PRO 24 HG2 PRO 24 -12.627 -2.936 -3.120
205 HG3 PRO 24 HG1 PRO 24 -12.015 -1.807 -4.333
206 HD2 PRO 24 HD2 PRO 24 -11.384 -1.931 -1.533
207 HD3 PRO 24 HD1 PRO 24 -10.713 -0.842 -2.767
208 HA PRO 25 HA PRO 25 -15.595 -1.429 1.526
209 HB2 PRO 25 HB2 PRO 25 -18.044 -0.246 1.723
210 HB3 PRO 25 HB1 PRO 25 -16.533 0.565 2.183
211 HG2 PRO 25 HG2 PRO 25 -18.148 0.855 -0.295
212 HG3 PRO 25 HG1 PRO 25 -17.274 2.082 0.637
213 HD2 PRO 25 HD2 PRO 25 -16.330 1.005 -1.676
214 HD3 PRO 25 HD1 PRO 25 -15.285 1.645 -0.388
215 H ARG 26 HN ARG 26 -16.954 -3.181 1.982
216 HA ARG 26 HA ARG 26 -18.268 -4.478 -0.342
217 HB2 ARG 26 HB2 ARG 26 -17.451 -5.331 2.441
218 HB3 ARG 26 HB1 ARG 26 -18.397 -6.377 1.385
219 HG2 ARG 26 HG2 ARG 26 -16.593 -6.925 0.152
220 HG3 ARG 26 HG1 ARG 26 -16.112 -5.237 -0.020
221 HD2 ARG 26 HD2 ARG 26 -15.148 -5.328 2.302
222 HD3 ARG 26 HD1 ARG 26 -15.492 -7.069 2.323
223 HE ARG 26 HE ARG 26 -13.650 -5.752 0.362
224 HH11 ARG 26 HH11 ARG 26 -14.780 -8.359 -0.556
225 HH12 ARG 26 HH12 ARG 26 -13.610 -9.499 0.017
226 HH21 ARG 26 HH21 ARG 26 -12.157 -7.258 2.259
227 HH22 ARG 26 HH22 ARG 26 -12.110 -8.869 1.628
228 H ALA 27 HN ALA 27 -19.113 -3.323 2.934
229 HA ALA 27 HA ALA 27 -22.014 -3.609 2.221
230 HB1 ALA 27 HB1 ALA 27 -21.392 -5.186 3.941
231 HB2 ALA 27 HB2 ALA 27 -22.271 -3.879 4.734
232 HB3 ALA 27 HB3 ALA 27 -20.512 -3.946 4.835
233 H TYR 28 HN TYR 28 -21.199 -1.361 1.311
234 HA TYR 28 HA TYR 28 -21.090 0.774 3.352
235 HB2 TYR 28 HB2 TYR 28 -20.499 2.204 1.492
236 HB3 TYR 28 HB1 TYR 28 -19.593 0.707 1.348
237 HD1 TYR 28 HD2 TYR 28 -22.343 2.731 -0.032
238 HD2 TYR 28 HD1 TYR 28 -20.059 -0.883 -0.462
239 HE1 TYR 28 HE2 TYR 28 -23.275 2.411 -2.303
240 HE2 TYR 28 HE1 TYR 28 -20.991 -1.200 -2.735
241 HH TYR 28 HH TYR 28 -22.174 0.910 -4.548
242 H ALA 29 HN ALA 29 -23.344 -0.336 0.799
243 HA ALA 29 HA ALA 29 -25.613 0.866 2.192
244 HB1 ALA 29 HB1 ALA 29 -26.142 2.534 0.517
245 HB2 ALA 29 HB2 ALA 29 -24.813 1.996 -0.507
246 HB3 ALA 29 HB3 ALA 29 -24.475 2.797 1.028
Start of MODEL 19
1 H1 ARG 1 HT1 ARG 1 12.346 -3.160 -6.796
2 H2 ARG 1 HT2 ARG 1 13.761 -4.049 -7.106
3 H3 ARG 1 HT3 ARG 1 13.126 -3.971 -5.532
4 HA ARG 1 HA ARG 1 11.253 -5.302 -6.101
5 HB2 ARG 1 HB2 ARG 1 11.780 -4.057 -8.593
6 HB3 ARG 1 HB1 ARG 1 11.849 -5.793 -8.881
7 HG2 ARG 1 HG2 ARG 1 9.648 -6.112 -7.943
8 HG3 ARG 1 HG1 ARG 1 9.580 -4.435 -7.404
9 HD2 ARG 1 HD2 ARG 1 9.899 -5.169 -10.328
10 HD3 ARG 1 HD1 ARG 1 8.312 -4.936 -9.571
11 HE ARG 1 HE ARG 1 9.439 -2.651 -8.793
12 HH11 ARG 1 HH21 ARG 1 7.858 -2.377 -11.240
13 HH12 ARG 1 HH22 ARG 1 9.002 -1.802 -12.404
14 HH21 ARG 1 HH11 ARG 1 11.777 -2.758 -10.520
15 HH22 ARG 1 HH12 ARG 1 11.246 -2.021 -11.993
16 H LEU 2 HN LEU 2 14.196 -5.761 -5.435
17 HA LEU 2 HA LEU 2 14.243 -8.658 -6.054
18 HB2 LEU 2 HB2 LEU 2 15.901 -6.578 -7.328
19 HB3 LEU 2 HB1 LEU 2 16.823 -7.939 -6.696
20 HG LEU 2 HG LEU 2 14.476 -8.949 -8.018
21 HD11 LEU 2 HD11 LEU 2 14.932 -8.187 -10.303
22 HD12 LEU 2 HD12 LEU 2 16.221 -7.137 -9.714
23 HD13 LEU 2 HD13 LEU 2 14.545 -6.810 -9.272
24 HD21 LEU 2 HD21 LEU 2 16.562 -10.196 -7.649
25 HD22 LEU 2 HD22 LEU 2 17.439 -9.062 -8.677
26 HD23 LEU 2 HD23 LEU 2 16.206 -10.112 -9.374
27 H VAL 3 HN VAL 3 13.951 -7.207 -3.526
28 HA VAL 3 HA VAL 3 16.431 -8.157 -2.147
29 HB VAL 3 HB VAL 3 14.933 -5.657 -1.359
30 HG11 VAL 3 HG11 VAL 3 17.075 -5.159 -0.203
31 HG12 VAL 3 HG12 VAL 3 17.704 -6.713 -0.750
32 HG13 VAL 3 HG13 VAL 3 16.338 -6.658 0.365
33 HG21 VAL 3 HG21 VAL 3 15.732 -5.014 -3.488
34 HG22 VAL 3 HG22 VAL 3 17.184 -6.004 -3.341
35 HG23 VAL 3 HG23 VAL 3 17.034 -4.515 -2.408
36 HA PRO 4 HA PRO 4 13.260 -10.083 0.314
37 HB2 PRO 4 HB2 PRO 4 14.933 -11.473 1.962
38 HB3 PRO 4 HB1 PRO 4 14.608 -11.940 0.282
39 HG2 PRO 4 HG2 PRO 4 17.009 -10.742 1.455
40 HG3 PRO 4 HG1 PRO 4 16.825 -11.698 -0.021
41 HD2 PRO 4 HD2 PRO 4 17.092 -8.882 0.193
42 HD3 PRO 4 HD1 PRO 4 16.786 -9.827 -1.276
43 H GLY 5 HN GLY 5 12.284 -8.451 1.535
44 HA2 GLY 5 HA2 GLY 5 11.821 -7.837 3.875
45 HA3 GLY 5 HA1 GLY 5 13.562 -7.771 4.149
46 H ALA 6 HN ALA 6 14.599 -6.230 2.285
47 HA ALA 6 HA ALA 6 13.735 -3.553 2.935
48 HB1 ALA 6 HB1 ALA 6 15.714 -2.965 1.945
49 HB2 ALA 6 HB2 ALA 6 15.446 -4.013 0.554
50 HB3 ALA 6 HB3 ALA 6 16.037 -4.693 2.070
51 H ALA 7 HN ALA 7 13.472 -5.515 -0.007
52 HA ALA 7 HA ALA 7 11.737 -3.456 -1.280
53 HB1 ALA 7 HB1 ALA 7 12.116 -4.798 -3.291
54 HB2 ALA 7 HB2 ALA 7 12.855 -6.075 -2.326
55 HB3 ALA 7 HB3 ALA 7 13.656 -4.512 -2.480
56 H TYR 8 HN TYR 8 10.951 -5.430 1.018
57 HA TYR 8 HA TYR 8 8.643 -6.777 -0.322
58 HB2 TYR 8 HB2 TYR 8 10.561 -7.491 1.744
59 HB3 TYR 8 HB1 TYR 8 8.917 -7.622 2.359
60 HD1 TYR 8 HD1 TYR 8 11.138 -8.671 -0.459
61 HD2 TYR 8 HD2 TYR 8 7.517 -9.420 1.731
62 HE1 TYR 8 HE1 TYR 8 10.839 -10.809 -1.678
63 HE2 TYR 8 HE2 TYR 8 7.220 -11.556 0.511
64 HH TYR 8 HH TYR 8 8.343 -12.329 -2.140
65 H ALA 9 HN ALA 9 9.490 -5.117 2.712
66 HA ALA 9 HA ALA 9 6.795 -4.491 3.489
67 HB1 ALA 9 HB1 ALA 9 7.901 -2.992 5.096
68 HB2 ALA 9 HB2 ALA 9 9.397 -3.082 4.168
69 HB3 ALA 9 HB3 ALA 9 8.785 -4.515 4.996
70 H LEU 10 HN LEU 10 9.253 -2.702 1.703
71 HA LEU 10 HA LEU 10 7.949 -0.192 1.363
72 HB2 LEU 10 HB2 LEU 10 10.323 -1.349 0.644
73 HB3 LEU 10 HB1 LEU 10 9.506 -1.296 -0.913
74 HG LEU 10 HG LEU 10 9.403 1.164 0.780
75 HD11 LEU 10 HD11 LEU 10 11.832 0.047 0.563
76 HD12 LEU 10 HD12 LEU 10 11.593 1.791 0.454
77 HD13 LEU 10 HD13 LEU 10 11.764 0.831 -1.016
78 HD21 LEU 10 HD21 LEU 10 10.037 1.035 -2.150
79 HD22 LEU 10 HD22 LEU 10 9.068 2.214 -1.267
80 HD23 LEU 10 HD23 LEU 10 8.402 0.624 -1.631
81 H TYR 11 HN TYR 11 8.006 -3.030 -0.806
82 HA TYR 11 HA TYR 11 6.039 -1.994 -2.658
83 HB2 TYR 11 HB2 TYR 11 7.534 -4.528 -2.168
84 HB3 TYR 11 HB1 TYR 11 6.111 -4.617 -3.201
85 HD1 TYR 11 HD2 TYR 11 9.377 -2.893 -2.739
86 HD2 TYR 11 HD1 TYR 11 6.129 -3.740 -5.419
87 HE1 TYR 11 HE2 TYR 11 10.677 -1.928 -4.615
88 HE2 TYR 11 HE1 TYR 11 7.428 -2.776 -7.296
89 HH TYR 11 HH TYR 11 9.790 -0.796 -7.075
90 H GLY 12 HN GLY 12 5.719 -3.494 0.420
91 HA2 GLY 12 HA2 GLY 12 3.038 -4.586 -0.109
92 HA3 GLY 12 HA1 GLY 12 3.914 -4.680 1.414
93 H VAL 13 HN VAL 13 4.349 -1.549 0.957
94 HA VAL 13 HA VAL 13 1.722 -0.827 2.181
95 HB VAL 13 HB VAL 13 2.949 0.988 3.293
96 HG11 VAL 13 HG11 VAL 13 3.500 -1.856 3.655
97 HG12 VAL 13 HG12 VAL 13 3.144 -0.615 4.854
98 HG13 VAL 13 HG13 VAL 13 4.795 -0.837 4.281
99 HG21 VAL 13 HG21 VAL 13 5.412 -0.180 1.944
100 HG22 VAL 13 HG22 VAL 13 5.403 1.116 3.138
101 HG23 VAL 13 HG23 VAL 13 4.675 1.375 1.555
102 H TRP 14 HN TRP 14 3.937 0.054 -0.397
103 HA TRP 14 HA TRP 14 2.914 2.619 -1.048
104 HB2 TRP 14 HB2 TRP 14 4.989 1.549 -1.938
105 HB3 TRP 14 HB1 TRP 14 3.995 0.508 -2.937
106 HD1 TRP 14 HD1 TRP 14 4.369 1.392 -5.300
107 HE1 TRP 14 HE1 TRP 14 4.090 3.670 -6.467
108 HE3 TRP 14 HE3 TRP 14 3.416 4.363 -1.249
109 HZ2 TRP 14 HZ2 TRP 14 3.535 6.388 -5.782
110 HZ3 TRP 14 HZ3 TRP 14 3.016 6.784 -1.538
111 HH2 TRP 14 HH2 TRP 14 3.074 7.804 -3.795
112 HA PRO 15 HA PRO 15 -0.277 0.671 -3.996
113 HB2 PRO 15 HB2 PRO 15 -0.710 -2.024 -3.964
114 HB3 PRO 15 HB1 PRO 15 0.492 -1.250 -5.017
115 HG2 PRO 15 HG2 PRO 15 0.885 -2.732 -2.481
116 HG3 PRO 15 HG1 PRO 15 1.908 -2.665 -3.924
117 HD2 PRO 15 HD2 PRO 15 2.402 -1.285 -1.607
118 HD3 PRO 15 HD1 PRO 15 3.020 -0.818 -3.204
119 H LEU 16 HN LEU 16 0.030 -1.061 -0.874
120 HA LEU 16 HA LEU 16 -2.788 -1.392 -0.409
121 HB2 LEU 16 HB2 LEU 16 -0.249 -1.600 1.106
122 HB3 LEU 16 HB1 LEU 16 -1.685 -1.304 2.083
123 HG LEU 16 HG LEU 16 -2.796 -3.217 0.825
124 HD11 LEU 16 HD11 LEU 16 -1.102 -4.866 -0.137
125 HD12 LEU 16 HD12 LEU 16 0.060 -3.540 -0.124
126 HD13 LEU 16 HD13 LEU 16 -1.400 -3.424 -1.106
127 HD21 LEU 16 HD21 LEU 16 -1.766 -4.913 2.234
128 HD22 LEU 16 HD22 LEU 16 -1.820 -3.399 3.135
129 HD23 LEU 16 HD23 LEU 16 -0.308 -3.937 2.406
130 H LEU 17 HN LEU 17 -0.516 1.161 0.569
131 HA LEU 17 HA LEU 17 -2.416 2.757 2.036
132 HB2 LEU 17 HB2 LEU 17 0.101 2.939 2.093
133 HB3 LEU 17 HB1 LEU 17 0.045 3.619 0.469
134 HG LEU 17 HG LEU 17 -1.789 4.991 2.287
135 HD11 LEU 17 HD11 LEU 17 0.207 4.215 3.782
136 HD12 LEU 17 HD12 LEU 17 -0.278 5.910 3.833
137 HD13 LEU 17 HD13 LEU 17 1.131 5.423 2.890
138 HD21 LEU 17 HD21 LEU 17 -1.004 5.777 0.039
139 HD22 LEU 17 HD22 LEU 17 0.618 5.960 0.707
140 HD23 LEU 17 HD23 LEU 17 -0.705 6.951 1.319
141 H LEU 18 HN LEU 18 -1.385 2.683 -1.336
142 HA LEU 18 HA LEU 18 -2.959 4.882 -2.323
143 HB2 LEU 18 HB2 LEU 18 -1.280 2.711 -3.298
144 HB3 LEU 18 HB1 LEU 18 -2.691 2.888 -4.330
145 HG LEU 18 HG LEU 18 -2.191 5.364 -4.449
146 HD11 LEU 18 HD11 LEU 18 -0.828 5.816 -2.581
147 HD12 LEU 18 HD12 LEU 18 0.316 5.833 -3.922
148 HD13 LEU 18 HD13 LEU 18 0.204 4.418 -2.879
149 HD21 LEU 18 HD21 LEU 18 -0.261 5.064 -6.014
150 HD22 LEU 18 HD22 LEU 18 -1.542 3.882 -6.279
151 HD23 LEU 18 HD23 LEU 18 -0.075 3.415 -5.418
152 H LEU 19 HN LEU 19 -3.570 1.386 -1.948
153 HA LEU 19 HA LEU 19 -6.230 1.363 -3.068
154 HB2 LEU 19 HB2 LEU 19 -4.327 -0.449 -1.952
155 HB3 LEU 19 HB1 LEU 19 -5.828 -0.666 -1.064
156 HG LEU 19 HG LEU 19 -5.767 -0.578 -4.085
157 HD11 LEU 19 HD11 LEU 19 -4.264 -2.390 -3.122
158 HD12 LEU 19 HD12 LEU 19 -5.585 -2.967 -4.137
159 HD13 LEU 19 HD13 LEU 19 -5.709 -3.082 -2.382
160 HD21 LEU 19 HD21 LEU 19 -7.698 -1.936 -2.178
161 HD22 LEU 19 HD22 LEU 19 -7.929 -1.616 -3.897
162 HD23 LEU 19 HD23 LEU 19 -7.923 -0.281 -2.743
163 H LEU 20 HN LEU 20 -4.909 1.828 0.163
164 HA LEU 20 HA LEU 20 -7.390 1.810 1.636
165 HB2 LEU 20 HB2 LEU 20 -4.552 2.256 2.052
166 HB3 LEU 20 HB1 LEU 20 -5.476 3.463 2.928
167 HG LEU 20 HG LEU 20 -5.114 1.540 4.363
168 HD11 LEU 20 HD11 LEU 20 -7.291 1.272 5.135
169 HD12 LEU 20 HD12 LEU 20 -7.969 1.190 3.509
170 HD13 LEU 20 HD13 LEU 20 -7.443 2.740 4.168
171 HD21 LEU 20 HD21 LEU 20 -6.364 -0.640 3.564
172 HD22 LEU 20 HD22 LEU 20 -4.730 -0.307 2.996
173 HD23 LEU 20 HD23 LEU 20 -6.111 0.040 1.957
174 H LEU 21 HN LEU 21 -5.469 4.412 0.112
175 HA LEU 21 HA LEU 21 -6.879 6.687 1.028
176 HB2 LEU 21 HB2 LEU 21 -4.714 6.447 -0.335
177 HB3 LEU 21 HB1 LEU 21 -5.753 6.334 -1.755
178 HG LEU 21 HG LEU 21 -6.823 8.532 -0.577
179 HD11 LEU 21 HD11 LEU 21 -3.873 8.513 0.128
180 HD12 LEU 21 HD12 LEU 21 -5.222 8.558 1.263
181 HD13 LEU 21 HD13 LEU 21 -4.912 9.936 0.205
182 HD21 LEU 21 HD21 LEU 21 -5.896 8.197 -2.927
183 HD22 LEU 21 HD22 LEU 21 -4.320 8.658 -2.284
184 HD23 LEU 21 HD23 LEU 21 -5.658 9.808 -2.250
185 H ALA 22 HN ALA 22 -7.702 4.380 -1.461
186 HA ALA 22 HA ALA 22 -10.410 5.599 -1.764
187 HB1 ALA 22 HB1 ALA 22 -10.195 5.654 -4.121
188 HB2 ALA 22 HB2 ALA 22 -8.846 4.519 -4.115
189 HB3 ALA 22 HB3 ALA 22 -8.601 6.182 -3.583
190 H LEU 23 HN LEU 23 -9.991 3.513 -0.091
191 HA LEU 23 HA LEU 23 -10.044 0.924 -1.374
192 HB2 LEU 23 HB2 LEU 23 -10.053 0.085 0.828
193 HB3 LEU 23 HB1 LEU 23 -9.173 1.595 0.935
194 HG LEU 23 HG LEU 23 -11.684 2.501 1.433
195 HD11 LEU 23 HD11 LEU 23 -11.547 -0.310 2.577
196 HD12 LEU 23 HD12 LEU 23 -12.677 0.245 1.342
197 HD13 LEU 23 HD13 LEU 23 -12.769 0.896 2.978
198 HD21 LEU 23 HD21 LEU 23 -10.025 1.215 3.607
199 HD22 LEU 23 HD22 LEU 23 -10.990 2.688 3.695
200 HD23 LEU 23 HD23 LEU 23 -9.492 2.672 2.769
201 HA PRO 24 HA PRO 24 -14.438 0.800 -2.002
202 HB2 PRO 24 HB2 PRO 24 -14.447 -1.609 -3.284
203 HB3 PRO 24 HB1 PRO 24 -13.878 -0.110 -4.043
204 HG2 PRO 24 HG2 PRO 24 -12.350 -2.423 -3.165
205 HG3 PRO 24 HG1 PRO 24 -11.882 -1.109 -4.247
206 HD2 PRO 24 HD2 PRO 24 -11.224 -1.464 -1.460
207 HD3 PRO 24 HD1 PRO 24 -10.647 -0.217 -2.587
208 HA PRO 25 HA PRO 25 -15.950 -1.724 1.318
209 HB2 PRO 25 HB2 PRO 25 -18.504 -2.238 0.488
210 HB3 PRO 25 HB1 PRO 25 -17.982 -0.654 1.102
211 HG2 PRO 25 HG2 PRO 25 -18.353 -1.557 -1.707
212 HG3 PRO 25 HG1 PRO 25 -18.758 -0.004 -0.956
213 HD2 PRO 25 HD2 PRO 25 -16.559 -0.362 -2.491
214 HD3 PRO 25 HD1 PRO 25 -16.628 0.808 -1.154
215 H ARG 26 HN ARG 26 -16.298 -3.928 1.836
216 HA ARG 26 HA ARG 26 -16.389 -5.899 -0.410
217 HB2 ARG 26 HB2 ARG 26 -14.160 -5.207 1.313
218 HB3 ARG 26 HB1 ARG 26 -14.603 -6.900 1.537
219 HG2 ARG 26 HG2 ARG 26 -13.942 -7.489 -0.557
220 HG3 ARG 26 HG1 ARG 26 -14.552 -6.001 -1.278
221 HD2 ARG 26 HD2 ARG 26 -12.260 -5.532 0.503
222 HD3 ARG 26 HD1 ARG 26 -11.869 -6.578 -0.874
223 HE ARG 26 HE ARG 26 -12.680 -3.761 -1.041
224 HH11 ARG 26 HH21 ARG 26 -10.589 -5.141 -2.763
225 HH12 ARG 26 HH22 ARG 26 -11.399 -5.226 -4.291
226 HH21 ARG 26 HH11 ARG 26 -14.551 -4.587 -2.938
227 HH22 ARG 26 HH12 ARG 26 -13.666 -4.909 -4.390
228 H ALA 27 HN ALA 27 -16.025 -5.974 3.166
229 HA ALA 27 HA ALA 27 -17.186 -7.158 4.820
230 HB1 ALA 27 HB1 ALA 27 -18.840 -5.464 4.058
231 HB2 ALA 27 HB2 ALA 27 -19.607 -6.942 4.644
232 HB3 ALA 27 HB3 ALA 27 -19.481 -6.642 2.911
233 H TYR 28 HN TYR 28 -15.861 -8.864 3.011
234 HA TYR 28 HA TYR 28 -17.629 -10.969 2.045
235 HB2 TYR 28 HB2 TYR 28 -15.573 -12.033 1.370
236 HB3 TYR 28 HB1 TYR 28 -15.380 -10.307 1.095
237 HD1 TYR 28 HD1 TYR 28 -14.411 -13.166 3.217
238 HD2 TYR 28 HD2 TYR 28 -13.835 -8.979 2.447
239 HE1 TYR 28 HE1 TYR 28 -12.405 -13.173 4.668
240 HE2 TYR 28 HE2 TYR 28 -11.830 -8.987 3.900
241 HH TYR 28 HH TYR 28 -10.126 -11.384 4.661
242 H ALA 29 HN ALA 29 -15.911 -10.342 5.057
243 HA ALA 29 HA ALA 29 -16.896 -12.960 6.144
244 HB1 ALA 29 HB1 ALA 29 -14.363 -11.369 6.624
245 HB2 ALA 29 HB2 ALA 29 -14.505 -13.014 6.001
246 HB3 ALA 29 HB3 ALA 29 -14.878 -12.676 7.691
Start of MODEL 20
1 H1 ARG 1 HT1 ARG 1 14.505 2.610 -5.224
2 H2 ARG 1 HT2 ARG 1 13.129 2.434 -6.203
3 H3 ARG 1 HT3 ARG 1 14.415 3.421 -6.711
4 HA ARG 1 HA ARG 1 14.505 1.343 -7.924
5 HB2 ARG 1 HB2 ARG 1 16.530 2.639 -6.847
6 HB3 ARG 1 HB1 ARG 1 16.652 1.213 -5.817
7 HG2 ARG 1 HG2 ARG 1 16.941 -0.235 -7.720
8 HG3 ARG 1 HG1 ARG 1 16.567 1.074 -8.841
9 HD2 ARG 1 HD2 ARG 1 18.877 1.360 -6.921
10 HD3 ARG 1 HD1 ARG 1 19.083 0.479 -8.448
11 HE ARG 1 HE ARG 1 18.127 3.318 -8.304
12 HH11 ARG 1 HH11 ARG 1 17.591 1.870 -10.867
13 HH12 ARG 1 HH12 ARG 1 18.990 2.253 -11.810
14 HH21 ARG 1 HH21 ARG 1 20.863 3.306 -9.064
15 HH22 ARG 1 HH22 ARG 1 20.861 3.074 -10.778
16 H LEU 2 HN LEU 2 14.260 -0.922 -7.898
17 HA LEU 2 HA LEU 2 12.926 -2.104 -5.607
18 HB2 LEU 2 HB2 LEU 2 13.108 -2.590 -8.333
19 HB3 LEU 2 HB1 LEU 2 13.989 -3.947 -7.632
20 HG LEU 2 HG LEU 2 11.222 -3.081 -6.746
21 HD11 LEU 2 HD11 LEU 2 12.068 -5.363 -8.557
22 HD12 LEU 2 HD12 LEU 2 11.178 -3.924 -9.056
23 HD13 LEU 2 HD13 LEU 2 10.433 -5.085 -7.958
24 HD21 LEU 2 HD21 LEU 2 12.312 -4.261 -4.973
25 HD22 LEU 2 HD22 LEU 2 13.024 -5.426 -6.088
26 HD23 LEU 2 HD23 LEU 2 11.290 -5.454 -5.772
27 H VAL 3 HN VAL 3 13.955 -2.780 -3.841
28 HA VAL 3 HA VAL 3 16.600 -4.156 -4.048
29 HB VAL 3 HB VAL 3 15.803 -2.126 -1.941
30 HG11 VAL 3 HG11 VAL 3 17.447 -3.673 -1.116
31 HG12 VAL 3 HG12 VAL 3 18.270 -2.154 -1.469
32 HG13 VAL 3 HG13 VAL 3 18.410 -3.512 -2.585
33 HG21 VAL 3 HG21 VAL 3 17.288 -1.808 -4.539
34 HG22 VAL 3 HG22 VAL 3 17.723 -0.796 -3.163
35 HG23 VAL 3 HG23 VAL 3 16.086 -0.743 -3.813
36 HA PRO 4 HA PRO 4 14.319 -6.987 -1.509
37 HB2 PRO 4 HB2 PRO 4 16.374 -8.607 -0.732
38 HB3 PRO 4 HB1 PRO 4 15.675 -8.628 -2.362
39 HG2 PRO 4 HG2 PRO 4 18.224 -7.484 -1.424
40 HG3 PRO 4 HG1 PRO 4 17.789 -8.143 -3.007
41 HD2 PRO 4 HD2 PRO 4 17.968 -5.436 -2.341
42 HD3 PRO 4 HD1 PRO 4 17.200 -6.103 -3.792
43 H GLY 5 HN GLY 5 13.582 -6.688 0.543
44 HA2 GLY 5 HA2 GLY 5 13.765 -6.658 2.929
45 HA3 GLY 5 HA1 GLY 5 15.462 -6.208 2.772
46 H ALA 6 HN ALA 6 15.495 -3.990 1.285
47 HA ALA 6 HA ALA 6 14.204 -1.994 3.025
48 HB1 ALA 6 HB1 ALA 6 16.061 -1.669 0.657
49 HB2 ALA 6 HB2 ALA 6 16.592 -1.893 2.325
50 HB3 ALA 6 HB3 ALA 6 15.692 -0.446 1.874
51 H ALA 7 HN ALA 7 14.276 -2.649 -0.473
52 HA ALA 7 HA ALA 7 11.743 -1.066 -0.745
53 HB1 ALA 7 HB1 ALA 7 12.756 -1.179 -3.245
54 HB2 ALA 7 HB2 ALA 7 14.244 -1.372 -2.322
55 HB3 ALA 7 HB3 ALA 7 13.237 0.052 -2.078
56 H TYR 8 HN TYR 8 11.438 -3.669 0.104
57 HA TYR 8 HA TYR 8 10.314 -5.056 -2.301
58 HB2 TYR 8 HB2 TYR 8 12.522 -5.872 -0.899
59 HB3 TYR 8 HB1 TYR 8 11.244 -6.708 -0.020
60 HD1 TYR 8 HD2 TYR 8 12.788 -6.231 -3.367
61 HD2 TYR 8 HD1 TYR 8 10.053 -8.544 -0.993
62 HE1 TYR 8 HE2 TYR 8 12.647 -7.924 -5.174
63 HE2 TYR 8 HE1 TYR 8 9.914 -10.235 -2.799
64 HH TYR 8 HH TYR 8 11.916 -10.753 -4.986
65 H ALA 9 HN ALA 9 10.341 -5.182 1.248
66 HA ALA 9 HA ALA 9 7.590 -6.056 1.507
67 HB1 ALA 9 HB1 ALA 9 7.990 -5.620 3.892
68 HB2 ALA 9 HB2 ALA 9 9.408 -4.647 3.495
69 HB3 ALA 9 HB3 ALA 9 9.420 -6.386 3.200
70 H LEU 10 HN LEU 10 9.268 -2.971 1.634
71 HA LEU 10 HA LEU 10 7.102 -1.231 2.364
72 HB2 LEU 10 HB2 LEU 10 9.835 -1.065 1.803
73 HB3 LEU 10 HB1 LEU 10 9.102 -0.162 0.489
74 HG LEU 10 HG LEU 10 9.626 1.325 2.356
75 HD11 LEU 10 HD11 LEU 10 6.641 1.046 2.478
76 HD12 LEU 10 HD12 LEU 10 7.411 1.463 0.947
77 HD13 LEU 10 HD13 LEU 10 7.624 2.505 2.354
78 HD21 LEU 10 HD21 LEU 10 8.731 1.039 4.545
79 HD22 LEU 10 HD22 LEU 10 9.365 -0.541 4.086
80 HD23 LEU 10 HD23 LEU 10 7.630 -0.231 4.013
81 H TYR 11 HN TYR 11 8.442 -2.193 -0.805
82 HA TYR 11 HA TYR 11 6.666 -0.690 -2.463
83 HB2 TYR 11 HB2 TYR 11 8.379 -3.139 -2.825
84 HB3 TYR 11 HB1 TYR 11 7.417 -2.504 -4.151
85 HD1 TYR 11 HD1 TYR 11 8.604 0.031 -1.815
86 HD2 TYR 11 HD2 TYR 11 9.663 -2.252 -5.303
87 HE1 TYR 11 HE1 TYR 11 10.392 1.655 -2.333
