Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
525514 | 2l8x RC | 17430 | cing | 1-original | 8 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 H1 ARG 1 HN ARG 1 9.910 -6.875 1.330
2 HA ARG 1 HA ARG 1 7.115 -6.353 1.827
3 HB2 ARG 1 HB2 ARG 1 9.243 -8.047 3.187
4 HB3 ARG 1 HB3 ARG 1 7.767 -7.649 4.044
5 HG2 ARG 1 HG2 ARG 1 7.840 -9.864 2.647
6 HG3 ARG 1 HG3 ARG 1 6.402 -8.866 2.554
7 HD2 ARG 1 HD2 ARG 1 7.210 -7.838 0.446
8 HD3 ARG 1 HD3 ARG 1 8.713 -8.731 0.556
9 HE ARG 1 HE ARG 1 6.598 -10.628 0.676
10 HH11 ARG 1 HH22 ARG 1 7.975 -8.337 -1.650
11 HH12 ARG 1 HH21 ARG 1 7.493 -9.261 -3.033
12 HH22 ARG 1 HH1 ARG 1 6.310 -11.321 -2.715
13 H TRP 2 HN TRP 2 6.459 -5.292 3.906
14 HA TRP 2 HA TRP 2 8.479 -3.322 4.723
15 HB2 TRP 2 HB2 TRP 2 5.578 -2.938 5.280
16 HB3 TRP 2 HB3 TRP 2 6.836 -1.756 4.977
17 HD1 TRP 2 HD1 TRP 2 3.849 -2.499 3.357
18 HE1 TRP 2 HE1 TRP 2 3.837 -2.350 0.722
19 HE3 TRP 2 HE3 TRP 2 8.896 -2.757 2.794
20 HZ2 TRP 2 HZ2 TRP 2 5.893 -2.356 -1.257
21 HZ3 TRP 2 HZ3 TRP 2 9.812 -2.678 0.476
22 HH2 TRP 2 HH2 TRP 2 8.399 -2.485 -1.508
23 H CYS 3 HN CYS 3 9.226 -3.442 6.809
24 HA CYS 3 HA CYS 3 7.572 -4.912 8.716
25 HB2 CYS 3 HB2 CYS 3 10.414 -5.460 7.958
26 HB3 CYS 3 HB3 CYS 3 9.925 -5.690 9.624
27 H VAL 4 HN VAL 4 8.748 -4.514 11.047
28 HA VAL 4 HA VAL 4 9.976 -1.899 11.171
29 HB VAL 4 HB VAL 4 8.316 -0.771 12.229
30 HG11 VAL 4 HG11 VAL 4 6.115 -1.249 11.151
31 HG12 VAL 4 HG12 VAL 4 7.477 -1.210 10.006
32 HG13 VAL 4 HG13 VAL 4 6.794 -2.770 10.525
33 HG21 VAL 4 HG21 VAL 4 6.310 -2.056 13.300
34 HG22 VAL 4 HG22 VAL 4 7.402 -3.460 13.231
35 HG23 VAL 4 HG23 VAL 4 7.875 -2.009 14.147
36 H TYR 5 HN TYR 5 11.476 -1.860 12.791
37 HA TYR 5 HA TYR 5 11.246 -3.981 14.819
38 HB2 TYR 5 HB2 TYR 5 13.445 -2.968 12.981
39 HB3 TYR 5 HB3 TYR 5 13.939 -3.463 14.587
40 HD1 TYR 5 HD1 TYR 5 12.084 -5.783 15.031
41 HD2 TYR 5 HD2 TYR 5 14.362 -4.633 11.597
42 HE1 TYR 5 HE1 TYR 5 12.154 -8.204 14.258
43 HE2 TYR 5 HE2 TYR 5 14.424 -7.058 10.835
44 HH TYR 5 HH TYR 5 12.624 -9.543 12.585
45 H ALA 6 HN ALA 6 11.278 -3.283 16.904
46 HA ALA 6 HA ALA 6 12.401 -0.610 17.380
47 HB1 ALA 6 HB1 ALA 6 10.347 -1.081 19.270
48 HB2 ALA 6 HB2 ALA 6 10.335 0.088 17.927
49 HB3 ALA 6 HB3 ALA 6 9.673 -1.547 17.690
50 H TYR 7 HN TYR 7 13.405 -0.325 19.461
51 HA TYR 7 HA TYR 7 13.617 -2.684 21.139
52 HB2 TYR 7 HB2 TYR 7 15.420 -2.843 19.369
53 HB3 TYR 7 HB3 TYR 7 15.916 -1.200 19.720
54 HD1 TYR 7 HD1 TYR 7 16.661 -0.747 22.221
55 HD2 TYR 7 HD2 TYR 7 16.546 -4.612 20.390
56 HE1 TYR 7 HE1 TYR 7 18.314 -1.621 23.944
57 HE2 TYR 7 HE2 TYR 7 18.200 -5.472 22.119
58 HH TYR 7 HH TYR 7 19.855 -3.323 24.255
59 H VAL 8 HN VAL 8 13.212 -1.938 23.156
60 HA VAL 8 HA VAL 8 14.274 0.726 23.807
61 HB VAL 8 HB VAL 8 11.832 -0.589 24.999
62 HG11 VAL 8 HG11 VAL 8 13.367 1.737 25.662
63 HG12 VAL 8 HG12 VAL 8 11.767 2.260 25.082
64 HG13 VAL 8 HG13 VAL 8 11.891 1.112 26.438
65 HG21 VAL 8 HG21 VAL 8 12.149 0.967 22.478
66 HG22 VAL 8 HG22 VAL 8 10.962 -0.285 22.916
67 HG23 VAL 8 HG23 VAL 8 10.762 1.379 23.515
68 H ARG 9 HN ARG 9 15.579 0.889 25.599
69 HA ARG 9 HA ARG 9 15.564 -1.311 27.447
70 HB2 ARG 9 HB2 ARG 9 17.312 -2.197 26.146
71 HB3 ARG 9 HB3 ARG 9 17.861 -0.620 25.614
72 HG2 ARG 9 HG2 ARG 9 18.842 -0.146 27.812
73 HG3 ARG 9 HG3 ARG 9 18.139 -1.601 28.492
74 HD2 ARG 9 HD2 ARG 9 19.938 -2.814 27.825
75 HD3 ARG 9 HD3 ARG 9 19.644 -2.376 26.154
76 HE ARG 9 HE ARG 9 20.851 -0.112 27.051
77 HH11 ARG 9 HH22 ARG 9 21.731 -3.513 27.514
78 HH12 ARG 9 HH21 ARG 9 23.427 -3.185 27.642
79 HH22 ARG 9 HH1 ARG 9 24.203 -0.924 27.466
80 H ILE 10 HN ILE 10 15.497 -0.372 29.465
81 HA ILE 10 HA ILE 10 17.231 1.873 30.010
82 HB ILE 10 HB ILE 10 14.357 2.257 30.716
83 HG12 ILE 10 HG12 ILE 10 15.537 3.006 28.024
84 HG13 ILE 10 HG13 ILE 10 14.361 1.735 28.294
85 HG21 ILE 10 HG21 ILE 10 16.760 3.683 31.075
86 HG22 ILE 10 HG22 ILE 10 15.813 4.594 29.875
87 HG23 ILE 10 HG23 ILE 10 15.104 4.208 31.461
88 HD11 ILE 10 HD11 ILE 10 13.994 4.694 28.310
89 HD12 ILE 10 HD12 ILE 10 12.854 3.408 27.847
90 HD13 ILE 10 HD13 ILE 10 13.099 3.804 29.565
91 H ARG 11 HN ARG 11 17.496 2.232 32.329
92 HA ARG 11 HA ARG 11 17.786 1.547 34.356
93 HB2 ARG 11 HB2 ARG 11 15.012 0.502 33.793
94 HB3 ARG 11 HB3 ARG 11 15.792 -0.057 35.259
95 HG2 ARG 11 HG2 ARG 11 15.137 1.876 36.249
96 HG3 ARG 11 HG3 ARG 11 16.309 2.711 35.249
97 HD2 ARG 11 HD2 ARG 11 14.689 3.324 33.622
98 HD3 ARG 11 HD3 ARG 11 13.578 2.057 34.103
99 HE ARG 11 HE ARG 11 13.890 3.727 36.362
100 HH11 ARG 11 HH22 ARG 11 12.650 4.028 33.057
101 HH12 ARG 11 HH21 ARG 11 11.521 5.277 33.462
102 HH22 ARG 11 HH1 ARG 11 11.391 6.053 35.726
103 H GLY 12 HN GLY 12 15.957 -1.422 33.383
104 HA2 GLY 12 HA1 GLY 12 18.361 -2.960 32.959
105 HA3 GLY 12 HA2 GLY 12 17.563 -3.305 34.480
106 H VAL 13 HN VAL 13 15.678 -2.192 31.680
107 HA VAL 13 HA VAL 13 14.710 -4.946 31.338
108 HB VAL 13 HB VAL 13 13.136 -2.364 31.317
109 HG11 VAL 13 HG11 VAL 13 11.158 -3.931 31.126
110 HG12 VAL 13 HG12 VAL 13 12.172 -3.795 29.670
111 HG13 VAL 13 HG13 VAL 13 12.317 -5.221 30.725
112 HG21 VAL 13 HG21 VAL 13 13.621 -4.468 33.364
113 HG22 VAL 13 HG22 VAL 13 13.264 -2.735 33.557
114 HG23 VAL 13 HG23 VAL 13 11.949 -3.880 33.203
115 H LEU 14 HN LEU 14 13.925 -5.456 29.156
116 HA LEU 14 HA LEU 14 14.778 -3.556 27.114
117 HB2 LEU 14 HB2 LEU 14 16.716 -4.926 27.438
118 HB3 LEU 14 HB3 LEU 14 15.763 -6.396 27.376
119 HG LEU 14 HG LEU 14 15.539 -6.340 25.080
120 HD11 LEU 14 HD11 LEU 14 14.519 -4.257 24.695
121 HD12 LEU 14 HD12 LEU 14 15.943 -3.354 25.268
122 HD13 LEU 14 HD13 LEU 14 16.009 -4.233 23.721
123 HD21 LEU 14 HD21 LEU 14 17.766 -5.711 24.110
124 HD22 LEU 14 HD22 LEU 14 18.198 -5.034 25.699
125 HD23 LEU 14 HD23 LEU 14 17.840 -6.770 25.540
126 H VAL 15 HN VAL 15 12.962 -3.172 25.971
127 HA VAL 15 HA VAL 15 11.176 -5.465 25.536
128 HB VAL 15 HB VAL 15 10.294 -2.619 25.283
129 HG11 VAL 15 HG11 VAL 15 8.539 -4.526 26.628
130 HG12 VAL 15 HG12 VAL 15 8.248 -3.524 25.186
131 HG13 VAL 15 HG13 VAL 15 9.058 -5.101 25.026
132 HG21 VAL 15 HG21 VAL 15 11.184 -3.924 27.782
133 HG22 VAL 15 HG22 VAL 15 10.977 -2.199 27.394
134 HG23 VAL 15 HG23 VAL 15 9.566 -3.184 27.851
135 H ARG 16 HN ARG 16 12.072 -6.275 23.627
136 HA ARG 16 HA ARG 16 12.604 -4.387 21.533
137 HB2 ARG 16 HB2 ARG 16 12.997 -7.393 21.841
138 HB3 ARG 16 HB3 ARG 16 13.223 -6.612 20.289
139 HG2 ARG 16 HG2 ARG 16 14.841 -4.992 21.471
140 HG3 ARG 16 HG3 ARG 16 14.739 -6.039 22.873
141 HD2 ARG 16 HD2 ARG 16 16.706 -6.663 21.536
142 HD3 ARG 16 HD3 ARG 16 15.539 -7.970 21.489
143 HE ARG 16 HE ARG 16 16.254 -6.168 19.253
144 HH11 ARG 16 HH22 ARG 16 14.071 -8.689 20.452
145 HH12 ARG 16 HH21 ARG 16 13.526 -9.142 18.872
146 HH22 ARG 16 HH1 ARG 16 14.400 -7.999 16.956
147 H TYR 17 HN TYR 17 10.736 -3.654 20.515
148 HA TYR 17 HA TYR 17 8.545 -5.514 20.106
149 HB2 TYR 17 HB2 TYR 17 8.727 -2.872 20.788
150 HB3 TYR 17 HB3 TYR 17 8.765 -2.665 19.048
151 HD1 TYR 17 HD1 TYR 17 6.712 -3.804 21.901
152 HD2 TYR 17 HD2 TYR 17 6.788 -3.013 17.697
153 HE1 TYR 17 HE1 TYR 17 4.174 -3.929 21.825
154 HE2 TYR 17 HE2 TYR 17 4.249 -3.141 17.635
155 HH TYR 17 HH TYR 17 2.473 -4.334 19.068
156 H ARG 18 HN ARG 18 7.519 -5.755 17.964
157 HA ARG 18 HA ARG 18 9.161 -5.029 15.737
158 HB2 ARG 18 HB2 ARG 18 8.903 -7.559 14.932
159 HB3 ARG 18 HB3 ARG 18 10.244 -7.094 15.959
160 HG2 ARG 18 HG2 ARG 18 8.793 -7.737 17.976
161 HG3 ARG 18 HG3 ARG 18 7.631 -8.399 16.844
162 HD2 ARG 18 HD2 ARG 18 10.557 -9.252 16.812
163 HD3 ARG 18 HD3 ARG 18 9.380 -10.040 17.843
164 HE ARG 18 HE ARG 18 8.187 -10.037 15.319
165 HH11 ARG 18 HH22 ARG 18 11.233 -11.265 16.647
166 HH12 ARG 18 HH21 ARG 18 11.347 -12.567 15.510
167 HH22 ARG 18 HH1 ARG 18 9.633 -12.836 13.857
168 H ARG 19 HN ARG 19 7.992 -6.000 13.606
169 HA ARG 19 HA ARG 19 5.364 -6.760 13.748
170 HB2 ARG 19 HB2 ARG 19 5.316 -4.250 14.632
171 HB3 ARG 19 HB3 ARG 19 5.480 -3.836 12.937
172 HG2 ARG 19 HG2 ARG 19 3.381 -5.868 13.688
173 HG3 ARG 19 HG3 ARG 19 3.069 -4.190 14.084
174 HD2 ARG 19 HD2 ARG 19 4.052 -4.104 11.432
175 HD3 ARG 19 HD3 ARG 19 3.018 -5.519 11.461
176 HE ARG 19 HE ARG 19 1.140 -4.138 11.815
177 HH11 ARG 19 HH22 ARG 19 4.105 -2.243 12.224
178 HH12 ARG 19 HH21 ARG 19 3.275 -0.723 12.267
179 HH22 ARG 19 HH1 ARG 19 0.888 -0.683 12.057
180 H CYS 20 HN CYS 20 4.394 -6.909 11.550
181 HA CYS 20 HA CYS 20 6.040 -5.969 9.376
182 HB2 CYS 20 HB2 CYS 20 5.684 -8.895 9.997
183 HB3 CYS 20 HB3 CYS 20 5.975 -8.332 8.364
184 H TRP 21 HN TRP 21 4.837 -6.221 7.274
185 HA TRP 21 HA TRP 21 1.949 -6.438 7.783
186 HB2 TRP 21 HB2 TRP 21 3.586 -4.576 6.126
187 HB3 TRP 21 HB3 TRP 21 2.002 -5.034 5.532
188 HD1 TRP 21 HD1 TRP 21 -0.079 -4.569 7.500
189 HE1 TRP 21 HE1 TRP 21 -0.468 -2.486 9.073
190 HE3 TRP 21 HE3 TRP 21 4.698 -2.841 7.271
191 HZ2 TRP 21 HZ2 TRP 21 1.227 -0.397 10.023
192 HZ3 TRP 21 HZ3 TRP 21 5.247 -0.773 8.551
193 HH2 TRP 21 HH2 TRP 21 3.603 0.439 9.893
194 H1 ARG 31 HN ARG 31 7.232 -0.638 3.436
195 HA ARG 31 HA ARG 31 9.506 1.093 3.680
196 HB2 ARG 31 HB2 ARG 31 6.851 0.895 5.179
197 HB3 ARG 31 HB3 ARG 31 8.101 2.034 5.639
198 HG2 ARG 31 HG2 ARG 31 6.872 3.375 4.188
199 HG3 ARG 31 HG3 ARG 31 8.026 2.701 3.054
200 HD2 ARG 31 HD2 ARG 31 5.783 2.503 2.094
201 HD3 ARG 31 HD3 ARG 31 6.370 0.895 2.471
202 HE ARG 31 HE ARG 31 4.878 2.056 4.690
203 HH11 ARG 31 HH22 ARG 31 4.524 0.344 1.607
204 HH12 ARG 31 HH21 ARG 31 2.976 -0.319 2.012
205 HH22 ARG 31 HH1 ARG 31 2.003 0.186 4.143
206 H TRP 32 HN TRP 32 10.544 1.387 5.910
207 HA TRP 32 HA TRP 32 10.392 -1.031 7.546
208 HB2 TRP 32 HB2 TRP 32 12.741 -0.078 5.998
209 HB3 TRP 32 HB3 TRP 32 13.040 -0.603 7.643
210 HD1 TRP 32 HD1 TRP 32 12.066 -1.998 4.212
211 HE1 TRP 32 HE1 TRP 32 12.149 -4.635 4.176
212 HE3 TRP 32 HE3 TRP 32 12.720 -2.570 9.222
213 HZ2 TRP 32 HZ2 TRP 32 12.471 -6.620 6.201
214 HZ3 TRP 32 HZ3 TRP 32 12.910 -4.891 10.111
215 HH2 TRP 32 HH2 TRP 32 12.795 -6.875 8.689
216 H CYS 33 HN CYS 33 9.572 -0.102 9.397
217 HA CYS 33 HA CYS 33 10.457 2.550 10.114
218 HB2 CYS 33 HB2 CYS 33 8.251 0.734 10.924
219 HB3 CYS 33 HB3 CYS 33 8.848 1.836 12.148
220 H VAL 34 HN VAL 34 11.446 2.984 12.248
221 HA VAL 34 HA VAL 34 12.429 0.694 13.711
222 HB VAL 34 HB VAL 34 14.715 1.120 13.436
223 HG11 VAL 34 HG11 VAL 34 13.470 1.461 10.686
224 HG12 VAL 34 HG12 VAL 34 15.105 0.853 11.039
225 HG13 VAL 34 HG13 VAL 34 13.680 -0.084 11.546
226 HG21 VAL 34 HG21 VAL 34 15.610 3.031 12.115
227 HG22 VAL 34 HG22 VAL 34 13.955 3.672 11.976
228 HG23 VAL 34 HG23 VAL 34 14.727 3.540 13.574
229 H TYR 35 HN TYR 35 12.155 1.163 15.828
230 HA TYR 35 HA TYR 35 12.661 3.894 16.706
231 HB2 TYR 35 HB2 TYR 35 10.120 3.129 16.051
232 HB3 TYR 35 HB3 TYR 35 10.189 2.366 17.627
233 HD1 TYR 35 HD1 TYR 35 10.556 3.783 19.679