88 HE2 TYR 11 HE2 TYR 11 11.449 -0.620 -5.817
89 HH TYR 11 HH TYR 11 12.870 1.133 -4.120
90 H GLY 12 HN GLY 12 6.084 -3.608 -0.688
91 HA2 GLY 12 HA2 GLY 12 3.765 -4.367 -2.367
92 HA3 GLY 12 HA1 GLY 12 4.404 -5.296 -1.011
93 H VAL 13 HN VAL 13 4.513 -3.183 0.907
94 HA VAL 13 HA VAL 13 1.731 -3.133 1.773
95 HB VAL 13 HB VAL 13 4.280 -1.924 2.879
96 HG11 VAL 13 HG11 VAL 13 1.478 -2.095 3.986
97 HG12 VAL 13 HG12 VAL 13 2.557 -0.701 3.930
98 HG13 VAL 13 HG13 VAL 13 2.877 -2.018 5.056
99 HG21 VAL 13 HG21 VAL 13 4.648 -3.912 3.947
100 HG22 VAL 13 HG22 VAL 13 3.655 -4.572 2.648
101 HG23 VAL 13 HG23 VAL 13 2.930 -4.205 4.212
102 H TRP 14 HN TRP 14 3.948 -0.808 0.325
103 HA TRP 14 HA TRP 14 2.643 1.635 0.857
104 HB2 TRP 14 HB2 TRP 14 4.847 1.398 -0.201
105 HB3 TRP 14 HB1 TRP 14 4.108 0.721 -1.636
106 HD1 TRP 14 HD1 TRP 14 4.297 2.490 -3.440
107 HE1 TRP 14 HE1 TRP 14 3.733 4.995 -3.635
108 HE3 TRP 14 HE3 TRP 14 2.970 3.483 1.396
109 HZ2 TRP 14 HZ2 TRP 14 2.841 7.140 -1.966
110 HZ3 TRP 14 HZ3 TRP 14 2.271 5.761 2.059
111 HH2 TRP 14 HH2 TRP 14 2.204 7.589 0.391
112 HA PRO 15 HA PRO 15 -0.075 1.103 -3.068
113 HB2 PRO 15 HB2 PRO 15 -0.264 -1.376 -4.210
114 HB3 PRO 15 HB1 PRO 15 0.942 -0.168 -4.701
115 HG2 PRO 15 HG2 PRO 15 1.258 -2.533 -2.928
116 HG3 PRO 15 HG1 PRO 15 2.366 -1.875 -4.144
117 HD2 PRO 15 HD2 PRO 15 2.675 -1.473 -1.483
118 HD3 PRO 15 HD1 PRO 15 3.237 -0.315 -2.703
119 H LEU 16 HN LEU 16 0.104 -1.783 -0.954
120 HA LEU 16 HA LEU 16 -2.723 -2.349 -0.954
121 HB2 LEU 16 HB2 LEU 16 -0.281 -3.183 0.472
122 HB3 LEU 16 HB1 LEU 16 -1.732 -3.255 1.470
123 HG LEU 16 HG LEU 16 -2.826 -4.473 -0.526
124 HD11 LEU 16 HD11 LEU 16 -0.699 -3.804 -1.948
125 HD12 LEU 16 HD12 LEU 16 -1.488 -5.357 -2.210
126 HD13 LEU 16 HD13 LEU 16 -0.022 -5.269 -1.237
127 HD21 LEU 16 HD21 LEU 16 -2.029 -5.499 1.665
128 HD22 LEU 16 HD22 LEU 16 -0.533 -5.919 0.831
129 HD23 LEU 16 HD23 LEU 16 -2.065 -6.604 0.290
130 H LEU 17 HN LEU 17 -0.647 -0.398 1.150
131 HA LEU 17 HA LEU 17 -2.712 0.425 2.996
132 HB2 LEU 17 HB2 LEU 17 -0.209 0.557 3.346
133 HB3 LEU 17 HB1 LEU 17 -0.165 1.865 2.166
134 HG LEU 17 HG LEU 17 -2.204 2.351 4.187
135 HD11 LEU 17 HD11 LEU 17 0.606 2.414 5.269
136 HD12 LEU 17 HD12 LEU 17 -0.380 0.961 5.434
137 HD13 LEU 17 HD13 LEU 17 -0.921 2.481 6.147
138 HD21 LEU 17 HD21 LEU 17 -0.983 4.500 4.339
139 HD22 LEU 17 HD22 LEU 17 -1.266 4.048 2.659
140 HD23 LEU 17 HD23 LEU 17 0.330 3.821 3.377
141 H LEU 18 HN LEU 18 -1.415 1.743 -0.016
142 HA LEU 18 HA LEU 18 -2.984 4.161 -0.110
143 HB2 LEU 18 HB2 LEU 18 -1.137 2.649 -1.760
144 HB3 LEU 18 HB1 LEU 18 -2.505 3.160 -2.741
145 HG LEU 18 HG LEU 18 -2.179 5.493 -1.788
146 HD11 LEU 18 HD11 LEU 18 -0.216 6.034 -0.599
147 HD12 LEU 18 HD12 LEU 18 0.581 4.526 -1.048
148 HD13 LEU 18 HD13 LEU 18 -0.726 4.514 0.135
149 HD21 LEU 18 HD21 LEU 18 -0.212 5.959 -3.259
150 HD22 LEU 18 HD22 LEU 18 -1.409 4.926 -4.039
151 HD23 LEU 18 HD23 LEU 18 0.071 4.222 -3.384
152 H LEU 19 HN LEU 19 -3.499 0.817 -1.231
153 HA LEU 19 HA LEU 19 -6.037 1.221 -2.525
154 HB2 LEU 19 HB2 LEU 19 -4.192 -0.887 -1.952
155 HB3 LEU 19 HB1 LEU 19 -5.769 -1.408 -1.385
156 HG LEU 19 HG LEU 19 -5.510 -2.097 -3.692
157 HD11 LEU 19 HD11 LEU 19 -7.265 0.288 -4.055
158 HD12 LEU 19 HD12 LEU 19 -7.689 -0.844 -2.772
159 HD13 LEU 19 HD13 LEU 19 -7.572 -1.406 -4.440
160 HD21 LEU 19 HD21 LEU 19 -5.159 0.814 -4.447
161 HD22 LEU 19 HD22 LEU 19 -4.943 -0.604 -5.470
162 HD23 LEU 19 HD23 LEU 19 -3.790 -0.266 -4.182
163 H LEU 20 HN LEU 20 -5.050 0.478 0.768
164 HA LEU 20 HA LEU 20 -7.721 0.006 1.829
165 HB2 LEU 20 HB2 LEU 20 -4.988 -0.160 2.656
166 HB3 LEU 20 HB1 LEU 20 -5.811 0.877 3.811
167 HG LEU 20 HG LEU 20 -5.922 -1.468 4.523
168 HD11 LEU 20 HD11 LEU 20 -8.719 -1.033 3.615
169 HD12 LEU 20 HD12 LEU 20 -7.986 0.271 4.549
170 HD13 LEU 20 HD13 LEU 20 -8.092 -1.351 5.232
171 HD21 LEU 20 HD21 LEU 20 -7.702 -2.172 2.222
172 HD22 LEU 20 HD22 LEU 20 -6.644 -3.207 3.182
173 HD23 LEU 20 HD23 LEU 20 -5.960 -2.157 1.942
174 H LEU 21 HN LEU 21 -5.482 2.796 1.738
175 HA LEU 21 HA LEU 21 -6.996 4.634 3.299
176 HB2 LEU 21 HB2 LEU 21 -4.619 4.848 2.477
177 HB3 LEU 21 HB1 LEU 21 -5.263 5.205 0.877
178 HG LEU 21 HG LEU 21 -6.468 6.835 3.013
179 HD11 LEU 21 HD11 LEU 21 -3.572 7.346 2.292
180 HD12 LEU 21 HD12 LEU 21 -4.066 6.556 3.789
181 HD13 LEU 21 HD13 LEU 21 -4.560 8.217 3.465
182 HD21 LEU 21 HD21 LEU 21 -6.559 7.038 0.414
183 HD22 LEU 21 HD22 LEU 21 -4.968 7.784 0.572
184 HD23 LEU 21 HD23 LEU 21 -6.366 8.513 1.361
185 H ALA 22 HN ALA 22 -7.059 3.933 -0.166
186 HA ALA 22 HA ALA 22 -9.613 5.487 -0.441
187 HB1 ALA 22 HB1 ALA 22 -7.819 4.664 -2.718
188 HB2 ALA 22 HB2 ALA 22 -7.349 6.022 -1.697
189 HB3 ALA 22 HB3 ALA 22 -8.870 6.075 -2.590
190 H LEU 23 HN LEU 23 -9.716 2.879 0.624
191 HA LEU 23 HA LEU 23 -10.055 0.835 -1.360
192 HB2 LEU 23 HB2 LEU 23 -10.581 -0.525 0.472
193 HB3 LEU 23 HB1 LEU 23 -9.568 0.718 1.183
194 HG LEU 23 HG LEU 23 -12.050 1.854 1.451
195 HD11 LEU 23 HD11 LEU 23 -13.005 -0.354 0.575
196 HD12 LEU 23 HD12 LEU 23 -13.639 0.199 2.126
197 HD13 LEU 23 HD13 LEU 23 -12.429 -1.084 2.074
198 HD21 LEU 23 HD21 LEU 23 -11.892 0.715 3.825
199 HD22 LEU 23 HD22 LEU 23 -10.655 1.868 3.324
200 HD23 LEU 23 HD23 LEU 23 -10.338 0.136 3.226
201 HA PRO 24 HA PRO 24 -14.169 1.780 -2.652
202 HB2 PRO 24 HB2 PRO 24 -14.589 -0.482 -4.121
203 HB3 PRO 24 HB1 PRO 24 -13.519 0.833 -4.640
204 HG2 PRO 24 HG2 PRO 24 -12.843 -1.840 -3.683
205 HG3 PRO 24 HG1 PRO 24 -11.882 -0.701 -4.633
206 HD2 PRO 24 HD2 PRO 24 -11.698 -1.256 -1.837
207 HD3 PRO 24 HD1 PRO 24 -10.738 -0.100 -2.785
208 HA PRO 25 HA PRO 25 -16.620 -0.348 0.429
209 HB2 PRO 25 HB2 PRO 25 -19.054 0.694 -0.241
210 HB3 PRO 25 HB1 PRO 25 -17.819 1.606 0.654
211 HG2 PRO 25 HG2 PRO 25 -18.514 1.714 -2.238
212 HG3 PRO 25 HG1 PRO 25 -18.106 3.030 -1.122
213 HD2 PRO 25 HD2 PRO 25 -16.341 2.015 -2.904
214 HD3 PRO 25 HD1 PRO 25 -15.851 2.702 -1.338
215 H ARG 26 HN ARG 26 -18.570 -1.829 0.441
216 HA ARG 26 HA ARG 26 -18.491 -3.647 -1.874
217 HB2 ARG 26 HB2 ARG 26 -19.730 -3.673 0.875
218 HB3 ARG 26 HB1 ARG 26 -20.067 -4.945 -0.297
219 HG2 ARG 26 HG2 ARG 26 -17.261 -4.136 0.512
220 HG3 ARG 26 HG1 ARG 26 -18.154 -5.439 1.292
221 HD2 ARG 26 HD2 ARG 26 -17.770 -6.874 -0.428
222 HD3 ARG 26 HD1 ARG 26 -18.173 -5.652 -1.645
223 HE ARG 26 HE ARG 26 -15.509 -6.325 -0.839
224 HH11 ARG 26 HH21 ARG 26 -16.741 -4.537 -3.156
225 HH12 ARG 26 HH22 ARG 26 -15.820 -3.093 -2.910
226 HH21 ARG 26 HH11 ARG 26 -14.653 -4.065 0.229
227 HH22 ARG 26 HH12 ARG 26 -14.627 -2.819 -0.976
228 H ALA 27 HN ALA 27 -20.445 -0.965 -1.034
229 HA ALA 27 HA ALA 27 -22.472 -0.136 -1.848
230 HB1 ALA 27 HB1 ALA 27 -21.999 -2.161 -4.053
231 HB2 ALA 27 HB2 ALA 27 -21.118 -0.638 -3.931
232 HB3 ALA 27 HB3 ALA 27 -22.865 -0.630 -4.172
233 H TYR 28 HN TYR 28 -23.234 -1.511 0.140
234 HA TYR 28 HA TYR 28 -24.719 -3.954 -0.398
235 HB2 TYR 28 HB2 TYR 28 -25.252 -3.860 1.938
236 HB3 TYR 28 HB1 TYR 28 -23.602 -3.282 1.767
237 HD1 TYR 28 HD1 TYR 28 -27.098 -2.319 2.464
238 HD2 TYR 28 HD2 TYR 28 -23.038 -0.942 2.194
239 HE1 TYR 28 HE1 TYR 28 -27.732 -0.216 3.609
240 HE2 TYR 28 HE2 TYR 28 -23.674 1.160 3.336
241 HH TYR 28 HH TYR 28 -26.080 2.492 3.546
242 H ALA 29 HN ALA 29 -25.554 -0.532 -0.473
243 HA ALA 29 HA ALA 29 -28.389 -1.292 -1.091
244 HB1 ALA 29 HB1 ALA 29 -28.319 -0.322 1.109
245 HB2 ALA 29 HB2 ALA 29 -28.939 0.922 0.024
246 HB3 ALA 29 HB3 ALA 29 -27.261 0.980 0.564
Start of MODEL 21
1 H1 ARG 1 HT1 ARG 1 13.997 -7.011 -6.663
2 H2 ARG 1 HT2 ARG 1 14.156 -7.495 -8.280
3 H3 ARG 1 HT3 ARG 1 14.347 -5.860 -7.857
4 HA ARG 1 HA ARG 1 16.124 -7.909 -6.665
5 HB2 ARG 1 HB2 ARG 1 16.001 -6.874 -9.467
6 HB3 ARG 1 HB1 ARG 1 17.594 -7.097 -8.744
7 HG2 ARG 1 HG2 ARG 1 17.339 -9.395 -8.534
8 HG3 ARG 1 HG1 ARG 1 15.579 -9.304 -8.485
9 HD2 ARG 1 HD2 ARG 1 15.389 -9.101 -10.814
10 HD3 ARG 1 HD1 ARG 1 17.053 -8.509 -10.995
11 HE ARG 1 HE ARG 1 17.869 -10.764 -10.626
12 HH11 ARG 1 HH21 ARG 1 15.923 -11.916 -8.775
13 HH12 ARG 1 HH22 ARG 1 14.968 -12.955 -9.776
14 HH21 ARG 1 HH11 ARG 1 16.004 -11.464 -12.752
15 HH22 ARG 1 HH12 ARG 1 15.015 -12.697 -12.048
16 H LEU 2 HN LEU 2 15.153 -5.539 -5.450
17 HA LEU 2 HA LEU 2 17.647 -3.903 -5.322
18 HB2 LEU 2 HB2 LEU 2 16.015 -2.868 -6.891
19 HB3 LEU 2 HB1 LEU 2 14.818 -2.833 -5.599
20 HG LEU 2 HG LEU 2 17.383 -1.629 -4.820
21 HD11 LEU 2 HD11 LEU 2 15.735 -0.102 -6.838
22 HD12 LEU 2 HD12 LEU 2 17.129 -1.067 -7.326
23 HD13 LEU 2 HD13 LEU 2 17.339 0.285 -6.214
24 HD21 LEU 2 HD21 LEU 2 15.432 -1.354 -3.432
25 HD22 LEU 2 HD22 LEU 2 14.467 -0.796 -4.798
26 HD23 LEU 2 HD23 LEU 2 15.761 0.217 -4.160
27 H VAL 3 HN VAL 3 18.221 -4.374 -3.224
28 HA VAL 3 HA VAL 3 18.139 -4.583 -0.893
29 HB VAL 3 HB VAL 3 15.978 -2.513 -1.270
30 HG11 VAL 3 HG11 VAL 3 17.991 -2.638 0.970
31 HG12 VAL 3 HG12 VAL 3 16.484 -3.548 1.062
32 HG13 VAL 3 HG13 VAL 3 16.446 -1.791 0.930
33 HG21 VAL 3 HG21 VAL 3 17.962 -0.906 -0.989
34 HG22 VAL 3 HG22 VAL 3 17.846 -1.737 -2.539
35 HG23 VAL 3 HG23 VAL 3 18.993 -2.298 -1.322
36 HA PRO 4 HA PRO 4 14.359 -7.300 -1.169
37 HB2 PRO 4 HB2 PRO 4 15.699 -9.648 -0.757
38 HB3 PRO 4 HB1 PRO 4 15.456 -8.934 -2.365
39 HG2 PRO 4 HG2 PRO 4 17.859 -8.878 -0.620
40 HG3 PRO 4 HG1 PRO 4 17.743 -9.036 -2.381
41 HD2 PRO 4 HD2 PRO 4 18.394 -6.708 -1.119
42 HD3 PRO 4 HD1 PRO 4 17.602 -6.764 -2.705
43 H GLY 5 HN GLY 5 13.224 -7.457 0.687
44 HA2 GLY 5 HA2 GLY 5 12.964 -8.406 2.946
45 HA3 GLY 5 HA1 GLY 5 14.651 -7.990 3.255
46 H ALA 6 HN ALA 6 14.892 -5.421 2.444
47 HA ALA 6 HA ALA 6 13.186 -3.964 4.384
48 HB1 ALA 6 HB1 ALA 6 15.505 -2.880 2.798
49 HB2 ALA 6 HB2 ALA 6 15.762 -3.913 4.204
50 HB3 ALA 6 HB3 ALA 6 14.929 -2.369 4.383
51 H ALA 7 HN ALA 7 14.220 -3.617 0.992
52 HA ALA 7 HA ALA 7 12.184 -1.529 0.499
53 HB1 ALA 7 HB1 ALA 7 13.331 -1.310 -1.618
54 HB2 ALA 7 HB2 ALA 7 14.124 -2.868 -1.398
55 HB3 ALA 7 HB3 ALA 7 14.554 -1.508 -0.361
56 H TYR 8 HN TYR 8 11.670 -4.685 0.841
57 HA TYR 8 HA TYR 8 10.077 -5.062 -1.657
58 HB2 TYR 8 HB2 TYR 8 11.407 -6.833 0.364
59 HB3 TYR 8 HB1 TYR 8 10.002 -7.457 -0.490
60 HD1 TYR 8 HD2 TYR 8 12.690 -5.151 -1.758
61 HD2 TYR 8 HD1 TYR 8 10.875 -9.038 -1.985
62 HE1 TYR 8 HE2 TYR 8 14.094 -5.692 -3.717
63 HE2 TYR 8 HE1 TYR 8 12.286 -9.578 -3.948
64 HH TYR 8 HH TYR 8 14.687 -8.659 -4.793
65 H ALA 9 HN ALA 9 9.876 -5.548 1.854
66 HA ALA 9 HA ALA 9 7.022 -5.908 1.969
67 HB1 ALA 9 HB1 ALA 9 7.411 -5.487 4.416
68 HB2 ALA 9 HB2 ALA 9 9.070 -5.029 4.027
69 HB3 ALA 9 HB3 ALA 9 8.519 -6.680 3.737
70 H LEU 10 HN LEU 10 9.122 -3.090 2.332
71 HA LEU 10 HA LEU 10 7.189 -1.135 3.125
72 HB2 LEU 10 HB2 LEU 10 9.887 -1.217 2.693
73 HB3 LEU 10 HB1 LEU 10 9.370 -0.332 1.263
74 HG LEU 10 HG LEU 10 8.328 0.458 3.974
75 HD11 LEU 10 HD11 LEU 10 10.670 0.525 4.378
76 HD12 LEU 10 HD12 LEU 10 10.238 2.174 3.928
77 HD13 LEU 10 HD13 LEU 10 11.013 1.114 2.751
78 HD21 LEU 10 HD21 LEU 10 8.930 2.023 1.440
79 HD22 LEU 10 HD22 LEU 10 8.107 2.635 2.873
80 HD23 LEU 10 HD23 LEU 10 7.339 1.398 1.878
81 H TYR 11 HN TYR 11 8.468 -1.909 -0.124
82 HA TYR 11 HA TYR 11 6.651 -0.232 -1.594
83 HB2 TYR 11 HB2 TYR 11 8.592 -2.432 -2.141
84 HB3 TYR 11 HB1 TYR 11 7.435 -2.047 -3.411
85 HD1 TYR 11 HD2 TYR 11 7.446 0.140 -4.518
86 HD2 TYR 11 HD1 TYR 11 10.280 -0.806 -1.431
87 HE1 TYR 11 HE2 TYR 11 8.810 2.106 -5.165
88 HE2 TYR 11 HE1 TYR 11 11.643 1.159 -2.080
89 HH TYR 11 HH TYR 11 11.874 2.531 -4.457
90 H GLY 12 HN GLY 12 6.368 -3.468 -0.309
91 HA2 GLY 12 HA2 GLY 12 4.213 -4.419 -1.944
92 HA3 GLY 12 HA1 GLY 12 4.644 -5.047 -0.354
93 H VAL 13 HN VAL 13 4.266 -2.645 1.166
94 HA VAL 13 HA VAL 13 1.326 -2.646 1.291
95 HB VAL 13 HB VAL 13 1.676 -1.377 3.380
96 HG11 VAL 13 HG11 VAL 13 1.823 -3.871 3.327
97 HG12 VAL 13 HG12 VAL 13 2.763 -3.141 4.627
98 HG13 VAL 13 HG13 VAL 13 3.575 -3.727 3.177
99 HG21 VAL 13 HG21 VAL 13 3.860 -0.289 2.373
100 HG22 VAL 13 HG22 VAL 13 4.651 -1.703 3.071
101 HG23 VAL 13 HG23 VAL 13 3.751 -0.595 4.107
102 H TRP 14 HN TRP 14 3.617 -0.715 -0.309
103 HA TRP 14 HA TRP 14 2.559 1.905 -0.021
104 HB2 TRP 14 HB2 TRP 14 4.692 0.915 -1.217
105 HB3 TRP 14 HB1 TRP 14 3.655 0.897 -2.630
106 HD1 TRP 14 HD1 TRP 14 5.851 2.673 -3.158
107 HE1 TRP 14 HE1 TRP 14 5.756 5.243 -3.116
108 HE3 TRP 14 HE3 TRP 14 1.740 3.389 -0.173
109 HZ2 TRP 14 HZ2 TRP 14 4.168 7.320 -1.985
110 HZ3 TRP 14 HZ3 TRP 14 0.975 5.672 0.358
111 HH2 TRP 14 HH2 TRP 14 2.178 7.641 -0.540
112 HA PRO 15 HA PRO 15 -0.300 1.040 -3.801
113 HB2 PRO 15 HB2 PRO 15 -0.703 -1.556 -4.565
114 HB3 PRO 15 HB1 PRO 15 0.572 -0.531 -5.256
115 HG2 PRO 15 HG2 PRO 15 0.770 -2.616 -3.141
116 HG3 PRO 15 HG1 PRO 15 1.870 -2.262 -4.486
117 HD2 PRO 15 HD2 PRO 15 2.365 -1.470 -1.958
118 HD3 PRO 15 HD1 PRO 15 2.902 -0.543 -3.375
119 H LEU 16 HN LEU 16 -0.186 -1.397 -1.202
120 HA LEU 16 HA LEU 16 -2.982 -1.985 -1.018
121 HB2 LEU 16 HB2 LEU 16 -0.623 -2.014 0.861
122 HB3 LEU 16 HB1 LEU 16 -2.231 -2.395 1.466
123 HG LEU 16 HG LEU 16 -1.083 -3.782 -0.961
124 HD11 LEU 16 HD11 LEU 16 -0.049 -3.963 1.662
125 HD12 LEU 16 HD12 LEU 16 0.275 -5.047 0.311
126 HD13 LEU 16 HD13 LEU 16 -1.038 -5.405 1.433
127 HD21 LEU 16 HD21 LEU 16 -2.754 -5.482 -0.373
128 HD22 LEU 16 HD22 LEU 16 -3.535 -3.909 -0.523
129 HD23 LEU 16 HD23 LEU 16 -3.195 -4.575 1.074
130 H LEU 17 HN LEU 17 -1.004 0.441 0.642
131 HA LEU 17 HA LEU 17 -3.099 1.698 2.149
132 HB2 LEU 17 HB2 LEU 17 -0.536 1.900 2.339
133 HB3 LEU 17 HB1 LEU 17 -0.631 3.026 0.987
134 HG LEU 17 HG LEU 17 -2.565 3.641 3.105
135 HD11 LEU 17 HD11 LEU 17 -0.693 2.707 4.476
136 HD12 LEU 17 HD12 LEU 17 -0.945 4.432 4.746
137 HD13 LEU 17 HD13 LEU 17 0.394 3.883 3.737
138 HD21 LEU 17 HD21 LEU 17 -1.897 5.860 2.629
139 HD22 LEU 17 HD22 LEU 17 -1.704 5.036 1.082
140 HD23 LEU 17 HD23 LEU 17 -0.295 5.358 2.091
141 H LEU 18 HN LEU 18 -1.783 2.278 -1.075
142 HA LEU 18 HA LEU 18 -3.378 4.568 -1.784
143 HB2 LEU 18 HB2 LEU 18 -1.524 2.661 -2.993
144 HB3 LEU 18 HB1 LEU 18 -2.836 3.040 -4.102
145 HG LEU 18 HG LEU 18 -2.403 5.482 -3.676
146 HD11 LEU 18 HD11 LEU 18 -1.134 4.840 -1.461
147 HD12 LEU 18 HD12 LEU 18 -0.581 6.216 -2.413
148 HD13 LEU 18 HD13 LEU 18 0.256 4.669 -2.533
149 HD21 LEU 18 HD21 LEU 18 -1.483 4.436 -5.672
150 HD22 LEU 18 HD22 LEU 18 -0.127 3.786 -4.750
151 HD23 LEU 18 HD23 LEU 18 -0.269 5.525 -5.002
152 H LEU 19 HN LEU 19 -3.832 1.048 -2.109
153 HA LEU 19 HA LEU 19 -6.372 1.121 -3.476
154 HB2 LEU 19 HB2 LEU 19 -4.477 -0.779 -2.420
155 HB3 LEU 19 HB1 LEU 19 -6.088 -1.237 -1.885
156 HG LEU 19 HG LEU 19 -6.746 -0.773 -4.392
157 HD11 LEU 19 HD11 LEU 19 -4.367 0.113 -4.818
158 HD12 LEU 19 HD12 LEU 19 -5.005 -1.042 -5.987
159 HD13 LEU 19 HD13 LEU 19 -3.854 -1.573 -4.760
160 HD21 LEU 19 HD21 LEU 19 -7.055 -2.974 -3.701
161 HD22 LEU 19 HD22 LEU 19 -5.380 -3.153 -3.173
162 HD23 LEU 19 HD23 LEU 19 -5.772 -3.191 -4.891
163 H LEU 20 HN LEU 20 -5.374 1.162 -0.112
164 HA LEU 20 HA LEU 20 -8.016 0.819 1.061
165 HB2 LEU 20 HB2 LEU 20 -5.238 1.112 1.859
166 HB3 LEU 20 HB1 LEU 20 -6.254 2.147 2.850
167 HG LEU 20 HG LEU 20 -6.038 -0.047 3.894
168 HD11 LEU 20 HD11 LEU 20 -8.333 1.269 3.689
169 HD12 LEU 20 HD12 LEU 20 -8.266 -0.326 4.440
170 HD13 LEU 20 HD13 LEU 20 -8.810 -0.160 2.771
171 HD21 LEU 20 HD21 LEU 20 -5.559 -1.560 2.165
172 HD22 LEU 20 HD22 LEU 20 -6.901 -1.000 1.168
173 HD23 LEU 20 HD23 LEU 20 -7.214 -1.987 2.595
174 H LEU 21 HN LEU 21 -5.975 3.617 0.168
175 HA LEU 21 HA LEU 21 -7.438 5.717 1.382
176 HB2 LEU 21 HB2 LEU 21 -5.205 5.709 0.089
177 HB3 LEU 21 HB1 LEU 21 -6.188 5.836 -1.368
178 HG LEU 21 HG LEU 21 -7.327 7.813 0.039
179 HD11 LEU 21 HD11 LEU 21 -5.962 7.520 2.032
180 HD12 LEU 21 HD12 LEU 21 -5.520 9.044 1.260
181 HD13 LEU 21 HD13 LEU 21 -4.483 7.629 1.076
182 HD21 LEU 21 HD21 LEU 21 -5.903 9.361 -1.193
183 HD22 LEU 21 HD22 LEU 21 -6.204 7.948 -2.202
184 HD23 LEU 21 HD23 LEU 21 -4.658 8.127 -1.374
185 H ALA 22 HN ALA 22 -7.872 4.173 -1.763
186 HA ALA 22 HA ALA 22 -10.617 5.372 -1.983
187 HB1 ALA 22 HB1 ALA 22 -8.658 5.997 -3.608
188 HB2 ALA 22 HB2 ALA 22 -10.222 5.581 -4.309
189 HB3 ALA 22 HB3 ALA 22 -8.923 4.390 -4.285
190 H LEU 23 HN LEU 23 -10.314 3.084 -0.465
191 HA LEU 23 HA LEU 23 -10.430 0.619 -1.917
192 HB2 LEU 23 HB2 LEU 23 -10.944 -0.344 0.222
193 HB3 LEU 23 HB1 LEU 23 -9.813 0.970 0.485
194 HG LEU 23 HG LEU 23 -12.245 2.258 0.707
195 HD11 LEU 23 HD11 LEU 23 -13.646 0.360 0.739
196 HD12 LEU 23 HD12 LEU 23 -13.394 0.710 2.449
197 HD13 LEU 23 HD13 LEU 23 -12.490 -0.590 1.672
198 HD21 LEU 23 HD21 LEU 23 -10.019 1.518 2.343
199 HD22 LEU 23 HD22 LEU 23 -11.490 1.288 3.287
200 HD23 LEU 23 HD23 LEU 23 -11.139 2.860 2.566
201 HA PRO 24 HA PRO 24 -14.598 0.907 -3.296
202 HB2 PRO 24 HB2 PRO 24 -14.584 -1.424 -4.739
203 HB3 PRO 24 HB1 PRO 24 -13.878 0.110 -5.272
204 HG2 PRO 24 HG2 PRO 24 -12.541 -2.334 -4.410
205 HG3 PRO 24 HG1 PRO 24 -11.913 -0.960 -5.319
206 HD2 PRO 24 HD2 PRO 24 -11.551 -1.538 -2.537
207 HD3 PRO 24 HD1 PRO 24 -10.897 -0.180 -3.468
208 HA PRO 25 HA PRO 25 -16.811 -2.754 -1.372
209 HB2 PRO 25 HB2 PRO 25 -15.531 -4.996 -0.498
210 HB3 PRO 25 HB1 PRO 25 -16.106 -4.798 -2.165
211 HG2 PRO 25 HG2 PRO 25 -13.367 -4.542 -1.073
212 HG3 PRO 25 HG1 PRO 25 -13.910 -5.175 -2.633
213 HD2 PRO 25 HD2 PRO 25 -12.831 -2.691 -2.271