234 HD2 TYR 35 HD2 TYR 35 9.823 5.492 15.826
235 HE1 TYR 35 HE1 TYR 35 9.938 5.995 20.770
236 HE2 TYR 35 HE2 TYR 35 9.207 7.698 16.930
237 HH TYR 35 HH TYR 35 9.902 8.804 19.252
238 H ALA 36 HN ALA 36 14.106 3.692 18.337
239 HA ALA 36 HA ALA 36 13.620 1.551 20.277
240 HB1 ALA 36 HB1 ALA 36 15.368 0.595 19.036
241 HB2 ALA 36 HB2 ALA 36 16.141 2.169 18.729
242 HB3 ALA 36 HB3 ALA 36 16.228 1.435 20.348
243 H TYR 37 HN TYR 37 14.764 2.014 22.394
244 HA TYR 37 HA TYR 37 15.467 4.804 22.775
245 HB2 TYR 37 HB2 TYR 37 12.883 4.295 23.031
246 HB3 TYR 37 HB3 TYR 37 13.330 3.340 24.431
247 HD1 TYR 37 HD1 TYR 37 14.491 4.493 26.384
248 HD2 TYR 37 HD2 TYR 37 12.662 6.655 23.177
249 HE1 TYR 37 HE1 TYR 37 14.417 6.586 27.827
250 HE2 TYR 37 HE2 TYR 37 12.595 8.740 24.630
251 HH TYR 37 HH TYR 37 12.673 9.414 26.811
252 H VAL 38 HN VAL 38 17.574 3.730 23.120
253 HA VAL 38 HA VAL 38 17.677 2.147 25.576
254 HB VAL 38 HB VAL 38 19.682 2.635 23.366
255 HG11 VAL 38 HG11 VAL 38 20.812 0.615 24.610
256 HG12 VAL 38 HG12 VAL 38 21.081 2.281 25.174
257 HG13 VAL 38 HG13 VAL 38 19.911 1.235 26.015
258 HG21 VAL 38 HG21 VAL 38 19.276 0.001 23.285
259 HG22 VAL 38 HG22 VAL 38 17.699 0.478 23.958
260 HG23 VAL 38 HG23 VAL 38 18.239 1.144 22.398
261 H ARG 39 HN ARG 39 18.829 2.823 27.398
262 HA ARG 39 HA ARG 39 20.164 5.372 27.171
263 HB2 ARG 39 HB2 ARG 39 17.718 5.682 27.953
264 HB3 ARG 39 HB3 ARG 39 18.163 4.819 29.412
265 HG2 ARG 39 HG2 ARG 39 20.020 6.530 29.771
266 HG3 ARG 39 HG3 ARG 39 19.389 7.429 28.406
267 HD2 ARG 39 HD2 ARG 39 17.840 8.408 29.745
268 HD3 ARG 39 HD3 ARG 39 17.161 6.839 30.133
269 HE ARG 39 HE ARG 39 19.320 6.859 31.782
270 HH11 ARG 39 HH22 ARG 39 16.896 9.367 31.156
271 HH12 ARG 39 HH21 ARG 39 17.028 10.063 32.736
272 HH22 ARG 39 HH1 ARG 39 18.561 9.112 34.314
273 H ILE 40 HN ILE 40 21.997 5.503 28.523
274 HA ILE 40 HA ILE 40 22.231 3.652 30.729
275 HB ILE 40 HB ILE 40 23.746 3.370 28.174
276 HG12 ILE 40 HG12 ILE 40 22.019 1.762 29.863
277 HG13 ILE 40 HG13 ILE 40 22.514 1.512 28.200
278 HG21 ILE 40 HG21 ILE 40 25.574 2.211 29.342
279 HG22 ILE 40 HG22 ILE 40 25.499 3.940 29.758
280 HG23 ILE 40 HG23 ILE 40 24.891 2.721 30.904
281 HD11 ILE 40 HD11 ILE 40 23.268 -0.337 29.709
282 HD12 ILE 40 HD12 ILE 40 24.635 0.495 28.930
283 HD13 ILE 40 HD13 ILE 40 24.236 0.839 30.631
284 H ARG 41 HN ARG 41 24.173 4.162 32.074
285 HA ARG 41 HA ARG 41 25.323 5.604 33.200
286 HB2 ARG 41 HB2 ARG 41 25.941 6.631 30.392
287 HB3 ARG 41 HB3 ARG 41 26.726 7.298 31.810
288 HG2 ARG 41 HG2 ARG 41 26.715 4.297 31.347
289 HG3 ARG 41 HG3 ARG 41 27.877 5.310 30.514
290 HD2 ARG 41 HD2 ARG 41 27.502 5.278 33.548
291 HD3 ARG 41 HD3 ARG 41 28.735 4.365 32.701
292 HE ARG 41 HE ARG 41 28.795 7.186 31.979
293 HH11 ARG 41 HH22 ARG 41 29.837 4.862 34.442
294 HH12 ARG 41 HH21 ARG 41 31.166 5.837 34.976
295 HH22 ARG 41 HH1 ARG 41 31.565 7.955 33.928
296 H GLY 42 HN GLY 42 24.579 7.982 30.578
297 HA2 GLY 42 HA1 GLY 42 22.443 9.225 32.056
298 HA3 GLY 42 HA2 GLY 42 23.947 10.121 32.130
299 H VAL 43 HN VAL 43 23.182 8.083 29.314
300 HA VAL 43 HA VAL 43 22.447 10.491 27.815
301 HB VAL 43 HB VAL 43 24.202 8.454 26.534
302 HG11 VAL 43 HG11 VAL 43 24.063 9.988 24.919
303 HG12 VAL 43 HG12 VAL 43 23.226 11.124 26.004
304 HG13 VAL 43 HG13 VAL 43 25.005 11.093 25.950
305 HG21 VAL 43 HG21 VAL 43 26.241 9.572 27.330
306 HG22 VAL 43 HG22 VAL 43 25.262 10.599 28.405
307 HG23 VAL 43 HG23 VAL 43 25.333 8.841 28.676
308 H LEU 44 HN LEU 44 20.588 10.203 26.692
309 HA LEU 44 HA LEU 44 19.645 7.447 26.430
310 HB2 LEU 44 HB2 LEU 44 17.974 8.504 27.515
311 HB3 LEU 44 HB3 LEU 44 18.378 10.080 26.864
312 HG LEU 44 HG LEU 44 17.344 9.433 24.699
313 HD11 LEU 44 HD11 LEU 44 15.688 7.305 25.306
314 HD12 LEU 44 HD12 LEU 44 17.139 7.253 24.276
315 HD13 LEU 44 HD13 LEU 44 17.254 6.818 25.998
316 HD21 LEU 44 HD21 LEU 44 14.980 9.467 25.523
317 HD22 LEU 44 HD22 LEU 44 15.612 9.283 27.177
318 HD23 LEU 44 HD23 LEU 44 16.029 10.725 26.220
319 H VAL 45 HN VAL 45 19.939 6.465 24.509
320 HA VAL 45 HA VAL 45 20.312 8.187 22.176
321 HB VAL 45 HB VAL 45 20.806 5.226 22.305
322 HG11 VAL 45 HG11 VAL 45 21.186 5.781 20.135
323 HG12 VAL 45 HG12 VAL 45 21.511 7.490 20.512
324 HG13 VAL 45 HG13 VAL 45 22.774 6.265 20.776
325 HG21 VAL 45 HG21 VAL 45 22.095 5.795 24.143
326 HG22 VAL 45 HG22 VAL 45 23.257 6.015 22.813
327 HG23 VAL 45 HG23 VAL 45 22.447 7.428 23.530
328 H ARG 46 HN ARG 46 18.340 8.693 21.308
329 HA ARG 46 HA ARG 46 16.451 6.498 21.108
330 HB2 ARG 46 HB2 ARG 46 15.790 9.397 20.484
331 HB3 ARG 46 HB3 ARG 46 14.706 8.126 21.014
332 HG2 ARG 46 HG2 ARG 46 15.666 8.140 23.262
333 HG3 ARG 46 HG3 ARG 46 16.957 9.215 22.763
334 HD2 ARG 46 HD2 ARG 46 13.998 9.859 23.063
335 HD3 ARG 46 HD3 ARG 46 15.355 10.618 23.873
336 HE ARG 46 HE ARG 46 15.945 11.191 21.282
337 HH11 ARG 46 HH22 ARG 46 12.886 11.462 23.049
338 HH12 ARG 46 HH21 ARG 46 12.305 12.781 22.089
339 HH22 ARG 46 HH1 ARG 46 13.669 13.629 20.310
340 H TYR 47 HN TYR 47 15.405 6.057 19.036
341 HA TYR 47 HA TYR 47 16.564 7.435 16.732
342 HB2 TYR 47 HB2 TYR 47 17.752 5.206 17.453
343 HB3 TYR 47 HB3 TYR 47 16.245 4.394 17.077
344 HD1 TYR 47 HD1 TYR 47 15.293 5.197 14.604
345 HD2 TYR 47 HD2 TYR 47 19.388 5.027 15.831
346 HE1 TYR 47 HE1 TYR 47 16.020 4.987 12.176
347 HE2 TYR 47 HE2 TYR 47 20.101 4.817 13.399
348 HH TYR 47 HH TYR 47 18.883 5.639 11.091
349 H ARG 48 HN ARG 48 15.112 7.767 15.073
350 HA ARG 48 HA ARG 48 12.755 6.141 15.014
351 HB2 ARG 48 HB2 ARG 48 11.406 8.438 14.790
352 HB3 ARG 48 HB3 ARG 48 11.713 7.739 16.367
353 HG2 ARG 48 HG2 ARG 48 13.068 9.465 16.987
354 HG3 ARG 48 HG3 ARG 48 13.965 9.410 15.483
355 HD2 ARG 48 HD2 ARG 48 12.554 11.556 16.014
356 HD3 ARG 48 HD3 ARG 48 12.498 10.906 14.387
357 HE ARG 48 HE ARG 48 10.436 9.841 16.204
358 HH11 ARG 48 HH22 ARG 48 11.230 12.305 13.786
359 HH12 ARG 48 HH21 ARG 48 9.575 12.633 13.395
360 HH22 ARG 48 HH1 ARG 48 7.841 11.427 14.526
361 H ARG 49 HN ARG 49 12.347 5.688 12.866
362 HA ARG 49 HA ARG 49 12.318 7.620 10.907
363 HB2 ARG 49 HB2 ARG 49 14.852 7.468 11.278
364 HB3 ARG 49 HB3 ARG 49 14.777 5.814 10.705
365 HG2 ARG 49 HG2 ARG 49 13.651 8.100 9.043
366 HG3 ARG 49 HG3 ARG 49 15.355 7.694 8.982
367 HD2 ARG 49 HD2 ARG 49 13.871 5.231 8.745
368 HD3 ARG 49 HD3 ARG 49 13.153 6.386 7.639
369 HE ARG 49 HE ARG 49 15.863 5.259 7.482
370 HH11 ARG 49 HH22 ARG 49 13.727 7.872 6.404
371 HH12 ARG 49 HH21 ARG 49 14.671 8.231 4.997
372 HH22 ARG 49 HH1 ARG 49 16.656 6.961 4.559
373 H CYS 50 HN CYS 50 11.630 6.694 8.821
374 HA CYS 50 HA CYS 50 11.298 3.801 8.841
375 HB2 CYS 50 HB2 CYS 50 9.027 5.707 8.242
376 HB3 CYS 50 HB3 CYS 50 8.974 3.957 8.161
377 H TRP 51 HN TRP 51 11.581 2.921 6.764
378 HA TRP 51 HA TRP 51 12.425 4.819 4.735
379 HB2 TRP 51 HB2 TRP 51 12.839 1.926 5.283
380 HB3 TRP 51 HB3 TRP 51 12.853 2.431 3.605
381 HD1 TRP 51 HD1 TRP 51 14.963 3.923 2.802
382 HE1 TRP 51 HE1 TRP 51 17.332 4.514 3.803
383 HE3 TRP 51 HE3 TRP 51 13.925 2.390 7.537
384 HZ2 TRP 51 HZ2 TRP 51 18.480 4.279 6.405
385 HZ3 TRP 51 HZ3 TRP 51 15.725 2.605 9.248
386 HH2 TRP 51 HH2 TRP 51 17.939 3.511 8.746
Start of MODEL 2
1 H1 ARG 1 HN ARG 1 9.695 -6.248 0.547
2 HA ARG 1 HA ARG 1 7.457 -6.998 2.254
3 HB2 ARG 1 HB2 ARG 1 10.286 -8.047 2.086
4 HB3 ARG 1 HB3 ARG 1 9.528 -8.006 3.665
5 HG2 ARG 1 HG2 ARG 1 9.220 -10.183 2.351
6 HG3 ARG 1 HG3 ARG 1 7.749 -9.466 2.978
7 HD2 ARG 1 HD2 ARG 1 7.301 -8.416 0.753
8 HD3 ARG 1 HD3 ARG 1 8.784 -9.106 0.123
9 HE ARG 1 HE ARG 1 7.438 -11.315 1.118
10 HH11 ARG 1 HH22 ARG 1 6.567 -8.744 -1.159
11 HH12 ARG 1 HH21 ARG 1 5.473 -9.741 -2.059
12 HH22 ARG 1 HH1 ARG 1 5.152 -12.023 -1.399
13 H TRP 2 HN TRP 2 7.186 -5.776 4.146
14 HA TRP 2 HA TRP 2 9.377 -3.987 4.897
15 HB2 TRP 2 HB2 TRP 2 6.612 -2.888 4.950
16 HB3 TRP 2 HB3 TRP 2 8.152 -2.064 4.808
17 HD1 TRP 2 HD1 TRP 2 5.287 -3.175 2.700
18 HE1 TRP 2 HE1 TRP 2 5.724 -2.876 0.115
19 HE3 TRP 2 HE3 TRP 2 10.288 -2.349 3.107
20 HZ2 TRP 2 HZ2 TRP 2 8.060 -2.340 -1.435
21 HZ3 TRP 2 HZ3 TRP 2 11.573 -1.947 1.010
22 HH2 TRP 2 HH2 TRP 2 10.538 -1.933 -1.204
23 H CYS 3 HN CYS 3 9.416 -3.547 7.172
24 HA CYS 3 HA CYS 3 7.292 -4.670 8.770
25 HB2 CYS 3 HB2 CYS 3 10.117 -5.733 8.868
26 HB3 CYS 3 HB3 CYS 3 8.975 -5.925 10.183
27 H VAL 4 HN VAL 4 8.423 -4.416 11.284
28 HA VAL 4 HA VAL 4 9.815 -1.861 11.336
29 HB VAL 4 HB VAL 4 8.213 -0.688 12.429
30 HG11 VAL 4 HG11 VAL 4 6.607 -2.690 10.810
31 HG12 VAL 4 HG12 VAL 4 5.953 -1.167 11.458
32 HG13 VAL 4 HG13 VAL 4 7.268 -1.132 10.259
33 HG21 VAL 4 HG21 VAL 4 7.316 -3.341 13.527
34 HG22 VAL 4 HG22 VAL 4 7.818 -1.865 14.387
35 HG23 VAL 4 HG23 VAL 4 6.226 -1.935 13.595
36 H TYR 5 HN TYR 5 11.329 -1.790 12.956
37 HA TYR 5 HA TYR 5 11.160 -3.937 14.962
38 HB2 TYR 5 HB2 TYR 5 13.331 -2.844 13.127
39 HB3 TYR 5 HB3 TYR 5 13.836 -3.406 14.708
40 HD1 TYR 5 HD2 TYR 5 12.093 -5.767 15.118
41 HD2 TYR 5 HD1 TYR 5 14.145 -4.426 11.611
42 HE1 TYR 5 HE2 TYR 5 12.166 -8.152 14.240
43 HE2 TYR 5 HE1 TYR 5 14.211 -6.816 10.745
44 HH TYR 5 HH TYR 5 12.375 -9.063 11.522
45 H ALA 6 HN ALA 6 11.162 -3.247 17.046
46 HA ALA 6 HA ALA 6 12.297 -0.585 17.554
47 HB1 ALA 6 HB1 ALA 6 9.558 -1.502 17.832
48 HB2 ALA 6 HB2 ALA 6 10.223 -1.053 19.421
49 HB3 ALA 6 HB3 ALA 6 10.232 0.125 18.087
50 H TYR 7 HN TYR 7 13.311 -0.332 19.625
51 HA TYR 7 HA TYR 7 13.466 -2.690 21.309
52 HB2 TYR 7 HB2 TYR 7 15.262 -2.905 19.537
53 HB3 TYR 7 HB3 TYR 7 15.804 -1.275 19.881
54 HD1 TYR 7 HD2 TYR 7 16.525 -0.847 22.411
55 HD2 TYR 7 HD1 TYR 7 16.378 -4.688 20.532
56 HE1 TYR 7 HE2 TYR 7 18.155 -1.761 24.135
57 HE2 TYR 7 HE1 TYR 7 18.009 -5.589 22.262
58 HH TYR 7 HH TYR 7 19.485 -4.995 23.820
59 H VAL 8 HN VAL 8 13.113 -1.938 23.332
60 HA VAL 8 HA VAL 8 14.211 0.717 23.958
61 HB VAL 8 HB VAL 8 11.768 -0.606 25.148
62 HG11 VAL 8 HG11 VAL 8 13.343 1.710 25.868
63 HG12 VAL 8 HG12 VAL 8 11.687 2.199 25.435
64 HG13 VAL 8 HG13 VAL 8 11.952 0.980 26.706
65 HG21 VAL 8 HG21 VAL 8 10.480 0.176 23.493
66 HG22 VAL 8 HG22 VAL 8 11.275 1.769 23.526
67 HG23 VAL 8 HG23 VAL 8 11.981 0.441 22.573
68 H ARG 9 HN ARG 9 15.544 0.886 25.731
69 HA ARG 9 HA ARG 9 15.577 -1.331 27.563
70 HB2 ARG 9 HB2 ARG 9 17.320 -2.167 26.217
71 HB3 ARG 9 HB3 ARG 9 17.846 -0.572 25.719
72 HG2 ARG 9 HG2 ARG 9 18.886 -0.141 27.872
73 HG3 ARG 9 HG3 ARG 9 18.137 -1.554 28.590
74 HD2 ARG 9 HD2 ARG 9 19.878 -2.853 27.931
75 HD3 ARG 9 HD3 ARG 9 19.601 -2.425 26.255
76 HE ARG 9 HE ARG 9 20.897 -0.199 27.121
77 HH11 ARG 9 HH22 ARG 9 21.642 -3.625 27.634
78 HH12 ARG 9 HH21 ARG 9 23.350 -3.362 27.759
79 HH22 ARG 9 HH1 ARG 9 24.213 -1.137 27.551
80 H ILE 10 HN ILE 10 15.484 -0.398 29.582
81 HA ILE 10 HA ILE 10 17.212 1.844 30.152
82 HB ILE 10 HB ILE 10 14.329 2.221 30.833
83 HG12 ILE 10 HG12 ILE 10 15.552 2.990 28.166
84 HG13 ILE 10 HG13 ILE 10 14.351 1.738 28.410
85 HG21 ILE 10 HG21 ILE 10 16.736 3.647 31.226
86 HG22 ILE 10 HG22 ILE 10 15.774 4.577 30.052
87 HG23 ILE 10 HG23 ILE 10 15.078 4.147 31.633
88 HD11 ILE 10 HD11 ILE 10 13.087 3.795 29.673
89 HD12 ILE 10 HD12 ILE 10 14.041 4.711 28.481
90 HD13 ILE 10 HD13 ILE 10 12.898 3.460 27.935
91 H ARG 11 HN ARG 11 17.489 2.171 32.466
92 HA ARG 11 HA ARG 11 17.785 1.458 34.483
93 HB2 ARG 11 HB2 ARG 11 14.975 0.505 33.936
94 HB3 ARG 11 HB3 ARG 11 15.748 -0.086 35.394
95 HG2 ARG 11 HG2 ARG 11 15.164 1.863 36.397
96 HG3 ARG 11 HG3 ARG 11 16.352 2.666 35.389
97 HD2 ARG 11 HD2 ARG 11 14.722 3.280 33.744
98 HD3 ARG 11 HD3 ARG 11 13.558 2.106 34.327
99 HE ARG 11 HE ARG 11 14.171 3.952 36.443
100 HH11 ARG 11 HH22 ARG 11 12.425 3.806 33.364
101 HH12 ARG 11 HH21 ARG 11 11.305 5.054 33.798
102 HH22 ARG 11 HH1 ARG 11 11.481 6.094 35.950
103 H GLY 12 HN GLY 12 15.851 -1.449 33.537
104 HA2 GLY 12 HA1 GLY 12 18.207 -3.060 33.086
105 HA3 GLY 12 HA2 GLY 12 17.396 -3.388 34.604
106 H VAL 13 HN VAL 13 15.535 -2.192 31.827
107 HA VAL 13 HA VAL 13 14.473 -4.910 31.473
108 HB VAL 13 HB VAL 13 12.977 -2.284 31.341
109 HG11 VAL 13 HG11 VAL 13 11.934 -3.810 29.848
110 HG12 VAL 13 HG12 VAL 13 12.114 -5.166 30.987
111 HG13 VAL 13 HG13 VAL 13 10.971 -3.849 31.344
112 HG21 VAL 13 HG21 VAL 13 11.924 -3.940 33.371
113 HG22 VAL 13 HG22 VAL 13 13.690 -3.944 33.595
114 HG23 VAL 13 HG23 VAL 13 12.800 -2.402 33.561
115 H LEU 14 HN LEU 14 13.682 -5.398 29.288
116 HA LEU 14 HA LEU 14 14.631 -3.549 27.242
117 HB2 LEU 14 HB2 LEU 14 16.506 -5.006 27.606
118 HB3 LEU 14 HB3 LEU 14 15.488 -6.430 27.513
119 HG LEU 14 HG LEU 14 15.300 -6.337 25.212
120 HD11 LEU 14 HD11 LEU 14 15.901 -3.383 25.422
121 HD12 LEU 14 HD12 LEU 14 15.887 -4.263 23.875
122 HD13 LEU 14 HD13 LEU 14 14.409 -4.177 24.863
123 HD21 LEU 14 HD21 LEU 14 18.017 -5.179 25.876
124 HD22 LEU 14 HD22 LEU 14 17.569 -6.895 25.731
125 HD23 LEU 14 HD23 LEU 14 17.572 -5.851 24.289
126 H VAL 15 HN VAL 15 12.853 -3.103 26.064
127 HA VAL 15 HA VAL 15 10.962 -5.314 25.652
128 HB VAL 15 HB VAL 15 10.233 -2.434 25.313
129 HG11 VAL 15 HG11 VAL 15 8.147 -3.237 25.202
130 HG12 VAL 15 HG12 VAL 15 8.874 -4.859 25.108
131 HG13 VAL 15 HG13 VAL 15 8.360 -4.204 26.681
132 HG21 VAL 15 HG21 VAL 15 11.021 -3.717 27.858
133 HG22 VAL 15 HG22 VAL 15 10.908 -1.995 27.423
134 HG23 VAL 15 HG23 VAL 15 9.443 -2.894 27.885
135 H ARG 16 HN ARG 16 11.842 -6.218 23.778
136 HA ARG 16 HA ARG 16 12.475 -4.408 21.640
137 HB2 ARG 16 HB2 ARG 16 12.734 -7.432 21.976
138 HB3 ARG 16 HB3 ARG 16 13.107 -6.629 20.463
139 HG2 ARG 16 HG2 ARG 16 14.731 -5.133 21.753
140 HG3 ARG 16 HG3 ARG 16 14.448 -6.137 23.161
141 HD2 ARG 16 HD2 ARG 16 16.319 -6.610 21.080
142 HD3 ARG 16 HD3 ARG 16 15.931 -7.683 22.409
143 HE ARG 16 HE ARG 16 14.500 -8.939 20.988
144 HH11 ARG 16 HH22 ARG 16 15.711 -6.058 19.317
145 HH12 ARG 16 HH21 ARG 16 15.200 -6.599 17.753
146 HH22 ARG 16 HH1 ARG 16 14.094 -8.715 17.545
147 H TYR 17 HN TYR 17 10.595 -3.638 20.649
148 HA TYR 17 HA TYR 17 8.396 -5.481 20.212
149 HB2 TYR 17 HB2 TYR 17 8.589 -2.846 20.918
150 HB3 TYR 17 HB3 TYR 17 8.638 -2.624 19.180
151 HD1 TYR 17 HD2 TYR 17 6.586 -4.226 21.869
152 HD2 TYR 17 HD1 TYR 17 6.643 -2.499 17.955
153 HE1 TYR 17 HE2 TYR 17 4.048 -4.335 21.776
154 HE2 TYR 17 HE1 TYR 17 4.105 -2.614 17.876
155 HH TYR 17 HH TYR 17 2.312 -3.437 18.833
156 H ARG 18 HN ARG 18 7.365 -5.653 18.051
157 HA ARG 18 HA ARG 18 9.057 -4.952 15.852
158 HB2 ARG 18 HB2 ARG 18 8.709 -7.463 15.011
159 HB3 ARG 18 HB3 ARG 18 10.059 -7.058 16.052
160 HG2 ARG 18 HG2 ARG 18 8.579 -7.672 18.053
161 HG3 ARG 18 HG3 ARG 18 7.393 -8.270 16.910
162 HD2 ARG 18 HD2 ARG 18 10.199 -9.269 16.536
163 HD3 ARG 18 HD3 ARG 18 9.367 -9.833 17.971
164 HE ARG 18 HE ARG 18 7.460 -10.252 16.061
165 HH11 ARG 18 HH22 ARG 18 10.906 -11.074 16.132
166 HH12 ARG 18 HH21 ARG 18 10.722 -12.466 15.118
167 HH22 ARG 18 HH1 ARG 18 8.544 -13.043 14.301
168 H ARG 19 HN ARG 19 7.867 -5.965 13.706
169 HA ARG 19 HA ARG 19 5.193 -6.551 13.848
170 HB2 ARG 19 HB2 ARG 19 5.342 -3.985 14.613
171 HB3 ARG 19 HB3 ARG 19 5.468 -3.689 12.891
172 HG2 ARG 19 HG2 ARG 19 3.289 -5.552 13.820
173 HG3 ARG 19 HG3 ARG 19 3.083 -3.843 14.150
174 HD2 ARG 19 HD2 ARG 19 4.011 -4.299 11.393
175 HD3 ARG 19 HD3 ARG 19 2.520 -5.161 11.717
176 HE ARG 19 HE ARG 19 2.317 -2.487 12.760
177 HH11 ARG 19 HH22 ARG 19 2.337 -4.234 9.678
178 HH12 ARG 19 HH21 ARG 19 1.394 -3.038 8.852
179 HH22 ARG 19 HH1 ARG 19 0.662 -1.092 10.044
180 H CYS 20 HN CYS 20 4.173 -6.525 11.605
181 HA CYS 20 HA CYS 20 6.052 -5.972 9.470
182 HB2 CYS 20 HB2 CYS 20 5.094 -8.708 10.215
183 HB3 CYS 20 HB3 CYS 20 5.298 -8.314 8.520
184 H TRP 21 HN TRP 21 4.884 -6.006 7.318
185 HA TRP 21 HA TRP 21 2.140 -5.127 7.724
186 HB2 TRP 21 HB2 TRP 21 3.278 -3.558 6.481
187 HB3 TRP 21 HB3 TRP 21 4.216 -4.752 5.607
188 HD1 TRP 21 HD1 TRP 21 1.031 -2.741 5.321
189 HE1 TRP 21 HE1 TRP 21 -0.269 -3.231 3.077
190 HE3 TRP 21 HE3 TRP 21 3.777 -6.814 4.005
191 HZ2 TRP 21 HZ2 TRP 21 -0.008 -5.223 1.049
192 HZ3 TRP 21 HZ3 TRP 21 3.189 -7.973 1.878
193 HH2 TRP 21 HH2 TRP 21 1.369 -7.239 0.421
194 H1 ARG 31 HN ARG 31 6.110 -0.741 6.154
195 HA ARG 31 HA ARG 31 8.138 0.181 4.290
196 HB2 ARG 31 HB2 ARG 31 6.722 1.742 6.477
197 HB3 ARG 31 HB3 ARG 31 8.361 2.175 6.033
198 HG2 ARG 31 HG2 ARG 31 7.274 3.507 4.497
199 HG3 ARG 31 HG3 ARG 31 7.308 2.039 3.540
200 HD2 ARG 31 HD2 ARG 31 5.029 2.988 3.543
201 HD3 ARG 31 HD3 ARG 31 5.028 1.436 4.356
202 HE ARG 31 HE ARG 31 5.442 3.741 6.142
203 HH11 ARG 31 HH22 ARG 31 3.065 1.557 4.680
204 HH12 ARG 31 HH21 ARG 31 1.856 1.868 5.882
205 HH22 ARG 31 HH1 ARG 31 2.338 3.397 7.663
206 H TRP 32 HN TRP 32 10.040 1.189 6.013
207 HA TRP 32 HA TRP 32 10.518 -1.063 7.844
208 HB2 TRP 32 HB2 TRP 32 12.251 0.333 5.879
209 HB3 TRP 32 HB3 TRP 32 12.986 -0.098 7.410
210 HD1 TRP 32 HD1 TRP 32 12.254 -1.584 4.094
211 HE1 TRP 32 HE1 TRP 32 12.632 -4.194 4.006
212 HE3 TRP 32 HE3 TRP 32 12.541 -2.239 9.128
213 HZ2 TRP 32 HZ2 TRP 32 13.000 -6.195 6.008
214 HZ3 TRP 32 HZ3 TRP 32 12.911 -4.553 9.979
215 HH2 TRP 32 HH2 TRP 32 13.138 -6.492 8.508
216 H CYS 33 HN CYS 33 9.464 -0.021 9.631
217 HA CYS 33 HA CYS 33 10.377 2.628 10.328
218 HB2 CYS 33 HB2 CYS 33 8.161 0.837 11.159
219 HB3 CYS 33 HB3 CYS 33 8.787 1.922 12.385
220 H VAL 34 HN VAL 34 11.367 3.055 12.473
221 HA VAL 34 HA VAL 34 12.372 0.754 13.906
222 HB VAL 34 HB VAL 34 14.687 1.377 13.705
223 HG11 VAL 34 HG11 VAL 34 13.599 -0.142 11.995
224 HG12 VAL 34 HG12 VAL 34 13.554 1.257 10.896
225 HG13 VAL 34 HG13 VAL 34 15.116 0.633 11.479
226 HG21 VAL 34 HG21 VAL 34 15.197 3.107 11.778
227 HG22 VAL 34 HG22 VAL 34 13.583 3.727 12.201
228 HG23 VAL 34 HG23 VAL 34 14.863 3.661 13.436
229 H TYR 35 HN TYR 35 12.022 1.199 16.014
230 HA TYR 35 HA TYR 35 12.533 3.922 16.931
231 HB2 TYR 35 HB2 TYR 35 10.008 3.200 16.267
232 HB3 TYR 35 HB3 TYR 35 10.072 2.321 17.782
233 HD1 TYR 35 HD2 TYR 35 11.081 5.753 16.612
234 HD2 TYR 35 HD1 TYR 35 9.037 3.401 19.543
235 HE1 TYR 35 HE2 TYR 35 10.442 7.866 17.873
236 HE2 TYR 35 HE1 TYR 35 8.405 5.522 20.794
237 HH TYR 35 HH TYR 35 8.745 7.673 20.971
238 H ALA 36 HN ALA 36 14.015 3.693 18.527
239 HA ALA 36 HA ALA 36 13.535 1.556 20.473
240 HB1 ALA 36 HB1 ALA 36 16.147 1.409 20.497
241 HB2 ALA 36 HB2 ALA 36 15.247 0.568 19.212
242 HB3 ALA 36 HB3 ALA 36 16.033 2.129 18.873
243 H TYR 37 HN TYR 37 14.627 2.010 22.587
244 HA TYR 37 HA TYR 37 15.388 4.799 22.945
245 HB2 TYR 37 HB2 TYR 37 12.814 4.263 23.275
246 HB3 TYR 37 HB3 TYR 37 13.314 3.321 24.665
247 HD1 TYR 37 HD2 TYR 37 14.558 4.510 26.560
248 HD2 TYR 37 HD1 TYR 37 12.538 6.611 23.428
249 HE1 TYR 37 HE2 TYR 37 14.508 6.610 27.991
250 HE2 TYR 37 HE1 TYR 37 12.494 8.704 24.870
251 HH TYR 37 HH TYR 37 12.735 8.793 27.922
252 H VAL 38 HN VAL 38 17.509 3.718 23.217
253 HA VAL 38 HA VAL 38 17.685 2.177 25.699
254 HB VAL 38 HB VAL 38 19.595 2.537 23.382
255 HG11 VAL 38 HG11 VAL 38 20.953 2.257 25.314
256 HG12 VAL 38 HG12 VAL 38 19.879 1.004 25.979
257 HG13 VAL 38 HG13 VAL 38 20.860 0.659 24.535
258 HG21 VAL 38 HG21 VAL 38 18.146 1.034 22.491
259 HG22 VAL 38 HG22 VAL 38 19.079 -0.113 23.483
260 HG23 VAL 38 HG23 VAL 38 17.526 0.522 24.080
261 H ARG 39 HN ARG 39 18.927 2.884 27.444
262 HA ARG 39 HA ARG 39 20.192 5.470 27.067
263 HB2 ARG 39 HB2 ARG 39 17.856 5.539 28.239
264 HB3 ARG 39 HB3 ARG 39 18.644 4.762 29.598
265 HG2 ARG 39 HG2 ARG 39 20.295 6.635 29.719
266 HG3 ARG 39 HG3 ARG 39 19.525 7.409 28.349
267 HD2 ARG 39 HD2 ARG 39 18.209 8.486 29.868
268 HD3 ARG 39 HD3 ARG 39 17.367 6.962 30.068
269 HE ARG 39 HE ARG 39 19.531 6.679 31.760
270 HH11 ARG 39 HH22 ARG 39 17.052 9.187 31.407
271 HH12 ARG 39 HH21 ARG 39 17.102 9.645 33.077
272 HH22 ARG 39 HH1 ARG 39 18.605 8.513 34.561
273 H ILE 40 HN ILE 40 22.223 5.634 28.065
274 HA ILE 40 HA ILE 40 22.895 3.612 30.059
275 HB ILE 40 HB ILE 40 24.438 4.143 27.520
276 HG12 ILE 40 HG12 ILE 40 24.053 1.392 27.945
277 HG13 ILE 40 HG13 ILE 40 22.508 2.128 28.322
278 HG21 ILE 40 HG21 ILE 40 25.235 2.631 30.017
279 HG22 ILE 40 HG22 ILE 40 26.040 2.441 28.441
280 HG23 ILE 40 HG23 ILE 40 26.056 4.020 29.263
281 HD11 ILE 40 HD11 ILE 40 22.471 3.288 26.152
282 HD12 ILE 40 HD12 ILE 40 24.100 2.677 25.774
283 HD13 ILE 40 HD13 ILE 40 22.731 1.546 25.896
284 H ARG 41 HN ARG 41 25.001 4.205 31.198
285 HA ARG 41 HA ARG 41 25.845 5.670 32.587
286 HB2 ARG 41 HB2 ARG 41 26.459 6.872 29.854
287 HB3 ARG 41 HB3 ARG 41 27.125 7.573 31.316
288 HG2 ARG 41 HG2 ARG 41 27.448 4.630 30.569
289 HG3 ARG 41 HG3 ARG 41 28.624 5.862 30.157
290 HD2 ARG 41 HD2 ARG 41 27.823 4.886 32.924
291 HD3 ARG 41 HD3 ARG 41 29.421 4.903 32.204
292 HE ARG 41 HE ARG 41 28.087 7.138 33.533
293 HH11 ARG 41 HH22 ARG 41 30.566 6.286 31.149
294 HH12 ARG 41 HH21 ARG 41 31.432 7.775 31.335
295 HH22 ARG 41 HH1 ARG 41 30.628 9.415 32.886
296 H GLY 42 HN GLY 42 25.215 8.303 30.238
297 HA2 GLY 42 HA1 GLY 42 22.929 9.276 31.771
298 HA3 GLY 42 HA2 GLY 42 24.379 10.260 31.805
299 H VAL 43 HN VAL 43 23.276 8.231 29.040
300 HA VAL 43 HA VAL 43 22.476 10.656 27.628
301 HB VAL 43 HB VAL 43 24.183 8.695 26.176
302 HG11 VAL 43 HG11 VAL 43 24.850 11.390 25.615
303 HG12 VAL 43 HG12 VAL 43 23.921 10.256 24.605
304 HG13 VAL 43 HG13 VAL 43 23.076 11.321 25.754
305 HG21 VAL 43 HG21 VAL 43 25.450 9.086 28.249
306 HG22 VAL 43 HG22 VAL 43 26.246 9.835 26.844
307 HG23 VAL 43 HG23 VAL 43 25.331 10.843 27.991
308 H LEU 44 HN LEU 44 20.564 10.344 26.597
309 HA LEU 44 HA LEU 44 19.655 7.573 26.380
310 HB2 LEU 44 HB2 LEU 44 18.029 8.593 27.561
311 HB3 LEU 44 HB3 LEU 44 18.374 10.181 26.905
312 HG LEU 44 HG LEU 44 17.225 9.550 24.799
313 HD11 LEU 44 HD11 LEU 44 17.242 6.911 26.066
314 HD12 LEU 44 HD12 LEU 44 15.647 7.383 25.431