214 HD3 PRO 25 HD1 PRO 25 -13.909 -3.136 -3.609
215 H ARG 26 HN ARG 26 -17.143 -3.632 0.931
216 HA ARG 26 HA ARG 26 -16.034 -1.771 2.872
217 HB2 ARG 26 HB2 ARG 26 -18.347 -2.627 2.908
218 HB3 ARG 26 HB1 ARG 26 -17.744 -4.259 3.180
219 HG2 ARG 26 HG2 ARG 26 -17.404 -3.887 5.386
220 HG3 ARG 26 HG1 ARG 26 -16.667 -2.314 5.094
221 HD2 ARG 26 HD2 ARG 26 -18.977 -1.367 4.728
222 HD3 ARG 26 HD1 ARG 26 -19.638 -2.933 5.247
223 HE ARG 26 HE ARG 26 -18.520 -2.613 7.426
224 HH11 ARG 26 HH11 ARG 26 -16.497 -0.566 6.456
225 HH12 ARG 26 HH12 ARG 26 -17.113 0.892 7.159
226 HH21 ARG 26 HH21 ARG 26 -20.254 -0.460 7.831
227 HH22 ARG 26 HH22 ARG 26 -19.260 0.952 7.945
228 H ALA 27 HN ALA 27 -15.071 -4.966 1.797
229 HA ALA 27 HA ALA 27 -13.336 -6.384 2.451
230 HB1 ALA 27 HB1 ALA 27 -11.407 -5.305 3.383
231 HB2 ALA 27 HB2 ALA 27 -12.385 -4.043 4.127
232 HB3 ALA 27 HB3 ALA 27 -12.193 -4.089 2.375
233 H TYR 28 HN TYR 28 -15.080 -7.538 3.610
234 HA TYR 28 HA TYR 28 -15.442 -7.132 6.494
235 HB2 TYR 28 HB2 TYR 28 -16.306 -9.285 4.541
236 HB3 TYR 28 HB1 TYR 28 -16.816 -9.226 6.225
237 HD1 TYR 28 HD1 TYR 28 -18.017 -7.083 7.044
238 HD2 TYR 28 HD2 TYR 28 -17.443 -8.047 2.897
239 HE1 TYR 28 HE1 TYR 28 -19.835 -5.513 6.426
240 HE2 TYR 28 HE2 TYR 28 -19.259 -6.477 2.280
241 HH TYR 28 HH TYR 28 -21.445 -5.541 3.716
242 H ALA 29 HN ALA 29 -13.794 -9.548 4.428
243 HA ALA 29 HA ALA 29 -12.418 -10.627 6.868
244 HB1 ALA 29 HB1 ALA 29 -12.190 -12.677 5.331
245 HB2 ALA 29 HB2 ALA 29 -13.342 -11.868 4.269
246 HB3 ALA 29 HB3 ALA 29 -13.813 -12.305 5.912
Start of MODEL 22
1 H1 ARG 1 HT1 ARG 1 23.555 2.748 -3.701
2 H2 ARG 1 HT2 ARG 1 23.632 1.156 -4.291
3 H3 ARG 1 HT3 ARG 1 23.837 1.463 -2.634
4 HA ARG 1 HA ARG 1 21.528 2.245 -2.480
5 HB2 ARG 1 HB2 ARG 1 21.700 2.925 -4.961
6 HB3 ARG 1 HB1 ARG 1 21.310 1.244 -5.323
7 HG2 ARG 1 HG2 ARG 1 19.172 2.110 -5.288
8 HG3 ARG 1 HG1 ARG 1 19.339 1.710 -3.581
9 HD2 ARG 1 HD2 ARG 1 18.616 3.922 -3.422
10 HD3 ARG 1 HD1 ARG 1 20.371 4.179 -3.467
11 HE ARG 1 HE ARG 1 20.186 4.700 -5.858
12 HH11 ARG 1 HH11 ARG 1 18.203 6.560 -4.533
13 HH12 ARG 1 HH12 ARG 1 16.805 6.357 -5.533
14 HH21 ARG 1 HH21 ARG 1 17.965 3.420 -7.004
15 HH22 ARG 1 HH22 ARG 1 16.669 4.564 -6.943
16 H LEU 2 HN LEU 2 22.203 0.370 -1.100
17 HA LEU 2 HA LEU 2 21.045 -2.217 -2.094
18 HB2 LEU 2 HB2 LEU 2 23.691 -1.630 -1.415
19 HB3 LEU 2 HB1 LEU 2 23.054 -2.440 0.016
20 HG LEU 2 HG LEU 2 22.035 -4.079 -1.847
21 HD11 LEU 2 HD11 LEU 2 22.957 -2.815 -3.739
22 HD12 LEU 2 HD12 LEU 2 23.712 -4.406 -3.643
23 HD13 LEU 2 HD13 LEU 2 24.584 -2.982 -3.077
24 HD21 LEU 2 HD21 LEU 2 23.989 -5.536 -1.452
25 HD22 LEU 2 HD22 LEU 2 23.511 -4.717 0.035
26 HD23 LEU 2 HD23 LEU 2 24.911 -4.148 -0.872
27 H VAL 3 HN VAL 3 19.424 -3.009 -0.811
28 HA VAL 3 HA VAL 3 19.241 -2.091 2.028
29 HB VAL 3 HB VAL 3 16.756 -1.881 1.644
30 HG11 VAL 3 HG11 VAL 3 16.901 0.318 0.645
31 HG12 VAL 3 HG12 VAL 3 18.441 -0.083 -0.114
32 HG13 VAL 3 HG13 VAL 3 18.334 0.061 1.640
33 HG21 VAL 3 HG21 VAL 3 17.514 -1.925 -1.296
34 HG22 VAL 3 HG22 VAL 3 15.899 -1.742 -0.616
35 HG23 VAL 3 HG23 VAL 3 16.746 -3.281 -0.469
36 HA PRO 4 HA PRO 4 18.452 -6.358 2.828
37 HB2 PRO 4 HB2 PRO 4 17.106 -6.178 5.200
38 HB3 PRO 4 HB1 PRO 4 18.845 -5.868 5.047
39 HG2 PRO 4 HG2 PRO 4 16.605 -3.951 5.301
40 HG3 PRO 4 HG1 PRO 4 18.260 -3.852 5.921
41 HD2 PRO 4 HD2 PRO 4 17.329 -2.527 3.695
42 HD3 PRO 4 HD1 PRO 4 19.037 -2.877 4.034
43 H GLY 5 HN GLY 5 16.243 -7.581 3.986
44 HA2 GLY 5 HA2 GLY 5 14.321 -7.697 1.891
45 HA3 GLY 5 HA1 GLY 5 14.105 -8.382 3.496
46 H ALA 6 HN ALA 6 14.559 -5.456 4.531
47 HA ALA 6 HA ALA 6 11.914 -4.731 5.098
48 HB1 ALA 6 HB1 ALA 6 14.431 -3.077 4.842
49 HB2 ALA 6 HB2 ALA 6 13.834 -3.879 6.296
50 HB3 ALA 6 HB3 ALA 6 12.954 -2.509 5.620
51 H ALA 7 HN ALA 7 13.749 -4.019 2.186
52 HA ALA 7 HA ALA 7 12.198 -1.834 1.176
53 HB1 ALA 7 HB1 ALA 7 14.465 -2.903 0.426
54 HB2 ALA 7 HB2 ALA 7 13.414 -2.198 -0.800
55 HB3 ALA 7 HB3 ALA 7 13.445 -3.946 -0.566
56 H TYR 8 HN TYR 8 11.810 -5.337 0.800
57 HA TYR 8 HA TYR 8 9.582 -5.275 -1.018
58 HB2 TYR 8 HB2 TYR 8 10.536 -7.294 1.037
59 HB3 TYR 8 HB1 TYR 8 9.221 -7.623 -0.086
60 HD1 TYR 8 HD2 TYR 8 9.660 -7.628 -2.559
61 HD2 TYR 8 HD1 TYR 8 12.829 -7.342 0.328
62 HE1 TYR 8 HE2 TYR 8 11.307 -8.261 -4.302
63 HE2 TYR 8 HE1 TYR 8 14.472 -7.975 -1.413
64 HH TYR 8 HH TYR 8 14.092 -7.740 -4.479
65 H ALA 9 HN ALA 9 9.836 -5.105 2.483
66 HA ALA 9 HA ALA 9 6.987 -5.316 3.033
67 HB1 ALA 9 HB1 ALA 9 8.764 -5.928 4.635
68 HB2 ALA 9 HB2 ALA 9 7.711 -4.685 5.311
69 HB3 ALA 9 HB3 ALA 9 9.298 -4.247 4.680
70 H LEU 10 HN LEU 10 8.899 -2.792 1.768
71 HA LEU 10 HA LEU 10 7.016 -0.655 2.688
72 HB2 LEU 10 HB2 LEU 10 9.732 -0.803 2.830
73 HB3 LEU 10 HB1 LEU 10 9.561 -0.058 1.249
74 HG LEU 10 HG LEU 10 9.765 1.665 2.970
75 HD11 LEU 10 HD11 LEU 10 6.889 1.562 2.027
76 HD12 LEU 10 HD12 LEU 10 8.243 2.020 0.993
77 HD13 LEU 10 HD13 LEU 10 7.840 2.998 2.404
78 HD21 LEU 10 HD21 LEU 10 7.219 0.516 4.159
79 HD22 LEU 10 HD22 LEU 10 8.138 1.893 4.763
80 HD23 LEU 10 HD23 LEU 10 8.830 0.274 4.835
81 H TYR 11 HN TYR 11 8.940 -1.608 -0.170
82 HA TYR 11 HA TYR 11 7.389 -0.127 -2.101
83 HB2 TYR 11 HB2 TYR 11 9.432 -2.342 -2.164
84 HB3 TYR 11 HB1 TYR 11 8.677 -1.785 -3.650
85 HD1 TYR 11 HD2 TYR 11 9.013 0.556 -4.436
86 HD2 TYR 11 HD1 TYR 11 11.011 -0.971 -0.952
87 HE1 TYR 11 HE2 TYR 11 10.593 2.467 -4.501
88 HE2 TYR 11 HE1 TYR 11 12.588 0.936 -1.019
89 HH TYR 11 HH TYR 11 12.261 3.552 -2.179
90 H GLY 12 HN GLY 12 7.206 -3.395 -0.820
91 HA2 GLY 12 HA2 GLY 12 5.401 -4.484 -2.775
92 HA3 GLY 12 HA1 GLY 12 5.700 -5.151 -1.173
93 H VAL 13 HN VAL 13 4.869 -2.597 0.184
94 HA VAL 13 HA VAL 13 1.937 -3.058 -0.008
95 HB VAL 13 HB VAL 13 1.885 -1.891 2.169
96 HG11 VAL 13 HG11 VAL 13 4.042 -4.013 2.113
97 HG12 VAL 13 HG12 VAL 13 2.315 -4.357 1.989
98 HG13 VAL 13 HG13 VAL 13 2.966 -3.621 3.454
99 HG21 VAL 13 HG21 VAL 13 3.863 -1.116 3.264
100 HG22 VAL 13 HG22 VAL 13 3.929 -0.438 1.638
101 HG23 VAL 13 HG23 VAL 13 4.911 -1.844 2.047
102 H TRP 14 HN TRP 14 3.881 -1.048 -1.654
103 HA TRP 14 HA TRP 14 2.834 1.571 -1.168
104 HB2 TRP 14 HB2 TRP 14 4.831 0.505 -2.684
105 HB3 TRP 14 HB1 TRP 14 3.647 0.901 -3.934
106 HD1 TRP 14 HD1 TRP 14 6.109 2.469 -1.590
107 HE1 TRP 14 HE1 TRP 14 6.028 5.038 -1.834
108 HE3 TRP 14 HE3 TRP 14 1.923 2.941 -4.456
109 HZ2 TRP 14 HZ2 TRP 14 4.374 7.028 -3.098
110 HZ3 TRP 14 HZ3 TRP 14 1.129 5.172 -5.157
111 HH2 TRP 14 HH2 TRP 14 2.342 7.211 -4.488
112 HA PRO 15 HA PRO 15 -0.337 0.689 -4.696
113 HB2 PRO 15 HB2 PRO 15 -0.919 -1.931 -5.243
114 HB3 PRO 15 HB1 PRO 15 0.330 -1.019 -6.117
115 HG2 PRO 15 HG2 PRO 15 0.636 -2.965 -3.884
116 HG3 PRO 15 HG1 PRO 15 1.614 -2.763 -5.349
117 HD2 PRO 15 HD2 PRO 15 2.398 -1.830 -2.951
118 HD3 PRO 15 HD1 PRO 15 2.824 -1.014 -4.472
119 H LEU 16 HN LEU 16 -0.017 -1.477 -1.910
120 HA LEU 16 HA LEU 16 -2.813 -1.917 -1.391
121 HB2 LEU 16 HB2 LEU 16 -0.204 -2.166 0.032
122 HB3 LEU 16 HB1 LEU 16 -1.633 -2.056 1.054
123 HG LEU 16 HG LEU 16 -2.617 -3.879 -0.538
124 HD11 LEU 16 HD11 LEU 16 0.366 -4.113 -1.039
125 HD12 LEU 16 HD12 LEU 16 -0.898 -3.851 -2.241
126 HD13 LEU 16 HD13 LEU 16 -0.794 -5.393 -1.395
127 HD21 LEU 16 HD21 LEU 16 -1.672 -4.015 1.929
128 HD22 LEU 16 HD22 LEU 16 -0.354 -4.896 1.158
129 HD23 LEU 16 HD23 LEU 16 -2.008 -5.494 1.030
130 H LEU 17 HN LEU 17 -0.500 0.544 -0.394
131 HA LEU 17 HA LEU 17 -2.155 2.089 1.377
132 HB2 LEU 17 HB2 LEU 17 0.374 2.170 0.980
133 HB3 LEU 17 HB1 LEU 17 0.037 3.010 -0.524
134 HG LEU 17 HG LEU 17 -0.750 4.006 2.237
135 HD11 LEU 17 HD11 LEU 17 1.379 5.069 0.363
136 HD12 LEU 17 HD12 LEU 17 1.735 3.930 1.661
137 HD13 LEU 17 HD13 LEU 17 1.095 5.529 2.041
138 HD21 LEU 17 HD21 LEU 17 -0.853 6.191 0.714
139 HD22 LEU 17 HD22 LEU 17 -2.242 5.111 0.819
140 HD23 LEU 17 HD23 LEU 17 -1.153 5.016 -0.567
141 H LEU 18 HN LEU 18 -1.429 2.359 -2.068
142 HA LEU 18 HA LEU 18 -3.178 4.532 -2.714
143 HB2 LEU 18 HB2 LEU 18 -1.473 2.560 -4.004
144 HB3 LEU 18 HB1 LEU 18 -2.943 2.786 -4.941
145 HG LEU 18 HG LEU 18 -2.572 5.201 -5.023
146 HD11 LEU 18 HD11 LEU 18 -0.296 6.027 -4.128
147 HD12 LEU 18 HD12 LEU 18 -0.266 4.544 -3.176
148 HD13 LEU 18 HD13 LEU 18 -1.556 5.722 -2.934
149 HD21 LEU 18 HD21 LEU 18 -0.073 3.610 -5.684
150 HD22 LEU 18 HD22 LEU 18 -0.440 5.217 -6.307
151 HD23 LEU 18 HD23 LEU 18 -1.462 3.848 -6.745
152 H LEU 19 HN LEU 19 -3.672 0.998 -2.595
153 HA LEU 19 HA LEU 19 -6.394 0.992 -3.564
154 HB2 LEU 19 HB2 LEU 19 -4.399 -0.850 -2.659
155 HB3 LEU 19 HB1 LEU 19 -5.857 -1.151 -1.722
156 HG LEU 19 HG LEU 19 -5.998 -0.832 -4.715
157 HD11 LEU 19 HD11 LEU 19 -4.306 -2.589 -4.164
158 HD12 LEU 19 HD12 LEU 19 -5.737 -3.236 -4.963
159 HD13 LEU 19 HD13 LEU 19 -5.538 -3.431 -3.222
160 HD21 LEU 19 HD21 LEU 19 -8.090 -1.897 -4.486
161 HD22 LEU 19 HD22 LEU 19 -8.015 -0.869 -3.055
162 HD23 LEU 19 HD23 LEU 19 -7.668 -2.595 -2.921
163 H LEU 20 HN LEU 20 -4.872 1.302 -0.410
164 HA LEU 20 HA LEU 20 -7.233 1.163 1.243
165 HB2 LEU 20 HB2 LEU 20 -4.378 1.604 1.453
166 HB3 LEU 20 HB1 LEU 20 -5.217 2.785 2.441
167 HG LEU 20 HG LEU 20 -4.733 0.789 3.756
168 HD11 LEU 20 HD11 LEU 20 -7.096 2.061 3.735
169 HD12 LEU 20 HD12 LEU 20 -6.770 0.693 4.799
170 HD13 LEU 20 HD13 LEU 20 -7.652 0.446 3.294
171 HD21 LEU 20 HD21 LEU 20 -6.037 -0.580 1.419
172 HD22 LEU 20 HD22 LEU 20 -6.143 -1.316 3.017
173 HD23 LEU 20 HD23 LEU 20 -4.566 -1.014 2.289
174 H LEU 21 HN LEU 21 -5.524 3.837 -0.389
175 HA LEU 21 HA LEU 21 -6.882 6.047 0.785
176 HB2 LEU 21 HB2 LEU 21 -4.815 5.931 -0.747
177 HB3 LEU 21 HB1 LEU 21 -5.957 5.858 -2.087
178 HG LEU 21 HG LEU 21 -7.009 7.966 -0.827
179 HD11 LEU 21 HD11 LEU 21 -5.509 8.015 1.053
180 HD12 LEU 21 HD12 LEU 21 -5.075 9.373 0.016
181 HD13 LEU 21 HD13 LEU 21 -4.096 7.906 0.005
182 HD21 LEU 21 HD21 LEU 21 -4.535 8.019 -2.590
183 HD22 LEU 21 HD22 LEU 21 -5.588 9.403 -2.300
184 HD23 LEU 21 HD23 LEU 21 -6.211 7.984 -3.140
185 H ALA 22 HN ALA 22 -7.648 4.128 -2.086
186 HA ALA 22 HA ALA 22 -10.414 5.300 -2.119
187 HB1 ALA 22 HB1 ALA 22 -8.635 5.619 -4.043
188 HB2 ALA 22 HB2 ALA 22 -10.304 5.234 -4.462
189 HB3 ALA 22 HB3 ALA 22 -9.080 3.965 -4.467
190 H LEU 23 HN LEU 23 -9.789 3.162 -0.378
191 HA LEU 23 HA LEU 23 -10.238 0.571 -1.517
192 HB2 LEU 23 HB2 LEU 23 -10.081 -0.162 0.701
193 HB3 LEU 23 HB1 LEU 23 -9.174 1.340 0.727
194 HG LEU 23 HG LEU 23 -11.674 2.267 1.313
195 HD11 LEU 23 HD11 LEU 23 -11.472 -0.318 2.861
196 HD12 LEU 23 HD12 LEU 23 -12.374 -0.230 1.349
197 HD13 LEU 23 HD13 LEU 23 -12.851 0.772 2.719
198 HD21 LEU 23 HD21 LEU 23 -10.855 2.005 3.768
199 HD22 LEU 23 HD22 LEU 23 -9.852 2.931 2.656
200 HD23 LEU 23 HD23 LEU 23 -9.422 1.269 3.053
201 HA PRO 24 HA PRO 24 -14.640 0.700 -1.846
202 HB2 PRO 24 HB2 PRO 24 -15.036 -1.950 -2.364
203 HB3 PRO 24 HB1 PRO 24 -14.336 -0.822 -3.541
204 HG2 PRO 24 HG2 PRO 24 -13.044 -2.950 -2.011
205 HG3 PRO 24 HG1 PRO 24 -12.529 -2.156 -3.504
206 HD2 PRO 24 HD2 PRO 24 -11.586 -1.689 -0.852
207 HD3 PRO 24 HD1 PRO 24 -11.091 -0.860 -2.344
208 HA PRO 25 HA PRO 25 -15.924 -0.420 2.286
209 HB2 PRO 25 HB2 PRO 25 -18.589 0.120 2.019
210 HB3 PRO 25 HB1 PRO 25 -17.358 1.385 2.209
211 HG2 PRO 25 HG2 PRO 25 -18.712 0.430 -0.261
212 HG3 PRO 25 HG1 PRO 25 -18.274 2.077 0.224
213 HD2 PRO 25 HD2 PRO 25 -16.838 0.632 -1.562
214 HD3 PRO 25 HD1 PRO 25 -16.117 1.866 -0.503
215 H ARG 26 HN ARG 26 -16.985 -2.183 3.291
216 HA ARG 26 HA ARG 26 -17.967 -4.333 1.440
217 HB2 ARG 26 HB2 ARG 26 -16.250 -4.215 3.876
218 HB3 ARG 26 HB1 ARG 26 -17.267 -5.640 3.685
219 HG2 ARG 26 HG2 ARG 26 -15.759 -4.746 1.278
220 HG3 ARG 26 HG1 ARG 26 -14.820 -5.466 2.586
221 HD2 ARG 26 HD2 ARG 26 -16.880 -7.240 2.469
222 HD3 ARG 26 HD1 ARG 26 -16.795 -6.740 0.769
223 HE ARG 26 HE ARG 26 -14.557 -7.595 0.647
224 HH11 ARG 26 HH21 ARG 26 -15.832 -9.767 2.345
225 HH12 ARG 26 HH22 ARG 26 -14.666 -9.948 3.611
226 HH21 ARG 26 HH11 ARG 26 -13.071 -6.927 2.910
227 HH22 ARG 26 HH12 ARG 26 -13.087 -8.322 3.936
228 H ALA 27 HN ALA 27 -19.656 -2.161 2.668
229 HA ALA 27 HA ALA 27 -21.710 -3.918 3.880
230 HB1 ALA 27 HB1 ALA 27 -20.350 -3.214 5.775
231 HB2 ALA 27 HB2 ALA 27 -21.887 -2.352 5.837
232 HB3 ALA 27 HB3 ALA 27 -20.438 -1.530 5.258
233 H TYR 28 HN TYR 28 -22.005 -2.876 1.407
234 HA TYR 28 HA TYR 28 -23.715 -0.426 1.737
235 HB2 TYR 28 HB2 TYR 28 -21.660 -1.294 -0.213
236 HB3 TYR 28 HB1 TYR 28 -23.097 -0.568 -0.926
237 HD1 TYR 28 HD1 TYR 28 -20.876 0.034 2.058
238 HD2 TYR 28 HD2 TYR 28 -23.008 1.726 -1.266
239 HE1 TYR 28 HE1 TYR 28 -20.054 2.288 2.677
240 HE2 TYR 28 HE2 TYR 28 -22.184 3.980 -0.646
241 HH TYR 28 HH TYR 28 -21.134 4.845 2.142
242 H ALA 29 HN ALA 29 -23.354 -3.355 -0.322
243 HA ALA 29 HA ALA 29 -26.348 -3.505 -0.484
244 HB1 ALA 29 HB1 ALA 29 -24.251 -4.330 -2.521
245 HB2 ALA 29 HB2 ALA 29 -25.182 -2.833 -2.584
246 HB3 ALA 29 HB3 ALA 29 -25.999 -4.386 -2.747
Start of MODEL 23
1 H1 ARG 1 HT1 ARG 1 24.602 -0.383 10.696
2 H2 ARG 1 HT2 ARG 1 25.844 0.282 9.750
3 H3 ARG 1 HT3 ARG 1 25.474 -1.374 9.635
4 HA ARG 1 HA ARG 1 23.731 0.893 8.786
5 HB2 ARG 1 HB2 ARG 1 25.805 0.228 7.445
6 HB3 ARG 1 HB1 ARG 1 25.017 -1.326 7.172
7 HG2 ARG 1 HG2 ARG 1 23.110 -0.210 6.116
8 HG3 ARG 1 HG1 ARG 1 23.825 1.368 6.443
9 HD2 ARG 1 HD2 ARG 1 25.510 -0.599 4.946
10 HD3 ARG 1 HD1 ARG 1 24.162 0.159 4.075
11 HE ARG 1 HE ARG 1 26.119 1.839 5.592
12 HH11 ARG 1 HH11 ARG 1 23.775 3.054 4.129
13 HH12 ARG 1 HH12 ARG 1 24.501 3.548 2.638
14 HH21 ARG 1 HH21 ARG 1 27.338 1.569 3.073
15 HH22 ARG 1 HH22 ARG 1 26.540 2.699 2.034
16 H LEU 2 HN LEU 2 21.643 0.262 8.067
17 HA LEU 2 HA LEU 2 20.814 -2.570 8.203
18 HB2 LEU 2 HB2 LEU 2 19.037 -2.012 9.887
19 HB3 LEU 2 HB1 LEU 2 20.672 -1.894 10.526
20 HG LEU 2 HG LEU 2 19.648 0.620 9.355
21 HD11 LEU 2 HD11 LEU 2 18.383 -0.575 11.840
22 HD12 LEU 2 HD12 LEU 2 17.560 -0.179 10.330
23 HD13 LEU 2 HD13 LEU 2 18.222 1.108 11.339
24 HD21 LEU 2 HD21 LEU 2 21.776 0.344 10.671
25 HD22 LEU 2 HD22 LEU 2 20.799 -0.046 12.086
26 HD23 LEU 2 HD23 LEU 2 20.688 1.553 11.350
27 H VAL 3 HN VAL 3 18.894 -2.953 7.018
28 HA VAL 3 HA VAL 3 17.472 -0.602 5.859
29 HB VAL 3 HB VAL 3 17.579 -1.906 3.628
30 HG11 VAL 3 HG11 VAL 3 18.777 0.217 4.106
31 HG12 VAL 3 HG12 VAL 3 19.680 -0.841 3.023
32 HG13 VAL 3 HG13 VAL 3 20.139 -0.719 4.720
33 HG21 VAL 3 HG21 VAL 3 18.562 -3.985 4.761
34 HG22 VAL 3 HG22 VAL 3 20.073 -3.083 4.891
35 HG23 VAL 3 HG23 VAL 3 19.393 -3.439 3.304
36 HA PRO 4 HA PRO 4 14.049 -3.272 6.851
37 HB2 PRO 4 HB2 PRO 4 12.064 -1.755 5.744
38 HB3 PRO 4 HB1 PRO 4 12.860 -1.336 7.274
39 HG2 PRO 4 HG2 PRO 4 13.264 -0.202 4.566
40 HG3 PRO 4 HG1 PRO 4 13.319 0.591 6.149
41 HD2 PRO 4 HD2 PRO 4 15.530 -0.130 4.690
42 HD3 PRO 4 HD1 PRO 4 15.515 0.117 6.449
43 H GLY 5 HN GLY 5 14.861 -4.941 5.304
44 HA2 GLY 5 HA2 GLY 5 14.573 -6.384 3.471
45 HA3 GLY 5 HA1 GLY 5 12.996 -5.631 3.267
46 H ALA 6 HN ALA 6 16.057 -3.924 3.136
47 HA ALA 6 HA ALA 6 17.004 -2.540 1.491
48 HB1 ALA 6 HB1 ALA 6 16.060 -4.929 -0.127
49 HB2 ALA 6 HB2 ALA 6 17.617 -4.760 0.683
50 HB3 ALA 6 HB3 ALA 6 17.227 -3.734 -0.696
51 H ALA 7 HN ALA 7 14.282 -1.872 2.162
52 HA ALA 7 HA ALA 7 12.461 -0.594 1.409
53 HB1 ALA 7 HB1 ALA 7 13.305 1.218 0.343
54 HB2 ALA 7 HB2 ALA 7 13.758 0.267 -1.071
55 HB3 ALA 7 HB3 ALA 7 14.844 0.357 0.314
56 H TYR 8 HN TYR 8 12.678 -3.436 0.466
57 HA TYR 8 HA TYR 8 11.262 -3.270 -2.159
58 HB2 TYR 8 HB2 TYR 8 13.313 -4.944 -1.035
59 HB3 TYR 8 HB1 TYR 8 11.914 -5.943 -1.423
60 HD1 TYR 8 HD2 TYR 8 10.964 -5.895 -3.757
61 HD2 TYR 8 HD1 TYR 8 14.674 -3.982 -2.739
62 HE1 TYR 8 HE2 TYR 8 11.570 -5.792 -6.158
63 HE2 TYR 8 HE1 TYR 8 15.279 -3.879 -5.142
64 HH TYR 8 HH TYR 8 13.431 -3.963 -7.506
65 H ALA 9 HN ALA 9 11.161 -5.024 0.933
66 HA ALA 9 HA ALA 9 8.517 -6.106 0.613
67 HB1 ALA 9 HB1 ALA 9 10.240 -6.939 2.201
68 HB2 ALA 9 HB2 ALA 9 8.727 -6.565 3.027
69 HB3 ALA 9 HB3 ALA 9 10.086 -5.444 3.125
70 H LEU 10 HN LEU 10 9.744 -3.146 2.068
71 HA LEU 10 HA LEU 10 7.338 -2.129 3.241
72 HB2 LEU 10 HB2 LEU 10 9.955 -1.406 3.151
73 HB3 LEU 10 HB1 LEU 10 9.299 -0.255 1.994
74 HG LEU 10 HG LEU 10 7.965 -0.653 4.668
75 HD11 LEU 10 HD11 LEU 10 9.311 1.307 5.468
76 HD12 LEU 10 HD12 LEU 10 10.319 1.149 4.031
77 HD13 LEU 10 HD13 LEU 10 10.275 -0.150 5.223
78 HD21 LEU 10 HD21 LEU 10 7.360 1.762 4.211
79 HD22 LEU 10 HD22 LEU 10 6.710 0.620 3.034
80 HD23 LEU 10 HD23 LEU 10 8.126 1.591 2.631
81 H TYR 11 HN TYR 11 8.830 -1.514 0.054
82 HA TYR 11 HA TYR 11 6.675 0.120 -0.957
83 HB2 TYR 11 HB2 TYR 11 9.169 -1.146 -1.958
84 HB3 TYR 11 HB1 TYR 11 7.968 -0.715 -3.175
85 HD1 TYR 11 HD1 TYR 11 10.209 0.582 -0.546
86 HD2 TYR 11 HD2 TYR 11 7.335 1.604 -3.572
87 HE1 TYR 11 HE1 TYR 11 10.875 2.964 -0.374
88 HE2 TYR 11 HE2 TYR 11 8.001 3.985 -3.399
89 HH TYR 11 HH TYR 11 10.729 5.047 -2.162
90 H GLY 12 HN GLY 12 6.780 -3.241 -0.457
91 HA2 GLY 12 HA2 GLY 12 5.049 -3.936 -2.735
92 HA3 GLY 12 HA1 GLY 12 5.636 -5.050 -1.497
93 H VAL 13 HN VAL 13 4.820 -3.382 0.762
94 HA VAL 13 HA VAL 13 1.923 -4.021 0.739
95 HB VAL 13 HB VAL 13 2.111 -3.885 3.170
96 HG11 VAL 13 HG11 VAL 13 2.849 -5.961 1.981
97 HG12 VAL 13 HG12 VAL 13 3.638 -5.726 3.541
98 HG13 VAL 13 HG13 VAL 13 4.507 -5.363 2.050
99 HG21 VAL 13 HG21 VAL 13 4.214 -3.332 4.279
100 HG22 VAL 13 HG22 VAL 13 3.745 -1.987 3.240
101 HG23 VAL 13 HG23 VAL 13 5.014 -3.099 2.725
102 H TRP 14 HN TRP 14 4.035 -1.252 0.804
103 HA TRP 14 HA TRP 14 2.415 0.743 1.961
104 HB2 TRP 14 HB2 TRP 14 4.780 0.984 1.281
105 HB3 TRP 14 HB1 TRP 14 4.299 0.955 -0.404
106 HD1 TRP 14 HD1 TRP 14 4.695 3.345 -1.197
107 HE1 TRP 14 HE1 TRP 14 3.892 5.676 -0.456
108 HE3 TRP 14 HE3 TRP 14 2.344 2.131 3.178
109 HZ2 TRP 14 HZ2 TRP 14 2.445 6.874 1.703
110 HZ3 TRP 14 HZ3 TRP 14 1.266 3.879 4.548
111 HH2 TRP 14 HH2 TRP 14 1.311 6.250 3.821
112 HA PRO 15 HA PRO 15 0.459 1.653 -2.334
113 HB2 PRO 15 HB2 PRO 15 0.625 -0.270 -4.272
114 HB3 PRO 15 HB1 PRO 15 1.808 1.043 -4.093
115 HG2 PRO 15 HG2 PRO 15 1.991 -1.790 -3.209
116 HG3 PRO 15 HG1 PRO 15 3.234 -0.743 -3.916
117 HD2 PRO 15 HD2 PRO 15 3.093 -1.285 -1.271
118 HD3 PRO 15 HD1 PRO 15 3.746 0.241 -1.903
119 H LEU 16 HN LEU 16 0.412 -1.664 -1.064
120 HA LEU 16 HA LEU 16 -2.250 -2.350 -1.931
121 HB2 LEU 16 HB2 LEU 16 -0.152 -3.584 -0.600
122 HB3 LEU 16 HB1 LEU 16 -1.353 -3.410 0.672
123 HG LEU 16 HG LEU 16 -1.639 -5.562 -0.445
124 HD11 LEU 16 HD11 LEU 16 -3.652 -4.218 0.316
125 HD12 LEU 16 HD12 LEU 16 -3.985 -5.432 -0.920
126 HD13 LEU 16 HD13 LEU 16 -3.867 -3.730 -1.364
127 HD21 LEU 16 HD21 LEU 16 -0.654 -4.708 -2.650
128 HD22 LEU 16 HD22 LEU 16 -2.251 -4.045 -2.995
129 HD23 LEU 16 HD23 LEU 16 -2.043 -5.784 -2.790
130 H LEU 17 HN LEU 17 -1.005 -0.915 1.057
131 HA LEU 17 HA LEU 17 -3.567 -0.561 2.345
132 HB2 LEU 17 HB2 LEU 17 -0.757 0.392 2.667
133 HB3 LEU 17 HB1 LEU 17 -2.001 1.388 3.417
134 HG LEU 17 HG LEU 17 -2.892 -0.922 4.328
135 HD11 LEU 17 HD11 LEU 17 -0.967 -2.023 2.888
136 HD12 LEU 17 HD12 LEU 17 -1.362 -2.667 4.480
137 HD13 LEU 17 HD13 LEU 17 0.030 -1.603 4.280
138 HD21 LEU 17 HD21 LEU 17 -1.559 -0.586 6.347
139 HD22 LEU 17 HD22 LEU 17 -1.978 0.987 5.670
140 HD23 LEU 17 HD23 LEU 17 -0.358 0.332 5.439
141 H LEU 18 HN LEU 18 -1.582 1.454 0.239
142 HA LEU 18 HA LEU 18 -3.190 3.839 0.267
143 HB2 LEU 18 HB2 LEU 18 -0.976 2.628 -1.266
144 HB3 LEU 18 HB1 LEU 18 -1.991 3.687 -2.237
145 HG LEU 18 HG LEU 18 -1.682 5.508 -0.615
146 HD11 LEU 18 HD11 LEU 18 -0.268 5.295 1.314
147 HD12 LEU 18 HD12 LEU 18 0.262 3.686 0.828
148 HD13 LEU 18 HD13 LEU 18 -1.395 3.940 1.373
149 HD21 LEU 18 HD21 LEU 18 0.734 5.890 -0.987
150 HD22 LEU 18 HD22 LEU 18 -0.043 5.268 -2.442
151 HD23 LEU 18 HD23 LEU 18 0.929 4.195 -1.433
152 H LEU 19 HN LEU 19 -3.263 0.865 -1.710
153 HA LEU 19 HA LEU 19 -5.433 1.715 -3.449
154 HB2 LEU 19 HB2 LEU 19 -3.564 -0.353 -3.312
155 HB3 LEU 19 HB1 LEU 19 -5.091 -1.169 -3.011
156 HG LEU 19 HG LEU 19 -5.896 0.306 -5.077
157 HD11 LEU 19 HD11 LEU 19 -3.928 0.311 -6.739
158 HD12 LEU 19 HD12 LEU 19 -2.887 0.158 -5.324
159 HD13 LEU 19 HD13 LEU 19 -3.931 1.569 -5.504
160 HD21 LEU 19 HD21 LEU 19 -4.207 -2.212 -5.258
161 HD22 LEU 19 HD22 LEU 19 -5.218 -1.602 -6.567
162 HD23 LEU 19 HD23 LEU 19 -5.956 -2.130 -5.055
163 H LEU 20 HN LEU 20 -5.143 -0.174 -0.491
164 HA LEU 20 HA LEU 20 -7.874 -1.005 -0.193
165 HB2 LEU 20 HB2 LEU 20 -5.386 -0.878 1.362
166 HB3 LEU 20 HB1 LEU 20 -6.817 -0.702 2.366
167 HG LEU 20 HG LEU 20 -6.554 -2.903 0.309
168 HD11 LEU 20 HD11 LEU 20 -5.805 -4.380 2.075
169 HD12 LEU 20 HD12 LEU 20 -5.946 -3.094 3.273
170 HD13 LEU 20 HD13 LEU 20 -4.711 -2.998 2.017
171 HD21 LEU 20 HD21 LEU 20 -8.277 -2.551 2.788
172 HD22 LEU 20 HD22 LEU 20 -8.305 -3.951 1.716
173 HD23 LEU 20 HD23 LEU 20 -8.830 -2.376 1.122
174 H LEU 21 HN LEU 21 -6.140 1.932 0.853
175 HA LEU 21 HA LEU 21 -8.202 3.093 2.448
176 HB2 LEU 21 HB2 LEU 21 -5.679 3.656 2.109
177 HB3 LEU 21 HB1 LEU 21 -6.250 4.677 0.791
178 HG LEU 21 HG LEU 21 -7.941 5.581 2.593
179 HD11 LEU 21 HD11 LEU 21 -5.669 4.749 4.405
180 HD12 LEU 21 HD12 LEU 21 -7.128 3.776 4.232
181 HD13 LEU 21 HD13 LEU 21 -7.235 5.421 4.857
182 HD21 LEU 21 HD21 LEU 21 -6.075 6.856 1.507
183 HD22 LEU 21 HD22 LEU 21 -4.989 6.271 2.768
184 HD23 LEU 21 HD23 LEU 21 -6.339 7.325 3.187
185 H ALA 22 HN ALA 22 -7.811 2.946 -1.022
186 HA ALA 22 HA ALA 22 -10.040 4.898 -1.434
187 HB1 ALA 22 HB1 ALA 22 -9.076 5.293 -3.513
188 HB2 ALA 22 HB2 ALA 22 -8.410 3.665 -3.629
189 HB3 ALA 22 HB3 ALA 22 -7.647 4.857 -2.576
190 H LEU 23 HN LEU 23 -10.226 1.899 -0.581
191 HA LEU 23 HA LEU 23 -12.057 1.020 -2.796
192 HB2 LEU 23 HB2 LEU 23 -9.676 -0.029 -1.974
193 HB3 LEU 23 HB1 LEU 23 -10.836 -0.990 -1.076
194 HG LEU 23 HG LEU 23 -10.358 -2.086 -3.207
195 HD11 LEU 23 HD11 LEU 23 -13.077 -0.792 -3.474
196 HD12 LEU 23 HD12 LEU 23 -12.730 -2.038 -2.275
197 HD13 LEU 23 HD13 LEU 23 -12.585 -2.404 -3.993
198 HD21 LEU 23 HD21 LEU 23 -11.501 -0.424 -5.150
199 HD22 LEU 23 HD22 LEU 23 -9.783 -0.753 -4.936
200 HD23 LEU 23 HD23 LEU 23 -10.509 0.661 -4.175
201 HA PRO 24 HA PRO 24 -14.215 1.221 1.431
202 HB2 PRO 24 HB2 PRO 24 -16.019 3.168 0.767
203 HB3 PRO 24 HB1 PRO 24 -14.420 3.524 1.454
204 HG2 PRO 24 HG2 PRO 24 -15.318 3.644 -1.382
205 HG3 PRO 24 HG1 PRO 24 -14.255 4.744 -0.486
206 HD2 PRO 24 HD2 PRO 24 -13.298 2.848 -2.201
207 HD3 PRO 24 HD1 PRO 24 -12.399 3.405 -0.780
208 HA PRO 25 HA PRO 25 -17.246 -1.492 -0.373
209 HB2 PRO 25 HB2 PRO 25 -18.922 -1.778 1.768
210 HB3 PRO 25 HB1 PRO 25 -17.340 -2.578 1.657
211 HG2 PRO 25 HG2 PRO 25 -18.097 -0.095 3.117
212 HG3 PRO 25 HG1 PRO 25 -17.043 -1.429 3.626
213 HD2 PRO 25 HD2 PRO 25 -16.066 0.911 2.722
214 HD3 PRO 25 HD1 PRO 25 -15.237 -0.638 2.448
215 H ARG 26 HN ARG 26 -19.505 -1.482 -1.031
216 HA ARG 26 HA ARG 26 -21.093 0.985 -0.562
217 HB2 ARG 26 HB2 ARG 26 -19.533 0.337 -2.977
218 HB3 ARG 26 HB1 ARG 26 -21.212 0.751 -3.308
219 HG2 ARG 26 HG2 ARG 26 -20.755 2.924 -3.000
220 HG3 ARG 26 HG1 ARG 26 -20.233 2.587 -1.350
221 HD2 ARG 26 HD2 ARG 26 -18.074 1.696 -2.842
222 HD3 ARG 26 HD1 ARG 26 -18.604 3.137 -3.733
223 HE ARG 26 HE ARG 26 -17.594 3.103 -0.965
224 HH11 ARG 26 HH11 ARG 26 -20.060 4.701 -0.795
225 HH12 ARG 26 HH12 ARG 26 -19.542 6.290 -1.250
226 HH21 ARG 26 HH21 ARG 26 -16.582 5.175 -2.716
227 HH22 ARG 26 HH22 ARG 26 -17.555 6.555 -2.347
228 H ALA 27 HN ALA 27 -20.950 -1.928 -2.667
229 HA ALA 27 HA ALA 27 -22.535 -3.584 -3.150
230 HB1 ALA 27 HB1 ALA 27 -24.025 -2.658 -0.695
231 HB2 ALA 27 HB2 ALA 27 -22.485 -3.506 -0.559
232 HB3 ALA 27 HB3 ALA 27 -23.860 -4.295 -1.330
233 H TYR 28 HN TYR 28 -22.963 -0.613 -3.897
234 HA TYR 28 HA TYR 28 -25.575 -0.936 -5.180
235 HB2 TYR 28 HB2 TYR 28 -25.230 0.474 -2.636
236 HB3 TYR 28 HB1 TYR 28 -25.872 1.538 -3.883
237 HD1 TYR 28 HD2 TYR 28 -27.817 0.493 -5.364
238 HD2 TYR 28 HD1 TYR 28 -26.711 -0.877 -1.444
239 HE1 TYR 28 HE2 TYR 28 -30.053 -0.545 -5.094
240 HE2 TYR 28 HE1 TYR 28 -28.946 -1.913 -1.176
241 HH TYR 28 HH TYR 28 -30.832 -2.781 -3.275
242 H ALA 29 HN ALA 29 -23.253 1.601 -4.140
243 HA ALA 29 HA ALA 29 -22.994 2.472 -6.999
244 HB1 ALA 29 HB1 ALA 29 -22.856 4.745 -6.124
245 HB2 ALA 29 HB2 ALA 29 -22.848 4.143 -4.466
246 HB3 ALA 29 HB3 ALA 29 -24.296 3.977 -5.457
Start of MODEL 24
1 H1 ARG 1 HT1 ARG 1 18.655 -2.992 -8.291
2 H2 ARG 1 HT2 ARG 1 17.499 -3.419 -7.119
3 H3 ARG 1 HT3 ARG 1 17.696 -4.372 -8.511
4 HA ARG 1 HA ARG 1 19.897 -5.055 -7.803
5 HB2 ARG 1 HB2 ARG 1 19.311 -2.852 -5.870
6 HB3 ARG 1 HB1 ARG 1 20.309 -4.187 -5.299
7 HG2 ARG 1 HG2 ARG 1 21.943 -3.834 -7.004
8 HG3 ARG 1 HG1 ARG 1 20.882 -2.737 -7.891
9 HD2 ARG 1 HD2 ARG 1 21.127 -1.006 -6.287
10 HD3 ARG 1 HD1 ARG 1 21.774 -2.119 -5.064
11 HE ARG 1 HE ARG 1 23.846 -2.270 -6.351
12 HH11 ARG 1 HH21 ARG 1 23.276 0.728 -6.066
13 HH12 ARG 1 HH22 ARG 1 23.614 1.283 -7.670
14 HH21 ARG 1 HH11 ARG 1 23.528 -1.907 -9.068
15 HH22 ARG 1 HH12 ARG 1 23.759 -0.222 -9.385
16 H LEU 2 HN LEU 2 20.170 -6.839 -6.275
17 HA LEU 2 HA LEU 2 17.663 -8.142 -5.547
18 HB2 LEU 2 HB2 LEU 2 20.477 -8.789 -5.874
19 HB3 LEU 2 HB1 LEU 2 19.853 -9.499 -4.388
20 HG LEU 2 HG LEU 2 18.326 -9.741 -6.978
21 HD11 LEU 2 HD11 LEU 2 19.426 -11.921 -7.321
22 HD12 LEU 2 HD12 LEU 2 20.473 -11.616 -5.935
23 HD13 LEU 2 HD13 LEU 2 20.604 -10.609 -7.379
24 HD21 LEU 2 HD21 LEU 2 18.453 -11.312 -4.381
25 HD22 LEU 2 HD22 LEU 2 17.537 -11.831 -5.796
26 HD23 LEU 2 HD23 LEU 2 17.104 -10.338 -4.965
27 H VAL 3 HN VAL 3 16.675 -6.870 -3.923
28 HA VAL 3 HA VAL 3 18.156 -6.107 -1.503
29 HB VAL 3 HB VAL 3 15.940 -5.192 -0.809
30 HG11 VAL 3 HG11 VAL 3 17.438 -3.816 -2.152
31 HG12 VAL 3 HG12 VAL 3 15.767 -3.521 -2.633
32 HG13 VAL 3 HG13 VAL 3 16.807 -4.533 -3.636
33 HG21 VAL 3 HG21 VAL 3 13.987 -5.775 -1.807
34 HG22 VAL 3 HG22 VAL 3 14.883 -7.097 -2.550
35 HG23 VAL 3 HG23 VAL 3 14.665 -5.581 -3.423
36 HA PRO 4 HA PRO 4 17.034 -9.799 0.696
37 HB2 PRO 4 HB2 PRO 4 17.918 -9.050 3.164
38 HB3 PRO 4 HB1 PRO 4 19.005 -9.460 1.825
39 HG2 PRO 4 HG2 PRO 4 18.431 -6.859 3.014
40 HG3 PRO 4 HG1 PRO 4 19.802 -7.375 2.027
41 HD2 PRO 4 HD2 PRO 4 17.511 -5.863 1.217
42 HD3 PRO 4 HD1 PRO 4 18.906 -6.366 0.237
43 H GLY 5 HN GLY 5 14.791 -7.832 0.378
44 HA2 GLY 5 HA2 GLY 5 12.578 -8.072 1.311
45 HA3 GLY 5 HA1 GLY 5 13.301 -8.539 2.846
46 H ALA 6 HN ALA 6 15.201 -6.293 2.929
47 HA ALA 6 HA ALA 6 13.824 -4.365 4.402
48 HB1 ALA 6 HB1 ALA 6 16.214 -4.545 4.433
49 HB2 ALA 6 HB2 ALA 6 15.830 -2.928 3.842
50 HB3 ALA 6 HB3 ALA 6 16.317 -4.189 2.708
51 H ALA 7 HN ALA 7 14.729 -4.053 0.973
52 HA ALA 7 HA ALA 7 12.920 -1.704 0.683
53 HB1 ALA 7 HB1 ALA 7 14.093 -1.860 -1.685
54 HB2 ALA 7 HB2 ALA 7 15.205 -2.929 -0.833
55 HB3 ALA 7 HB3 ALA 7 14.990 -1.266 -0.288
56 H TYR 8 HN TYR 8 12.077 -4.730 0.832
57 HA TYR 8 HA TYR 8 10.627 -4.906 -1.771
58 HB2 TYR 8 HB2 TYR 8 12.171 -6.735 -0.395
59 HB3 TYR 8 HB1 TYR 8 10.544 -7.176 0.113
60 HD1 TYR 8 HD1 TYR 8 8.755 -7.079 -1.934
61 HD2 TYR 8 HD2 TYR 8 12.977 -7.786 -2.303
62 HE1 TYR 8 HE1 TYR 8 8.378 -8.195 -4.113
63 HE2 TYR 8 HE2 TYR 8 12.598 -8.901 -4.482
64 HH TYR 8 HH TYR 8 10.092 -10.173 -5.485
65 H ALA 9 HN ALA 9 10.103 -5.594 1.682
66 HA ALA 9 HA ALA 9 7.236 -5.607 1.583
67 HB1 ALA 9 HB1 ALA 9 9.181 -5.017 3.834
68 HB2 ALA 9 HB2 ALA 9 8.527 -6.600 3.410
69 HB3 ALA 9 HB3 ALA 9 7.465 -5.352 4.063
70 H LEU 10 HN LEU 10 9.574 -3.065 2.249
71 HA LEU 10 HA LEU 10 7.846 -0.927 3.008
72 HB2 LEU 10 HB2 LEU 10 10.559 -1.391 2.549
73 HB3 LEU 10 HB1 LEU 10 10.148 -0.171 1.349
74 HG LEU 10 HG LEU 10 9.264 0.136 4.214
75 HD11 LEU 10 HD11 LEU 10 11.295 1.095 4.852
76 HD12 LEU 10 HD12 LEU 10 11.801 1.381 3.187
77 HD13 LEU 10 HD13 LEU 10 11.836 -0.253 3.852
78 HD21 LEU 10 HD21 LEU 10 9.369 2.544 3.566
79 HD22 LEU 10 HD22 LEU 10 8.271 1.627 2.535
80 HD23 LEU 10 HD23 LEU 10 9.874 2.067 1.945
81 H TYR 11 HN TYR 11 8.987 -1.983 -0.195
82 HA TYR 11 HA TYR 11 7.495 0.078 -1.641
83 HB2 TYR 11 HB2 TYR 11 9.383 -2.153 -2.217
84 HB3 TYR 11 HB1 TYR 11 8.346 -1.622 -3.540
85 HD1 TYR 11 HD2 TYR 11 10.787 -0.422 -0.992
86 HD2 TYR 11 HD1 TYR 11 8.764 0.417 -4.688
87 HE1 TYR 11 HE2 TYR 11 12.242 1.554 -1.340
88 HE2 TYR 11 HE1 TYR 11 10.219 2.392 -5.035
89 HH TYR 11 HH TYR 11 12.988 2.890 -3.713
90 H GLY 12 HN GLY 12 6.866 -3.169 -0.576
91 HA2 GLY 12 HA2 GLY 12 4.757 -3.735 -2.498
92 HA3 GLY 12 HA1 GLY 12 5.145 -4.694 -1.075
93 H VAL 13 HN VAL 13 4.876 -2.229 0.707
94 HA VAL 13 HA VAL 13 2.009 -2.509 1.156
95 HB VAL 13 HB VAL 13 2.439 -0.973 3.069
96 HG11 VAL 13 HG11 VAL 13 2.690 -3.266 3.560
97 HG12 VAL 13 HG12 VAL 13 4.161 -2.519 4.184
98 HG13 VAL 13 HG13 VAL 13 4.195 -3.389 2.650
99 HG21 VAL 13 HG21 VAL 13 5.384 -1.119 2.533
100 HG22 VAL 13 HG22 VAL 13 4.467 0.080 3.443
101 HG23 VAL 13 HG23 VAL 13 4.449 0.112 1.682
102 H TRP 14 HN TRP 14 3.974 -0.199 -0.537
103 HA TRP 14 HA TRP 14 2.448 2.159 -0.399
104 HB2 TRP 14 HB2 TRP 14 4.648 1.871 -1.525
105 HB3 TRP 14 HB1 TRP 14 3.853 1.022 -2.836
106 HD1 TRP 14 HD1 TRP 14 3.770 2.621 -4.813
107 HE1 TRP 14 HE1 TRP 14 3.062 5.073 -5.168
108 HE3 TRP 14 HE3 TRP 14 2.844 3.985 0.018
109 HZ2 TRP 14 HZ2 TRP 14 2.212 7.319 -3.608
110 HZ3 TRP 14 HZ3 TRP 14 2.088 6.277 0.557
111 HH2 TRP 14 HH2 TRP 14 1.772 7.946 -1.246
112 HA PRO 15 HA PRO 15 -0.335 0.720 -4.011
113 HB2 PRO 15 HB2 PRO 15 -0.328 -1.923 -4.719
114 HB3 PRO 15 HB1 PRO 15 0.724 -0.708 -5.475
115 HG2 PRO 15 HG2 PRO 15 1.361 -2.706 -3.368
116 HG3 PRO 15 HG1 PRO 15 2.337 -2.159 -4.741
117 HD2 PRO 15 HD2 PRO 15 2.733 -1.293 -2.203
118 HD3 PRO 15 HD1 PRO 15 3.114 -0.308 -3.628
119 H LEU 16 HN LEU 16 0.220 -1.487 -1.289
120 HA LEU 16 HA LEU 16 -2.517 -2.446 -1.108
121 HB2 LEU 16 HB2 LEU 16 0.003 -2.556 0.483
122 HB3 LEU 16 HB1 LEU 16 -1.490 -2.810 1.376
123 HG LEU 16 HG LEU 16 -0.525 -4.942 0.579
124 HD11 LEU 16 HD11 LEU 16 -2.545 -5.887 -0.125
125 HD12 LEU 16 HD12 LEU 16 -3.001 -4.464 -1.062
126 HD13 LEU 16 HD13 LEU 16 -3.074 -4.421 0.699
127 HD21 LEU 16 HD21 LEU 16 -1.094 -3.905 -2.214
128 HD22 LEU 16 HD22 LEU 16 -0.377 -5.456 -1.782
129 HD23 LEU 16 HD23 LEU 16 0.514 -3.964 -1.497
130 H LEU 17 HN LEU 17 -0.667 0.021 0.691
131 HA LEU 17 HA LEU 17 -2.975 0.934 2.184
132 HB2 LEU 17 HB2 LEU 17 -1.514 2.763 2.891
133 HB3 LEU 17 HB1 LEU 17 -0.594 1.267 2.884
134 HG LEU 17 HG LEU 17 -0.011 2.063 0.404
135 HD11 LEU 17 HD11 LEU 17 -1.278 4.381 1.629
136 HD12 LEU 17 HD12 LEU 17 -0.770 4.141 -0.042
137 HD13 LEU 17 HD13 LEU 17 0.383 4.733 1.153
138 HD21 LEU 17 HD21 LEU 17 1.969 3.315 1.476
139 HD22 LEU 17 HD22 LEU 17 1.728 1.640 1.969
140 HD23 LEU 17 HD23 LEU 17 1.205 2.953 3.023
141 H LEU 18 HN LEU 18 -1.645 1.635 -0.963
142 HA LEU 18 HA LEU 18 -3.147 4.045 -1.552
143 HB2 LEU 18 HB2 LEU 18 -1.617 1.923 -3.037
144 HB3 LEU 18 HB1 LEU 18 -2.688 2.951 -3.973
145 HG LEU 18 HG LEU 18 -0.454 3.917 -2.159
146 HD11 LEU 18 HD11 LEU 18 -0.709 3.573 -5.146
147 HD12 LEU 18 HD12 LEU 18 0.578 3.010 -4.080
148 HD13 LEU 18 HD13 LEU 18 0.427 4.727 -4.448
149 HD21 LEU 18 HD21 LEU 18 -0.972 6.094 -3.464
150 HD22 LEU 18 HD22 LEU 18 -2.072 5.639 -2.164
151 HD23 LEU 18 HD23 LEU 18 -2.518 5.337 -3.844
152 H LEU 19 HN LEU 19 -3.610 0.546 -2.075
153 HA LEU 19 HA LEU 19 -6.166 0.659 -3.384
154 HB2 LEU 19 HB2 LEU 19 -4.271 -1.256 -2.655
155 HB3 LEU 19 HB1 LEU 19 -5.656 -1.671 -1.663
156 HG LEU 19 HG LEU 19 -5.822 -2.893 -3.738
157 HD11 LEU 19 HD11 LEU 19 -7.918 -1.852 -2.791
158 HD12 LEU 19 HD12 LEU 19 -7.991 -2.196 -4.519
159 HD13 LEU 19 HD13 LEU 19 -7.724 -0.545 -3.960
160 HD21 LEU 19 HD21 LEU 19 -5.795 -1.812 -5.914
161 HD22 LEU 19 HD22 LEU 19 -4.335 -1.350 -5.038
162 HD23 LEU 19 HD23 LEU 19 -5.683 -0.219 -5.165
163 H LEU 20 HN LEU 20 -5.149 0.353 -0.027
164 HA LEU 20 HA LEU 20 -7.727 0.070 1.220
165 HB2 LEU 20 HB2 LEU 20 -4.920 0.551 1.935
166 HB3 LEU 20 HB1 LEU 20 -6.033 1.370 3.024
167 HG LEU 20 HG LEU 20 -6.519 -1.505 2.284
168 HD11 LEU 20 HD11 LEU 20 -5.208 -2.122 4.338
169 HD12 LEU 20 HD12 LEU 20 -4.598 -0.468 4.389
170 HD13 LEU 20 HD13 LEU 20 -4.210 -1.509 3.020
171 HD21 LEU 20 HD21 LEU 20 -8.261 -0.301 3.518
172 HD22 LEU 20 HD22 LEU 20 -7.084 0.210 4.727
173 HD23 LEU 20 HD23 LEU 20 -7.510 -1.495 4.576
174 H LEU 21 HN LEU 21 -5.688 2.947 0.559
175 HA LEU 21 HA LEU 21 -7.389 4.919 1.729
176 HB2 LEU 21 HB2 LEU 21 -4.944 5.010 0.822
177 HB3 LEU 21 HB1 LEU 21 -5.704 5.363 -0.730
178 HG LEU 21 HG LEU 21 -7.048 7.095 0.907
179 HD11 LEU 21 HD11 LEU 21 -5.592 8.075 2.498
180 HD12 LEU 21 HD12 LEU 21 -4.183 7.232 1.855
181 HD13 LEU 21 HD13 LEU 21 -5.412 6.338 2.752
182 HD21 LEU 21 HD21 LEU 21 -4.422 7.522 -0.557
183 HD22 LEU 21 HD22 LEU 21 -5.482 8.822 -0.014
184 HD23 LEU 21 HD23 LEU 21 -6.042 7.683 -1.236
185 H ALA 22 HN ALA 22 -7.352 3.450 -1.473
186 HA ALA 22 HA ALA 22 -9.751 5.036 -2.299
187 HB1 ALA 22 HB1 ALA 22 -9.090 4.175 -4.557
188 HB2 ALA 22 HB2 ALA 22 -7.751 3.310 -3.801
189 HB3 ALA 22 HB3 ALA 22 -7.793 5.074 -3.768
190 H LEU 23 HN LEU 23 -9.958 2.809 -0.345
191 HA LEU 23 HA LEU 23 -11.227 0.622 -1.901
192 HB2 LEU 23 HB2 LEU 23 -9.483 0.496 0.051
193 HB3 LEU 23 HB1 LEU 23 -10.886 0.713 1.079
194 HG LEU 23 HG LEU 23 -10.198 -1.680 0.679
195 HD11 LEU 23 HD11 LEU 23 -12.336 -2.329 0.994
196 HD12 LEU 23 HD12 LEU 23 -12.895 -1.570 -0.494
197 HD13 LEU 23 HD13 LEU 23 -12.689 -0.603 0.966
198 HD21 LEU 23 HD21 LEU 23 -9.796 -1.069 -1.876
199 HD22 LEU 23 HD22 LEU 23 -11.494 -1.519 -2.020
200 HD23 LEU 23 HD23 LEU 23 -10.323 -2.685 -1.408
201 HA PRO 24 HA PRO 24 -15.152 2.486 -0.836
202 HB2 PRO 24 HB2 PRO 24 -16.640 0.852 -2.434
203 HB3 PRO 24 HB1 PRO 24 -15.671 2.199 -3.054
204 HG2 PRO 24 HG2 PRO 24 -15.197 -0.682 -3.243
205 HG3 PRO 24 HG1 PRO 24 -14.586 0.634 -4.253
206 HD2 PRO 24 HD2 PRO 24 -13.209 -0.754 -2.183
207 HD3 PRO 24 HD1 PRO 24 -12.621 0.623 -3.130
208 HA PRO 25 HA PRO 25 -16.964 -0.177 2.205
209 HB2 PRO 25 HB2 PRO 25 -19.646 0.268 1.940
210 HB3 PRO 25 HB1 PRO 25 -18.530 1.464 2.629
211 HG2 PRO 25 HG2 PRO 25 -19.680 1.320 -0.109
212 HG3 PRO 25 HG1 PRO 25 -19.412 2.730 0.930
213 HD2 PRO 25 HD2 PRO 25 -17.771 2.083 -1.123
214 HD3 PRO 25 HD1 PRO 25 -17.209 2.920 0.342
215 H ARG 26 HN ARG 26 -18.826 -1.927 2.458
216 HA ARG 26 HA ARG 26 -18.405 -4.004 0.486
217 HB2 ARG 26 HB2 ARG 26 -18.957 -4.071 3.047
218 HB3 ARG 26 HB1 ARG 26 -20.635 -3.988 2.509
219 HG2 ARG 26 HG2 ARG 26 -20.532 -6.228 2.245
220 HG3 ARG 26 HG1 ARG 26 -19.514 -5.916 0.841
221 HD2 ARG 26 HD2 ARG 26 -17.900 -7.098 1.924
222 HD3 ARG 26 HD1 ARG 26 -17.748 -5.703 3.009
223 HE ARG 26 HE ARG 26 -19.523 -6.772 4.437
224 HH11 ARG 26 HH11 ARG 26 -20.520 -8.904 2.693
225 HH12 ARG 26 HH12 ARG 26 -19.639 -10.299 3.212