315 HD13 LEU 44 HD13 LEU 44 17.065 7.368 24.355
316 HD21 LEU 44 HD21 LEU 44 14.918 9.542 25.742
317 HD22 LEU 44 HD22 LEU 44 15.623 9.296 27.357
318 HD23 LEU 44 HD23 LEU 44 15.985 10.781 26.445
319 H VAL 45 HN VAL 45 19.693 6.587 24.437
320 HA VAL 45 HA VAL 45 19.956 8.323 22.091
321 HB VAL 45 HB VAL 45 20.499 5.366 22.213
322 HG11 VAL 45 HG11 VAL 45 21.092 7.623 20.341
323 HG12 VAL 45 HG12 VAL 45 22.281 6.306 20.474
324 HG13 VAL 45 HG13 VAL 45 20.605 5.945 19.997
325 HG21 VAL 45 HG21 VAL 45 21.998 5.896 23.851
326 HG22 VAL 45 HG22 VAL 45 22.984 6.340 22.437
327 HG23 VAL 45 HG23 VAL 45 22.118 7.599 23.349
328 H ARG 46 HN ARG 46 17.981 8.779 21.237
329 HA ARG 46 HA ARG 46 16.091 6.570 21.185
330 HB2 ARG 46 HB2 ARG 46 15.501 9.546 20.806
331 HB3 ARG 46 HB3 ARG 46 14.317 8.270 21.009
332 HG2 ARG 46 HG2 ARG 46 14.949 7.898 23.304
333 HG3 ARG 46 HG3 ARG 46 16.435 8.811 23.128
334 HD2 ARG 46 HD2 ARG 46 14.114 10.459 22.414
335 HD3 ARG 46 HD3 ARG 46 13.931 9.795 24.025
336 HE ARG 46 HE ARG 46 16.601 10.898 23.537
337 HH11 ARG 46 HH22 ARG 46 13.303 11.674 24.575
338 HH12 ARG 46 HH21 ARG 46 13.780 13.086 25.457
339 HH22 ARG 46 HH1 ARG 46 16.094 13.706 25.517
340 H TYR 47 HN TYR 47 15.980 5.563 19.203
341 HA TYR 47 HA TYR 47 16.716 7.132 16.844
342 HB2 TYR 47 HB2 TYR 47 17.849 4.930 17.403
343 HB3 TYR 47 HB3 TYR 47 16.286 4.140 17.452
344 HD1 TYR 47 HD2 TYR 47 17.037 6.667 14.880
345 HD2 TYR 47 HD1 TYR 47 16.926 2.486 15.780
346 HE1 TYR 47 HE2 TYR 47 17.232 6.122 12.405
347 HE2 TYR 47 HE1 TYR 47 17.122 1.955 13.302
348 HH TYR 47 HH TYR 47 17.651 2.807 11.317
349 H ARG 48 HN ARG 48 15.300 7.518 15.159
350 HA ARG 48 HA ARG 48 12.817 6.090 15.149
351 HB2 ARG 48 HB2 ARG 48 11.541 8.339 14.950
352 HB3 ARG 48 HB3 ARG 48 12.081 7.883 16.554
353 HG2 ARG 48 HG2 ARG 48 14.285 9.253 15.784
354 HG3 ARG 48 HG3 ARG 48 13.124 10.046 14.738
355 HD2 ARG 48 HD2 ARG 48 11.722 10.056 17.104
356 HD3 ARG 48 HD3 ARG 48 13.361 10.131 17.720
357 HE ARG 48 HE ARG 48 11.968 12.215 16.197
358 HH11 ARG 48 HH22 ARG 48 15.139 10.985 17.190
359 HH12 ARG 48 HH21 ARG 48 15.935 12.508 16.974
360 HH22 ARG 48 HH1 ARG 48 14.669 14.398 16.223
361 H ARG 49 HN ARG 49 12.277 5.667 13.016
362 HA ARG 49 HA ARG 49 12.523 7.551 11.010
363 HB2 ARG 49 HB2 ARG 49 15.020 6.729 11.496
364 HB3 ARG 49 HB3 ARG 49 14.536 5.328 10.562
365 HG2 ARG 49 HG2 ARG 49 13.998 8.108 9.477
366 HG3 ARG 49 HG3 ARG 49 15.605 7.422 9.340
367 HD2 ARG 49 HD2 ARG 49 13.688 5.401 8.541
368 HD3 ARG 49 HD3 ARG 49 13.304 6.887 7.694
369 HE ARG 49 HE ARG 49 15.704 5.248 7.343
370 HH11 ARG 49 HH22 ARG 49 14.345 8.493 6.930
371 HH12 ARG 49 HH21 ARG 49 15.473 8.944 5.697
372 HH22 ARG 49 HH1 ARG 49 17.140 7.370 4.998
373 H CYS 50 HN CYS 50 11.801 6.636 8.878
374 HA CYS 50 HA CYS 50 11.005 3.863 8.924
375 HB2 CYS 50 HB2 CYS 50 8.955 6.073 8.667
376 HB3 CYS 50 HB3 CYS 50 8.659 4.375 8.349
377 H TRP 51 HN TRP 51 10.780 3.052 6.765
378 HA TRP 51 HA TRP 51 11.519 5.011 4.700
379 HB2 TRP 51 HB2 TRP 51 12.364 2.215 5.253
380 HB3 TRP 51 HB3 TRP 51 12.163 2.669 3.572
381 HD1 TRP 51 HD1 TRP 51 13.545 5.280 3.104
382 HE1 TRP 51 HE1 TRP 51 16.049 5.886 3.675
383 HE3 TRP 51 HE3 TRP 51 14.163 1.672 6.634
384 HZ2 TRP 51 HZ2 TRP 51 17.964 4.812 5.499
385 HZ3 TRP 51 HZ3 TRP 51 16.381 1.519 7.762
386 HH2 TRP 51 HH2 TRP 51 18.244 3.015 7.245
Start of MODEL 3
1 H1 ARG 1 HN ARG 1 10.173 -6.861 1.824
2 HA ARG 1 HA ARG 1 7.418 -5.987 1.466
3 HB2 ARG 1 HB2 ARG 1 8.622 -8.122 3.221
4 HB3 ARG 1 HB3 ARG 1 7.287 -7.206 3.891
5 HG2 ARG 1 HG2 ARG 1 7.234 -8.685 1.217
6 HG3 ARG 1 HG3 ARG 1 6.515 -9.269 2.704
7 HD2 ARG 1 HD2 ARG 1 4.629 -8.081 2.279
8 HD3 ARG 1 HD3 ARG 1 5.548 -6.588 2.295
9 HE ARG 1 HE ARG 1 5.553 -6.582 -0.051
10 HH11 ARG 1 HH22 ARG 1 4.601 -9.797 1.092
11 HH12 ARG 1 HH21 ARG 1 4.164 -10.365 -0.485
12 HH22 ARG 1 HH1 ARG 1 4.393 -8.897 -2.366
13 H TRP 2 HN TRP 2 6.588 -5.080 3.794
14 HA TRP 2 HA TRP 2 8.650 -3.167 4.621
15 HB2 TRP 2 HB2 TRP 2 5.777 -2.815 5.318
16 HB3 TRP 2 HB3 TRP 2 7.013 -1.618 4.988
17 HD1 TRP 2 HD1 TRP 2 3.969 -2.220 3.496
18 HE1 TRP 2 HE1 TRP 2 3.831 -2.048 0.866
19 HE3 TRP 2 HE3 TRP 2 8.963 -2.715 2.676
20 HZ2 TRP 2 HZ2 TRP 2 5.782 -2.136 -1.215
21 HZ3 TRP 2 HZ3 TRP 2 9.763 -2.662 0.316
22 HH2 TRP 2 HH2 TRP 2 8.263 -2.384 -1.593
23 H CYS 3 HN CYS 3 9.539 -3.418 6.631
24 HA CYS 3 HA CYS 3 7.993 -5.005 8.548
25 HB2 CYS 3 HB2 CYS 3 10.806 -5.325 7.643
26 HB3 CYS 3 HB3 CYS 3 10.502 -5.518 9.358
27 H VAL 4 HN VAL 4 8.904 -4.538 10.888
28 HA VAL 4 HA VAL 4 10.089 -1.914 11.146
29 HB VAL 4 HB VAL 4 8.333 -0.853 12.194
30 HG11 VAL 4 HG11 VAL 4 6.365 -1.059 10.727
31 HG12 VAL 4 HG12 VAL 4 7.883 -1.075 9.798
32 HG13 VAL 4 HG13 VAL 4 7.003 -2.595 10.090
33 HG21 VAL 4 HG21 VAL 4 6.162 -2.244 12.739
34 HG22 VAL 4 HG22 VAL 4 7.296 -3.616 12.747
35 HG23 VAL 4 HG23 VAL 4 7.546 -2.247 13.858
36 H TYR 5 HN TYR 5 11.548 -2.008 12.777
37 HA TYR 5 HA TYR 5 11.094 -4.073 14.826
38 HB2 TYR 5 HB2 TYR 5 13.473 -3.114 13.173
39 HB3 TYR 5 HB3 TYR 5 13.795 -3.730 14.782
40 HD1 TYR 5 HD2 TYR 5 11.817 -5.957 14.957
41 HD2 TYR 5 HD1 TYR 5 14.363 -4.742 11.740
42 HE1 TYR 5 HE2 TYR 5 11.809 -8.330 14.044
43 HE2 TYR 5 HE1 TYR 5 14.347 -7.119 10.839
44 HH TYR 5 HH TYR 5 12.517 -9.669 12.512
45 H ALA 6 HN ALA 6 11.368 -3.481 16.969
46 HA ALA 6 HA ALA 6 12.356 -0.759 17.438
47 HB1 ALA 6 HB1 ALA 6 10.276 -1.481 19.314
48 HB2 ALA 6 HB2 ALA 6 10.355 -0.089 18.207
49 HB3 ALA 6 HB3 ALA 6 9.662 -1.631 17.650
50 H TYR 7 HN TYR 7 13.520 -0.491 19.391
51 HA TYR 7 HA TYR 7 13.796 -2.858 21.074
52 HB2 TYR 7 HB2 TYR 7 15.617 -3.060 19.440
53 HB3 TYR 7 HB3 TYR 7 15.902 -1.331 19.446
54 HD1 TYR 7 HD2 TYR 7 15.382 -2.878 22.693
55 HD2 TYR 7 HD1 TYR 7 18.329 -1.885 19.755
56 HE1 TYR 7 HE2 TYR 7 17.220 -3.183 24.423
57 HE2 TYR 7 HE1 TYR 7 20.157 -2.194 21.495
58 HH TYR 7 HH TYR 7 19.702 -3.791 24.322
59 H VAL 8 HN VAL 8 13.172 -2.058 23.029
60 HA VAL 8 HA VAL 8 14.206 0.597 23.745
61 HB VAL 8 HB VAL 8 11.792 -0.893 24.796
62 HG11 VAL 8 HG11 VAL 8 13.229 1.514 25.682
63 HG12 VAL 8 HG12 VAL 8 11.486 1.772 25.432
64 HG13 VAL 8 HG13 VAL 8 12.046 0.499 26.542
65 HG21 VAL 8 HG21 VAL 8 10.578 -0.041 23.129
66 HG22 VAL 8 HG22 VAL 8 11.212 1.594 23.434
67 HG23 VAL 8 HG23 VAL 8 12.093 0.484 22.358
68 H ARG 9 HN ARG 9 15.200 0.879 25.797
69 HA ARG 9 HA ARG 9 15.402 -1.358 27.523
70 HB2 ARG 9 HB2 ARG 9 17.201 -2.193 26.281
71 HB3 ARG 9 HB3 ARG 9 17.660 -0.613 25.677
72 HG2 ARG 9 HG2 ARG 9 18.603 0.004 27.875
73 HG3 ARG 9 HG3 ARG 9 18.037 -1.500 28.576
74 HD2 ARG 9 HD2 ARG 9 19.466 -2.598 26.594
75 HD3 ARG 9 HD3 ARG 9 20.297 -1.055 26.615
76 HE ARG 9 HE ARG 9 20.506 -3.144 28.613
77 HH11 ARG 9 HH22 ARG 9 20.601 0.376 28.221
78 HH12 ARG 9 HH21 ARG 9 21.587 0.630 29.623
79 HH22 ARG 9 HH1 ARG 9 22.284 -1.258 30.925
80 H ILE 10 HN ILE 10 15.138 -0.341 29.486
81 HA ILE 10 HA ILE 10 16.819 1.963 30.047
82 HB ILE 10 HB ILE 10 13.933 2.172 30.774
83 HG12 ILE 10 HG12 ILE 10 15.056 2.919 28.058
84 HG13 ILE 10 HG13 ILE 10 13.889 1.652 28.376
85 HG21 ILE 10 HG21 ILE 10 15.420 4.537 29.884
86 HG22 ILE 10 HG22 ILE 10 14.467 4.260 31.362
87 HG23 ILE 10 HG23 ILE 10 16.157 3.706 31.275
88 HD11 ILE 10 HD11 ILE 10 13.429 4.494 28.029
89 HD12 ILE 10 HD12 ILE 10 12.235 3.183 28.180
90 HD13 ILE 10 HD13 ILE 10 12.857 3.993 29.638
91 H ARG 11 HN ARG 11 17.130 2.313 32.345
92 HA ARG 11 HA ARG 11 17.513 1.627 34.356
93 HB2 ARG 11 HB2 ARG 11 14.719 0.618 33.885
94 HB3 ARG 11 HB3 ARG 11 15.539 -0.005 35.303
95 HG2 ARG 11 HG2 ARG 11 14.989 1.908 36.387
96 HG3 ARG 11 HG3 ARG 11 16.099 2.766 35.338
97 HD2 ARG 11 HD2 ARG 11 14.373 3.391 33.808
98 HD3 ARG 11 HD3 ARG 11 13.278 2.153 34.391
99 HE ARG 11 HE ARG 11 13.707 3.731 36.633
100 HH11 ARG 11 HH22 ARG 11 12.616 4.404 33.329
101 HH12 ARG 11 HH21 ARG 11 11.648 5.764 33.793
102 HH22 ARG 11 HH1 ARG 11 11.553 6.404 36.101
103 H GLY 12 HN GLY 12 15.652 -1.360 33.539
104 HA2 GLY 12 HA1 GLY 12 18.030 -2.900 32.991
105 HA3 GLY 12 HA2 GLY 12 17.334 -3.214 34.568
106 H VAL 13 HN VAL 13 15.259 -2.165 31.882
107 HA VAL 13 HA VAL 13 14.275 -4.927 31.673
108 HB VAL 13 HB VAL 13 12.669 -2.367 31.558
109 HG11 VAL 13 HG11 VAL 13 10.909 -4.423 32.019
110 HG12 VAL 13 HG12 VAL 13 11.242 -3.695 30.430
111 HG13 VAL 13 HG13 VAL 13 12.084 -5.184 30.919
112 HG21 VAL 13 HG21 VAL 13 13.206 -2.528 33.816
113 HG22 VAL 13 HG22 VAL 13 11.674 -3.428 33.724
114 HG23 VAL 13 HG23 VAL 13 13.220 -4.308 33.795
115 H LEU 14 HN LEU 14 14.316 -5.775 29.648
116 HA LEU 14 HA LEU 14 14.938 -3.907 27.484
117 HB2 LEU 14 HB2 LEU 14 16.567 -5.648 27.870
118 HB3 LEU 14 HB3 LEU 14 15.333 -6.888 27.762
119 HG LEU 14 HG LEU 14 15.255 -6.834 25.484
120 HD11 LEU 14 HD11 LEU 14 16.023 -4.749 24.162
121 HD12 LEU 14 HD12 LEU 14 14.456 -4.704 25.006
122 HD13 LEU 14 HD13 LEU 14 15.875 -3.899 25.718
123 HD21 LEU 14 HD21 LEU 14 18.024 -5.743 26.054
124 HD22 LEU 14 HD22 LEU 14 17.523 -7.451 26.060
125 HD23 LEU 14 HD23 LEU 14 17.518 -6.526 24.538
126 H VAL 15 HN VAL 15 13.242 -3.227 26.298
127 HA VAL 15 HA VAL 15 11.075 -5.168 25.879
128 HB VAL 15 HB VAL 15 10.719 -2.182 25.879
129 HG11 VAL 15 HG11 VAL 15 8.533 -2.622 25.617
130 HG12 VAL 15 HG12 VAL 15 9.051 -4.264 25.166
131 HG13 VAL 15 HG13 VAL 15 8.553 -3.916 26.839
132 HG21 VAL 15 HG21 VAL 15 11.252 -3.906 28.188
133 HG22 VAL 15 HG22 VAL 15 11.218 -2.131 28.066
134 HG23 VAL 15 HG23 VAL 15 9.705 -3.035 28.312
135 H ARG 16 HN ARG 16 11.864 -6.001 23.922
136 HA ARG 16 HA ARG 16 12.385 -4.017 21.875
137 HB2 ARG 16 HB2 ARG 16 12.898 -7.034 21.842
138 HB3 ARG 16 HB3 ARG 16 13.416 -5.902 20.608
139 HG2 ARG 16 HG2 ARG 16 14.529 -4.674 22.751
140 HG3 ARG 16 HG3 ARG 16 14.488 -6.305 23.392
141 HD2 ARG 16 HD2 ARG 16 16.633 -5.729 22.160
142 HD3 ARG 16 HD3 ARG 16 15.826 -7.162 21.555
143 HE ARG 16 HE ARG 16 14.944 -4.771 20.152
144 HH11 ARG 16 HH22 ARG 16 17.553 -7.164 20.303
145 HH12 ARG 16 HH21 ARG 16 18.030 -6.930 18.654
146 HH22 ARG 16 HH1 ARG 16 16.853 -5.337 17.306
147 H TYR 17 HN TYR 17 10.732 -3.567 20.454
148 HA TYR 17 HA TYR 17 8.552 -5.503 20.262
149 HB2 TYR 17 HB2 TYR 17 8.623 -2.804 20.703
150 HB3 TYR 17 HB3 TYR 17 8.695 -2.756 18.953
151 HD1 TYR 17 HD1 TYR 17 6.625 -3.795 21.846
152 HD2 TYR 17 HD2 TYR 17 6.757 -3.215 17.609
153 HE1 TYR 17 HE1 TYR 17 4.096 -4.024 21.729
154 HE2 TYR 17 HE2 TYR 17 4.227 -3.447 17.506
155 HH TYR 17 HH TYR 17 2.443 -4.779 19.859
156 H ARG 18 HN ARG 18 7.582 -5.944 18.115
157 HA ARG 18 HA ARG 18 9.290 -5.386 15.885
158 HB2 ARG 18 HB2 ARG 18 9.061 -7.983 15.296
159 HB3 ARG 18 HB3 ARG 18 10.375 -7.416 16.308
160 HG2 ARG 18 HG2 ARG 18 9.119 -8.004 18.350
161 HG3 ARG 18 HG3 ARG 18 7.713 -8.443 17.400
162 HD2 ARG 18 HD2 ARG 18 8.534 -10.560 17.300
163 HD3 ARG 18 HD3 ARG 18 9.809 -9.958 16.260
164 HE ARG 18 HE ARG 18 10.384 -9.490 19.081