226 HH21 ARG 26 HH21 ARG 26 -17.194 -8.453 4.873
227 HH22 ARG 26 HH22 ARG 26 -17.738 -10.042 4.459
228 H ALA 27 HN ALA 27 -21.010 -1.641 1.018
229 HA ALA 27 HA ALA 27 -22.532 -2.806 -1.288
230 HB1 ALA 27 HB1 ALA 27 -23.352 -1.046 1.047
231 HB2 ALA 27 HB2 ALA 27 -23.727 -2.757 0.842
232 HB3 ALA 27 HB3 ALA 27 -24.439 -1.563 -0.243
233 H TYR 28 HN TYR 28 -20.397 -1.385 -2.109
234 HA TYR 28 HA TYR 28 -20.859 1.471 -2.371
235 HB2 TYR 28 HB2 TYR 28 -18.855 1.415 -3.724
236 HB3 TYR 28 HB1 TYR 28 -18.633 0.322 -2.365
237 HD1 TYR 28 HD1 TYR 28 -19.301 0.525 -6.007
238 HD2 TYR 28 HD2 TYR 28 -18.413 -2.065 -2.695
239 HE1 TYR 28 HE1 TYR 28 -18.824 -1.327 -7.582
240 HE2 TYR 28 HE2 TYR 28 -17.937 -3.915 -4.271
241 HH TYR 28 HH TYR 28 -18.733 -4.465 -6.753
242 H ALA 29 HN ALA 29 -22.002 -1.290 -4.185
243 HA ALA 29 HA ALA 29 -22.746 0.439 -6.502
244 HB1 ALA 29 HB1 ALA 29 -22.908 -1.614 -7.711
245 HB2 ALA 29 HB2 ALA 29 -22.991 -2.566 -6.229
246 HB3 ALA 29 HB3 ALA 29 -21.478 -1.787 -6.692
Start of MODEL 25
1 H1 ARG 1 HT1 ARG 1 21.016 -0.471 -5.954
2 H2 ARG 1 HT2 ARG 1 19.503 -1.245 -5.933
3 H3 ARG 1 HT3 ARG 1 20.817 -1.916 -5.094
4 HA ARG 1 HA ARG 1 20.797 -0.230 -3.454
5 HB2 ARG 1 HB2 ARG 1 19.566 1.165 -5.713
6 HB3 ARG 1 HB1 ARG 1 18.765 1.526 -4.187
7 HG2 ARG 1 HG2 ARG 1 21.087 1.944 -3.211
8 HG3 ARG 1 HG1 ARG 1 21.690 1.891 -4.867
9 HD2 ARG 1 HD2 ARG 1 21.275 4.170 -4.692
10 HD3 ARG 1 HD1 ARG 1 19.677 3.637 -5.245
11 HE ARG 1 HE ARG 1 20.079 3.587 -2.318
12 HH11 ARG 1 HH11 ARG 1 20.223 6.422 -3.496
13 HH12 ARG 1 HH12 ARG 1 18.577 6.928 -3.332
14 HH21 ARG 1 HH21 ARG 1 17.374 3.700 -2.795
15 HH22 ARG 1 HH22 ARG 1 16.948 5.371 -2.932
16 H LEU 2 HN LEU 2 19.395 -2.726 -3.738
17 HA LEU 2 HA LEU 2 17.028 -2.167 -2.034
18 HB2 LEU 2 HB2 LEU 2 15.552 -3.416 -3.447
19 HB3 LEU 2 HB1 LEU 2 16.395 -2.275 -4.485
20 HG LEU 2 HG LEU 2 17.943 -4.698 -4.343
21 HD11 LEU 2 HD11 LEU 2 15.519 -5.518 -3.768
22 HD12 LEU 2 HD12 LEU 2 16.450 -6.377 -4.993
23 HD13 LEU 2 HD13 LEU 2 15.208 -5.223 -5.479
24 HD21 LEU 2 HD21 LEU 2 17.918 -2.993 -6.170
25 HD22 LEU 2 HD22 LEU 2 16.288 -3.511 -6.597
26 HD23 LEU 2 HD23 LEU 2 17.641 -4.627 -6.773
27 H VAL 3 HN VAL 3 16.070 -4.513 -1.432
28 HA VAL 3 HA VAL 3 17.936 -6.711 -1.249
29 HB VAL 3 HB VAL 3 19.076 -5.267 0.297
30 HG11 VAL 3 HG11 VAL 3 17.379 -3.629 0.802
31 HG12 VAL 3 HG12 VAL 3 17.904 -4.350 2.322
32 HG13 VAL 3 HG13 VAL 3 16.376 -4.841 1.596
33 HG21 VAL 3 HG21 VAL 3 18.808 -6.497 2.462
34 HG22 VAL 3 HG22 VAL 3 18.968 -7.562 1.067
35 HG23 VAL 3 HG23 VAL 3 17.383 -7.290 1.792
36 HA PRO 4 HA PRO 4 14.001 -8.619 -0.565
37 HB2 PRO 4 HB2 PRO 4 14.860 -11.115 0.125
38 HB3 PRO 4 HB1 PRO 4 14.897 -10.500 -1.540
39 HG2 PRO 4 HG2 PRO 4 17.103 -10.726 0.435
40 HG3 PRO 4 HG1 PRO 4 17.118 -10.995 -1.316
41 HD2 PRO 4 HD2 PRO 4 18.061 -8.726 -0.131
42 HD3 PRO 4 HD1 PRO 4 17.430 -8.782 -1.789
43 H GLY 5 HN GLY 5 12.652 -8.662 1.190
44 HA2 GLY 5 HA2 GLY 5 11.957 -9.162 3.417
45 HA3 GLY 5 HA1 GLY 5 13.640 -9.414 3.865
46 H ALA 6 HN ALA 6 14.847 -7.078 3.122
47 HA ALA 6 HA ALA 6 13.796 -5.178 5.112
48 HB1 ALA 6 HB1 ALA 6 16.103 -5.493 5.269
49 HB2 ALA 6 HB2 ALA 6 16.007 -4.006 4.327
50 HB3 ALA 6 HB3 ALA 6 16.311 -5.544 3.519
51 H ALA 7 HN ALA 7 14.399 -5.240 1.624
52 HA ALA 7 HA ALA 7 12.954 -2.626 1.358
53 HB1 ALA 7 HB1 ALA 7 14.314 -3.161 -1.017
54 HB2 ALA 7 HB2 ALA 7 15.383 -3.793 0.233
55 HB3 ALA 7 HB3 ALA 7 14.875 -2.108 0.282
56 H TYR 8 HN TYR 8 11.660 -5.323 1.537
57 HA TYR 8 HA TYR 8 10.463 -5.502 -1.206
58 HB2 TYR 8 HB2 TYR 8 11.237 -7.467 0.893
59 HB3 TYR 8 HB1 TYR 8 9.752 -7.815 0.018
60 HD1 TYR 8 HD1 TYR 8 12.856 -6.132 -1.268
61 HD2 TYR 8 HD2 TYR 8 10.341 -9.615 -1.384
62 HE1 TYR 8 HE1 TYR 8 14.163 -7.013 -3.176
63 HE2 TYR 8 HE2 TYR 8 11.652 -10.493 -3.293
64 HH TYR 8 HH TYR 8 13.266 -9.060 -5.232
65 H ALA 9 HN ALA 9 9.697 -5.924 2.237
66 HA ALA 9 HA ALA 9 6.832 -5.583 1.910
67 HB1 ALA 9 HB1 ALA 9 7.993 -6.806 3.787
68 HB2 ALA 9 HB2 ALA 9 6.850 -5.591 4.358
69 HB3 ALA 9 HB3 ALA 9 8.579 -5.248 4.374
70 H LEU 10 HN LEU 10 9.508 -3.539 2.964
71 HA LEU 10 HA LEU 10 8.077 -1.120 3.531
72 HB2 LEU 10 HB2 LEU 10 10.743 -2.087 3.455
73 HB3 LEU 10 HB1 LEU 10 10.713 -0.674 2.408
74 HG LEU 10 HG LEU 10 9.542 -0.663 5.199
75 HD11 LEU 10 HD11 LEU 10 11.593 0.272 6.004
76 HD12 LEU 10 HD12 LEU 10 12.249 0.413 4.374
77 HD13 LEU 10 HD13 LEU 10 12.038 -1.178 5.106
78 HD21 LEU 10 HD21 LEU 10 9.785 1.794 4.914
79 HD22 LEU 10 HD22 LEU 10 8.742 1.101 3.671
80 HD23 LEU 10 HD23 LEU 10 10.407 1.534 3.283
81 H TYR 11 HN TYR 11 9.517 -2.401 0.531
82 HA TYR 11 HA TYR 11 8.652 -0.034 -1.031
83 HB2 TYR 11 HB2 TYR 11 10.304 -2.507 -1.525
84 HB3 TYR 11 HB1 TYR 11 9.823 -1.459 -2.853
85 HD1 TYR 11 HD1 TYR 11 11.640 -1.542 0.394
86 HD2 TYR 11 HD2 TYR 11 10.919 0.630 -3.240
87 HE1 TYR 11 HE1 TYR 11 13.505 -0.009 0.945
88 HE2 TYR 11 HE2 TYR 11 12.784 2.166 -2.687
89 HH TYR 11 HH TYR 11 14.049 2.550 0.240
90 H GLY 12 HN GLY 12 6.921 -2.565 0.081
91 HA2 GLY 12 HA2 GLY 12 5.384 -2.871 -2.466
92 HA3 GLY 12 HA1 GLY 12 5.581 -4.192 -1.317
93 H VAL 13 HN VAL 13 5.025 -0.869 -0.242
94 HA VAL 13 HA VAL 13 2.268 -1.681 0.599
95 HB VAL 13 HB VAL 13 2.699 -0.153 2.587
96 HG11 VAL 13 HG11 VAL 13 4.183 -1.903 3.711
97 HG12 VAL 13 HG12 VAL 13 4.233 -2.713 2.146
98 HG13 VAL 13 HG13 VAL 13 2.693 -2.490 2.972
99 HG21 VAL 13 HG21 VAL 13 4.870 0.569 3.105
100 HG22 VAL 13 HG22 VAL 13 4.802 0.835 1.363
101 HG23 VAL 13 HG23 VAL 13 5.623 -0.586 2.007
102 H TRP 14 HN TRP 14 4.081 0.699 -1.104
103 HA TRP 14 HA TRP 14 2.533 3.040 -0.709
104 HB2 TRP 14 HB2 TRP 14 4.702 2.930 -1.876
105 HB3 TRP 14 HB1 TRP 14 3.970 2.036 -3.187
106 HD1 TRP 14 HD1 TRP 14 4.404 3.830 -5.012
107 HE1 TRP 14 HE1 TRP 14 3.406 6.154 -5.492
108 HE3 TRP 14 HE3 TRP 14 1.971 4.697 -0.594
109 HZ2 TRP 14 HZ2 TRP 14 1.793 8.119 -4.187
110 HZ3 TRP 14 HZ3 TRP 14 0.718 6.793 -0.247
111 HH2 TRP 14 HH2 TRP 14 0.623 8.509 -2.034
112 HA PRO 15 HA PRO 15 -0.289 1.672 -4.354
113 HB2 PRO 15 HB2 PRO 15 -0.181 -0.935 -5.179
114 HB3 PRO 15 HB1 PRO 15 0.807 0.355 -5.897
115 HG2 PRO 15 HG2 PRO 15 1.559 -1.698 -3.883
116 HG3 PRO 15 HG1 PRO 15 2.489 -1.062 -5.251
117 HD2 PRO 15 HD2 PRO 15 2.905 -0.279 -2.695
118 HD3 PRO 15 HD1 PRO 15 3.204 0.783 -4.086
119 H LEU 16 HN LEU 16 0.425 -0.538 -1.693
120 HA LEU 16 HA LEU 16 -2.154 -1.795 -1.465
121 HB2 LEU 16 HB2 LEU 16 0.353 -1.849 -0.178
122 HB3 LEU 16 HB1 LEU 16 -0.777 -1.321 1.064
123 HG LEU 16 HG LEU 16 -2.116 -3.404 -0.244
124 HD11 LEU 16 HD11 LEU 16 0.838 -3.978 0.071
125 HD12 LEU 16 HD12 LEU 16 -0.169 -4.222 -1.356
126 HD13 LEU 16 HD13 LEU 16 -0.376 -5.258 0.056
127 HD21 LEU 16 HD21 LEU 16 -0.482 -3.388 2.316
128 HD22 LEU 16 HD22 LEU 16 -1.681 -4.612 1.898
129 HD23 LEU 16 HD23 LEU 16 -2.181 -2.941 2.159
130 H LEU 17 HN LEU 17 -0.750 1.096 0.024
131 HA LEU 17 HA LEU 17 -3.087 1.884 1.529
132 HB2 LEU 17 HB2 LEU 17 -0.474 3.034 0.685
133 HB3 LEU 17 HB1 LEU 17 -1.734 4.212 1.046
134 HG LEU 17 HG LEU 17 -2.115 2.884 3.221
135 HD11 LEU 17 HD11 LEU 17 -0.790 0.896 2.479
136 HD12 LEU 17 HD12 LEU 17 -0.225 1.563 4.010
137 HD13 LEU 17 HD13 LEU 17 0.666 1.891 2.525
138 HD21 LEU 17 HD21 LEU 17 -0.353 4.126 4.360
139 HD22 LEU 17 HD22 LEU 17 -0.980 5.116 3.041
140 HD23 LEU 17 HD23 LEU 17 0.560 4.275 2.858
141 H LEU 18 HN LEU 18 -1.951 2.487 -1.743
142 HA LEU 18 HA LEU 18 -3.937 4.443 -2.513
143 HB2 LEU 18 HB2 LEU 18 -1.823 2.769 -3.718
144 HB3 LEU 18 HB1 LEU 18 -3.186 3.031 -4.801
145 HG LEU 18 HG LEU 18 -2.996 5.511 -4.226
146 HD11 LEU 18 HD11 LEU 18 -0.175 4.861 -3.410
147 HD12 LEU 18 HD12 LEU 18 -1.457 4.873 -2.198
148 HD13 LEU 18 HD13 LEU 18 -1.104 6.331 -3.123
149 HD21 LEU 18 HD21 LEU 18 -0.953 5.789 -5.722
150 HD22 LEU 18 HD22 LEU 18 -2.228 4.764 -6.377
151 HD23 LEU 18 HD23 LEU 18 -0.783 4.034 -5.677
152 H LEU 19 HN LEU 19 -3.705 0.889 -2.658
153 HA LEU 19 HA LEU 19 -6.212 0.361 -3.968
154 HB2 LEU 19 HB2 LEU 19 -3.993 -1.049 -2.985
155 HB3 LEU 19 HB1 LEU 19 -5.334 -1.633 -2.012
156 HG LEU 19 HG LEU 19 -6.465 -1.644 -4.502
157 HD11 LEU 19 HD11 LEU 19 -4.554 -1.104 -5.780
158 HD12 LEU 19 HD12 LEU 19 -4.635 -2.863 -5.876
159 HD13 LEU 19 HD13 LEU 19 -3.492 -2.092 -4.777
160 HD21 LEU 19 HD21 LEU 19 -4.797 -3.875 -3.284
161 HD22 LEU 19 HD22 LEU 19 -6.120 -4.073 -4.434
162 HD23 LEU 19 HD23 LEU 19 -6.449 -3.476 -2.807
163 H LEU 20 HN LEU 20 -5.218 0.660 -0.598
164 HA LEU 20 HA LEU 20 -7.776 0.066 0.623
165 HB2 LEU 20 HB2 LEU 20 -5.070 0.924 1.355
166 HB3 LEU 20 HB1 LEU 20 -6.287 1.704 2.350
167 HG LEU 20 HG LEU 20 -5.535 -0.410 3.361
168 HD11 LEU 20 HD11 LEU 20 -7.947 0.396 3.537
169 HD12 LEU 20 HD12 LEU 20 -7.682 -1.318 3.858
170 HD13 LEU 20 HD13 LEU 20 -8.340 -0.804 2.305
171 HD21 LEU 20 HD21 LEU 20 -6.831 -1.949 1.127
172 HD22 LEU 20 HD22 LEU 20 -5.604 -2.475 2.279
173 HD23 LEU 20 HD23 LEU 20 -5.162 -1.408 0.948
174 H LEU 21 HN LEU 21 -6.141 3.091 -0.346
175 HA LEU 21 HA LEU 21 -8.055 4.953 0.683
176 HB2 LEU 21 HB2 LEU 21 -5.728 5.446 -0.090
177 HB3 LEU 21 HB1 LEU 21 -6.249 5.149 -1.746
178 HG LEU 21 HG LEU 21 -8.021 7.034 -0.399
179 HD11 LEU 21 HD11 LEU 21 -6.477 8.883 -0.167
180 HD12 LEU 21 HD12 LEU 21 -5.137 7.898 -0.756
181 HD13 LEU 21 HD13 LEU 21 -5.874 7.542 0.807
182 HD21 LEU 21 HD21 LEU 21 -7.684 8.282 -2.441
183 HD22 LEU 21 HD22 LEU 21 -7.763 6.576 -2.878
184 HD23 LEU 21 HD23 LEU 21 -6.203 7.395 -2.802
185 H ALA 22 HN ALA 22 -7.811 3.253 -2.399
186 HA ALA 22 HA ALA 22 -10.398 4.420 -3.326
187 HB1 ALA 22 HB1 ALA 22 -9.643 3.456 -5.504
188 HB2 ALA 22 HB2 ALA 22 -8.215 2.808 -4.695
189 HB3 ALA 22 HB3 ALA 22 -8.447 4.553 -4.810
190 H LEU 23 HN LEU 23 -10.502 2.501 -1.173
191 HA LEU 23 HA LEU 23 -11.502 0.024 -2.500
192 HB2 LEU 23 HB2 LEU 23 -9.622 0.167 -0.677
193 HB3 LEU 23 HB1 LEU 23 -10.974 0.313 0.439
194 HG LEU 23 HG LEU 23 -11.201 -1.842 -1.591
195 HD11 LEU 23 HD11 LEU 23 -8.807 -1.969 -0.956
196 HD12 LEU 23 HD12 LEU 23 -9.720 -3.353 -0.356
197 HD13 LEU 23 HD13 LEU 23 -9.275 -2.047 0.742
198 HD21 LEU 23 HD21 LEU 23 -12.911 -1.583 0.116
199 HD22 LEU 23 HD22 LEU 23 -11.695 -1.594 1.394
200 HD23 LEU 23 HD23 LEU 23 -12.009 -3.058 0.464
201 HA PRO 24 HA PRO 24 -15.534 1.360 -1.172
202 HB2 PRO 24 HB2 PRO 24 -16.900 -0.764 -2.205
203 HB3 PRO 24 HB1 PRO 24 -16.247 0.552 -3.198
204 HG2 PRO 24 HG2 PRO 24 -15.323 -2.208 -2.926
205 HG3 PRO 24 HG1 PRO 24 -15.049 -1.046 -4.228
206 HD2 PRO 24 HD2 PRO 24 -13.253 -1.787 -2.145
207 HD3 PRO 24 HD1 PRO 24 -12.997 -0.570 -3.410
208 HA PRO 25 HA PRO 25 -15.703 -0.985 2.667
209 HB2 PRO 25 HB2 PRO 25 -17.720 0.443 3.831
210 HB3 PRO 25 HB1 PRO 25 -16.042 1.018 3.749
211 HG2 PRO 25 HG2 PRO 25 -18.370 1.755 2.054
212 HG3 PRO 25 HG1 PRO 25 -17.069 2.774 2.692
213 HD2 PRO 25 HD2 PRO 25 -17.138 1.893 0.128
214 HD3 PRO 25 HD1 PRO 25 -15.628 2.230 1.003
215 H ARG 26 HN ARG 26 -17.565 -2.062 3.948
216 HA ARG 26 HA ARG 26 -19.260 -3.571 2.075
217 HB2 ARG 26 HB2 ARG 26 -17.974 -4.001 4.535
218 HB3 ARG 26 HB1 ARG 26 -19.695 -4.055 4.908
219 HG2 ARG 26 HG2 ARG 26 -19.830 -6.113 4.027
220 HG3 ARG 26 HG1 ARG 26 -19.297 -5.489 2.469
221 HD2 ARG 26 HD2 ARG 26 -17.666 -7.129 3.000
222 HD3 ARG 26 HD1 ARG 26 -16.894 -5.612 3.502
223 HE ARG 26 HE ARG 26 -18.458 -7.227 5.478
224 HH11 ARG 26 HH21 ARG 26 -15.674 -8.205 5.206
225 HH12 ARG 26 HH22 ARG 26 -14.814 -7.249 6.364
226 HH21 ARG 26 HH11 ARG 26 -17.348 -4.862 6.637
227 HH22 ARG 26 HH12 ARG 26 -15.774 -5.332 7.184
228 H ALA 27 HN ALA 27 -19.686 -0.874 4.282
229 HA ALA 27 HA ALA 27 -21.518 0.507 4.708
230 HB1 ALA 27 HB1 ALA 27 -23.212 -1.120 2.833
231 HB2 ALA 27 HB2 ALA 27 -21.886 -0.162 2.172
232 HB3 ALA 27 HB3 ALA 27 -23.180 0.625 3.076
233 H TYR 28 HN TYR 28 -21.716 -0.299 6.836
234 HA TYR 28 HA TYR 28 -22.778 -1.354 8.647
235 HB2 TYR 28 HB2 TYR 28 -24.678 -0.170 7.852
236 HB3 TYR 28 HB1 TYR 28 -24.840 -1.193 6.437
237 HD1 TYR 28 HD2 TYR 28 -24.808 -1.580 10.185
238 HD2 TYR 28 HD1 TYR 28 -26.594 -2.668 6.434
239 HE1 TYR 28 HE2 TYR 28 -26.455 -2.991 11.375
240 HE2 TYR 28 HE1 TYR 28 -28.241 -4.077 7.618
241 HH TYR 28 HH TYR 28 -28.026 -5.307 10.291
242 H ALA 29 HN ALA 29 -20.980 -2.957 7.326
243 HA ALA 29 HA ALA 29 -21.938 -5.662 7.899
244 HB1 ALA 29 HB1 ALA 29 -22.874 -5.606 5.751
245 HB2 ALA 29 HB2 ALA 29 -21.291 -6.324 5.451
246 HB3 ALA 29 HB3 ALA 29 -21.565 -4.617 5.100
Start of MODEL 26
1 H1 ARG 1 HT1 ARG 1 17.238 -0.887 -5.473
2 H2 ARG 1 HT2 ARG 1 16.222 -1.074 -6.820
3 H3 ARG 1 HT3 ARG 1 17.886 -0.818 -7.039
4 HA ARG 1 HA ARG 1 17.412 -3.145 -7.413
5 HB2 ARG 1 HB2 ARG 1 19.051 -2.062 -5.219
6 HB3 ARG 1 HB1 ARG 1 18.705 -3.782 -5.049
7 HG2 ARG 1 HG2 ARG 1 19.637 -4.274 -7.208
8 HG3 ARG 1 HG1 ARG 1 19.756 -2.561 -7.614
9 HD2 ARG 1 HD2 ARG 1 21.549 -2.199 -6.118
10 HD3 ARG 1 HD1 ARG 1 21.209 -3.685 -5.210
11 HE ARG 1 HE ARG 1 22.291 -3.666 -8.007
12 HH11 ARG 1 HH21 ARG 1 24.200 -4.256 -5.824
13 HH12 ARG 1 HH22 ARG 1 24.159 -5.983 -5.726
14 HH21 ARG 1 HH11 ARG 1 21.173 -6.265 -7.504
15 HH22 ARG 1 HH12 ARG 1 22.427 -7.131 -6.686
16 H LEU 2 HN LEU 2 16.164 -4.946 -6.889
17 HA LEU 2 HA LEU 2 14.077 -4.595 -4.824
18 HB2 LEU 2 HB2 LEU 2 13.938 -5.485 -7.306
19 HB3 LEU 2 HB1 LEU 2 14.410 -7.017 -6.572
20 HG LEU 2 HG LEU 2 12.424 -6.052 -4.865
21 HD11 LEU 2 HD11 LEU 2 11.506 -5.706 -7.731
22 HD12 LEU 2 HD12 LEU 2 11.922 -4.359 -6.672
23 HD13 LEU 2 HD13 LEU 2 10.570 -5.415 -6.266
24 HD21 LEU 2 HD21 LEU 2 11.111 -7.916 -5.759
25 HD22 LEU 2 HD22 LEU 2 12.805 -8.394 -5.648
26 HD23 LEU 2 HD23 LEU 2 12.111 -7.957 -7.211
27 H VAL 3 HN VAL 3 15.726 -4.773 -3.021
28 HA VAL 3 HA VAL 3 16.916 -7.431 -2.588
29 HB VAL 3 HB VAL 3 17.743 -6.338 -0.457
30 HG11 VAL 3 HG11 VAL 3 18.980 -6.406 -2.650
31 HG12 VAL 3 HG12 VAL 3 19.430 -5.070 -1.592
32 HG13 VAL 3 HG13 VAL 3 18.372 -4.782 -2.973
33 HG21 VAL 3 HG21 VAL 3 15.762 -4.569 -0.652
34 HG22 VAL 3 HG22 VAL 3 16.942 -3.694 -1.629
35 HG23 VAL 3 HG23 VAL 3 17.315 -4.110 0.043
36 HA PRO 4 HA PRO 4 13.583 -9.126 -0.274
37 HB2 PRO 4 HB2 PRO 4 14.966 -10.966 1.200
38 HB3 PRO 4 HB1 PRO 4 14.614 -11.167 -0.530
39 HG2 PRO 4 HG2 PRO 4 17.115 -10.222 0.785
40 HG3 PRO 4 HG1 PRO 4 16.910 -11.332 -0.582
41 HD2 PRO 4 HD2 PRO 4 17.605 -8.756 -0.928
42 HD3 PRO 4 HD1 PRO 4 16.590 -9.632 -2.098
43 H GLY 5 HN GLY 5 12.845 -7.530 1.131
44 HA2 GLY 5 HA2 GLY 5 12.589 -7.436 3.692
45 HA3 GLY 5 HA1 GLY 5 14.323 -7.100 3.692
46 H ALA 6 HN ALA 6 14.930 -5.251 2.105
47 HA ALA 6 HA ALA 6 13.463 -2.870 2.922
48 HB1 ALA 6 HB1 ALA 6 15.544 -2.847 0.775
49 HB2 ALA 6 HB2 ALA 6 16.028 -3.340 2.398
50 HB3 ALA 6 HB3 ALA 6 15.328 -1.743 2.132
51 H ALA 7 HN ALA 7 13.668 -4.808 -0.006
52 HA ALA 7 HA ALA 7 11.799 -2.931 -1.406
53 HB1 ALA 7 HB1 ALA 7 14.063 -3.611 -2.373
54 HB2 ALA 7 HB2 ALA 7 12.680 -3.900 -3.427
55 HB3 ALA 7 HB3 ALA 7 13.407 -5.238 -2.542
56 H TYR 8 HN TYR 8 10.970 -4.856 0.698
57 HA TYR 8 HA TYR 8 9.153 -6.615 -0.907
58 HB2 TYR 8 HB2 TYR 8 10.952 -7.099 1.398
59 HB3 TYR 8 HB1 TYR 8 9.340 -7.783 1.573
60 HD1 TYR 8 HD2 TYR 8 11.868 -7.421 -1.206
61 HD2 TYR 8 HD1 TYR 8 9.132 -9.984 0.893
62 HE1 TYR 8 HE2 TYR 8 12.483 -9.300 -2.698
63 HE2 TYR 8 HE1 TYR 8 9.747 -11.861 -0.601
64 HH TYR 8 HH TYR 8 11.126 -11.573 -3.446
65 H ALA 9 HN ALA 9 9.512 -5.265 2.367
66 HA ALA 9 HA ALA 9 6.697 -5.048 2.912
67 HB1 ALA 9 HB1 ALA 9 8.965 -3.400 4.069
68 HB2 ALA 9 HB2 ALA 9 8.617 -5.055 4.569
69 HB3 ALA 9 HB3 ALA 9 7.429 -3.783 4.846
70 H LEU 10 HN LEU 10 9.084 -2.809 1.602
71 HA LEU 10 HA LEU 10 7.507 -0.422 1.444
72 HB2 LEU 10 HB2 LEU 10 10.086 -1.266 0.806
73 HB3 LEU 10 HB1 LEU 10 9.392 -0.926 -0.769
74 HG LEU 10 HG LEU 10 10.473 1.079 0.108
75 HD11 LEU 10 HD11 LEU 10 8.727 2.613 -0.300
76 HD12 LEU 10 HD12 LEU 10 7.508 1.550 0.402
77 HD13 LEU 10 HD13 LEU 10 8.224 1.158 -1.162
78 HD21 LEU 10 HD21 LEU 10 10.117 0.388 2.540
79 HD22 LEU 10 HD22 LEU 10 8.476 1.021 2.384
80 HD23 LEU 10 HD23 LEU 10 9.859 2.097 2.184
81 H TYR 11 HN TYR 11 7.996 -3.110 -0.836
82 HA TYR 11 HA TYR 11 6.338 -2.056 -2.951
83 HB2 TYR 11 HB2 TYR 11 7.553 -4.713 -2.230
84 HB3 TYR 11 HB1 TYR 11 6.458 -4.586 -3.605
85 HD1 TYR 11 HD1 TYR 11 9.475 -2.879 -2.143
86 HD2 TYR 11 HD2 TYR 11 7.324 -3.994 -5.691
87 HE1 TYR 11 HE1 TYR 11 11.314 -1.987 -3.534
88 HE2 TYR 11 HE2 TYR 11 9.170 -3.099 -7.083
89 HH TYR 11 HH TYR 11 11.116 -1.137 -6.517
90 H GLY 12 HN GLY 12 5.673 -3.902 -0.062
91 HA2 GLY 12 HA2 GLY 12 2.897 -4.481 -0.929
92 HA3 GLY 12 HA1 GLY 12 3.683 -5.136 0.502
93 H VAL 13 HN VAL 13 4.456 -1.898 0.595
94 HA VAL 13 HA VAL 13 2.085 -1.321 2.310
95 HB VAL 13 HB VAL 13 4.452 -1.503 3.264
96 HG11 VAL 13 HG11 VAL 13 5.301 0.036 1.277
97 HG12 VAL 13 HG12 VAL 13 6.043 0.132 2.872
98 HG13 VAL 13 HG13 VAL 13 4.847 1.332 2.383
99 HG21 VAL 13 HG21 VAL 13 4.100 0.488 4.740
100 HG22 VAL 13 HG22 VAL 13 2.656 -0.505 4.542
101 HG23 VAL 13 HG23 VAL 13 2.812 1.013 3.655
102 H TRP 14 HN TRP 14 3.922 -0.110 -0.419
103 HA TRP 14 HA TRP 14 2.870 2.570 -0.410
104 HB2 TRP 14 HB2 TRP 14 4.922 1.824 -1.589
105 HB3 TRP 14 HB1 TRP 14 3.939 0.895 -2.699
106 HD1 TRP 14 HD1 TRP 14 4.464 2.242 -4.843
107 HE1 TRP 14 HE1 TRP 14 3.890 4.618 -5.648
108 HE3 TRP 14 HE3 TRP 14 2.778 4.294 -0.466
109 HZ2 TRP 14 HZ2 TRP 14 2.856 7.062 -4.590
110 HZ3 TRP 14 HZ3 TRP 14 2.007 6.640 -0.403
111 HH2 TRP 14 HH2 TRP 14 2.043 8.029 -2.454
112 HA PRO 15 HA PRO 15 -0.356 1.053 -3.610
113 HB2 PRO 15 HB2 PRO 15 -0.729 -1.634 -3.950
114 HB3 PRO 15 HB1 PRO 15 0.416 -0.683 -4.917
115 HG2 PRO 15 HG2 PRO 15 0.934 -2.465 -2.597
116 HG3 PRO 15 HG1 PRO 15 1.881 -2.227 -4.074
117 HD2 PRO 15 HD2 PRO 15 2.533 -1.117 -1.685
118 HD3 PRO 15 HD1 PRO 15 2.966 -0.390 -3.246
119 H LEU 16 HN LEU 16 0.114 -0.925 -0.690
120 HA LEU 16 HA LEU 16 -2.659 -1.507 -0.194
121 HB2 LEU 16 HB2 LEU 16 -0.067 -1.618 1.239
122 HB3 LEU 16 HB1 LEU 16 -1.479 -1.465 2.278
123 HG LEU 16 HG LEU 16 -0.899 -3.830 1.892
124 HD11 LEU 16 HD11 LEU 16 -3.091 -4.586 1.509
125 HD12 LEU 16 HD12 LEU 16 -3.435 -3.300 0.355
126 HD13 LEU 16 HD13 LEU 16 -3.327 -2.934 2.077
127 HD21 LEU 16 HD21 LEU 16 0.081 -3.514 -0.388
128 HD22 LEU 16 HD22 LEU 16 -1.544 -3.261 -1.021
129 HD23 LEU 16 HD23 LEU 16 -1.099 -4.822 -0.333
130 H LEU 17 HN LEU 17 -0.551 1.152 0.856
131 HA LEU 17 HA LEU 17 -2.518 2.516 2.468
132 HB2 LEU 17 HB2 LEU 17 0.140 2.790 2.058
133 HB3 LEU 17 HB1 LEU 17 -0.431 4.045 0.958
134 HG LEU 17 HG LEU 17 -1.577 3.940 3.728
135 HD11 LEU 17 HD11 LEU 17 0.782 3.788 4.205
136 HD12 LEU 17 HD12 LEU 17 0.304 5.468 4.448
137 HD13 LEU 17 HD13 LEU 17 1.163 4.999 2.980
138 HD21 LEU 17 HD21 LEU 17 -2.390 5.526 1.952
139 HD22 LEU 17 HD22 LEU 17 -0.779 6.241 1.912
140 HD23 LEU 17 HD23 LEU 17 -1.752 6.346 3.377
141 H LEU 18 HN LEU 18 -1.598 2.684 -0.929
142 HA LEU 18 HA LEU 18 -3.352 4.819 -1.751
143 HB2 LEU 18 HB2 LEU 18 -1.569 2.795 -2.889
144 HB3 LEU 18 HB1 LEU 18 -3.002 2.998 -3.888
145 HG LEU 18 HG LEU 18 -2.590 5.498 -3.804
146 HD11 LEU 18 HD11 LEU 18 -0.494 6.331 -3.028
147 HD12 LEU 18 HD12 LEU 18 0.173 4.709 -2.854
148 HD13 LEU 18 HD13 LEU 18 -1.077 5.273 -1.743
149 HD21 LEU 18 HD21 LEU 18 -1.954 4.252 -5.784
150 HD22 LEU 18 HD22 LEU 18 -0.489 3.663 -4.999
151 HD23 LEU 18 HD23 LEU 18 -0.643 5.371 -5.409
152 H LEU 19 HN LEU 19 -3.673 1.278 -1.547
153 HA LEU 19 HA LEU 19 -6.353 1.065 -2.590
154 HB2 LEU 19 HB2 LEU 19 -4.263 -0.593 -1.440
155 HB3 LEU 19 HB1 LEU 19 -5.823 -1.044 -0.777
156 HG LEU 19 HG LEU 19 -5.284 -2.332 -2.818
157 HD11 LEU 19 HD11 LEU 19 -7.398 -2.074 -3.903
158 HD12 LEU 19 HD12 LEU 19 -7.522 -0.384 -3.412
159 HD13 LEU 19 HD13 LEU 19 -7.658 -1.665 -2.208
160 HD21 LEU 19 HD21 LEU 19 -5.601 0.189 -4.434
161 HD22 LEU 19 HD22 LEU 19 -4.860 -1.342 -4.898
162 HD23 LEU 19 HD23 LEU 19 -4.017 -0.253 -3.799
163 H LEU 20 HN LEU 20 -4.988 1.672 0.576
164 HA LEU 20 HA LEU 20 -7.465 1.381 2.094
165 HB2 LEU 20 HB2 LEU 20 -4.622 1.893 2.512
166 HB3 LEU 20 HB1 LEU 20 -5.590 2.980 3.493
167 HG LEU 20 HG LEU 20 -5.072 0.904 4.708
168 HD11 LEU 20 HD11 LEU 20 -7.303 2.131 4.963
169 HD12 LEU 20 HD12 LEU 20 -7.259 0.460 5.525
170 HD13 LEU 20 HD13 LEU 20 -8.002 0.848 3.975
171 HD21 LEU 20 HD21 LEU 20 -5.641 -1.239 3.939
172 HD22 LEU 20 HD22 LEU 20 -5.093 -0.443 2.464
173 HD23 LEU 20 HD23 LEU 20 -6.818 -0.619 2.782
174 H LEU 21 HN LEU 21 -5.576 4.103 0.733
175 HA LEU 21 HA LEU 21 -7.169 6.256 1.745
176 HB2 LEU 21 HB2 LEU 21 -4.855 6.297 0.648
177 HB3 LEU 21 HB1 LEU 21 -5.686 6.139 -0.897
178 HG LEU 21 HG LEU 21 -6.794 8.256 0.830
179 HD11 LEU 21 HD11 LEU 21 -4.962 9.820 0.532
180 HD12 LEU 21 HD12 LEU 21 -4.022 8.615 -0.347
181 HD13 LEU 21 HD13 LEU 21 -4.350 8.396 1.372
182 HD21 LEU 21 HD21 LEU 21 -5.688 8.387 -1.991
183 HD22 LEU 21 HD22 LEU 21 -6.894 9.442 -1.255
184 HD23 LEU 21 HD23 LEU 21 -7.298 7.768 -1.625
185 H ALA 22 HN ALA 22 -7.268 4.477 -1.310
186 HA ALA 22 HA ALA 22 -9.999 5.575 -1.892
187 HB1 ALA 22 HB1 ALA 22 -9.419 5.026 -4.225
188 HB2 ALA 22 HB2 ALA 22 -7.919 4.267 -3.690
189 HB3 ALA 22 HB3 ALA 22 -8.138 6.008 -3.514
190 H LEU 23 HN LEU 23 -9.958 3.642 0.035
191 HA LEU 23 HA LEU 23 -10.013 0.937 -0.899
192 HB2 LEU 23 HB2 LEU 23 -10.468 0.427 1.315
193 HB3 LEU 23 HB1 LEU 23 -9.721 2.003 1.471
194 HG LEU 23 HG LEU 23 -12.722 1.761 1.232
195 HD11 LEU 23 HD11 LEU 23 -11.235 1.739 3.860
196 HD12 LEU 23 HD12 LEU 23 -11.808 0.262 3.083
197 HD13 LEU 23 HD13 LEU 23 -12.960 1.499 3.582
198 HD21 LEU 23 HD21 LEU 23 -12.312 3.807 2.879
199 HD22 LEU 23 HD22 LEU 23 -12.145 4.013 1.137
200 HD23 LEU 23 HD23 LEU 23 -10.712 3.796 2.139
201 HA PRO 24 HA PRO 24 -14.110 0.868 -2.593
202 HB2 PRO 24 HB2 PRO 24 -14.057 -1.764 -3.321
203 HB3 PRO 24 HB1 PRO 24 -13.158 -0.503 -4.184
204 HG2 PRO 24 HG2 PRO 24 -12.170 -2.628 -2.451
205 HG3 PRO 24 HG1 PRO 24 -11.312 -1.661 -3.656
206 HD2 PRO 24 HD2 PRO 24 -11.312 -1.352 -0.805
207 HD3 PRO 24 HD1 PRO 24 -10.423 -0.403 -2.018
208 HA PRO 25 HA PRO 25 -16.820 -0.978 0.411
209 HB2 PRO 25 HB2 PRO 25 -18.793 -2.168 -1.062
210 HB3 PRO 25 HB1 PRO 25 -18.620 -0.408 -0.912
211 HG2 PRO 25 HG2 PRO 25 -17.836 -2.197 -3.144
212 HG3 PRO 25 HG1 PRO 25 -18.504 -0.557 -3.187
213 HD2 PRO 25 HD2 PRO 25 -15.865 -1.147 -3.568
214 HD3 PRO 25 HD1 PRO 25 -16.462 0.419 -2.977
215 H ARG 26 HN ARG 26 -18.263 -3.333 0.564
216 HA ARG 26 HA ARG 26 -16.167 -5.357 0.889
217 HB2 ARG 26 HB2 ARG 26 -19.017 -4.944 1.635
218 HB3 ARG 26 HB1 ARG 26 -18.509 -6.621 1.456
219 HG2 ARG 26 HG2 ARG 26 -17.847 -6.374 3.623
220 HG3 ARG 26 HG1 ARG 26 -16.415 -5.663 2.884
221 HD2 ARG 26 HD2 ARG 26 -18.548 -3.685 3.155
222 HD3 ARG 26 HD1 ARG 26 -18.105 -4.394 4.720
223 HE ARG 26 HE ARG 26 -16.304 -2.848 2.960
224 HH11 ARG 26 HH11 ARG 26 -16.656 -2.480 5.964
225 HH12 ARG 26 HH12 ARG 26 -15.183 -3.159 6.566
226 HH21 ARG 26 HH21 ARG 26 -14.429 -4.812 3.590
227 HH22 ARG 26 HH22 ARG 26 -13.908 -4.490 5.207
228 H ALA 27 HN ALA 27 -19.360 -5.566 -0.776
229 HA ALA 27 HA ALA 27 -18.070 -6.839 -3.127
230 HB1 ALA 27 HB1 ALA 27 -19.503 -8.851 -2.867
231 HB2 ALA 27 HB2 ALA 27 -20.117 -8.203 -1.346
232 HB3 ALA 27 HB3 ALA 27 -18.416 -8.646 -1.493
233 H TYR 28 HN TYR 28 -19.120 -4.489 -3.523
234 HA TYR 28 HA TYR 28 -21.877 -4.938 -4.623
235 HB2 TYR 28 HB2 TYR 28 -20.903 -3.096 -2.604
236 HB3 TYR 28 HB1 TYR 28 -21.566 -2.206 -3.973
237 HD1 TYR 28 HD1 TYR 28 -22.341 -5.027 -1.631
238 HD2 TYR 28 HD2 TYR 28 -23.890 -1.981 -4.236
239 HE1 TYR 28 HE1 TYR 28 -24.641 -5.533 -0.857
240 HE2 TYR 28 HE2 TYR 28 -26.189 -2.489 -3.462
241 HH TYR 28 HH TYR 28 -27.033 -3.768 -0.920
242 H ALA 29 HN ALA 29 -19.072 -2.692 -4.774
243 HA ALA 29 HA ALA 29 -19.251 -2.740 -7.755
244 HB1 ALA 29 HB1 ALA 29 -19.149 -0.318 -5.929
245 HB2 ALA 29 HB2 ALA 29 -20.485 -0.788 -6.980
246 HB3 ALA 29 HB3 ALA 29 -18.961 -0.248 -7.681
Start of MODEL 27
1 H1 ARG 1 HT1 ARG 1 27.748 -1.991 3.806
2 H2 ARG 1 HT2 ARG 1 28.141 -3.234 2.720
3 H3 ARG 1 HT3 ARG 1 27.749 -3.601 4.333
4 HA ARG 1 HA ARG 1 25.843 -2.296 2.461
5 HB2 ARG 1 HB2 ARG 1 24.869 -4.650 2.319
6 HB3 ARG 1 HB1 ARG 1 26.380 -4.394 1.458
7 HG2 ARG 1 HG2 ARG 1 27.567 -5.771 2.859
8 HG3 ARG 1 HG1 ARG 1 26.616 -5.333 4.277
9 HD2 ARG 1 HD2 ARG 1 24.694 -6.627 2.917
10 HD3 ARG 1 HD1 ARG 1 26.108 -7.464 2.245
11 HE ARG 1 HE ARG 1 26.758 -8.101 4.520
12 HH11 ARG 1 HH11 ARG 1 25.533 -5.962 6.138
13 HH12 ARG 1 HH12 ARG 1 24.136 -6.729 6.815
14 HH21 ARG 1 HH21 ARG 1 24.167 -9.363 4.528
15 HH22 ARG 1 HH22 ARG 1 23.354 -8.676 5.892
16 H LEU 2 HN LEU 2 24.137 -1.507 3.596
17 HA LEU 2 HA LEU 2 23.303 -2.818 6.148
18 HB2 LEU 2 HB2 LEU 2 24.309 -0.019 5.696
19 HB3 LEU 2 HB1 LEU 2 23.114 -0.312 6.956
20 HG LEU 2 HG LEU 2 25.061 -2.351 7.236
21 HD11 LEU 2 HD11 LEU 2 26.353 0.387 7.115
22 HD12 LEU 2 HD12 LEU 2 26.502 -0.816 5.835
23 HD13 LEU 2 HD13 LEU 2 27.142 -1.155 7.443
24 HD21 LEU 2 HD21 LEU 2 24.453 0.189 8.778
25 HD22 LEU 2 HD22 LEU 2 25.536 -1.068 9.374
26 HD23 LEU 2 HD23 LEU 2 23.832 -1.431 9.097
27 H VAL 3 HN VAL 3 21.559 -3.473 4.511
28 HA VAL 3 HA VAL 3 19.419 -1.394 4.469
29 HB VAL 3 HB VAL 3 18.865 -2.296 2.118
30 HG11 VAL 3 HG11 VAL 3 19.792 -0.052 2.561
31 HG12 VAL 3 HG12 VAL 3 20.415 -0.728 1.057
32 HG13 VAL 3 HG13 VAL 3 21.423 -0.721 2.504
33 HG21 VAL 3 HG21 VAL 3 21.802 -3.012 2.059
34 HG22 VAL 3 HG22 VAL 3 20.561 -3.371 0.858
35 HG23 VAL 3 HG23 VAL 3 20.571 -4.229 2.398
36 HA PRO 4 HA PRO 4 17.316 -5.043 5.991
37 HB2 PRO 4 HB2 PRO 4 14.971 -3.809 6.652
38 HB3 PRO 4 HB1 PRO 4 16.434 -3.684 7.647
39 HG2 PRO 4 HG2 PRO 4 15.232 -1.710 5.815
40 HG3 PRO 4 HG1 PRO 4 16.171 -1.461 7.293
41 HD2 PRO 4 HD2 PRO 4 17.119 -1.190 4.692
42 HD3 PRO 4 HD1 PRO 4 18.116 -1.339 6.154
43 H GLY 5 HN GLY 5 17.260 -5.910 3.744
44 HA2 GLY 5 HA2 GLY 5 15.983 -6.854 1.987
45 HA3 GLY 5 HA1 GLY 5 14.561 -6.106 2.700
46 H ALA 6 HN ALA 6 17.032 -3.817 2.205
47 HA ALA 6 HA ALA 6 17.194 -1.967 0.787
48 HB1 ALA 6 HB1 ALA 6 18.060 -3.815 -0.610
49 HB2 ALA 6 HB2 ALA 6 17.247 -2.597 -1.593
50 HB3 ALA 6 HB3 ALA 6 16.432 -4.114 -1.217
51 H ALA 7 HN ALA 7 14.590 -2.300 2.073
52 HA ALA 7 HA ALA 7 12.380 -1.517 1.960
53 HB1 ALA 7 HB1 ALA 7 13.225 0.621 1.707
54 HB2 ALA 7 HB2 ALA 7 12.318 0.486 0.202
55 HB3 ALA 7 HB3 ALA 7 14.060 0.232 0.204
56 H TYR 8 HN TYR 8 12.339 -3.865 0.760
57 HA TYR 8 HA TYR 8 11.138 -3.545 -1.961
58 HB2 TYR 8 HB2 TYR 8 12.891 -5.449 -0.634
59 HB3 TYR 8 HB1 TYR 8 11.499 -6.265 -1.332
60 HD1 TYR 8 HD2 TYR 8 11.066 -6.179 -3.755
61 HD2 TYR 8 HD1 TYR 8 14.524 -4.305 -2.028
62 HE1 TYR 8 HE2 TYR 8 12.084 -5.987 -6.005
63 HE2 TYR 8 HE1 TYR 8 15.544 -4.112 -4.281
64 HH TYR 8 HH TYR 8 14.919 -5.747 -6.728
65 H ALA 9 HN ALA 9 10.668 -5.522 0.958
66 HA ALA 9 HA ALA 9 7.938 -6.245 0.411
67 HB1 ALA 9 HB1 ALA 9 9.418 -6.057 3.053
68 HB2 ALA 9 HB2 ALA 9 9.500 -7.436 1.954
69 HB3 ALA 9 HB3 ALA 9 7.976 -7.022 2.742
70 H LEU 10 HN LEU 10 9.408 -3.686 2.330
71 HA LEU 10 HA LEU 10 7.113 -2.495 3.523
72 HB2 LEU 10 HB2 LEU 10 9.787 -2.103 3.572
73 HB3 LEU 10 HB1 LEU 10 9.336 -0.774 2.514
74 HG LEU 10 HG LEU 10 7.896 -1.246 5.125
75 HD11 LEU 10 HD11 LEU 10 10.530 0.128 4.612
76 HD12 LEU 10 HD12 LEU 10 10.096 -0.981 5.914
77 HD13 LEU 10 HD13 LEU 10 9.472 0.668 5.916
78 HD21 LEU 10 HD21 LEU 10 6.773 0.284 3.646
79 HD22 LEU 10 HD22 LEU 10 8.282 1.100 3.241
80 HD23 LEU 10 HD23 LEU 10 7.591 1.273 4.854
81 H TYR 11 HN TYR 11 8.746 -1.771 0.432
82 HA TYR 11 HA TYR 11 6.875 0.264 -0.411
83 HB2 TYR 11 HB2 TYR 11 9.202 -1.219 -1.499
84 HB3 TYR 11 HB1 TYR 11 8.112 -0.507 -2.686
85 HD1 TYR 11 HD1 TYR 11 9.970 0.325 0.462
86 HD2 TYR 11 HD2 TYR 11 8.257 1.778 -3.200
87 HE1 TYR 11 HE1 TYR 11 10.940 2.564 0.895
88 HE2 TYR 11 HE2 TYR 11 9.230 4.014 -2.767
89 HH TYR 11 HH TYR 11 11.601 4.671 -0.968
90 H GLY 12 HN GLY 12 6.437 -3.094 -0.259
91 HA2 GLY 12 HA2 GLY 12 4.682 -3.229 -2.639
92 HA3 GLY 12 HA1 GLY 12 5.142 -4.589 -1.615
93 H VAL 13 HN VAL 13 4.502 -3.551 0.919
94 HA VAL 13 HA VAL 13 1.595 -3.859 0.895
95 HB VAL 13 HB VAL 13 1.825 -3.895 3.325
96 HG11 VAL 13 HG11 VAL 13 2.611 -5.840 1.791
97 HG12 VAL 13 HG12 VAL 13 3.057 -5.880 3.496
98 HG13 VAL 13 HG13 VAL 13 4.236 -5.370 2.289
99 HG21 VAL 13 HG21 VAL 13 4.717 -3.092 2.829
100 HG22 VAL 13 HG22 VAL 13 4.036 -3.550 4.389
101 HG23 VAL 13 HG23 VAL 13 3.481 -2.084 3.583
102 H TRP 14 HN TRP 14 3.787 -1.150 1.181
103 HA TRP 14 HA TRP 14 2.114 0.752 2.456
104 HB2 TRP 14 HB2 TRP 14 4.539 0.981 1.975
105 HB3 TRP 14 HB1 TRP 14 4.176 1.178 0.276
106 HD1 TRP 14 HD1 TRP 14 5.111 3.606 0.156
107 HE1 TRP 14 HE1 TRP 14 4.227 5.876 0.985
108 HE3 TRP 14 HE3 TRP 14 1.460 2.032 3.384
109 HZ2 TRP 14 HZ2 TRP 14 2.246 6.897 2.772
110 HZ3 TRP 14 HZ3 TRP 14 0.100 3.671 4.627
111 HH2 TRP 14 HH2 TRP 14 0.484 6.103 4.329
112 HA PRO 15 HA PRO 15 0.463 2.113 -1.848
113 HB2 PRO 15 HB2 PRO 15 0.829 0.435 -3.978
114 HB3 PRO 15 HB1 PRO 15 1.967 1.729 -3.551
115 HG2 PRO 15 HG2 PRO 15 2.136 -1.187 -2.990
116 HG3 PRO 15 HG1 PRO 15 3.409 -0.052 -3.472
117 HD2 PRO 15 HD2 PRO 15 3.076 -0.899 -0.926
118 HD3 PRO 15 HD1 PRO 15 3.746 0.695 -1.327
119 H LEU 16 HN LEU 16 0.433 -1.307 -0.938
120 HA LEU 16 HA LEU 16 -2.115 -1.996 -2.085
121 HB2 LEU 16 HB2 LEU 16 -0.113 -3.118 -0.259
122 HB3 LEU 16 HB1 LEU 16 -1.755 -3.563 0.197
123 HG LEU 16 HG LEU 16 -2.164 -4.322 -2.146
124 HD11 LEU 16 HD11 LEU 16 -0.680 -3.976 -3.814
125 HD12 LEU 16 HD12 LEU 16 0.671 -4.538 -2.832
126 HD13 LEU 16 HD13 LEU 16 0.139 -2.862 -2.721
127 HD21 LEU 16 HD21 LEU 16 -0.755 -6.364 -1.972
128 HD22 LEU 16 HD22 LEU 16 -1.484 -5.936 -0.424
129 HD23 LEU 16 HD23 LEU 16 0.214 -5.571 -0.730
130 H LEU 17 HN LEU 17 -1.165 -0.719 1.079
131 HA LEU 17 HA LEU 17 -3.825 -0.676 2.228
132 HB2 LEU 17 HB2 LEU 17 -1.248 -0.268 3.120
133 HB3 LEU 17 HB1 LEU 17 -1.848 1.384 3.058
134 HG LEU 17 HG LEU 17 -2.248 0.470 5.274
135 HD11 LEU 17 HD11 LEU 17 -4.923 0.418 3.875
136 HD12 LEU 17 HD12 LEU 17 -4.018 1.913 4.111
137 HD13 LEU 17 HD13 LEU 17 -4.552 0.976 5.506
138 HD21 LEU 17 HD21 LEU 17 -3.830 -1.707 3.870
139 HD22 LEU 17 HD22 LEU 17 -3.646 -1.517 5.613
140 HD23 LEU 17 HD23 LEU 17 -2.248 -1.924 4.619
141 H LEU 18 HN LEU 18 -1.868 1.602 0.388
142 HA LEU 18 HA LEU 18 -3.651 3.864 0.458
143 HB2 LEU 18 HB2 LEU 18 -1.207 2.971 -0.884
144 HB3 LEU 18 HB1 LEU 18 -2.241 3.872 -1.985
145 HG LEU 18 HG LEU 18 -2.406 5.687 -0.260
146 HD11 LEU 18 HD11 LEU 18 -0.401 3.899 1.135
147 HD12 LEU 18 HD12 LEU 18 -1.929 4.507 1.772
148 HD13 LEU 18 HD13 LEU 18 -0.578 5.611 1.516
149 HD21 LEU 18 HD21 LEU 18 0.437 4.980 -1.051
150 HD22 LEU 18 HD22 LEU 18 -0.183 6.590 -0.692
151 HD23 LEU 18 HD23 LEU 18 -0.736 5.734 -2.130
152 H LEU 19 HN LEU 19 -3.286 1.058 -1.710
153 HA LEU 19 HA LEU 19 -5.336 1.761 -3.611
154 HB2 LEU 19 HB2 LEU 19 -3.404 -0.241 -3.216
155 HB3 LEU 19 HB1 LEU 19 -4.939 -1.097 -3.149
156 HG LEU 19 HG LEU 19 -4.521 0.905 -5.336
157 HD11 LEU 19 HD11 LEU 19 -3.541 -1.950 -5.550
158 HD12 LEU 19 HD12 LEU 19 -2.466 -0.607 -5.160
159 HD13 LEU 19 HD13 LEU 19 -3.317 -0.634 -6.704
160 HD21 LEU 19 HD21 LEU 19 -6.441 -1.075 -4.602
161 HD22 LEU 19 HD22 LEU 19 -5.679 -1.616 -6.097
162 HD23 LEU 19 HD23 LEU 19 -6.452 -0.033 -6.024
163 H LEU 20 HN LEU 20 -5.249 -0.179 -0.665
164 HA LEU 20 HA LEU 20 -7.944 -1.134 -0.609
165 HB2 LEU 20 HB2 LEU 20 -5.620 -0.842 1.172
166 HB3 LEU 20 HB1 LEU 20 -7.143 -0.734 2.041
167 HG LEU 20 HG LEU 20 -6.657 -2.937 0.043
168 HD11 LEU 20 HD11 LEU 20 -5.901 -2.897 2.981
169 HD12 LEU 20 HD12 LEU 20 -4.798 -3.065 1.615
170 HD13 LEU 20 HD13 LEU 20 -5.951 -4.349 1.980
171 HD21 LEU 20 HD21 LEU 20 -8.348 -2.817 2.562
172 HD22 LEU 20 HD22 LEU 20 -8.378 -4.072 1.324
173 HD23 LEU 20 HD23 LEU 20 -8.963 -2.452 0.949
174 H LEU 21 HN LEU 21 -6.467 1.894 0.561
175 HA LEU 21 HA LEU 21 -8.780 2.996 1.849
176 HB2 LEU 21 HB2 LEU 21 -6.207 3.618 1.799
177 HB3 LEU 21 HB1 LEU 21 -6.686 4.646 0.457
178 HG LEU 21 HG LEU 21 -6.654 5.801 2.685
179 HD11 LEU 21 HD11 LEU 21 -9.511 5.814 1.839
180 HD12 LEU 21 HD12 LEU 21 -8.301 6.222 0.622
181 HD13 LEU 21 HD13 LEU 21 -8.407 7.162 2.110
182 HD21 LEU 21 HD21 LEU 21 -9.147 4.191 3.290
183 HD22 LEU 21 HD22 LEU 21 -8.278 5.289 4.362
184 HD23 LEU 21 HD23 LEU 21 -7.558 3.744 3.912
185 H ALA 22 HN ALA 22 -7.612 3.068 -1.470
186 HA ALA 22 HA ALA 22 -9.736 4.866 -2.417
187 HB1 ALA 22 HB1 ALA 22 -7.590 5.099 -3.415
188 HB2 ALA 22 HB2 ALA 22 -8.579 4.296 -4.634
189 HB3 ALA 22 HB3 ALA 22 -7.439 3.359 -3.668
190 H LEU 23 HN LEU 23 -9.773 1.620 -1.615
191 HA LEU 23 HA LEU 23 -11.869 1.014 -3.673
192 HB2 LEU 23 HB2 LEU 23 -9.346 -0.080 -3.311
193 HB3 LEU 23 HB1 LEU 23 -10.431 -1.243 -2.575
194 HG LEU 23 HG LEU 23 -10.106 -1.817 -4.930
195 HD11 LEU 23 HD11 LEU 23 -12.372 -2.137 -3.919
196 HD12 LEU 23 HD12 LEU 23 -12.414 -1.896 -5.665
197 HD13 LEU 23 HD13 LEU 23 -12.847 -0.573 -4.583
198 HD21 LEU 23 HD21 LEU 23 -9.494 0.444 -5.724
199 HD22 LEU 23 HD22 LEU 23 -11.164 0.969 -5.510
200 HD23 LEU 23 HD23 LEU 23 -10.774 -0.256 -6.715
201 HA PRO 24 HA PRO 24 -13.219 0.239 0.848
202 HB2 PRO 24 HB2 PRO 24 -14.908 2.366 1.146
203 HB3 PRO 24 HB1 PRO 24 -13.182 2.429 1.566
204 HG2 PRO 24 HG2 PRO 24 -14.570 3.458 -0.852
205 HG3 PRO 24 HG1 PRO 24 -13.225 4.158 0.066
206 HD2 PRO 24 HD2 PRO 24 -12.882 2.809 -2.298
207 HD3 PRO 24 HD1 PRO 24 -11.650 2.912 -1.033
208 HA PRO 25 HA PRO 25 -16.890 -1.602 -0.872
209 HB2 PRO 25 HB2 PRO 25 -18.110 -2.404 1.436
210 HB3 PRO 25 HB1 PRO 25 -16.692 -3.228 0.754
211 HG2 PRO 25 HG2 PRO 25 -16.846 -1.283 2.996
212 HG3 PRO 25 HG1 PRO 25 -15.837 -2.728 2.818
213 HD2 PRO 25 HD2 PRO 25 -14.914 -0.200 2.431
214 HD3 PRO 25 HD1 PRO 25 -14.236 -1.632 1.624
215 H ARG 26 HN ARG 26 -19.341 -1.395 -0.643
216 HA ARG 26 HA ARG 26 -20.100 1.371 0.246
217 HB2 ARG 26 HB2 ARG 26 -20.735 -0.314 -2.165
218 HB3 ARG 26 HB1 ARG 26 -21.890 0.910 -1.643
219 HG2 ARG 26 HG2 ARG 26 -20.569 2.134 -3.119
220 HG3 ARG 26 HG1 ARG 26 -19.784 2.481 -1.582
221 HD2 ARG 26 HD2 ARG 26 -17.852 1.609 -2.370
222 HD3 ARG 26 HD1 ARG 26 -18.656 0.051 -2.626
223 HE ARG 26 HE ARG 26 -19.263 2.035 -4.703
224 HH11 ARG 26 HH11 ARG 26 -19.257 -0.886 -5.237
225 HH12 ARG 26 HH12 ARG 26 -17.769 -1.115 -6.089
226 HH21 ARG 26 HH21 ARG 26 -16.422 1.937 -5.078
227 HH22 ARG 26 HH22 ARG 26 -16.143 0.498 -5.997
228 H ALA 27 HN ALA 27 -22.055 -1.465 -0.740
229 HA ALA 27 HA ALA 27 -23.070 -1.882 2.001
230 HB1 ALA 27 HB1 ALA 27 -24.777 -0.798 -0.262
231 HB2 ALA 27 HB2 ALA 27 -24.328 0.064 1.210
232 HB3 ALA 27 HB3 ALA 27 -25.398 -1.334 1.298
233 H TYR 28 HN TYR 28 -21.723 -3.536 -0.081
234 HA TYR 28 HA TYR 28 -23.477 -5.859 0.023
235 HB2 TYR 28 HB2 TYR 28 -23.839 -6.096 -2.365
236 HB3 TYR 28 HB1 TYR 28 -24.426 -4.522 -1.851