165 HH11 ARG 18 HH22 ARG 18 10.548 -11.913 16.501
166 HH12 ARG 18 HH21 ARG 18 11.831 -12.803 17.249
167 HH22 ARG 18 HH1 ARG 18 12.714 -12.051 19.346
168 H ARG 19 HN ARG 19 8.198 -6.033 13.777
169 HA ARG 19 HA ARG 19 5.676 -7.103 13.713
170 HB2 ARG 19 HB2 ARG 19 5.329 -4.741 14.913
171 HB3 ARG 19 HB3 ARG 19 5.444 -4.110 13.282
172 HG2 ARG 19 HG2 ARG 19 3.613 -6.461 13.738
173 HG3 ARG 19 HG3 ARG 19 3.094 -4.902 14.347
174 HD2 ARG 19 HD2 ARG 19 4.089 -4.412 11.714
175 HD3 ARG 19 HD3 ARG 19 3.125 -5.871 11.595
176 HE ARG 19 HE ARG 19 1.261 -4.490 11.760
177 HH11 ARG 19 HH22 ARG 19 3.860 -3.040 13.684
178 HH12 ARG 19 HH21 ARG 19 2.896 -1.698 14.202
179 HH22 ARG 19 HH1 ARG 19 0.623 -1.530 13.460
180 H CYS 20 HN CYS 20 4.744 -6.991 11.474
181 HA CYS 20 HA CYS 20 6.370 -5.628 9.520
182 HB2 CYS 20 HB2 CYS 20 6.174 -8.637 9.643
183 HB3 CYS 20 HB3 CYS 20 6.570 -7.773 8.171
184 H TRP 21 HN TRP 21 5.252 -5.689 7.347
185 HA TRP 21 HA TRP 21 2.366 -5.942 7.760
186 HB2 TRP 21 HB2 TRP 21 4.113 -4.206 6.093
187 HB3 TRP 21 HB3 TRP 21 2.561 -4.661 5.419
188 HD1 TRP 21 HD1 TRP 21 0.668 -2.981 6.040
189 HE1 TRP 21 HE1 TRP 21 0.113 -1.226 7.932
190 HE3 TRP 21 HE3 TRP 21 4.775 -3.953 8.875
191 HZ2 TRP 21 HZ2 TRP 21 1.426 -0.459 10.347
192 HZ3 TRP 21 HZ3 TRP 21 5.064 -2.658 10.985
193 HH2 TRP 21 HH2 TRP 21 3.471 -0.961 11.734
194 H1 ARG 31 HN ARG 31 7.552 -0.604 3.313
195 HA ARG 31 HA ARG 31 9.697 1.260 3.711
196 HB2 ARG 31 HB2 ARG 31 6.948 0.849 4.940
197 HB3 ARG 31 HB3 ARG 31 8.107 1.893 5.739
198 HG2 ARG 31 HG2 ARG 31 6.551 3.102 4.143
199 HG3 ARG 31 HG3 ARG 31 8.253 3.364 3.820
200 HD2 ARG 31 HD2 ARG 31 6.815 1.096 2.414
201 HD3 ARG 31 HD3 ARG 31 6.601 2.735 1.833
202 HE ARG 31 HE ARG 31 9.376 2.419 2.148
203 HH11 ARG 31 HH22 ARG 31 6.825 0.867 0.241
204 HH12 ARG 31 HH21 ARG 31 7.888 0.426 -1.053
205 HH22 ARG 31 HH1 ARG 31 10.209 1.006 -0.914
206 H TRP 32 HN TRP 32 10.794 1.464 5.855
207 HA TRP 32 HA TRP 32 10.666 -0.979 7.465
208 HB2 TRP 32 HB2 TRP 32 12.999 0.086 5.965
209 HB3 TRP 32 HB3 TRP 32 13.296 -0.480 7.596
210 HD1 TRP 32 HD1 TRP 32 12.424 -1.796 4.112
211 HE1 TRP 32 HE1 TRP 32 12.573 -4.428 3.998
212 HE3 TRP 32 HE3 TRP 32 12.981 -2.505 9.116
213 HZ2 TRP 32 HZ2 TRP 32 12.899 -6.465 5.970
214 HZ3 TRP 32 HZ3 TRP 32 13.208 -4.847 9.939
215 HH2 TRP 32 HH2 TRP 32 13.174 -6.789 8.455
216 H CYS 33 HN CYS 33 9.756 -0.082 9.299
217 HA CYS 33 HA CYS 33 10.613 2.556 10.104
218 HB2 CYS 33 HB2 CYS 33 8.377 0.726 10.796
219 HB3 CYS 33 HB3 CYS 33 8.931 1.805 12.061
220 H VAL 34 HN VAL 34 11.522 2.938 12.284
221 HA VAL 34 HA VAL 34 12.451 0.612 13.725
222 HB VAL 34 HB VAL 34 14.790 1.306 13.657
223 HG11 VAL 34 HG11 VAL 34 15.326 0.347 11.573
224 HG12 VAL 34 HG12 VAL 34 13.731 -0.330 11.982
225 HG13 VAL 34 HG13 VAL 34 13.860 0.992 10.797
226 HG21 VAL 34 HG21 VAL 34 14.457 3.702 13.205
227 HG22 VAL 34 HG22 VAL 34 15.586 2.968 12.041
228 HG23 VAL 34 HG23 VAL 34 13.909 3.316 11.556
229 H TYR 35 HN TYR 35 12.168 1.022 15.856
230 HA TYR 35 HA TYR 35 12.547 3.765 16.780
231 HB2 TYR 35 HB2 TYR 35 10.054 2.849 16.140
232 HB3 TYR 35 HB3 TYR 35 10.190 2.065 17.701
233 HD1 TYR 35 HD2 TYR 35 11.033 3.717 19.663
234 HD2 TYR 35 HD1 TYR 35 9.057 4.942 16.072
235 HE1 TYR 35 HE2 TYR 35 10.284 5.865 20.799
236 HE2 TYR 35 HE1 TYR 35 8.315 7.086 17.220
237 HH TYR 35 HH TYR 35 8.338 8.257 19.027
238 H ALA 36 HN ALA 36 14.092 3.576 18.325
239 HA ALA 36 HA ALA 36 13.713 1.449 20.303
240 HB1 ALA 36 HB1 ALA 36 15.405 0.528 18.914
241 HB2 ALA 36 HB2 ALA 36 16.210 2.103 18.709
242 HB3 ALA 36 HB3 ALA 36 16.281 1.264 20.277
243 H TYR 37 HN TYR 37 14.582 1.982 22.420
244 HA TYR 37 HA TYR 37 15.486 4.737 22.736
245 HB2 TYR 37 HB2 TYR 37 12.870 4.334 22.931
246 HB3 TYR 37 HB3 TYR 37 13.246 3.430 24.384
247 HD1 TYR 37 HD2 TYR 37 14.461 4.643 26.290
248 HD2 TYR 37 HD1 TYR 37 12.682 6.692 22.982
249 HE1 TYR 37 HE2 TYR 37 14.435 6.802 27.632
250 HE2 TYR 37 HE1 TYR 37 12.662 8.844 24.336
251 HH TYR 37 HH TYR 37 13.606 8.848 27.729
252 H VAL 38 HN VAL 38 17.521 3.517 23.145
253 HA VAL 38 HA VAL 38 17.473 2.095 25.705
254 HB VAL 38 HB VAL 38 19.508 2.187 23.470
255 HG11 VAL 38 HG11 VAL 38 20.591 0.304 24.754
256 HG12 VAL 38 HG12 VAL 38 20.717 1.908 25.516
257 HG13 VAL 38 HG13 VAL 38 19.536 0.723 26.125
258 HG21 VAL 38 HG21 VAL 38 18.099 0.698 22.545
259 HG22 VAL 38 HG22 VAL 38 18.712 -0.429 23.780
260 HG23 VAL 38 HG23 VAL 38 17.198 0.464 24.063
261 H ARG 39 HN ARG 39 18.622 2.840 27.480
262 HA ARG 39 HA ARG 39 20.044 5.338 27.027
263 HB2 ARG 39 HB2 ARG 39 17.703 5.413 28.256
264 HB3 ARG 39 HB3 ARG 39 18.573 4.743 29.622
265 HG2 ARG 39 HG2 ARG 39 20.167 6.654 29.570
266 HG3 ARG 39 HG3 ARG 39 19.354 7.313 28.164
267 HD2 ARG 39 HD2 ARG 39 18.169 8.518 29.723
268 HD3 ARG 39 HD3 ARG 39 17.208 7.057 29.846
269 HE ARG 39 HE ARG 39 19.536 6.953 31.587
270 HH11 ARG 39 HH22 ARG 39 16.245 8.239 31.333
271 HH12 ARG 39 HH21 ARG 39 16.018 8.339 33.047
272 HH22 ARG 39 HH1 ARG 39 17.791 7.655 34.507
273 H ILE 40 HN ILE 40 22.092 5.465 27.997
274 HA ILE 40 HA ILE 40 22.736 3.458 30.016
275 HB ILE 40 HB ILE 40 24.209 3.880 27.419
276 HG12 ILE 40 HG12 ILE 40 23.836 1.146 28.064
277 HG13 ILE 40 HG13 ILE 40 22.300 1.936 28.362
278 HG21 ILE 40 HG21 ILE 40 25.128 2.427 29.913
279 HG22 ILE 40 HG22 ILE 40 25.901 2.306 28.315
280 HG23 ILE 40 HG23 ILE 40 25.867 3.866 29.170
281 HD11 ILE 40 HD11 ILE 40 22.504 1.162 26.001
282 HD12 ILE 40 HD12 ILE 40 22.328 2.931 26.098
283 HD13 ILE 40 HD13 ILE 40 23.927 2.212 25.792
284 H ARG 41 HN ARG 41 24.819 4.019 31.166
285 HA ARG 41 HA ARG 41 25.710 5.494 32.514
286 HB2 ARG 41 HB2 ARG 41 26.408 6.578 29.752
287 HB3 ARG 41 HB3 ARG 41 27.090 7.291 31.200
288 HG2 ARG 41 HG2 ARG 41 27.289 4.319 30.525
289 HG3 ARG 41 HG3 ARG 41 28.531 5.489 30.125
290 HD2 ARG 41 HD2 ARG 41 27.764 5.751 32.938
291 HD3 ARG 41 HD3 ARG 41 28.217 4.096 32.585
292 HE ARG 41 HE ARG 41 30.128 5.888 31.390
293 HH11 ARG 41 HH22 ARG 41 29.149 4.623 34.551
294 HH12 ARG 41 HH21 ARG 41 30.717 4.829 35.257
295 HH22 ARG 41 HH1 ARG 41 32.494 5.734 33.928
296 H GLY 42 HN GLY 42 25.203 8.056 30.054
297 HA2 GLY 42 HA1 GLY 42 22.952 9.184 31.530
298 HA3 GLY 42 HA2 GLY 42 24.442 10.107 31.542
299 H VAL 43 HN VAL 43 23.279 8.023 28.844
300 HA VAL 43 HA VAL 43 22.595 10.424 27.333
301 HB VAL 43 HB VAL 43 24.231 8.336 25.977
302 HG11 VAL 43 HG11 VAL 43 24.043 9.838 24.340
303 HG12 VAL 43 HG12 VAL 43 23.235 10.985 25.436
304 HG13 VAL 43 HG13 VAL 43 25.010 10.976 25.310
305 HG21 VAL 43 HG21 VAL 43 26.312 9.646 26.597
306 HG22 VAL 43 HG22 VAL 43 25.350 10.406 27.887
307 HG23 VAL 43 HG23 VAL 43 25.614 8.646 27.893
308 H LEU 44 HN LEU 44 20.725 10.152 26.200
309 HA LEU 44 HA LEU 44 19.617 7.454 26.205
310 HB2 LEU 44 HB2 LEU 44 18.011 8.744 27.117
311 HB3 LEU 44 HB3 LEU 44 18.542 10.201 26.302
312 HG LEU 44 HG LEU 44 17.482 9.416 24.208
313 HD11 LEU 44 HD11 LEU 44 17.086 7.245 23.952
314 HD12 LEU 44 HD12 LEU 44 17.289 6.932 25.692
315 HD13 LEU 44 HD13 LEU 44 15.704 7.436 25.057
316 HD21 LEU 44 HD21 LEU 44 15.131 9.703 24.948
317 HD22 LEU 44 HD22 LEU 44 15.675 9.552 26.636
318 HD23 LEU 44 HD23 LEU 44 16.243 10.911 25.637
319 H VAL 45 HN VAL 45 19.994 6.235 24.438
320 HA VAL 45 HA VAL 45 20.404 7.636 21.906
321 HB VAL 45 HB VAL 45 20.861 4.710 22.410
322 HG11 VAL 45 HG11 VAL 45 21.802 4.737 20.384
323 HG12 VAL 45 HG12 VAL 45 21.165 6.388 20.188
324 HG13 VAL 45 HG13 VAL 45 22.818 6.138 20.802
325 HG21 VAL 45 HG21 VAL 45 22.133 5.466 24.186
326 HG22 VAL 45 HG22 VAL 45 23.317 5.543 22.859
327 HG23 VAL 45 HG23 VAL 45 22.496 7.025 23.407
328 H ARG 46 HN ARG 46 18.139 8.154 21.581
329 HA ARG 46 HA ARG 46 16.504 5.794 21.151
330 HB2 ARG 46 HB2 ARG 46 15.355 7.296 22.613
331 HB3 ARG 46 HB3 ARG 46 15.869 8.712 21.718
332 HG2 ARG 46 HG2 ARG 46 14.437 8.001 19.785
333 HG3 ARG 46 HG3 ARG 46 13.912 6.599 20.695
334 HD2 ARG 46 HD2 ARG 46 12.217 7.909 21.475
335 HD3 ARG 46 HD3 ARG 46 13.420 8.684 22.487
336 HE ARG 46 HE ARG 46 13.512 9.879 19.883
337 HH11 ARG 46 HH22 ARG 46 11.401 9.733 22.725
338 HH12 ARG 46 HH21 ARG 46 10.690 11.285 22.431
339 HH22 ARG 46 HH1 ARG 46 11.395 12.556 20.525
340 H TYR 47 HN TYR 47 15.174 5.691 19.150
341 HA TYR 47 HA TYR 47 16.050 7.503 17.028
342 HB2 TYR 47 HB2 TYR 47 17.374 5.252 17.203
343 HB3 TYR 47 HB3 TYR 47 15.860 4.433 16.875
344 HD1 TYR 47 HD1 TYR 47 14.596 5.296 14.676
345 HD2 TYR 47 HD2 TYR 47 18.790 5.705 15.417
346 HE1 TYR 47 HE1 TYR 47 15.023 5.521 12.179
347 HE2 TYR 47 HE2 TYR 47 19.202 5.929 12.918
348 HH TYR 47 HH TYR 47 16.692 6.489 10.721
349 H ARG 48 HN ARG 48 14.477 7.919 15.458
350 HA ARG 48 HA ARG 48 12.119 6.290 15.494
351 HB2 ARG 48 HB2 ARG 48 10.762 8.590 15.576
352 HB3 ARG 48 HB3 ARG 48 11.221 7.779 17.060
353 HG2 ARG 48 HG2 ARG 48 12.634 9.461 17.670
354 HG3 ARG 48 HG3 ARG 48 13.379 9.523 16.085
355 HD2 ARG 48 HD2 ARG 48 12.011 11.230 15.356
356 HD3 ARG 48 HD3 ARG 48 10.594 10.580 16.158
357 HE ARG 48 HE ARG 48 12.610 11.648 18.008
358 HH11 ARG 48 HH22 ARG 48 9.755 12.420 16.057
359 HH12 ARG 48 HH21 ARG 48 9.335 13.813 16.998
360 HH22 ARG 48 HH1 ARG 48 10.702 14.420 18.870
361 H ARG 49 HN ARG 49 12.161 5.789 13.305
362 HA ARG 49 HA ARG 49 11.443 7.689 11.464
363 HB2 ARG 49 HB2 ARG 49 14.027 8.203 11.957
364 HB3 ARG 49 HB3 ARG 49 14.295 6.850 10.876
365 HG2 ARG 49 HG2 ARG 49 12.312 8.883 9.928
366 HG3 ARG 49 HG3 ARG 49 13.972 9.436 10.027
367 HD2 ARG 49 HD2 ARG 49 13.708 6.746 8.799
368 HD3 ARG 49 HD3 ARG 49 12.876 8.001 7.902
369 HE ARG 49 HE ARG 49 15.321 9.167 8.429
370 HH11 ARG 49 HH22 ARG 49 14.391 6.062 6.997
371 HH12 ARG 49 HH21 ARG 49 15.804 5.957 6.001
372 HH22 ARG 49 HH1 ARG 49 17.434 7.713 6.087
373 H CYS 50 HN CYS 50 11.665 6.727 9.106
374 HA CYS 50 HA CYS 50 11.980 3.837 9.194
375 HB2 CYS 50 HB2 CYS 50 9.572 4.971 7.814
376 HB3 CYS 50 HB3 CYS 50 9.891 3.324 8.318
377 H TRP 51 HN TRP 51 13.047 3.124 7.346
378 HA TRP 51 HA TRP 51 13.718 5.166 5.395
379 HB2 TRP 51 HB2 TRP 51 15.598 4.015 6.144
380 HB3 TRP 51 HB3 TRP 51 14.797 2.457 6.104
381 HD1 TRP 51 HD1 TRP 51 17.132 4.502 4.078
382 HE1 TRP 51 HE1 TRP 51 17.529 3.547 1.650
383 HE3 TRP 51 HE3 TRP 51 13.228 1.245 4.152
384 HZ2 TRP 51 HZ2 TRP 51 16.196 1.581 0.069
385 HZ3 TRP 51 HZ3 TRP 51 12.845 -0.155 2.125
386 HH2 TRP 51 HH2 TRP 51 14.254 -0.026 0.132
Start of MODEL 4
1 H1 ARG 1 HN ARG 1 8.877 -6.021 1.227
2 HA ARG 1 HA ARG 1 6.149 -5.640 2.170
3 HB2 ARG 1 HB2 ARG 1 8.335 -7.575 2.955
4 HB3 ARG 1 HB3 ARG 1 7.220 -7.055 4.203
5 HG2 ARG 1 HG2 ARG 1 5.760 -7.738 1.761
6 HG3 ARG 1 HG3 ARG 1 6.789 -9.071 2.245
7 HD2 ARG 1 HD2 ARG 1 5.101 -7.678 4.342
8 HD3 ARG 1 HD3 ARG 1 4.341 -8.831 3.263
9 HE ARG 1 HE ARG 1 6.090 -9.463 5.467
10 HH11 ARG 1 HH22 ARG 1 5.281 -10.537 2.189
11 HH12 ARG 1 HH21 ARG 1 5.769 -12.174 2.471