237 HD1 TYR 28 HD1 TYR 28 -23.148 -2.460 -2.414
238 HD2 TYR 28 HD2 TYR 28 -21.952 -6.331 -3.848
239 HE1 TYR 28 HE1 TYR 28 -21.683 -1.383 -4.096
240 HE2 TYR 28 HE2 TYR 28 -20.486 -5.253 -5.530
241 HH TYR 28 HH TYR 28 -20.578 -2.764 -6.723
242 H ALA 29 HN ALA 29 -20.499 -4.448 -1.386
243 HA ALA 29 HA ALA 29 -18.343 -5.307 -1.568
244 HB1 ALA 29 HB1 ALA 29 -17.688 -6.873 0.038
245 HB2 ALA 29 HB2 ALA 29 -19.197 -7.776 -0.074
246 HB3 ALA 29 HB3 ALA 29 -19.159 -6.224 0.763
Start of MODEL 28
1 H1 ARG 1 HT1 ARG 1 17.237 -8.146 -10.823
2 H2 ARG 1 HT2 ARG 1 17.709 -9.423 -9.803
3 H3 ARG 1 HT3 ARG 1 17.477 -7.865 -9.169
4 HA ARG 1 HA ARG 1 15.099 -7.986 -9.671
5 HB2 ARG 1 HB2 ARG 1 15.886 -9.689 -11.589
6 HB3 ARG 1 HB1 ARG 1 15.451 -10.875 -10.358
7 HG2 ARG 1 HG2 ARG 1 13.272 -9.342 -10.173
8 HG3 ARG 1 HG1 ARG 1 13.710 -8.944 -11.834
9 HD2 ARG 1 HD2 ARG 1 13.635 -11.276 -12.492
10 HD3 ARG 1 HD1 ARG 1 13.413 -11.791 -10.809
11 HE ARG 1 HE ARG 1 11.333 -10.002 -11.215
12 HH11 ARG 1 HH11 ARG 1 11.353 -10.770 -14.085
13 HH12 ARG 1 HH12 ARG 1 10.313 -12.152 -14.118
14 HH21 ARG 1 HH21 ARG 1 10.487 -12.682 -10.676
15 HH22 ARG 1 HH22 ARG 1 9.818 -13.246 -12.169
16 H LEU 2 HN LEU 2 13.632 -8.991 -8.119
17 HA LEU 2 HA LEU 2 13.021 -9.911 -6.065
18 HB2 LEU 2 HB2 LEU 2 14.825 -11.755 -7.360
19 HB3 LEU 2 HB1 LEU 2 15.058 -11.832 -5.619
20 HG LEU 2 HG LEU 2 13.334 -13.428 -6.381
21 HD11 LEU 2 HD11 LEU 2 13.222 -12.228 -4.129
22 HD12 LEU 2 HD12 LEU 2 11.716 -12.938 -4.709
23 HD13 LEU 2 HD13 LEU 2 11.983 -11.200 -4.849
24 HD21 LEU 2 HD21 LEU 2 11.384 -12.789 -7.516
25 HD22 LEU 2 HD22 LEU 2 12.607 -11.770 -8.274
26 HD23 LEU 2 HD23 LEU 2 11.539 -11.099 -7.040
27 H VAL 3 HN VAL 3 13.328 -8.406 -4.474
28 HA VAL 3 HA VAL 3 16.093 -7.881 -3.478
29 HB VAL 3 HB VAL 3 15.077 -5.899 -2.425
30 HG11 VAL 3 HG11 VAL 3 15.827 -5.779 -4.782
31 HG12 VAL 3 HG12 VAL 3 14.486 -4.682 -4.452
32 HG13 VAL 3 HG13 VAL 3 14.195 -6.197 -5.307
33 HG21 VAL 3 HG21 VAL 3 12.466 -6.794 -3.694
34 HG22 VAL 3 HG22 VAL 3 12.729 -5.344 -2.727
35 HG23 VAL 3 HG23 VAL 3 12.832 -6.934 -1.974
36 HA PRO 4 HA PRO 4 15.255 -9.994 0.298
37 HB2 PRO 4 HB2 PRO 4 16.747 -8.563 2.087
38 HB3 PRO 4 HB1 PRO 4 17.468 -9.607 0.849
39 HG2 PRO 4 HG2 PRO 4 17.276 -6.669 0.947
40 HG3 PRO 4 HG1 PRO 4 18.499 -7.704 0.198
41 HD2 PRO 4 HD2 PRO 4 16.437 -6.373 -1.123
42 HD3 PRO 4 HD1 PRO 4 17.440 -7.680 -1.788
43 H GLY 5 HN GLY 5 14.868 -9.115 2.883
44 HA2 GLY 5 HA2 GLY 5 12.230 -8.061 2.915
45 HA3 GLY 5 HA1 GLY 5 13.292 -8.144 4.316
46 H ALA 6 HN ALA 6 15.306 -6.405 2.800
47 HA ALA 6 HA ALA 6 14.830 -3.891 3.908
48 HB1 ALA 6 HB1 ALA 6 16.498 -3.133 2.223
49 HB2 ALA 6 HB2 ALA 6 16.286 -4.665 1.375
50 HB3 ALA 6 HB3 ALA 6 16.961 -4.645 3.004
51 H ALA 7 HN ALA 7 13.910 -4.974 0.645
52 HA ALA 7 HA ALA 7 12.181 -2.530 0.415
53 HB1 ALA 7 HB1 ALA 7 14.099 -2.377 -1.049
54 HB2 ALA 7 HB2 ALA 7 12.681 -2.712 -2.043
55 HB3 ALA 7 HB3 ALA 7 13.817 -4.006 -1.664
56 H TYR 8 HN TYR 8 11.523 -5.399 1.345
57 HA TYR 8 HA TYR 8 9.656 -6.227 -0.820
58 HB2 TYR 8 HB2 TYR 8 11.298 -7.611 0.954
59 HB3 TYR 8 HB1 TYR 8 9.699 -7.787 1.674
60 HD1 TYR 8 HD2 TYR 8 11.720 -8.397 -1.374
61 HD2 TYR 8 HD1 TYR 8 7.977 -9.093 0.612
62 HE1 TYR 8 HE2 TYR 8 11.146 -10.116 -3.063
63 HE2 TYR 8 HE1 TYR 8 7.401 -10.813 -1.077
64 HH TYR 8 HH TYR 8 9.439 -12.317 -2.938
65 H ALA 9 HN ALA 9 9.650 -5.548 2.656
66 HA ALA 9 HA ALA 9 6.725 -5.205 2.733
67 HB1 ALA 9 HB1 ALA 9 7.810 -6.309 4.590
68 HB2 ALA 9 HB2 ALA 9 7.245 -4.742 5.167
69 HB3 ALA 9 HB3 ALA 9 8.948 -4.974 4.778
70 H LEU 10 HN LEU 10 9.531 -3.220 2.314
71 HA LEU 10 HA LEU 10 8.197 -0.698 3.115
72 HB2 LEU 10 HB2 LEU 10 10.791 -1.617 3.132
73 HB3 LEU 10 HB1 LEU 10 10.771 -0.674 1.649
74 HG LEU 10 HG LEU 10 10.016 0.319 4.414
75 HD11 LEU 10 HD11 LEU 10 12.258 1.131 2.538
76 HD12 LEU 10 HD12 LEU 10 12.457 0.067 3.930
77 HD13 LEU 10 HD13 LEU 10 11.977 1.747 4.166
78 HD21 LEU 10 HD21 LEU 10 8.575 1.435 2.833
79 HD22 LEU 10 HD22 LEU 10 9.898 1.643 1.685
80 HD23 LEU 10 HD23 LEU 10 9.889 2.554 3.194
81 H TYR 11 HN TYR 11 9.629 -2.143 0.179
82 HA TYR 11 HA TYR 11 8.486 -0.081 -1.576
83 HB2 TYR 11 HB2 TYR 11 10.561 -2.079 -1.579
84 HB3 TYR 11 HB1 TYR 11 9.595 -2.234 -3.042
85 HD1 TYR 11 HD2 TYR 11 9.227 -0.136 -4.479
86 HD2 TYR 11 HD1 TYR 11 12.085 -0.318 -1.274
87 HE1 TYR 11 HE2 TYR 11 10.393 1.846 -5.401
88 HE2 TYR 11 HE1 TYR 11 13.250 1.662 -2.198
89 HH TYR 11 HH TYR 11 12.144 3.771 -3.996
90 H GLY 12 HN GLY 12 6.926 -2.592 -0.129
91 HA2 GLY 12 HA2 GLY 12 5.285 -3.155 -2.567
92 HA3 GLY 12 HA1 GLY 12 5.614 -4.386 -1.355
93 H VAL 13 HN VAL 13 4.950 -1.117 -0.240
94 HA VAL 13 HA VAL 13 2.242 -2.056 0.629
95 HB VAL 13 HB VAL 13 2.608 -0.525 2.597
96 HG11 VAL 13 HG11 VAL 13 2.914 -2.902 2.858
97 HG12 VAL 13 HG12 VAL 13 4.221 -2.083 3.712
98 HG13 VAL 13 HG13 VAL 13 4.523 -2.823 2.139
99 HG21 VAL 13 HG21 VAL 13 5.538 -0.600 1.903
100 HG22 VAL 13 HG22 VAL 13 4.693 0.455 3.035
101 HG23 VAL 13 HG23 VAL 13 4.526 0.711 1.298
102 H TRP 14 HN TRP 14 3.882 0.420 -1.113
103 HA TRP 14 HA TRP 14 2.206 2.668 -0.755
104 HB2 TRP 14 HB2 TRP 14 4.392 2.569 -1.964
105 HB3 TRP 14 HB1 TRP 14 3.589 1.747 -3.287
106 HD1 TRP 14 HD1 TRP 14 3.562 3.498 -5.136
107 HE1 TRP 14 HE1 TRP 14 2.630 5.883 -5.380
108 HE3 TRP 14 HE3 TRP 14 2.207 4.429 -0.292
109 HZ2 TRP 14 HZ2 TRP 14 1.466 7.920 -3.748
110 HZ3 TRP 14 HZ3 TRP 14 1.189 6.594 0.327
111 HH2 TRP 14 HH2 TRP 14 0.816 8.342 -1.391
112 HA PRO 15 HA PRO 15 -0.516 1.119 -4.407
113 HB2 PRO 15 HB2 PRO 15 -0.402 -1.539 -5.061
114 HB3 PRO 15 HB1 PRO 15 0.603 -0.297 -5.841
115 HG2 PRO 15 HG2 PRO 15 1.311 -2.208 -3.672
116 HG3 PRO 15 HG1 PRO 15 2.265 -1.682 -5.070
117 HD2 PRO 15 HD2 PRO 15 2.661 -0.708 -2.586
118 HD3 PRO 15 HD1 PRO 15 2.954 0.264 -4.043
119 H LEU 16 HN LEU 16 0.135 -1.219 -1.782
120 HA LEU 16 HA LEU 16 -2.606 -2.109 -1.486
121 HB2 LEU 16 HB2 LEU 16 -0.032 -2.244 0.031
122 HB3 LEU 16 HB1 LEU 16 -1.508 -2.510 0.956
123 HG LEU 16 HG LEU 16 -2.141 -4.144 -0.985
124 HD11 LEU 16 HD11 LEU 16 0.051 -5.236 -1.824
125 HD12 LEU 16 HD12 LEU 16 0.824 -3.720 -1.367
126 HD13 LEU 16 HD13 LEU 16 -0.452 -3.728 -2.584
127 HD21 LEU 16 HD21 LEU 16 -1.006 -5.981 0.189
128 HD22 LEU 16 HD22 LEU 16 -1.616 -4.811 1.358
129 HD23 LEU 16 HD23 LEU 16 0.099 -4.837 0.949
130 H LEU 17 HN LEU 17 -0.654 0.416 0.024
131 HA LEU 17 HA LEU 17 -2.674 1.406 1.836
132 HB2 LEU 17 HB2 LEU 17 -0.074 1.766 1.708
133 HB3 LEU 17 HB1 LEU 17 -0.465 3.044 0.566
134 HG LEU 17 HG LEU 17 -0.152 3.768 2.978
135 HD11 LEU 17 HD11 LEU 17 -1.601 4.900 1.095
136 HD12 LEU 17 HD12 LEU 17 -1.684 5.489 2.754
137 HD13 LEU 17 HD13 LEU 17 -2.949 4.431 2.131
138 HD21 LEU 17 HD21 LEU 17 -2.938 2.739 3.460
139 HD22 LEU 17 HD22 LEU 17 -1.711 3.217 4.633
140 HD23 LEU 17 HD23 LEU 17 -1.553 1.691 3.763
141 H LEU 18 HN LEU 18 -1.716 2.198 -1.476
142 HA LEU 18 HA LEU 18 -3.541 4.396 -1.890
143 HB2 LEU 18 HB2 LEU 18 -1.646 2.760 -3.384
144 HB3 LEU 18 HB1 LEU 18 -3.096 3.042 -4.339
145 HG LEU 18 HG LEU 18 -2.890 5.469 -3.961
146 HD11 LEU 18 HD11 LEU 18 -0.201 4.938 -2.694
147 HD12 LEU 18 HD12 LEU 18 -1.655 5.099 -1.712
148 HD13 LEU 18 HD13 LEU 18 -1.122 6.441 -2.723
149 HD21 LEU 18 HD21 LEU 18 -0.871 5.835 -5.314
150 HD22 LEU 18 HD22 LEU 18 -1.746 4.421 -5.903
151 HD23 LEU 18 HD23 LEU 18 -0.295 4.216 -4.920
152 H LEU 19 HN LEU 19 -3.766 0.861 -2.323
153 HA LEU 19 HA LEU 19 -6.417 0.830 -3.482
154 HB2 LEU 19 HB2 LEU 19 -4.334 -0.991 -2.775
155 HB3 LEU 19 HB1 LEU 19 -5.793 -1.549 -1.970
156 HG LEU 19 HG LEU 19 -6.771 -0.913 -4.451
157 HD11 LEU 19 HD11 LEU 19 -5.214 -1.768 -6.120
158 HD12 LEU 19 HD12 LEU 19 -4.020 -2.120 -4.870
159 HD13 LEU 19 HD13 LEU 19 -4.444 -0.449 -5.238
160 HD21 LEU 19 HD21 LEU 19 -6.562 -3.414 -4.884
161 HD22 LEU 19 HD22 LEU 19 -7.295 -2.984 -3.340
162 HD23 LEU 19 HD23 LEU 19 -5.614 -3.513 -3.401
163 H LEU 20 HN LEU 20 -5.106 0.677 -0.227
164 HA LEU 20 HA LEU 20 -7.592 0.179 1.186
165 HB2 LEU 20 HB2 LEU 20 -4.747 0.773 1.725
166 HB3 LEU 20 HB1 LEU 20 -5.836 1.395 2.955
167 HG LEU 20 HG LEU 20 -5.888 -1.464 1.949
168 HD11 LEU 20 HD11 LEU 20 -4.790 -2.004 4.117
169 HD12 LEU 20 HD12 LEU 20 -4.604 -0.278 4.429
170 HD13 LEU 20 HD13 LEU 20 -3.762 -1.025 3.071
171 HD21 LEU 20 HD21 LEU 20 -7.133 -1.739 4.174
172 HD22 LEU 20 HD22 LEU 20 -8.005 -0.872 2.910
173 HD23 LEU 20 HD23 LEU 20 -7.238 0.021 4.223
174 H LEU 21 HN LEU 21 -5.723 3.115 0.360
175 HA LEU 21 HA LEU 21 -7.285 5.023 1.805
176 HB2 LEU 21 HB2 LEU 21 -4.997 5.283 0.734
177 HB3 LEU 21 HB1 LEU 21 -5.820 5.419 -0.817
178 HG LEU 21 HG LEU 21 -6.869 7.180 1.328
179 HD11 LEU 21 HD11 LEU 21 -4.418 7.273 1.741
180 HD12 LEU 21 HD12 LEU 21 -5.045 8.800 1.119
181 HD13 LEU 21 HD13 LEU 21 -4.167 7.706 0.050
182 HD21 LEU 21 HD21 LEU 21 -5.958 7.854 -1.481
183 HD22 LEU 21 HD22 LEU 21 -7.153 8.696 -0.495
184 HD23 LEU 21 HD23 LEU 21 -7.522 7.106 -1.159
185 H ALA 22 HN ALA 22 -7.573 3.741 -1.475
186 HA ALA 22 HA ALA 22 -10.198 5.156 -1.808
187 HB1 ALA 22 HB1 ALA 22 -9.702 5.178 -4.125
188 HB2 ALA 22 HB2 ALA 22 -8.518 3.880 -3.971
189 HB3 ALA 22 HB3 ALA 22 -8.144 5.491 -3.361
190 H LEU 23 HN LEU 23 -9.999 2.701 -0.248
191 HA LEU 23 HA LEU 23 -10.767 0.465 -1.944
192 HB2 LEU 23 HB2 LEU 23 -10.491 -0.779 -0.016
193 HB3 LEU 23 HB1 LEU 23 -9.535 0.626 0.398
194 HG LEU 23 HG LEU 23 -11.869 1.495 1.364
195 HD11 LEU 23 HD11 LEU 23 -12.834 -0.805 0.486
196 HD12 LEU 23 HD12 LEU 23 -13.363 -0.162 2.039
197 HD13 LEU 23 HD13 LEU 23 -12.142 -1.431 1.983
198 HD21 LEU 23 HD21 LEU 23 -9.529 0.610 2.447
199 HD22 LEU 23 HD22 LEU 23 -10.658 -0.564 3.122
200 HD23 LEU 23 HD23 LEU 23 -10.904 1.158 3.408
201 HA PRO 24 HA PRO 24 -15.113 1.400 -1.866
202 HB2 PRO 24 HB2 PRO 24 -15.902 -0.778 -3.305
203 HB3 PRO 24 HB1 PRO 24 -15.064 0.608 -4.025
204 HG2 PRO 24 HG2 PRO 24 -14.087 -2.092 -3.534
205 HG3 PRO 24 HG1 PRO 24 -13.450 -0.840 -4.605
206 HD2 PRO 24 HD2 PRO 24 -12.506 -1.607 -1.998
207 HD3 PRO 24 HD1 PRO 24 -11.822 -0.402 -3.111
208 HA PRO 25 HA PRO 25 -16.041 -1.364 1.648
209 HB2 PRO 25 HB2 PRO 25 -17.862 0.269 2.847
210 HB3 PRO 25 HB1 PRO 25 -16.108 0.470 3.037
211 HG2 PRO 25 HG2 PRO 25 -18.004 1.999 1.356
212 HG3 PRO 25 HG1 PRO 25 -16.549 2.540 2.207
213 HD2 PRO 25 HD2 PRO 25 -16.691 2.043 -0.498
214 HD3 PRO 25 HD1 PRO 25 -15.198 2.048 0.463
215 H ARG 26 HN ARG 26 -17.747 -2.797 1.944
216 HA ARG 26 HA ARG 26 -20.408 -2.320 0.787
217 HB2 ARG 26 HB2 ARG 26 -18.990 -2.976 -1.140
218 HB3 ARG 26 HB1 ARG 26 -18.564 -4.469 -0.311
219 HG2 ARG 26 HG2 ARG 26 -20.348 -4.926 -1.901
220 HG3 ARG 26 HG1 ARG 26 -20.984 -5.089 -0.264
221 HD2 ARG 26 HD2 ARG 26 -21.482 -2.436 -0.730
222 HD3 ARG 26 HD1 ARG 26 -21.673 -3.111 -2.359
223 HE ARG 26 HE ARG 26 -23.492 -4.436 -1.581
224 HH11 ARG 26 HH21 ARG 26 -23.845 -1.914 0.175
225 HH12 ARG 26 HH22 ARG 26 -24.181 -2.641 1.709
226 HH21 ARG 26 HH11 ARG 26 -23.055 -5.798 0.741
227 HH22 ARG 26 HH12 ARG 26 -23.725 -4.862 2.033
228 H ALA 27 HN ALA 27 -18.448 -5.231 1.649
229 HA ALA 27 HA ALA 27 -20.128 -5.701 4.040
230 HB1 ALA 27 HB1 ALA 27 -21.496 -6.609 2.270
231 HB2 ALA 27 HB2 ALA 27 -20.770 -7.968 3.128
232 HB3 ALA 27 HB3 ALA 27 -20.117 -7.458 1.571
233 H TYR 28 HN TYR 28 -17.331 -5.192 3.806
234 HA TYR 28 HA TYR 28 -15.851 -7.718 3.892
235 HB2 TYR 28 HB2 TYR 28 -13.932 -6.284 4.253
236 HB3 TYR 28 HB1 TYR 28 -14.950 -5.558 3.019
237 HD1 TYR 28 HD1 TYR 28 -13.974 -5.390 6.607
238 HD2 TYR 28 HD2 TYR 28 -15.964 -3.407 3.357
239 HE1 TYR 28 HE1 TYR 28 -14.102 -3.314 7.950
240 HE2 TYR 28 HE2 TYR 28 -16.093 -1.330 4.701
241 HH TYR 28 HH TYR 28 -15.790 -1.177 7.887
242 H ALA 29 HN ALA 29 -17.437 -5.678 6.256
243 HA ALA 29 HA ALA 29 -17.871 -5.991 8.520
244 HB1 ALA 29 HB1 ALA 29 -17.740 -8.174 9.379
245 HB2 ALA 29 HB2 ALA 29 -16.307 -8.567 8.431
246 HB3 ALA 29 HB3 ALA 29 -17.880 -8.447 7.642
Start of MODEL 29
1 H1 ARG 1 HT1 ARG 1 18.876 -5.568 -8.908
2 H2 ARG 1 HT2 ARG 1 18.146 -7.083 -8.657
3 H3 ARG 1 HT3 ARG 1 19.534 -6.647 -7.781
4 HA ARG 1 HA ARG 1 18.298 -4.879 -6.652
5 HB2 ARG 1 HB2 ARG 1 16.823 -4.701 -8.752
6 HB3 ARG 1 HB1 ARG 1 15.898 -6.040 -8.072
7 HG2 ARG 1 HG2 ARG 1 14.715 -4.265 -7.179
8 HG3 ARG 1 HG1 ARG 1 15.911 -4.495 -5.905
9 HD2 ARG 1 HD2 ARG 1 16.204 -2.226 -6.239
10 HD3 ARG 1 HD1 ARG 1 17.303 -2.804 -7.506
11 HE ARG 1 HE ARG 1 15.623 -2.319 -9.158
12 HH11 ARG 1 HH11 ARG 1 15.350 0.017 -7.115
13 HH12 ARG 1 HH12 ARG 1 13.627 0.156 -7.036
14 HH21 ARG 1 HH21 ARG 1 13.055 -2.926 -8.564
15 HH22 ARG 1 HH22 ARG 1 12.317 -1.527 -7.864
16 H LEU 2 HN LEU 2 19.293 -6.733 -5.367
17 HA LEU 2 HA LEU 2 17.291 -8.750 -4.435
18 HB2 LEU 2 HB2 LEU 2 20.312 -8.521 -4.311
19 HB3 LEU 2 HB1 LEU 2 19.423 -9.763 -3.434
20 HG LEU 2 HG LEU 2 18.699 -9.495 -6.294
21 HD11 LEU 2 HD11 LEU 2 21.382 -10.641 -5.466
22 HD12 LEU 2 HD12 LEU 2 21.157 -9.140 -6.366
23 HD13 LEU 2 HD13 LEU 2 20.689 -10.679 -7.087
24 HD21 LEU 2 HD21 LEU 2 19.286 -11.736 -4.342
25 HD22 LEU 2 HD22 LEU 2 18.976 -12.034 -6.053
26 HD23 LEU 2 HD23 LEU 2 17.732 -11.293 -5.048
27 H VAL 3 HN VAL 3 16.220 -6.911 -3.227
28 HA VAL 3 HA VAL 3 17.619 -5.612 -1.033
29 HB VAL 3 HB VAL 3 15.298 -4.888 -0.399
30 HG11 VAL 3 HG11 VAL 3 16.650 -3.608 -1.997
31 HG12 VAL 3 HG12 VAL 3 14.941 -3.534 -2.422
32 HG13 VAL 3 HG13 VAL 3 16.026 -4.589 -3.322
33 HG21 VAL 3 HG21 VAL 3 13.408 -5.766 -1.338
34 HG22 VAL 3 HG22 VAL 3 14.434 -7.159 -1.672
35 HG23 VAL 3 HG23 VAL 3 14.158 -5.947 -2.923
36 HA PRO 4 HA PRO 4 17.018 -8.833 1.958
37 HB2 PRO 4 HB2 PRO 4 17.805 -7.443 4.169
38 HB3 PRO 4 HB1 PRO 4 18.929 -7.985 2.911
39 HG2 PRO 4 HG2 PRO 4 18.007 -5.291 3.532
40 HG3 PRO 4 HG1 PRO 4 19.421 -5.819 2.613
41 HD2 PRO 4 HD2 PRO 4 16.907 -4.858 1.618
42 HD3 PRO 4 HD1 PRO 4 18.353 -5.337 0.700
43 H GLY 5 HN GLY 5 14.512 -7.374 1.297
44 HA2 GLY 5 HA2 GLY 5 12.361 -7.661 2.331
45 HA3 GLY 5 HA1 GLY 5 13.145 -7.697 3.907
46 H ALA 6 HN ALA 6 14.724 -5.272 3.514
47 HA ALA 6 HA ALA 6 13.127 -3.266 4.584
48 HB1 ALA 6 HB1 ALA 6 15.512 -3.114 4.577
49 HB2 ALA 6 HB2 ALA 6 14.925 -1.736 3.645
50 HB3 ALA 6 HB3 ALA 6 15.570 -3.154 2.815
51 H ALA 7 HN ALA 7 13.870 -3.661 1.127
52 HA ALA 7 HA ALA 7 11.764 -1.649 0.459
53 HB1 ALA 7 HB1 ALA 7 14.345 -1.948 -0.386
54 HB2 ALA 7 HB2 ALA 7 13.097 -1.119 -1.314
55 HB3 ALA 7 HB3 ALA 7 13.476 -2.805 -1.658
56 H TYR 8 HN TYR 8 11.209 -4.527 1.271
57 HA TYR 8 HA TYR 8 9.929 -5.501 -1.254
58 HB2 TYR 8 HB2 TYR 8 11.692 -6.804 0.331
59 HB3 TYR 8 HB1 TYR 8 10.202 -7.227 1.167
60 HD1 TYR 8 HD1 TYR 8 8.402 -8.470 0.011
61 HD2 TYR 8 HD2 TYR 8 12.158 -7.632 -1.902
62 HE1 TYR 8 HE1 TYR 8 7.896 -10.161 -1.730
63 HE2 TYR 8 HE2 TYR 8 11.649 -9.323 -3.641
64 HH TYR 8 HH TYR 8 9.806 -11.638 -3.471
65 H ALA 9 HN ALA 9 9.444 -5.504 2.260
66 HA ALA 9 HA ALA 9 6.578 -5.835 2.162
67 HB1 ALA 9 HB1 ALA 9 8.451 -4.753 4.289
68 HB2 ALA 9 HB2 ALA 9 7.903 -6.423 4.130
69 HB3 ALA 9 HB3 ALA 9 6.758 -5.155 4.574
70 H LEU 10 HN LEU 10 8.692 -3.028 2.502
71 HA LEU 10 HA LEU 10 6.738 -0.976 2.862
72 HB2 LEU 10 HB2 LEU 10 9.505 -1.202 2.656
73 HB3 LEU 10 HB1 LEU 10 9.079 -0.261 1.230
74 HG LEU 10 HG LEU 10 7.895 0.460 3.898
75 HD11 LEU 10 HD11 LEU 10 9.766 1.776 4.492
76 HD12 LEU 10 HD12 LEU 10 10.490 1.627 2.891
77 HD13 LEU 10 HD13 LEU 10 10.469 0.241 3.982
78 HD21 LEU 10 HD21 LEU 10 7.069 1.493 1.775
79 HD22 LEU 10 HD22 LEU 10 8.698 2.091 1.463
80 HD23 LEU 10 HD23 LEU 10 7.796 2.676 2.861
81 H TYR 11 HN TYR 11 8.376 -2.042 -0.142
82 HA TYR 11 HA TYR 11 6.808 -0.445 -1.938
83 HB2 TYR 11 HB2 TYR 11 8.700 -2.751 -2.090
84 HB3 TYR 11 HB1 TYR 11 7.744 -2.386 -3.522
85 HD1 TYR 11 HD2 TYR 11 7.926 -0.163 -4.630
86 HD2 TYR 11 HD1 TYR 11 10.435 -1.258 -1.320
87 HE1 TYR 11 HE2 TYR 11 9.456 1.713 -5.166
88 HE2 TYR 11 HE1 TYR 11 11.965 0.617 -1.856
89 HH TYR 11 HH TYR 11 11.385 3.097 -3.337
90 H GLY 12 HN GLY 12 6.229 -3.570 -0.482
91 HA2 GLY 12 HA2 GLY 12 4.058 -4.266 -2.333
92 HA3 GLY 12 HA1 GLY 12 4.574 -5.209 -0.938
93 H VAL 13 HN VAL 13 4.342 -2.487 0.646
94 HA VAL 13 HA VAL 13 1.428 -2.796 1.198
95 HB VAL 13 HB VAL 13 3.822 -1.916 2.814
96 HG11 VAL 13 HG11 VAL 13 2.224 -0.423 3.656
97 HG12 VAL 13 HG12 VAL 13 2.021 -1.825 4.707
98 HG13 VAL 13 HG13 VAL 13 0.889 -1.544 3.384
99 HG21 VAL 13 HG21 VAL 13 1.779 -4.012 3.528
100 HG22 VAL 13 HG22 VAL 13 3.459 -3.879 4.049
101 HG23 VAL 13 HG23 VAL 13 3.085 -4.391 2.405
102 H TRP 14 HN TRP 14 3.853 -0.413 0.294
103 HA TRP 14 HA TRP 14 2.529 2.002 0.863
104 HB2 TRP 14 HB2 TRP 14 4.851 1.755 0.057
105 HB3 TRP 14 HB1 TRP 14 4.257 1.309 -1.526
106 HD1 TRP 14 HD1 TRP 14 5.196 3.349 -2.807
107 HE1 TRP 14 HE1 TRP 14 4.625 5.858 -2.834
108 HE3 TRP 14 HE3 TRP 14 2.249 3.645 1.366
109 HZ2 TRP 14 HZ2 TRP 14 3.123 7.744 -1.300
110 HZ3 TRP 14 HZ3 TRP 14 1.266 5.803 2.051
111 HH2 TRP 14 HH2 TRP 14 1.696 7.856 0.728
112 HA PRO 15 HA PRO 15 0.293 1.903 -3.383
113 HB2 PRO 15 HB2 PRO 15 0.227 -0.448 -4.780
114 HB3 PRO 15 HB1 PRO 15 1.494 0.776 -5.003
115 HG2 PRO 15 HG2 PRO 15 1.573 -1.757 -3.446
116 HG3 PRO 15 HG1 PRO 15 2.825 -1.010 -4.453
117 HD2 PRO 15 HD2 PRO 15 2.822 -0.875 -1.748
118 HD3 PRO 15 HD1 PRO 15 3.534 0.385 -2.777
119 H LEU 16 HN LEU 16 0.233 -0.999 -1.348
120 HA LEU 16 HA LEU 16 -2.519 -1.722 -1.795
121 HB2 LEU 16 HB2 LEU 16 -0.326 -2.323 0.128
122 HB3 LEU 16 HB1 LEU 16 -1.959 -2.615 0.717
123 HG LEU 16 HG LEU 16 -0.911 -4.618 -0.362
124 HD11 LEU 16 HD11 LEU 16 -3.309 -3.535 -1.864
125 HD12 LEU 16 HD12 LEU 16 -3.380 -4.295 -0.275
126 HD13 LEU 16 HD13 LEU 16 -2.865 -5.230 -1.677
127 HD21 LEU 16 HD21 LEU 16 -0.578 -4.673 -2.763
128 HD22 LEU 16 HD22 LEU 16 0.329 -3.304 -2.123
129 HD23 LEU 16 HD23 LEU 16 -1.212 -3.036 -2.935
130 H LEU 17 HN LEU 17 -0.912 0.363 0.573
131 HA LEU 17 HA LEU 17 -3.266 1.097 2.067
132 HB2 LEU 17 HB2 LEU 17 -0.499 2.202 1.634
133 HB3 LEU 17 HB1 LEU 17 -1.685 3.201 2.468
134 HG LEU 17 HG LEU 17 -1.092 0.352 3.300
135 HD11 LEU 17 HD11 LEU 17 0.302 1.390 5.103
136 HD12 LEU 17 HD12 LEU 17 0.145 2.943 4.282
137 HD13 LEU 17 HD13 LEU 17 0.986 1.609 3.493
138 HD21 LEU 17 HD21 LEU 17 -3.222 1.312 4.088
139 HD22 LEU 17 HD22 LEU 17 -2.369 2.729 4.700
140 HD23 LEU 17 HD23 LEU 17 -2.094 1.150 5.434
141 H LEU 18 HN LEU 18 -1.641 2.440 -0.756
142 HA LEU 18 HA LEU 18 -3.292 4.759 -1.169
143 HB2 LEU 18 HB2 LEU 18 -1.220 3.188 -2.532
144 HB3 LEU 18 HB1 LEU 18 -2.398 3.828 -3.669
145 HG LEU 18 HG LEU 18 -2.088 6.093 -2.599
146 HD11 LEU 18 HD11 LEU 18 0.308 4.758 -1.303
147 HD12 LEU 18 HD12 LEU 18 -1.169 5.187 -0.442
148 HD13 LEU 18 HD13 LEU 18 -0.167 6.449 -1.156
149 HD21 LEU 18 HD21 LEU 18 0.429 4.811 -3.714
150 HD22 LEU 18 HD22 LEU 18 0.050 6.532 -3.718
151 HD23 LEU 18 HD23 LEU 18 -0.911 5.418 -4.689
152 H LEU 19 HN LEU 19 -3.462 1.381 -2.297
153 HA LEU 19 HA LEU 19 -5.841 1.612 -3.907
154 HB2 LEU 19 HB2 LEU 19 -3.932 -0.340 -3.151
155 HB3 LEU 19 HB1 LEU 19 -5.485 -0.969 -2.617
156 HG LEU 19 HG LEU 19 -5.459 0.214 -5.337
157 HD11 LEU 19 HD11 LEU 19 -3.261 -1.025 -5.165
158 HD12 LEU 19 HD12 LEU 19 -4.369 -1.668 -6.377
159 HD13 LEU 19 HD13 LEU 19 -4.185 -2.489 -4.827
160 HD21 LEU 19 HD21 LEU 19 -6.840 -1.824 -5.758
161 HD22 LEU 19 HD22 LEU 19 -7.452 -0.867 -4.410
162 HD23 LEU 19 HD23 LEU 19 -6.536 -2.343 -4.101
163 H LEU 20 HN LEU 20 -5.218 0.854 -0.525
164 HA LEU 20 HA LEU 20 -7.869 0.179 0.324
165 HB2 LEU 20 HB2 LEU 20 -5.252 0.643 1.428
166 HB3 LEU 20 HB1 LEU 20 -6.425 1.521 2.401
167 HG LEU 20 HG LEU 20 -6.792 -1.376 1.613
168 HD11 LEU 20 HD11 LEU 20 -5.718 -0.305 4.238
169 HD12 LEU 20 HD12 LEU 20 -4.708 -1.007 2.973
170 HD13 LEU 20 HD13 LEU 20 -5.923 -1.997 3.783
171 HD21 LEU 20 HD21 LEU 20 -8.823 -1.035 2.536
172 HD22 LEU 20 HD22 LEU 20 -8.394 0.621 2.962
173 HD23 LEU 20 HD23 LEU 20 -8.028 -0.699 4.073
174 H LEU 21 HN LEU 21 -6.145 3.304 0.137
175 HA LEU 21 HA LEU 21 -8.144 4.952 1.343
176 HB2 LEU 21 HB2 LEU 21 -5.684 5.416 0.756
177 HB3 LEU 21 HB1 LEU 21 -6.242 5.716 -0.883
178 HG LEU 21 HG LEU 21 -5.954 7.748 0.667
179 HD11 LEU 21 HD11 LEU 21 -7.435 8.898 -0.629
180 HD12 LEU 21 HD12 LEU 21 -8.756 7.776 -0.312
181 HD13 LEU 21 HD13 LEU 21 -7.514 7.364 -1.496
182 HD21 LEU 21 HD21 LEU 21 -8.665 6.877 1.701
183 HD22 LEU 21 HD22 LEU 21 -7.692 8.246 2.237
184 HD23 LEU 21 HD23 LEU 21 -7.172 6.601 2.598
185 H ALA 22 HN ALA 22 -7.692 3.827 -1.964
186 HA ALA 22 HA ALA 22 -10.239 5.160 -2.805
187 HB1 ALA 22 HB1 ALA 22 -8.326 5.845 -4.093
188 HB2 ALA 22 HB2 ALA 22 -9.228 4.719 -5.107
189 HB3 ALA 22 HB3 ALA 22 -7.772 4.180 -4.272
190 H LEU 23 HN LEU 23 -10.640 2.905 -1.278
191 HA LEU 23 HA LEU 23 -11.230 0.728 -3.247
192 HB2 LEU 23 HB2 LEU 23 -9.546 0.383 -1.358
193 HB3 LEU 23 HB1 LEU 23 -10.924 0.456 -0.267
194 HG LEU 23 HG LEU 23 -11.553 -1.320 -2.436
195 HD11 LEU 23 HD11 LEU 23 -9.148 -1.633 -2.705
196 HD12 LEU 23 HD12 LEU 23 -9.848 -3.069 -1.959
197 HD13 LEU 23 HD13 LEU 23 -8.964 -1.905 -0.972
198 HD21 LEU 23 HD21 LEU 23 -11.667 -2.946 -0.465
199 HD22 LEU 23 HD22 LEU 23 -12.656 -1.494 -0.319
200 HD23 LEU 23 HD23 LEU 23 -11.125 -1.608 0.549
201 HA PRO 24 HA PRO 24 -15.421 1.715 -2.223
202 HB2 PRO 24 HB2 PRO 24 -16.583 -0.118 -3.888
203 HB3 PRO 24 HB1 PRO 24 -15.925 1.446 -4.392
204 HG2 PRO 24 HG2 PRO 24 -14.826 -1.249 -4.765
205 HG3 PRO 24 HG1 PRO 24 -14.574 0.220 -5.709
206 HD2 PRO 24 HD2 PRO 24 -12.799 -0.880 -3.832
207 HD3 PRO 24 HD1 PRO 24 -12.670 0.716 -4.578
208 HA PRO 25 HA PRO 25 -16.917 -2.422 -0.384
209 HB2 PRO 25 HB2 PRO 25 -15.200 -4.535 -0.174
210 HB3 PRO 25 HB1 PRO 25 -16.277 -4.296 -1.566
211 HG2 PRO 25 HG2 PRO 25 -13.379 -3.707 -1.298
212 HG3 PRO 25 HG1 PRO 25 -14.279 -4.356 -2.678
213 HD2 PRO 25 HD2 PRO 25 -13.487 -1.768 -2.506
214 HD3 PRO 25 HD1 PRO 25 -14.920 -2.300 -3.408
215 H ARG 26 HN ARG 26 -16.126 -3.797 1.715
216 HA ARG 26 HA ARG 26 -13.879 -2.641 3.180
217 HB2 ARG 26 HB2 ARG 26 -15.529 -1.786 5.013
218 HB3 ARG 26 HB1 ARG 26 -15.232 -0.787 3.599
219 HG2 ARG 26 HG2 ARG 26 -17.329 -1.936 2.590
220 HG3 ARG 26 HG1 ARG 26 -17.661 -2.463 4.239
221 HD2 ARG 26 HD2 ARG 26 -18.842 -0.406 4.025
222 HD3 ARG 26 HD1 ARG 26 -17.357 0.036 4.890
223 HE ARG 26 HE ARG 26 -16.888 0.205 2.055
224 HH11 ARG 26 HH21 ARG 26 -19.470 1.618 2.080
225 HH12 ARG 26 HH22 ARG 26 -19.037 3.241 2.498
226 HH21 ARG 26 HH11 ARG 26 -15.891 2.352 3.715
227 HH22 ARG 26 HH12 ARG 26 -16.987 3.660 3.429
228 H ALA 27 HN ALA 27 -16.982 -4.414 3.578
229 HA ALA 27 HA ALA 27 -17.518 -6.337 4.810
230 HB1 ALA 27 HB1 ALA 27 -15.945 -8.115 4.491
231 HB2 ALA 27 HB2 ALA 27 -14.597 -6.987 4.365
232 HB3 ALA 27 HB3 ALA 27 -15.804 -7.064 3.081
233 H TYR 28 HN TYR 28 -17.095 -4.244 6.559
234 HA TYR 28 HA TYR 28 -16.041 -5.639 8.941
235 HB2 TYR 28 HB2 TYR 28 -14.246 -4.245 7.530
236 HB3 TYR 28 HB1 TYR 28 -14.935 -2.906 8.449
237 HD1 TYR 28 HD2 TYR 28 -14.921 -2.963 10.951
238 HD2 TYR 28 HD1 TYR 28 -12.874 -5.905 8.582
239 HE1 TYR 28 HE2 TYR 28 -13.606 -3.647 12.936
240 HE2 TYR 28 HE1 TYR 28 -11.558 -6.590 10.567
241 HH TYR 28 HH TYR 28 -12.251 -6.235 13.441
242 H ALA 29 HN ALA 29 -17.086 -2.400 7.783
243 HA ALA 29 HA ALA 29 -18.661 -0.881 8.613
244 HB1 ALA 29 HB1 ALA 29 -20.684 -1.860 9.220
245 HB2 ALA 29 HB2 ALA 29 -19.909 -3.121 10.176
246 HB3 ALA 29 HB3 ALA 29 -19.888 -3.212 8.415
Start of MODEL 30
1 H1 ARG 1 HT1 ARG 1 24.691 3.068 8.334
2 H2 ARG 1 HT2 ARG 1 24.713 1.474 8.922
3 H3 ARG 1 HT3 ARG 1 23.314 2.424 9.081
4 HA ARG 1 HA ARG 1 23.048 2.475 6.654
5 HB2 ARG 1 HB2 ARG 1 25.630 0.936 6.939
6 HB3 ARG 1 HB1 ARG 1 24.632 0.748 5.500
7 HG2 ARG 1 HG2 ARG 1 25.327 2.719 4.661
8 HG3 ARG 1 HG1 ARG 1 24.953 3.559 6.163
9 HD2 ARG 1 HD2 ARG 1 27.220 3.833 6.314
10 HD3 ARG 1 HD1 ARG 1 27.226 2.147 6.862
11 HE ARG 1 HE ARG 1 27.657 1.458 4.526
12 HH11 ARG 1 HH21 ARG 1 26.681 3.843 3.059
13 HH12 ARG 1 HH22 ARG 1 28.145 4.662 2.635
14 HH21 ARG 1 HH11 ARG 1 30.085 2.919 4.953
15 HH22 ARG 1 HH12 ARG 1 30.094 4.133 3.720
16 H LEU 2 HN LEU 2 21.142 1.315 6.644
17 HA LEU 2 HA LEU 2 21.213 -1.623 7.004
18 HB2 LEU 2 HB2 LEU 2 20.890 -0.161 9.229
19 HB3 LEU 2 HB1 LEU 2 19.222 -0.142 8.672
20 HG LEU 2 HG LEU 2 19.677 -2.014 10.237
21 HD11 LEU 2 HD11 LEU 2 18.362 -3.536 9.110
22 HD12 LEU 2 HD12 LEU 2 19.243 -3.346 7.596
23 HD13 LEU 2 HD13 LEU 2 18.096 -2.109 8.109
24 HD21 LEU 2 HD21 LEU 2 22.093 -2.275 9.326
25 HD22 LEU 2 HD22 LEU 2 21.360 -3.274 8.071
26 HD23 LEU 2 HD23 LEU 2 21.215 -3.739 9.766
27 H VAL 3 HN VAL 3 19.764 -2.538 5.601
28 HA VAL 3 HA VAL 3 17.478 -0.875 4.614
29 HB VAL 3 HB VAL 3 17.845 -2.139 2.422
30 HG11 VAL 3 HG11 VAL 3 19.973 -0.235 3.426
31 HG12 VAL 3 HG12 VAL 3 18.453 0.198 2.644
32 HG13 VAL 3 HG13 VAL 3 19.708 -0.639 1.730
33 HG21 VAL 3 HG21 VAL 3 20.633 -2.604 3.522
34 HG22 VAL 3 HG22 VAL 3 19.961 -3.170 1.992
35 HG23 VAL 3 HG23 VAL 3 19.400 -3.867 3.511
36 HA PRO 4 HA PRO 4 15.339 -4.495 6.159
37 HB2 PRO 4 HB2 PRO 4 12.803 -3.561 5.752
38 HB3 PRO 4 HB1 PRO 4 13.817 -3.041 7.112
39 HG2 PRO 4 HG2 PRO 4 13.187 -1.633 4.585
40 HG3 PRO 4 HG1 PRO 4 13.450 -0.983 6.212
41 HD2 PRO 4 HD2 PRO 4 15.301 -0.924 4.175
42 HD3 PRO 4 HD1 PRO 4 15.687 -0.793 5.905
43 H GLY 5 HN GLY 5 16.105 -5.789 4.314
44 HA2 GLY 5 HA2 GLY 5 15.698 -7.192 2.467
45 HA3 GLY 5 HA1 GLY 5 14.013 -6.708 2.575
46 H ALA 6 HN ALA 6 16.669 -4.452 2.137
47 HA ALA 6 HA ALA 6 17.080 -2.854 0.460
48 HB1 ALA 6 HB1 ALA 6 16.251 -5.282 -1.163
49 HB2 ALA 6 HB2 ALA 6 17.884 -4.879 -0.637
50 HB3 ALA 6 HB3 ALA 6 17.069 -3.871 -1.831
51 H ALA 7 HN ALA 7 14.488 -2.674 1.659
52 HA ALA 7 HA ALA 7 12.435 -1.585 1.377
53 HB1 ALA 7 HB1 ALA 7 14.224 -0.216 -0.036
54 HB2 ALA 7 HB2 ALA 7 12.509 0.185 -0.105
55 HB3 ALA 7 HB3 ALA 7 13.240 -0.777 -1.388
56 H TYR 8 HN TYR 8 12.455 -4.384 0.696
57 HA TYR 8 HA TYR 8 10.812 -4.591 -1.775
58 HB2 TYR 8 HB2 TYR 8 12.520 -6.340 -0.146
59 HB3 TYR 8 HB1 TYR 8 11.016 -7.116 -0.621
60 HD1 TYR 8 HD2 TYR 8 13.939 -5.218 -1.977
61 HD2 TYR 8 HD1 TYR 8 10.690 -7.899 -2.827
62 HE1 TYR 8 HE2 TYR 8 14.829 -5.573 -4.262
63 HE2 TYR 8 HE1 TYR 8 11.582 -8.252 -5.112
64 HH TYR 8 HH TYR 8 14.324 -7.910 -6.090
65 H ALA 9 HN ALA 9 10.572 -5.143 1.714
66 HA ALA 9 HA ALA 9 7.716 -5.863 1.567
67 HB1 ALA 9 HB1 ALA 9 9.280 -6.923 3.162
68 HB2 ALA 9 HB2 ALA 9 7.981 -6.088 4.013
69 HB3 ALA 9 HB3 ALA 9 9.580 -5.354 3.906
70 H LEU 10 HN LEU 10 9.052 -2.988 1.033
71 HA LEU 10 HA LEU 10 7.114 -1.405 2.687
72 HB2 LEU 10 HB2 LEU 10 9.816 -1.288 2.724
73 HB3 LEU 10 HB1 LEU 10 9.518 -0.191 1.386
74 HG LEU 10 HG LEU 10 8.290 0.046 4.154
75 HD11 LEU 10 HD11 LEU 10 10.719 1.187 2.851
76 HD12 LEU 10 HD12 LEU 10 10.435 0.782 4.543
77 HD13 LEU 10 HD13 LEU 10 9.768 2.269 3.870
78 HD21 LEU 10 HD21 LEU 10 7.638 2.335 3.275
79 HD22 LEU 10 HD22 LEU 10 6.789 0.997 2.502
80 HD23 LEU 10 HD23 LEU 10 8.127 1.790 1.670
81 H TYR 11 HN TYR 11 8.907 -1.432 -0.400
82 HA TYR 11 HA TYR 11 7.384 0.467 -1.842
83 HB2 TYR 11 HB2 TYR 11 9.352 -1.655 -2.338
84 HB3 TYR 11 HB1 TYR 11 8.327 -1.316 -3.725
85 HD1 TYR 11 HD2 TYR 11 8.166 1.049 -4.607
86 HD2 TYR 11 HD1 TYR 11 11.009 -0.102 -1.601
87 HE1 TYR 11 HE2 TYR 11 9.472 3.110 -5.046
88 HE2 TYR 11 HE1 TYR 11 12.312 1.957 -2.040
89 HH TYR 11 HH TYR 11 12.307 3.636 -4.544
90 H GLY 12 HN GLY 12 6.645 -2.895 -1.181
91 HA2 GLY 12 HA2 GLY 12 4.430 -2.905 -3.155
92 HA3 GLY 12 HA1 GLY 12 5.005 -4.303 -2.250
93 H VAL 13 HN VAL 13 4.982 -2.963 0.355
94 HA VAL 13 HA VAL 13 2.171 -3.360 1.021
95 HB VAL 13 HB VAL 13 4.564 -2.466 2.656
96 HG11 VAL 13 HG11 VAL 13 2.802 -1.884 4.045
97 HG12 VAL 13 HG12 VAL 13 2.987 -3.583 4.481
98 HG13 VAL 13 HG13 VAL 13 1.718 -3.093 3.358
99 HG21 VAL 13 HG21 VAL 13 3.292 -5.169 2.130
100 HG22 VAL 13 HG22 VAL 13 4.433 -4.882 3.443
101 HG23 VAL 13 HG23 VAL 13 4.946 -4.676 1.770
102 H TRP 14 HN TRP 14 4.263 -0.558 0.587
103 HA TRP 14 HA TRP 14 2.703 1.448 1.845
104 HB2 TRP 14 HB2 TRP 14 4.994 1.748 0.976
105 HB3 TRP 14 HB1 TRP 14 4.406 1.595 -0.663
106 HD1 TRP 14 HD1 TRP 14 5.103 3.998 -1.381
107 HE1 TRP 14 HE1 TRP 14 4.172 6.340 -0.854
108 HE3 TRP 14 HE3 TRP 14 2.095 2.896 2.611
109 HZ2 TRP 14 HZ2 TRP 14 2.393 7.586 1.004
110 HZ3 TRP 14 HZ3 TRP 14 0.802 4.673 3.728
111 HH2 TRP 14 HH2 TRP 14 0.943 7.019 2.936
112 HA PRO 15 HA PRO 15 0.322 2.072 -2.292
113 HB2 PRO 15 HB2 PRO 15 0.493 0.109 -4.191
114 HB3 PRO 15 HB1 PRO 15 1.575 1.518 -4.146
115 HG2 PRO 15 HG2 PRO 15 2.059 -1.260 -3.202
116 HG3 PRO 15 HG1 PRO 15 3.148 -0.148 -4.048
117 HD2 PRO 15 HD2 PRO 15 3.294 -0.593 -1.390
118 HD3 PRO 15 HD1 PRO 15 3.737 0.961 -2.122
119 H LEU 16 HN LEU 16 0.676 -1.142 -0.851
120 HA LEU 16 HA LEU 16 -1.925 -2.190 -1.490
121 HB2 LEU 16 HB2 LEU 16 0.247 -2.698 0.504
122 HB3 LEU 16 HB1 LEU 16 -1.341 -3.361 0.875
123 HG LEU 16 HG LEU 16 0.104 -3.816 -1.751
124 HD11 LEU 16 HD11 LEU 16 0.159 -5.278 0.865
125 HD12 LEU 16 HD12 LEU 16 1.454 -5.026 -0.306
126 HD13 LEU 16 HD13 LEU 16 0.197 -6.220 -0.626
127 HD21 LEU 16 HD21 LEU 16 -1.588 -5.782 -1.737
128 HD22 LEU 16 HD22 LEU 16 -2.217 -4.174 -2.085
129 HD23 LEU 16 HD23 LEU 16 -2.427 -4.873 -0.480
130 H LEU 17 HN LEU 17 -0.715 -0.291 1.246
131 HA LEU 17 HA LEU 17 -3.235 -0.126 2.659
132 HB2 LEU 17 HB2 LEU 17 -0.549 1.176 2.730
133 HB3 LEU 17 HB1 LEU 17 -1.867 2.090 3.452
134 HG LEU 17 HG LEU 17 -0.786 0.721 5.155
135 HD11 LEU 17 HD11 LEU 17 -2.714 -0.194 6.120
136 HD12 LEU 17 HD12 LEU 17 -3.366 -0.713 4.567
137 HD13 LEU 17 HD13 LEU 17 -3.371 0.996 4.999
138 HD21 LEU 17 HD21 LEU 17 0.116 -1.023 3.662
139 HD22 LEU 17 HD22 LEU 17 -1.515 -1.634 3.382
140 HD23 LEU 17 HD23 LEU 17 -0.795 -1.742 4.988
141 H LEU 18 HN LEU 18 -1.636 1.816 0.202
142 HA LEU 18 HA LEU 18 -3.490 4.019 0.100
143 HB2 LEU 18 HB2 LEU 18 -1.260 2.867 -1.466
144 HB3 LEU 18 HB1 LEU 18 -2.452 3.697 -2.460
145 HG LEU 18 HG LEU 18 -2.276 5.643 -0.815
146 HD11 LEU 18 HD11 LEU 18 0.397 4.495 -0.073
147 HD12 LEU 18 HD12 LEU 18 -1.030 4.022 0.850
148 HD13 LEU 18 HD13 LEU 18 -0.561 5.718 0.758
149 HD21 LEU 18 HD21 LEU 18 -1.206 5.645 -3.053
150 HD22 LEU 18 HD22 LEU 18 0.217 4.863 -2.364
151 HD23 LEU 18 HD23 LEU 18 -0.220 6.498 -1.865
152 H LEU 19 HN LEU 19 -3.285 0.860 -1.534
153 HA LEU 19 HA LEU 19 -5.619 1.160 -3.213
154 HB2 LEU 19 HB2 LEU 19 -3.524 -0.694 -2.725
155 HB3 LEU 19 HB1 LEU 19 -5.019 -1.574 -2.437
156 HG LEU 19 HG LEU 19 -4.760 0.147 -4.888
157 HD11 LEU 19 HD11 LEU 19 -3.919 -2.753 -4.845
158 HD12 LEU 19 HD12 LEU 19 -2.752 -1.450 -4.615
159 HD13 LEU 19 HD13 LEU 19 -3.670 -1.557 -6.116
160 HD21 LEU 19 HD21 LEU 19 -6.410 -1.365 -5.763
161 HD22 LEU 19 HD22 LEU 19 -6.925 -0.968 -4.124
162 HD23 LEU 19 HD23 LEU 19 -6.147 -2.516 -4.454
163 H LEU 20 HN LEU 20 -4.994 -0.182 -0.016
164 HA LEU 20 HA LEU 20 -7.601 -1.226 0.593
165 HB2 LEU 20 HB2 LEU 20 -5.060 -0.568 1.939
166 HB3 LEU 20 HB1 LEU 20 -6.457 -0.413 2.994
167 HG LEU 20 HG LEU 20 -6.087 -2.859 1.271
168 HD11 LEU 20 HD11 LEU 20 -5.028 -3.933 3.263
169 HD12 LEU 20 HD12 LEU 20 -4.949 -2.351 4.038
170 HD13 LEU 20 HD13 LEU 20 -4.029 -2.658 2.565
171 HD21 LEU 20 HD21 LEU 20 -8.270 -2.636 2.273
172 HD22 LEU 20 HD22 LEU 20 -7.573 -2.202 3.833
173 HD23 LEU 20 HD23 LEU 20 -7.396 -3.843 3.214
174 H LEU 21 HN LEU 21 -6.096 1.977 1.175
175 HA LEU 21 HA LEU 21 -8.308 3.165 2.565
176 HB2 LEU 21 HB2 LEU 21 -5.809 3.897 2.231
177 HB3 LEU 21 HB1 LEU 21 -6.418 4.680 0.774
178 HG LEU 21 HG LEU 21 -8.205 5.743 2.301
179 HD11 LEU 21 HD11 LEU 21 -7.413 6.003 4.676
180 HD12 LEU 21 HD12 LEU 21 -6.205 4.759 4.357
181 HD13 LEU 21 HD13 LEU 21 -7.922 4.365 4.271
182 HD21 LEU 21 HD21 LEU 21 -5.293 6.494 2.727
183 HD22 LEU 21 HD22 LEU 21 -6.683 7.562 2.921
184 HD23 LEU 21 HD23 LEU 21 -6.256 6.953 1.322
185 H ALA 22 HN ALA 22 -7.528 2.808 -0.843
186 HA ALA 22 HA ALA 22 -9.899 4.381 -1.696
187 HB1 ALA 22 HB1 ALA 22 -8.875 3.852 -3.968
188 HB2 ALA 22 HB2 ALA 22 -7.570 3.042 -3.104
189 HB3 ALA 22 HB3 ALA 22 -7.836 4.771 -2.880
190 H LEU 23 HN LEU 23 -10.269 1.806 -0.239
191 HA LEU 23 HA LEU 23 -11.676 0.236 -2.375
192 HB2 LEU 23 HB2 LEU 23 -9.443 -0.389 -0.847
193 HB3 LEU 23 HB1 LEU 23 -10.758 -1.242 -0.065
194 HG LEU 23 HG LEU 23 -9.686 -2.651 -1.785
195 HD11 LEU 23 HD11 LEU 23 -12.121 -2.890 -1.350
196 HD12 LEU 23 HD12 LEU 23 -11.693 -3.296 -3.011
197 HD13 LEU 23 HD13 LEU 23 -12.445 -1.742 -2.648
198 HD21 LEU 23 HD21 LEU 23 -9.133 -0.516 -3.196
199 HD22 LEU 23 HD22 LEU 23 -10.728 -0.778 -3.902
200 HD23 LEU 23 HD23 LEU 23 -9.487 -2.025 -4.036
201 HA PRO 24 HA PRO 24 -14.398 1.454 1.344
202 HB2 PRO 24 HB2 PRO 24 -16.060 3.159 0.001
203 HB3 PRO 24 HB1 PRO 24 -14.561 3.689 0.793
204 HG2 PRO 24 HG2 PRO 24 -15.071 3.121 -2.084
205 HG3 PRO 24 HG1 PRO 24 -14.117 4.416 -1.340
206 HD2 PRO 24 HD2 PRO 24 -12.976 2.181 -2.414
207 HD3 PRO 24 HD1 PRO 24 -12.265 3.074 -1.060
208 HA PRO 25 HA PRO 25 -17.331 -1.560 -0.111
209 HB2 PRO 25 HB2 PRO 25 -19.293 -1.243 1.754
210 HB3 PRO 25 HB1 PRO 25 -17.751 -2.054 2.100
211 HG2 PRO 25 HG2 PRO 25 -18.604 0.720 2.744
212 HG3 PRO 25 HG1 PRO 25 -17.656 -0.423 3.708
213 HD2 PRO 25 HD2 PRO 25 -16.551 1.634 2.328
214 HD3 PRO 25 HD1 PRO 25 -15.699 0.111 2.662
215 H ARG 26 HN ARG 26 -19.170 -1.611 -1.414
216 HA ARG 26 HA ARG 26 -20.436 1.022 -2.060
217 HB2 ARG 26 HB2 ARG 26 -19.895 -1.540 -3.554
218 HB3 ARG 26 HB1 ARG 26 -21.095 -0.393 -4.147
219 HG2 ARG 26 HG2 ARG 26 -18.835 1.159 -3.474
220 HG3 ARG 26 HG1 ARG 26 -18.208 -0.253 -4.321
221 HD2 ARG 26 HD2 ARG 26 -18.689 1.125 -6.135
222 HD3 ARG 26 HD1 ARG 26 -20.246 0.289 -5.979
223 HE ARG 26 HE ARG 26 -20.715 2.329 -4.309
224 HH11 ARG 26 HH11 ARG 26 -21.691 2.660 -7.093
225 HH12 ARG 26 HH12 ARG 26 -20.936 4.136 -7.586
226 HH21 ARG 26 HH21 ARG 26 -18.574 4.081 -5.027
227 HH22 ARG 26 HH22 ARG 26 -19.155 4.948 -6.407
228 H ALA 27 HN ALA 27 -21.425 -0.138 0.245
229 HA ALA 27 HA ALA 27 -23.970 -1.517 -0.518
230 HB1 ALA 27 HB1 ALA 27 -24.005 -2.083 1.912
231 HB2 ALA 27 HB2 ALA 27 -22.506 -1.177 2.120
232 HB3 ALA 27 HB3 ALA 27 -22.527 -2.631 1.120
233 H TYR 28 HN TYR 28 -23.158 1.533 -0.489
234 HA TYR 28 HA TYR 28 -25.735 2.588 0.240
235 HB2 TYR 28 HB2 TYR 28 -24.988 3.947 2.178
236 HB3 TYR 28 HB1 TYR 28 -24.860 2.227 2.504
237 HD1 TYR 28 HD2 TYR 28 -22.600 1.111 2.435
238 HD2 TYR 28 HD1 TYR 28 -23.066 5.372 2.147
239 HE1 TYR 28 HE2 TYR 28 -20.206 1.412 2.986
240 HE2 TYR 28 HE1 TYR 28 -20.669 5.671 2.701
241 HH TYR 28 HH TYR 28 -18.430 3.477 2.418
242 H ALA 29 HN ALA 29 -22.273 3.334 -0.280
243 HA ALA 29 HA ALA 29 -23.045 5.841 -1.721
244 HB1 ALA 29 HB1 ALA 29 -20.542 4.846 -0.342
245 HB2 ALA 29 HB2 ALA 29 -21.533 6.244 0.084
246 HB3 ALA 29 HB3 ALA 29 -20.541 6.276 -1.375
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