12 HH22 ARG 1 HH1 ARG 1 6.621 -12.791 4.625
13 H TRP 2 HN TRP 2 5.869 -4.485 4.217
14 HA TRP 2 HA TRP 2 8.199 -2.816 4.862
15 HB2 TRP 2 HB2 TRP 2 5.398 -2.086 5.614
16 HB3 TRP 2 HB3 TRP 2 6.788 -1.056 5.333
17 HD1 TRP 2 HD1 TRP 2 3.686 -1.321 3.779
18 HE1 TRP 2 HE1 TRP 2 3.620 -1.012 1.160
19 HE3 TRP 2 HE3 TRP 2 8.643 -2.172 3.027
20 HZ2 TRP 2 HZ2 TRP 2 5.603 -1.155 -0.888
21 HZ3 TRP 2 HZ3 TRP 2 9.496 -2.068 0.687
22 HH2 TRP 2 HH2 TRP 2 8.064 -1.580 -1.233
23 H CYS 3 HN CYS 3 9.066 -3.006 6.903
24 HA CYS 3 HA CYS 3 7.425 -4.403 8.883
25 HB2 CYS 3 HB2 CYS 3 10.153 -5.072 7.909
26 HB3 CYS 3 HB3 CYS 3 9.877 -5.193 9.636
27 H VAL 4 HN VAL 4 8.565 -4.032 11.179
28 HA VAL 4 HA VAL 4 9.978 -1.514 11.312
29 HB VAL 4 HB VAL 4 8.398 -0.316 12.505
30 HG11 VAL 4 HG11 VAL 4 6.807 -1.900 10.458
31 HG12 VAL 4 HG12 VAL 4 6.333 -0.332 11.155
32 HG13 VAL 4 HG13 VAL 4 7.790 -0.450 10.140
33 HG21 VAL 4 HG21 VAL 4 6.146 -1.530 13.154
34 HG22 VAL 4 HG22 VAL 4 7.165 -2.988 13.091
35 HG23 VAL 4 HG23 VAL 4 7.584 -1.656 14.195
36 H TYR 5 HN TYR 5 11.586 -1.792 12.766
37 HA TYR 5 HA TYR 5 11.131 -3.813 14.857
38 HB2 TYR 5 HB2 TYR 5 13.408 -2.952 13.037
39 HB3 TYR 5 HB3 TYR 5 13.856 -3.499 14.640
40 HD1 TYR 5 HD1 TYR 5 11.896 -5.692 15.094
41 HD2 TYR 5 HD2 TYR 5 14.136 -4.652 11.600
42 HE1 TYR 5 HE1 TYR 5 11.786 -8.104 14.297
43 HE2 TYR 5 HE2 TYR 5 14.018 -7.067 10.815
44 HH TYR 5 HH TYR 5 13.021 -9.010 11.122
45 H ALA 6 HN ALA 6 11.301 -3.181 16.966
46 HA ALA 6 HA ALA 6 12.529 -0.554 17.445
47 HB1 ALA 6 HB1 ALA 6 9.803 -1.525 17.980
48 HB2 ALA 6 HB2 ALA 6 10.609 -0.871 19.426
49 HB3 ALA 6 HB3 ALA 6 10.441 0.137 17.968
50 H TYR 7 HN TYR 7 13.754 -0.370 19.372
51 HA TYR 7 HA TYR 7 13.989 -2.809 20.970
52 HB2 TYR 7 HB2 TYR 7 15.755 -2.744 19.148
53 HB3 TYR 7 HB3 TYR 7 16.199 -1.121 19.637
54 HD1 TYR 7 HD2 TYR 7 17.057 -0.832 22.091
55 HD2 TYR 7 HD1 TYR 7 16.880 -4.589 20.053
56 HE1 TYR 7 HE2 TYR 7 18.772 -1.794 23.702
57 HE2 TYR 7 HE1 TYR 7 18.597 -5.539 21.671
58 HH TYR 7 HH TYR 7 20.130 -3.471 24.090
59 H VAL 8 HN VAL 8 13.486 -2.177 23.009
60 HA VAL 8 HA VAL 8 14.393 0.495 23.822
61 HB VAL 8 HB VAL 8 12.140 -1.242 24.849
62 HG11 VAL 8 HG11 VAL 8 13.333 1.332 25.840
63 HG12 VAL 8 HG12 VAL 8 11.587 1.041 26.026
64 HG13 VAL 8 HG13 VAL 8 12.759 -0.083 26.754
65 HG21 VAL 8 HG21 VAL 8 10.785 0.790 24.007
66 HG22 VAL 8 HG22 VAL 8 12.237 1.186 23.057
67 HG23 VAL 8 HG23 VAL 8 11.403 -0.366 22.803
68 H ARG 9 HN ARG 9 15.642 0.733 25.689
69 HA ARG 9 HA ARG 9 16.111 -1.609 27.267
70 HB2 ARG 9 HB2 ARG 9 17.924 -2.099 25.875
71 HB3 ARG 9 HB3 ARG 9 18.141 -0.431 25.385
72 HG2 ARG 9 HG2 ARG 9 19.237 0.143 27.466
73 HG3 ARG 9 HG3 ARG 9 18.751 -1.362 28.221
74 HD2 ARG 9 HD2 ARG 9 20.123 -2.335 26.042
75 HD3 ARG 9 HD3 ARG 9 20.990 -0.836 26.310
76 HE ARG 9 HE ARG 9 21.171 -3.187 27.937
77 HH11 ARG 9 HH22 ARG 9 20.994 0.336 28.278
78 HH12 ARG 9 HH21 ARG 9 21.848 0.357 29.785
79 HH22 ARG 9 HH1 ARG 9 22.604 -1.710 30.735
80 H ILE 10 HN ILE 10 15.758 -0.777 29.305
81 HA ILE 10 HA ILE 10 17.220 1.634 30.027
82 HB ILE 10 HB ILE 10 14.368 1.443 30.879
83 HG12 ILE 10 HG12 ILE 10 15.280 2.493 28.185
84 HG13 ILE 10 HG13 ILE 10 14.213 1.133 28.470
85 HG21 ILE 10 HG21 ILE 10 14.713 3.506 31.655
86 HG22 ILE 10 HG22 ILE 10 16.445 3.187 31.398
87 HG23 ILE 10 HG23 ILE 10 15.501 4.038 30.151
88 HD11 ILE 10 HD11 ILE 10 12.516 2.641 28.299
89 HD12 ILE 10 HD12 ILE 10 12.984 3.161 29.935
90 HD13 ILE 10 HD13 ILE 10 13.618 4.023 28.512
91 H ARG 11 HN ARG 11 17.610 1.805 32.329
92 HA ARG 11 HA ARG 11 18.163 0.990 34.251
93 HB2 ARG 11 HB2 ARG 11 15.487 -0.334 33.803
94 HB3 ARG 11 HB3 ARG 11 16.440 -0.889 35.165
95 HG2 ARG 11 HG2 ARG 11 15.637 0.880 36.337
96 HG3 ARG 11 HG3 ARG 11 16.632 1.913 35.330
97 HD2 ARG 11 HD2 ARG 11 14.795 2.215 33.721
98 HD3 ARG 11 HD3 ARG 11 13.807 1.037 34.561
99 HE ARG 11 HE ARG 11 14.547 3.034 36.452
100 HH11 ARG 11 HH22 ARG 11 12.567 2.742 33.529
101 HH12 ARG 11 HH21 ARG 11 11.481 4.010 33.988
102 HH22 ARG 11 HH1 ARG 11 11.822 5.152 36.067
103 H GLY 12 HN GLY 12 16.590 -2.099 33.229
104 HA2 GLY 12 HA1 GLY 12 19.080 -3.315 32.436
105 HA3 GLY 12 HA2 GLY 12 18.518 -3.835 34.012
106 H VAL 13 HN VAL 13 16.193 -2.804 31.529
107 HA VAL 13 HA VAL 13 15.517 -5.631 31.095
108 HB VAL 13 HB VAL 13 13.603 -3.308 31.395
109 HG11 VAL 13 HG11 VAL 13 13.268 -6.225 30.747
110 HG12 VAL 13 HG12 VAL 13 11.993 -5.366 31.645
111 HG13 VAL 13 HG13 VAL 13 12.478 -4.801 30.028
112 HG21 VAL 13 HG21 VAL 13 14.576 -5.388 33.344
113 HG22 VAL 13 HG22 VAL 13 14.343 -3.639 33.575
114 HG23 VAL 13 HG23 VAL 13 12.932 -4.719 33.485
115 H LEU 14 HN LEU 14 15.505 -6.238 28.986
116 HA LEU 14 HA LEU 14 15.695 -4.077 27.023
117 HB2 LEU 14 HB2 LEU 14 17.571 -5.589 27.078
118 HB3 LEU 14 HB3 LEU 14 16.516 -6.981 26.931
119 HG LEU 14 HG LEU 14 16.180 -6.689 24.683
120 HD11 LEU 14 HD11 LEU 14 15.159 -4.589 24.557
121 HD12 LEU 14 HD12 LEU 14 16.601 -3.744 25.170
122 HD13 LEU 14 HD13 LEU 14 16.604 -4.436 23.530
123 HD21 LEU 14 HD21 LEU 14 18.500 -7.177 24.911
124 HD22 LEU 14 HD22 LEU 14 18.337 -5.964 23.618
125 HD23 LEU 14 HD23 LEU 14 18.894 -5.471 25.235
126 H VAL 15 HN VAL 15 13.816 -3.514 26.073
127 HA VAL 15 HA VAL 15 11.860 -5.667 25.655
128 HB VAL 15 HB VAL 15 11.156 -2.758 25.684
129 HG11 VAL 15 HG11 VAL 15 9.375 -4.658 27.006
130 HG12 VAL 15 HG12 VAL 15 9.048 -3.514 25.683
131 HG13 VAL 15 HG13 VAL 15 9.728 -5.119 25.324
132 HG21 VAL 15 HG21 VAL 15 10.584 -3.510 28.251
133 HG22 VAL 15 HG22 VAL 15 12.147 -4.320 27.986
134 HG23 VAL 15 HG23 VAL 15 12.008 -2.560 27.764
135 H ARG 16 HN ARG 16 12.573 -6.385 23.626
136 HA ARG 16 HA ARG 16 12.931 -4.357 21.613
137 HB2 ARG 16 HB2 ARG 16 13.316 -7.392 21.550
138 HB3 ARG 16 HB3 ARG 16 13.637 -6.344 20.183
139 HG2 ARG 16 HG2 ARG 16 15.280 -5.052 21.615
140 HG3 ARG 16 HG3 ARG 16 15.011 -6.204 22.909
141 HD2 ARG 16 HD2 ARG 16 16.543 -6.534 20.366
142 HD3 ARG 16 HD3 ARG 16 16.830 -7.251 21.940
143 HE ARG 16 HE ARG 16 15.361 -9.039 21.401
144 HH11 ARG 16 HH22 ARG 16 15.325 -6.578 18.852
145 HH12 ARG 16 HH21 ARG 16 14.504 -7.592 17.713
146 HH22 ARG 16 HH1 ARG 16 13.898 -9.822 18.349
147 H TYR 17 HN TYR 17 11.091 -3.673 20.556
148 HA TYR 17 HA TYR 17 8.865 -5.545 20.325
149 HB2 TYR 17 HB2 TYR 17 9.052 -2.920 21.077
150 HB3 TYR 17 HB3 TYR 17 8.954 -2.661 19.347
151 HD1 TYR 17 HD1 TYR 17 7.177 -4.564 22.053
152 HD2 TYR 17 HD2 TYR 17 6.855 -2.373 18.392
153 HE1 TYR 17 HE1 TYR 17 4.643 -4.737 22.164
154 HE2 TYR 17 HE2 TYR 17 4.322 -2.554 18.515
155 HH TYR 17 HH TYR 17 2.740 -3.795 21.360
156 H ARG 18 HN ARG 18 7.667 -5.671 18.241
157 HA ARG 18 HA ARG 18 9.188 -4.895 15.942
158 HB2 ARG 18 HB2 ARG 18 8.784 -7.389 15.067
159 HB3 ARG 18 HB3 ARG 18 10.212 -6.997 16.003
160 HG2 ARG 18 HG2 ARG 18 9.080 -7.759 18.086
161 HG3 ARG 18 HG3 ARG 18 7.619 -8.104 17.181
162 HD2 ARG 18 HD2 ARG 18 8.488 -10.220 17.011
163 HD3 ARG 18 HD3 ARG 18 9.446 -9.541 15.710
164 HE ARG 18 HE ARG 18 11.343 -9.756 17.051
165 HH11 ARG 18 HH22 ARG 18 8.491 -9.752 19.152
166 HH12 ARG 18 HH21 ARG 18 9.396 -10.084 20.591
167 HH22 ARG 18 HH1 ARG 18 11.775 -10.339 20.448
168 H ARG 19 HN ARG 19 7.876 -5.504 13.854
169 HA ARG 19 HA ARG 19 5.268 -6.326 14.032
170 HB2 ARG 19 HB2 ARG 19 5.278 -3.943 15.254
171 HB3 ARG 19 HB3 ARG 19 5.275 -3.324 13.615
172 HG2 ARG 19 HG2 ARG 19 3.296 -5.496 14.281
173 HG3 ARG 19 HG3 ARG 19 2.991 -3.899 14.934
174 HD2 ARG 19 HD2 ARG 19 3.772 -3.678 12.130
175 HD3 ARG 19 HD3 ARG 19 2.451 -4.819 12.286
176 HE ARG 19 HE ARG 19 2.075 -2.325 13.804
177 HH11 ARG 19 HH22 ARG 19 1.520 -3.985 10.723
178 HH12 ARG 19 HH21 ARG 19 0.209 -2.952 10.260
179 HH22 ARG 19 HH1 ARG 19 -0.465 -1.182 11.728
180 H CYS 20 HN CYS 20 4.131 -6.078 11.892
181 HA CYS 20 HA CYS 20 5.703 -4.877 9.792
182 HB2 CYS 20 HB2 CYS 20 5.111 -7.842 9.832
183 HB3 CYS 20 HB3 CYS 20 5.638 -6.955 8.416
184 H TRP 21 HN TRP 21 4.375 -5.054 7.650
185 HA TRP 21 HA TRP 21 1.548 -4.793 8.372
186 HB2 TRP 21 HB2 TRP 21 2.088 -2.803 7.417
187 HB3 TRP 21 HB3 TRP 21 3.339 -3.485 6.398
188 HD1 TRP 21 HD1 TRP 21 -0.228 -2.351 6.240
189 HE1 TRP 21 HE1 TRP 21 -1.351 -2.825 3.899
190 HE3 TRP 21 HE3 TRP 21 3.433 -5.430 4.516
191 HZ2 TRP 21 HZ2 TRP 21 -0.599 -4.398 1.640
192 HZ3 TRP 21 HZ3 TRP 21 3.162 -6.393 2.233
193 HH2 TRP 21 HH2 TRP 21 1.231 -5.922 0.810
194 H1 ARG 31 HN ARG 31 6.863 0.516 4.181
195 HA ARG 31 HA ARG 31 9.589 1.077 3.482
196 HB2 ARG 31 HB2 ARG 31 7.828 2.253 5.692
197 HB3 ARG 31 HB3 ARG 31 9.391 2.878 5.207
198 HG2 ARG 31 HG2 ARG 31 6.819 2.830 3.579
199 HG3 ARG 31 HG3 ARG 31 7.738 4.233 4.089
200 HD2 ARG 31 HD2 ARG 31 9.667 2.889 2.661
201 HD3 ARG 31 HD3 ARG 31 8.232 2.371 1.800
202 HE ARG 31 HE ARG 31 8.408 5.274 2.327
203 HH11 ARG 31 HH22 ARG 31 8.982 2.645 0.021
204 HH12 ARG 31 HH21 ARG 31 9.032 3.696 -1.354
205 HH22 ARG 31 HH1 ARG 31 8.732 6.053 -1.042
206 H TRP 32 HN TRP 32 10.707 1.725 6.002
207 HA TRP 32 HA TRP 32 10.435 -0.696 7.610
208 HB2 TRP 32 HB2 TRP 32 12.818 0.099 6.029
209 HB3 TRP 32 HB3 TRP 32 13.108 -0.447 7.669
210 HD1 TRP 32 HD1 TRP 32 12.016 -1.772 4.251
211 HE1 TRP 32 HE1 TRP 32 11.910 -4.408 4.216
212 HE3 TRP 32 HE3 TRP 32 12.642 -2.387 9.260
213 HZ2 TRP 32 HZ2 TRP 32 12.095 -6.410 6.241
214 HZ3 TRP 32 HZ3 TRP 32 12.668 -4.715 10.149
215 HH2 TRP 32 HH2 TRP 32 12.407 -6.687 8.728
216 H CYS 33 HN CYS 33 9.645 0.336 9.432
217 HA CYS 33 HA CYS 33 10.788 2.883 10.171
218 HB2 CYS 33 HB2 CYS 33 8.389 1.307 10.935
219 HB3 CYS 33 HB3 CYS 33 9.077 2.338 12.174
220 H VAL 34 HN VAL 34 11.688 3.199 12.396
221 HA VAL 34 HA VAL 34 12.461 0.798 13.806
222 HB VAL 34 HB VAL 34 14.817 1.223 13.706
223 HG11 VAL 34 HG11 VAL 34 15.284 0.581 11.444
224 HG12 VAL 34 HG12 VAL 34 13.715 -0.132 11.892
225 HG13 VAL 34 HG13 VAL 34 13.772 1.318 10.860
226 HG21 VAL 34 HG21 VAL 34 14.071 3.639 12.035
227 HG22 VAL 34 HG22 VAL 34 14.947 3.602 13.584
228 HG23 VAL 34 HG23 VAL 34 15.719 2.970 12.110
229 H TYR 35 HN TYR 35 12.117 1.212 15.924
230 HA TYR 35 HA TYR 35 12.686 3.918 16.881
231 HB2 TYR 35 HB2 TYR 35 10.164 3.255 16.250
232 HB3 TYR 35 HB3 TYR 35 10.239 2.258 17.690
233 HD1 TYR 35 HD2 TYR 35 10.207 5.715 16.415
234 HD2 TYR 35 HD1 TYR 35 10.258 3.253 19.913
235 HE1 TYR 35 HE2 TYR 35 9.585 7.722 17.845
236 HE2 TYR 35 HE1 TYR 35 9.636 5.269 21.332
237 HH TYR 35 HH TYR 35 8.432 7.445 20.934
238 H ALA 36 HN ALA 36 14.204 3.671 18.442
239 HA ALA 36 HA ALA 36 13.799 1.458 20.327
240 HB1 ALA 36 HB1 ALA 36 16.395 1.428 20.382
241 HB2 ALA 36 HB2 ALA 36 15.577 0.658 19.001
242 HB3 ALA 36 HB3 ALA 36 16.294 2.278 18.822
243 H TYR 37 HN TYR 37 14.532 1.906 22.503
244 HA TYR 37 HA TYR 37 15.212 4.716 22.987
245 HB2 TYR 37 HB2 TYR 37 12.687 4.034 23.238
246 HB3 TYR 37 HB3 TYR 37 13.199 2.987 24.546
247 HD1 TYR 37 HD2 TYR 37 14.247 4.012 26.612
248 HD2 TYR 37 HD1 TYR 37 12.369 6.372 23.577
249 HE1 TYR 37 HE2 TYR 37 14.053 5.959 28.236
250 HE2 TYR 37 HE1 TYR 37 12.181 8.311 25.212
251 HH TYR 37 HH TYR 37 12.088 8.635 27.613
252 H VAL 38 HN VAL 38 17.403 3.883 23.311
253 HA VAL 38 HA VAL 38 17.659 2.188 25.686
254 HB VAL 38 HB VAL 38 19.586 2.891 23.464
255 HG11 VAL 38 HG11 VAL 38 20.780 2.631 25.592
256 HG12 VAL 38 HG12 VAL 38 19.990 1.057 25.853
257 HG13 VAL 38 HG13 VAL 38 21.121 1.271 24.496
258 HG21 VAL 38 HG21 VAL 38 19.271 0.136 23.557
259 HG22 VAL 38 HG22 VAL 38 17.628 0.751 23.859
260 HG23 VAL 38 HG23 VAL 38 18.507 1.244 22.392
261 H ARG 39 HN ARG 39 18.781 2.891 27.515
262 HA ARG 39 HA ARG 39 19.821 5.593 27.352
263 HB2 ARG 39 HB2 ARG 39 17.410 5.385 28.386
264 HB3 ARG 39 HB3 ARG 39 18.214 4.663 29.766
265 HG2 ARG 39 HG2 ARG 39 19.687 6.704 29.941
266 HG3 ARG 39 HG3 ARG 39 18.808 7.428 28.609
267 HD2 ARG 39 HD2 ARG 39 17.242 8.189 30.065
268 HD3 ARG 39 HD3 ARG 39 16.831 6.537 30.482
269 HE ARG 39 HE ARG 39 19.077 6.916 31.989
270 HH11 ARG 39 HH22 ARG 39 16.186 8.921 31.571
271 HH12 ARG 39 HH21 ARG 39 16.283 9.611 33.157
272 HH22 ARG 39 HH1 ARG 39 18.068 8.952 34.616
273 H ILE 40 HN ILE 40 21.720 5.911 28.588
274 HA ILE 40 HA ILE 40 22.426 3.894 30.546
275 HB ILE 40 HB ILE 40 23.856 4.303 27.944
276 HG12 ILE 40 HG12 ILE 40 22.431 2.150 29.303
277 HG13 ILE 40 HG13 ILE 40 22.841 2.339 27.610
278 HG21 ILE 40 HG21 ILE 40 25.524 4.793 29.654
279 HG22 ILE 40 HG22 ILE 40 25.119 3.283 30.504
280 HG23 ILE 40 HG23 ILE 40 25.847 3.223 28.881
281 HD11 ILE 40 HD11 ILE 40 24.784 1.411 29.776
282 HD12 ILE 40 HD12 ILE 40 23.950 0.347 28.619
283 HD13 ILE 40 HD13 ILE 40 25.140 1.535 28.036
284 H ARG 41 HN ARG 41 24.228 4.603 31.931
285 HA ARG 41 HA ARG 41 25.097 6.100 33.231
286 HB2 ARG 41 HB2 ARG 41 25.637 7.394 30.523
287 HB3 ARG 41 HB3 ARG 41 26.255 8.098 32.004
288 HG2 ARG 41 HG2 ARG 41 26.754 5.185 31.256
289 HG3 ARG 41 HG3 ARG 41 27.827 6.476 30.754
290 HD2 ARG 41 HD2 ARG 41 27.091 6.322 33.678
291 HD3 ARG 41 HD3 ARG 41 28.216 5.131 33.056
292 HE ARG 41 HE ARG 41 28.813 7.885 33.582
293 HH11 ARG 41 HH22 ARG 41 29.476 5.379 31.166
294 HH12 ARG 41 HH21 ARG 41 30.989 6.071 30.682
295 HH22 ARG 41 HH1 ARG 41 31.753 8.081 31.742
296 H GLY 42 HN GLY 42 24.138 8.598 30.808
297 HA2 GLY 42 HA1 GLY 42 21.811 9.404 32.326
298 HA3 GLY 42 HA2 GLY 42 23.176 10.495 32.461
299 H VAL 43 HN VAL 43 22.607 8.526 29.536
300 HA VAL 43 HA VAL 43 21.599 10.919 28.178
301 HB VAL 43 HB VAL 43 23.532 9.147 26.766
302 HG11 VAL 43 HG11 VAL 43 23.197 10.738 25.238
303 HG12 VAL 43 HG12 VAL 43 22.275 11.727 26.395
304 HG13 VAL 43 HG13 VAL 43 24.046 11.878 26.309
305 HG21 VAL 43 HG21 VAL 43 25.379 10.746 27.603
306 HG22 VAL 43 HG22 VAL 43 24.275 11.089 28.956
307 HG23 VAL 43 HG23 VAL 43 24.857 9.430 28.681
308 H LEU 44 HN LEU 44 19.771 10.501 27.040
309 HA LEU 44 HA LEU 44 19.101 7.679 26.665
310 HB2 LEU 44 HB2 LEU 44 17.337 8.510 27.791
311 HB3 LEU 44 HB3 LEU 44 17.591 10.151 27.230
312 HG LEU 44 HG LEU 44 16.604 9.550 25.039
313 HD11 LEU 44 HD11 LEU 44 16.474 7.427 24.413
314 HD12 LEU 44 HD12 LEU 44 16.919 6.874 26.046
315 HD13 LEU 44 HD13 LEU 44 15.211 7.173 25.642
316 HD21 LEU 44 HD21 LEU 44 14.238 9.142 25.948
317 HD22 LEU 44 HD22 LEU 44 14.994 9.168 27.559
318 HD23 LEU 44 HD23 LEU 44 15.107 10.594 26.500
319 H VAL 45 HN VAL 45 19.430 6.804 24.699
320 HA VAL 45 HA VAL 45 19.614 8.653 22.438
321 HB VAL 45 HB VAL 45 20.436 5.762 22.453
322 HG11 VAL 45 HG11 VAL 45 20.546 6.586 20.280
323 HG12 VAL 45 HG12 VAL 45 21.062 8.206 20.808
324 HG13 VAL 45 HG13 VAL 45 22.206 6.843 20.871
325 HG21 VAL 45 HG21 VAL 45 21.675 6.427 24.300
326 HG22 VAL 45 HG22 VAL 45 22.789 6.790 22.960
327 HG23 VAL 45 HG23 VAL 45 21.849 8.099 23.716
328 H ARG 46 HN ARG 46 17.645 8.955 21.503
329 HA ARG 46 HA ARG 46 15.984 6.582 21.267
330 HB2 ARG 46 HB2 ARG 46 15.156 9.507 20.921
331 HB3 ARG 46 HB3 ARG 46 14.078 8.128 21.003
332 HG2 ARG 46 HG2 ARG 46 14.780 7.672 23.336
333 HG3 ARG 46 HG3 ARG 46 15.950 8.975 23.263
334 HD2 ARG 46 HD2 ARG 46 12.980 9.110 23.567
335 HD3 ARG 46 HD3 ARG 46 14.215 10.160 24.232
336 HE ARG 46 HE ARG 46 14.161 11.480 22.263
337 HH11 ARG 46 HH22 ARG 46 12.171 8.577 21.857
338 HH12 ARG 46 HH21 ARG 46 11.409 9.151 20.412
339 HH22 ARG 46 HH1 ARG 46 12.003 11.306 19.547
340 H TYR 47 HN TYR 47 16.016 5.628 19.256
341 HA TYR 47 HA TYR 47 16.804 7.295 16.984
342 HB2 TYR 47 HB2 TYR 47 18.025 5.149 17.539
343 HB3 TYR 47 HB3 TYR 47 16.508 4.273 17.517
344 HD1 TYR 47 HD1 TYR 47 17.362 6.875 15.025
345 HD2 TYR 47 HD2 TYR 47 17.154 2.679 15.834
346 HE1 TYR 47 HE1 TYR 47 17.682 6.375 12.553
347 HE2 TYR 47 HE2 TYR 47 17.474 2.193 13.359
348 HH TYR 47 HH TYR 47 18.093 4.819 11.072
349 H ARG 48 HN ARG 48 15.468 7.669 15.237
350 HA ARG 48 HA ARG 48 13.065 6.118 15.044
351 HB2 ARG 48 HB2 ARG 48 11.956 7.750 16.272
352 HB3 ARG 48 HB3 ARG 48 13.142 8.986 15.904
353 HG2 ARG 48 HG2 ARG 48 11.487 7.988 13.603
354 HG3 ARG 48 HG3 ARG 48 10.653 8.953 14.806
355 HD2 ARG 48 HD2 ARG 48 13.221 10.187 14.163
356 HD3 ARG 48 HD3 ARG 48 12.323 9.889 12.688
357 HE ARG 48 HE ARG 48 10.641 11.052 14.765
358 HH11 ARG 48 HH22 ARG 48 13.005 11.841 12.246
359 HH12 ARG 48 HH21 ARG 48 12.442 13.467 12.053
360 HH22 ARG 48 HH1 ARG 48 10.614 14.244 13.395
361 H ARG 49 HN ARG 49 12.883 5.593 12.887
362 HA ARG 49 HA ARG 49 13.168 7.593 10.928
363 HB2 ARG 49 HB2 ARG 49 15.597 6.914 11.425
364 HB3 ARG 49 HB3 ARG 49 15.205 5.315 10.825
365 HG2 ARG 49 HG2 ARG 49 14.657 7.788 9.142
366 HG3 ARG 49 HG3 ARG 49 16.246 7.050 9.162
367 HD2 ARG 49 HD2 ARG 49 14.272 4.955 8.816
368 HD3 ARG 49 HD3 ARG 49 13.933 6.229 7.661
369 HE ARG 49 HE ARG 49 16.031 5.844 6.611
370 HH11 ARG 49 HH22 ARG 49 15.714 3.874 9.539
371 HH12 ARG 49 HH21 ARG 49 17.069 2.865 9.157
372 HH22 ARG 49 HH1 ARG 49 18.292 3.260 7.134
373 H CYS 50 HN CYS 50 12.420 6.810 8.800
374 HA CYS 50 HA CYS 50 11.556 4.041 8.737
375 HB2 CYS 50 HB2 CYS 50 9.629 6.325 8.267
376 HB3 CYS 50 HB3 CYS 50 9.287 4.619 8.061
377 H TRP 51 HN TRP 51 11.680 3.217 6.620
378 HA TRP 51 HA TRP 51 11.822 5.084 4.411
379 HB2 TRP 51 HB2 TRP 51 14.067 5.212 4.686
380 HB3 TRP 51 HB3 TRP 51 14.185 3.668 5.506
381 HD1 TRP 51 HD1 TRP 51 14.136 5.141 1.944
382 HE1 TRP 51 HE1 TRP 51 15.025 3.396 0.175
383 HE3 TRP 51 HE3 TRP 51 14.377 1.212 5.162
384 HZ2 TRP 51 HZ2 TRP 51 15.712 0.630 0.317
385 HZ3 TRP 51 HZ3 TRP 51 15.167 -0.976 4.266
386 HH2 TRP 51 HH2 TRP 51 15.822 -1.302 1.934
Start of MODEL 5
1 H1 ARG 1 HN ARG 1 6.611 -5.870 1.758
2 HA ARG 1 HA ARG 1 4.407 -4.985 3.370
3 HB2 ARG 1 HB2 ARG 1 5.745 -7.670 3.640
4 HB3 ARG 1 HB3 ARG 1 5.387 -6.818 5.129
5 HG2 ARG 1 HG2 ARG 1 3.539 -8.373 4.328
6 HG3 ARG 1 HG3 ARG 1 3.025 -6.725 4.631
7 HD2 ARG 1 HD2 ARG 1 3.210 -6.206 2.194
8 HD3 ARG 1 HD3 ARG 1 3.758 -7.841 1.880
9 HE ARG 1 HE ARG 1 1.372 -8.245 3.216
10 HH11 ARG 1 HH22 ARG 1 2.264 -6.331 0.371
11 HH12 ARG 1 HH21 ARG 1 0.704 -6.472 -0.368
12 HH22 ARG 1 HH1 ARG 1 -1.016 -7.711 0.750
13 H TRP 2 HN TRP 2 5.152 -3.381 4.743
14 HA TRP 2 HA TRP 2 8.027 -3.016 4.904
15 HB2 TRP 2 HB2 TRP 2 6.092 -1.151 6.186
16 HB3 TRP 2 HB3 TRP 2 7.613 -0.821 5.381
17 HD1 TRP 2 HD1 TRP 2 4.598 0.507 4.717
18 HE1 TRP 2 HE1 TRP 2 3.756 0.617 2.219
19 HE3 TRP 2 HE3 TRP 2 7.708 -3.110 2.958
20 HZ2 TRP 2 HZ2 TRP 2 4.469 -0.790 -0.160
21 HZ3 TRP 2 HZ3 TRP 2 7.571 -3.682 0.535
22 HH2 TRP 2 HH2 TRP 2 6.022 -2.587 -1.006
23 H CYS 3 HN CYS 3 9.219 -3.389 6.763
24 HA CYS 3 HA CYS 3 7.684 -4.432 9.023
25 HB2 CYS 3 HB2 CYS 3 10.328 -5.097 7.843
26 HB3 CYS 3 HB3 CYS 3 10.204 -5.177 9.589
27 H VAL 4 HN VAL 4 8.890 -3.970 11.227
28 HA VAL 4 HA VAL 4 10.324 -1.452 11.203
29 HB VAL 4 HB VAL 4 8.798 -0.191 12.314
30 HG11 VAL 4 HG11 VAL 4 7.859 -0.821 10.096
31 HG12 VAL 4 HG12 VAL 4 6.919 -2.106 10.892
32 HG13 VAL 4 HG13 VAL 4 6.610 -0.399 11.292
33 HG21 VAL 4 HG21 VAL 4 6.853 -1.179 13.617
34 HG22 VAL 4 HG22 VAL 4 7.614 -2.770 13.374
35 HG23 VAL 4 HG23 VAL 4 8.477 -1.499 14.273
36 H TYR 5 HN TYR 5 12.096 -1.870 12.408
37 HA TYR 5 HA TYR 5 11.857 -3.895 14.504
38 HB2 TYR 5 HB2 TYR 5 13.969 -2.619 12.731
39 HB3 TYR 5 HB3 TYR 5 14.514 -3.202 14.292
40 HD1 TYR 5 HD1 TYR 5 11.752 -5.068 12.907
41 HD2 TYR 5 HD2 TYR 5 16.015 -4.704 12.889
42 HE1 TYR 5 HE1 TYR 5 11.956 -7.419 11.960
43 HE2 TYR 5 HE2 TYR 5 16.205 -7.056 11.942
44 HH TYR 5 HH TYR 5 14.807 -8.580 10.620
45 H ALA 6 HN ALA 6 11.566 -3.239 16.570
46 HA ALA 6 HA ALA 6 12.628 -0.588 17.273
47 HB1 ALA 6 HB1 ALA 6 10.011 -1.897 17.689
48 HB2 ALA 6 HB2 ALA 6 10.701 -1.164 19.157
49 HB3 ALA 6 HB3 ALA 6 10.442 -0.170 17.704
50 H TYR 7 HN TYR 7 13.703 -0.385 19.305
51 HA TYR 7 HA TYR 7 14.088 -2.821 20.839
52 HB2 TYR 7 HB2 TYR 7 15.841 -2.718 18.988
53 HB3 TYR 7 HB3 TYR 7 16.281 -1.106 19.514
54 HD1 TYR 7 HD1 TYR 7 17.248 -0.825 21.879
55 HD2 TYR 7 HD2 TYR 7 16.855 -4.624 19.950
56 HE1 TYR 7 HE1 TYR 7 18.962 -1.820 23.472
57 HE2 TYR 7 HE2 TYR 7 18.570 -5.605 21.549
58 HH TYR 7 HH TYR 7 20.655 -3.919 23.211
59 H VAL 8 HN VAL 8 13.378 -2.060 22.791
60 HA VAL 8 HA VAL 8 14.346 0.586 23.601
61 HB VAL 8 HB VAL 8 12.051 -1.107 24.609
62 HG11 VAL 8 HG11 VAL 8 13.420 1.218 25.744
63 HG12 VAL 8 HG12 VAL 8 11.676 1.487 25.515
64 HG13 VAL 8 HG13 VAL 8 12.244 0.106 26.484
65 HG21 VAL 8 HG21 VAL 8 11.601 1.560 23.373
66 HG22 VAL 8 HG22 VAL 8 12.088 0.246 22.276
67 HG23 VAL 8 HG23 VAL 8 10.630 0.071 23.282
68 H ARG 9 HN ARG 9 15.448 0.858 25.582
69 HA ARG 9 HA ARG 9 15.868 -1.449 27.200
70 HB2 ARG 9 HB2 ARG 9 17.721 -2.035 25.917
71 HB3 ARG 9 HB3 ARG 9 17.961 -0.405 25.321
72 HG2 ARG 9 HG2 ARG 9 19.060 0.296 27.341
73 HG3 ARG 9 HG3 ARG 9 18.488 -1.097 28.236
74 HD2 ARG 9 HD2 ARG 9 20.318 -2.298 27.629
75 HD3 ARG 9 HD3 ARG 9 19.970 -2.043 25.931
76 HE ARG 9 HE ARG 9 21.059 0.362 26.573
77 HH11 ARG 9 HH22 ARG 9 22.143 -2.921 27.351
78 HH12 ARG 9 HH21 ARG 9 23.819 -2.487 27.408
79 HH22 ARG 9 HH1 ARG 9 24.458 -0.215 26.993
80 H ILE 10 HN ILE 10 15.391 -0.499 29.166
81 HA ILE 10 HA ILE 10 16.896 1.907 29.852
82 HB ILE 10 HB ILE 10 14.035 1.735 30.676
83 HG12 ILE 10 HG12 ILE 10 15.004 2.556 27.932
84 HG13 ILE 10 HG13 ILE 10 13.779 1.370 28.335
85 HG21 ILE 10 HG21 ILE 10 15.018 4.330 29.901
86 HG22 ILE 10 HG22 ILE 10 14.454 3.755 31.489
87 HG23 ILE 10 HG23 ILE 10 16.159 3.550 31.022
88 HD11 ILE 10 HD11 ILE 10 12.363 3.131 27.885
89 HD12 ILE 10 HD12 ILE 10 12.700 3.534 29.585
90 HD13 ILE 10 HD13 ILE 10 13.592 4.355 28.282
91 H ARG 11 HN ARG 11 17.315 2.127 32.128
92 HA ARG 11 HA ARG 11 17.839 1.378 34.084
93 HB2 ARG 11 HB2 ARG 11 15.154 0.062 33.670
94 HB3 ARG 11 HB3 ARG 11 16.097 -0.454 35.054
95 HG2 ARG 11 HG2 ARG 11 15.280 1.356 36.155
96 HG3 ARG 11 HG3 ARG 11 16.320 2.341 35.146
97 HD2 ARG 11 HD2 ARG 11 14.579 2.914 33.661
98 HD3 ARG 11 HD3 ARG 11 13.642 1.481 34.034
99 HE ARG 11 HE ARG 11 13.892 3.100 36.401
100 HH11 ARG 11 HH22 ARG 11 12.210 3.038 33.283
101 HH12 ARG 11 HH21 ARG 11 10.872 3.981 33.846
102 HH22 ARG 11 HH1 ARG 11 10.843 4.739 36.120
103 H GLY 12 HN GLY 12 16.246 -1.722 33.114
104 HA2 GLY 12 HA1 GLY 12 18.741 -2.982 32.408
105 HA3 GLY 12 HA2 GLY 12 18.133 -3.463 33.980
106 H VAL 13 HN VAL 13 15.886 -2.458 31.415
107 HA VAL 13 HA VAL 13 15.161 -5.284 31.059
108 HB VAL 13 HB VAL 13 13.311 -2.894 31.137
109 HG11 VAL 13 HG11 VAL 13 11.815 -4.238 30.177
110 HG12 VAL 13 HG12 VAL 13 12.993 -5.573 30.143
111 HG13 VAL 13 HG13 VAL 13 11.945 -5.345 31.564
112 HG21 VAL 13 HG21 VAL 13 14.159 -4.853 33.253
113 HG22 VAL 13 HG22 VAL 13 13.901 -3.096 33.367
114 HG23 VAL 13 HG23 VAL 13 12.505 -4.196 33.268
115 H LEU 14 HN LEU 14 15.340 -5.990 28.996
116 HA LEU 14 HA LEU 14 15.604 -3.932 26.932
117 HB2 LEU 14 HB2 LEU 14 17.505 -5.400 27.194
118 HB3 LEU 14 HB3 LEU 14 16.487 -6.818 27.036
119 HG LEU 14 HG LEU 14 16.339 -6.655 24.766
120 HD11 LEU 14 HD11 LEU 14 16.744 -4.403 23.555
121 HD12 LEU 14 HD12 LEU 14 15.207 -4.657 24.415
122 HD13 LEU 14 HD13 LEU 14 16.492 -3.676 25.160
123 HD21 LEU 14 HD21 LEU 14 18.490 -6.041 23.803
124 HD22 LEU 14 HD22 LEU 14 18.906 -5.124 25.271
125 HD23 LEU 14 HD23 LEU 14 18.710 -6.891 25.351
126 H VAL 15 HN VAL 15 13.796 -3.479 25.807
127 HA VAL 15 HA VAL 15 11.916 -5.701 25.395
128 HB VAL 15 HB VAL 15 11.219 -2.773 25.343
129 HG11 VAL 15 HG11 VAL 15 9.239 -4.701 26.310
130 HG12 VAL 15 HG12 VAL 15 9.106 -3.460 25.041
131 HG13 VAL 15 HG13 VAL 15 9.799 -5.054 24.657
132 HG21 VAL 15 HG21 VAL 15 11.933 -4.400 27.668
133 HG22 VAL 15 HG22 VAL 15 11.677 -2.644 27.533
134 HG23 VAL 15 HG23 VAL 15 10.288 -3.730 27.777
135 H ARG 16 HN ARG 16 12.830 -6.476 23.458
136 HA ARG 16 HA ARG 16 13.195 -4.524 21.370
137 HB2 ARG 16 HB2 ARG 16 13.741 -7.536 21.396
138 HB3 ARG 16 HB3 ARG 16 14.198 -6.444 20.104
139 HG2 ARG 16 HG2 ARG 16 15.562 -5.120 21.807
140 HG3 ARG 16 HG3 ARG 16 15.212 -6.371 22.983
141 HD2 ARG 16 HD2 ARG 16 16.904 -6.550 20.478
142 HD3 ARG 16 HD3 ARG 16 17.305 -7.047 22.110
143 HE ARG 16 HE ARG 16 15.745 -8.587 20.137
144 HH11 ARG 16 HH22 ARG 16 16.697 -8.273 23.535
145 HH12 ARG 16 HH21 ARG 16 16.334 -9.923 23.918
146 HH22 ARG 16 HH1 ARG 16 15.494 -11.369 22.201
147 H TYR 17 HN TYR 17 11.519 -4.091 19.971
148 HA TYR 17 HA TYR 17 9.475 -6.182 19.657
149 HB2 TYR 17 HB2 TYR 17 9.236 -3.626 20.602
150 HB3 TYR 17 HB3 TYR 17 9.204 -3.245 18.892
151 HD1 TYR 17 HD2 TYR 17 7.424 -4.981 21.624
152 HD2 TYR 17 HD1 TYR 17 7.284 -3.782 17.519
153 HE1 TYR 17 HE2 TYR 17 4.939 -5.515 21.545
154 HE2 TYR 17 HE1 TYR 17 4.800 -4.321 17.454
155 HH TYR 17 HH TYR 17 3.212 -5.616 18.570
156 H ARG 18 HN ARG 18 8.455 -6.364 17.503
157 HA ARG 18 HA ARG 18 9.907 -5.160 15.356
158 HB2 ARG 18 HB2 ARG 18 10.222 -7.481 14.251
159 HB3 ARG 18 HB3 ARG 18 11.321 -7.082 15.556
160 HG2 ARG 18 HG2 ARG 18 10.319 -8.575 17.057
161 HG3 ARG 18 HG3 ARG 18 8.747 -8.467 16.289
162 HD2 ARG 18 HD2 ARG 18 9.183 -10.291 15.006
163 HD3 ARG 18 HD3 ARG 18 10.648 -9.561 14.381
164 HE ARG 18 HE ARG 18 11.071 -10.505 17.082
165 HH11 ARG 18 HH22 ARG 18 10.787 -11.654 13.742
166 HH12 ARG 18 HH21 ARG 18 11.741 -13.074 14.019
167 HH22 ARG 18 HH1 ARG 18 12.637 -13.479 16.204
168 H ARG 19 HN ARG 19 7.835 -4.184 14.885
169 HA ARG 19 HA ARG 19 5.668 -6.013 14.390
170 HB2 ARG 19 HB2 ARG 19 5.573 -3.639 15.591
171 HB3 ARG 19 HB3 ARG 19 5.520 -3.012 13.955
172 HG2 ARG 19 HG2 ARG 19 3.648 -5.275 14.604
173 HG3 ARG 19 HG3 ARG 19 3.286 -3.718 15.323
174 HD2 ARG 19 HD2 ARG 19 3.845 -2.964 12.724
175 HD3 ARG 19 HD3 ARG 19 3.163 -4.556 12.461
176 HE ARG 19 HE ARG 19 1.713 -2.198 13.273
177 HH11 ARG 19 HH22 ARG 19 1.792 -5.704 13.778
178 HH12 ARG 19 HH21 ARG 19 0.108 -5.810 14.170
179 HH22 ARG 19 HH1 ARG 19 -1.225 -3.819 14.171
180 H CYS 20 HN CYS 20 4.479 -5.977 12.302
181 HA CYS 20 HA CYS 20 5.799 -4.648 10.111
182 HB2 CYS 20 HB2 CYS 20 5.556 -7.664 10.172
183 HB3 CYS 20 HB3 CYS 20 6.017 -6.708 8.777
184 H TRP 21 HN TRP 21 4.297 -4.242 8.418
185 HA TRP 21 HA TRP 21 1.751 -5.620 8.484
186 HB2 TRP 21 HB2 TRP 21 0.549 -3.383 8.452
187 HB3 TRP 21 HB3 TRP 21 1.114 -3.986 9.998
188 HD1 TRP 21 HD1 TRP 21 2.523 -2.273 11.396
189 HE1 TRP 21 HE1 TRP 21 3.752 0.032 11.022
190 HE3 TRP 21 HE3 TRP 21 1.865 -2.140 6.355
191 HZ2 TRP 21 HZ2 TRP 21 4.299 1.617 8.713
192 HZ3 TRP 21 HZ3 TRP 21 2.777 -0.179 5.116
193 HH2 TRP 21 HH2 TRP 21 3.959 1.658 6.214
194 H1 ARG 31 HN ARG 31 8.476 -1.254 3.415
195 HA ARG 31 HA ARG 31 10.319 0.943 3.422
196 HB2 ARG 31 HB2 ARG 31 7.769 1.706 3.729
197 HB3 ARG 31 HB3 ARG 31 8.002 1.127 5.366
198 HG2 ARG 31 HG2 ARG 31 9.018 3.084 5.881
199 HG3 ARG 31 HG3 ARG 31 10.321 2.668 4.785
200 HD2 ARG 31 HD2 ARG 31 9.417 4.838 4.115
201 HD3 ARG 31 HD3 ARG 31 9.004 3.667 2.879
202 HE ARG 31 HE ARG 31 6.856 3.663 4.719
203 HH11 ARG 31 HH22 ARG 31 8.373 5.962 2.490
204 HH12 ARG 31 HH21 ARG 31 6.916 6.860 2.228
205 HH22 ARG 31 HH1 ARG 31 4.905 6.187 3.345
206 H TRP 32 HN TRP 32 11.246 1.249 5.737
207 HA TRP 32 HA TRP 32 10.843 -1.061 7.452
208 HB2 TRP 32 HB2 TRP 32 13.278 -0.582 5.827
209 HB3 TRP 32 HB3 TRP 32 13.533 -1.014 7.506
210 HD1 TRP 32 HD1 TRP 32 12.207 -2.508 4.223
211 HE1 TRP 32 HE1 TRP 32 11.940 -5.127 4.395
212 HE3 TRP 32 HE3 TRP 32 13.089 -2.797 9.223
213 HZ2 TRP 32 HZ2 TRP 32 12.123 -6.985 6.554
214 HZ3 TRP 32 HZ3 TRP 32 13.027 -5.052 10.284
215 HH2 TRP 32 HH2 TRP 32 12.564 -7.100 9.034
216 H CYS 33 HN CYS 33 10.093 0.207 9.151
217 HA CYS 33 HA CYS 33 11.497 2.661 9.744
218 HB2 CYS 33 HB2 CYS 33 8.911 1.428 10.532
219 HB3 CYS 33 HB3 CYS 33 9.674 2.476 11.710
220 H VAL 34 HN VAL 34 12.178 3.036 12.101
221 HA VAL 34 HA VAL 34 12.749 0.628 13.593
222 HB VAL 34 HB VAL 34 15.133 1.030 13.699
223 HG11 VAL 34 HG11 VAL 34 14.082 -0.407 11.877
224 HG12 VAL 34 HG12 VAL 34 14.369 0.956 10.769
225 HG13 VAL 34 HG13 VAL 34 15.742 0.161 11.576
226 HG21 VAL 34 HG21 VAL 34 14.451 3.430 12.029
227 HG22 VAL 34 HG22 VAL 34 15.553 3.283 13.420
228 HG23 VAL 34 HG23 VAL 34 16.039 2.651 11.828
229 H TYR 35 HN TYR 35 12.184 1.095 15.649
230 HA TYR 35 HA TYR 35 12.728 3.821 16.594
231 HB2 TYR 35 HB2 TYR 35 10.243 2.923 15.893
232 HB3 TYR 35 HB3 TYR 35 10.326 2.164 17.471
233 HD1 TYR 35 HD1 TYR 35 11.335 5.542 16.158
234 HD2 TYR 35 HD2 TYR 35 9.070 3.324 19.031
235 HE1 TYR 35 HE1 TYR 35 10.578 7.711 17.247
236 HE2 TYR 35 HE2 TYR 35 8.321 5.501 20.110
237 HH TYR 35 HH TYR 35 9.235 8.619 18.700
238 H ALA 36 HN ALA 36 14.294 3.570 18.120
239 HA ALA 36 HA ALA 36 13.852 1.426 20.081
240 HB1 ALA 36 HB1 ALA 36 16.437 1.432 20.203
241 HB2 ALA 36 HB2 ALA 36 15.680 0.646 18.797
242 HB3 ALA 36 HB3 ALA 36 16.377 2.276 18.637
243 H TYR 37 HN TYR 37 14.343 1.966 22.261
244 HA TYR 37 HA TYR 37 15.026 4.788 22.700
245 HB2 TYR 37 HB2 TYR 37 12.498 4.042 22.860
246 HB3 TYR 37 HB3 TYR 37 12.984 3.085 24.245
247 HD1 TYR 37 HD2 TYR 37 13.940 4.262 26.282
248 HD2 TYR 37 HD1 TYR 37 12.085 6.378 23.059
249 HE1 TYR 37 HE2 TYR 37 13.628 6.290 27.784
250 HE2 TYR 37 HE1 TYR 37 11.779 8.399 24.572
251 HH TYR 37 HH TYR 37 12.200 8.210 27.937
252 H VAL 38 HN VAL 38 17.214 3.927 23.103
253 HA VAL 38 HA VAL 38 17.398 2.291 25.516
254 HB VAL 38 HB VAL 38 19.418 3.074 23.406
255 HG11 VAL 38 HG11 VAL 38 19.708 1.656 26.033
256 HG12 VAL 38 HG12 VAL 38 20.700 1.129 24.653
257 HG13 VAL 38 HG13 VAL 38 20.800 2.809 25.231
258 HG21 VAL 38 HG21 VAL 38 19.257 0.350 23.370
259 HG22 VAL 38 HG22 VAL 38 17.577 0.788 23.766
260 HG23 VAL 38 HG23 VAL 38 18.341 1.431 22.292
261 H ARG 39 HN ARG 39 18.417 3.020 27.401
262 HA ARG 39 HA ARG 39 19.429 5.725 27.308
263 HB2 ARG 39 HB2 ARG 39 16.928 5.597 28.076
264 HB3 ARG 39 HB3 ARG 39 17.543 4.850 29.538
265 HG2 ARG 39 HG2 ARG 39 19.098 6.869 29.806
266 HG3 ARG 39 HG3 ARG 39 18.249 7.621 28.470
267 HD2 ARG 39 HD2 ARG 39 16.622 8.322 29.888
268 HD3 ARG 39 HD3 ARG 39 16.242 6.659 30.289
269 HE ARG 39 HE ARG 39 18.431 7.051 31.850
270 HH11 ARG 39 HH22 ARG 39 15.585 9.100 31.343
271 HH12 ARG 39 HH21 ARG 39 15.658 9.806 32.923
272 HH22 ARG 39 HH1 ARG 39 17.397 9.134 34.430
273 H ILE 40 HN ILE 40 21.206 6.036 28.707
274 HA ILE 40 HA ILE 40 21.657 4.120 30.822
275 HB ILE 40 HB ILE 40 23.280 4.223 28.312
276 HG12 ILE 40 HG12 ILE 40 21.715 2.262 29.813
277 HG13 ILE 40 HG13 ILE 40 22.195 2.273 28.128
278 HG21 ILE 40 HG21 ILE 40 24.862 4.841 30.065
279 HG22 ILE 40 HG22 ILE 40 24.357 3.436 31.034
280 HG23 ILE 40 HG23 ILE 40 25.175 3.192 29.473
281 HD11 ILE 40 HD11 ILE 40 24.459 1.465 28.737
282 HD12 ILE 40 HD12 ILE 40 24.008 1.493 30.459
283 HD13 ILE 40 HD13 ILE 40 23.206 0.357 29.347
284 H ARG 41 HN ARG 41 23.414 4.833 32.281
285 HA ARG 41 HA ARG 41 24.325 6.361 33.509
286 HB2 ARG 41 HB2 ARG 41 24.940 7.562 30.771
287 HB3 ARG 41 HB3 ARG 41 25.566 8.269 32.247
288 HG2 ARG 41 HG2 ARG 41 25.956 5.309 31.698
289 HG3 ARG 41 HG3 ARG 41 27.016 6.486 30.948
290 HD2 ARG 41 HD2 ARG 41 26.562 6.104 33.945
291 HD3 ARG 41 HD3 ARG 41 28.022 5.720 33.055
292 HE ARG 41 HE ARG 41 27.482 8.457 32.569
293 HH11 ARG 41 HH22 ARG 41 28.298 6.404 35.339
294 HH12 ARG 41 HH21 ARG 41 29.087 7.678 36.208
295 HH22 ARG 41 HH1 ARG 41 29.208 9.864 35.235
296 H GLY 42 HN GLY 42 23.395 8.717 30.924
297 HA2 GLY 42 HA1 GLY 42 21.060 9.631 32.333
298 HA3 GLY 42 HA2 GLY 42 22.434 10.705 32.512
299 H VAL 43 HN VAL 43 22.049 8.692 29.599
300 HA VAL 43 HA VAL 43 21.110 11.055 28.141
301 HB VAL 43 HB VAL 43 23.123 9.258 26.881
302 HG11 VAL 43 HG11 VAL 43 21.885 11.822 26.379
303 HG12 VAL 43 HG12 VAL 43 23.657 11.986 26.405
304 HG13 VAL 43 HG13 VAL 43 22.887 10.818 25.304
305 HG21 VAL 43 HG21 VAL 43 24.389 9.568 28.802
306 HG22 VAL 43 HG22 VAL 43 24.886 10.957 27.806
307 HG23 VAL 43 HG23 VAL 43 23.708 11.180 29.121
308 H LEU 44 HN LEU 44 19.379 10.620 26.861
309 HA LEU 44 HA LEU 44 18.704 7.793 26.534
310 HB2 LEU 44 HB2 LEU 44 16.872 8.685 27.495
311 HB3 LEU 44 HB3 LEU 44 17.185 10.299 26.890
312 HG LEU 44 HG LEU 44 16.359 9.613 24.655
313 HD11 LEU 44 HD11 LEU 44 14.914 7.254 25.344
314 HD12 LEU 44 HD12 LEU 44 16.156 7.482 24.089
315 HD13 LEU 44 HD13 LEU 44 16.632 6.992 25.733
316 HD21 LEU 44 HD21 LEU 44 14.780 10.739 25.972
317 HD22 LEU 44 HD22 LEU 44 13.930 9.288 25.388
318 HD23 LEU 44 HD23 LEU 44 14.551 9.344 27.055
319 H VAL 45 HN VAL 45 19.199 6.849 24.636
320 HA VAL 45 HA VAL 45 19.554 8.614 22.328
321 HB VAL 45 HB VAL 45 20.371 5.729 22.487
322 HG11 VAL 45 HG11 VAL 45 21.088 8.133 20.839
323 HG12 VAL 45 HG12 VAL 45 22.298 6.849 21.078
324 HG13 VAL 45 HG13 VAL 45 20.729 6.465 20.329
325 HG21 VAL 45 HG21 VAL 45 21.435 6.424 24.431
326 HG22 VAL 45 HG22 VAL 45 22.670 6.755 23.193
327 HG23 VAL 45 HG23 VAL 45 21.674 8.083 23.834
328 H ARG 46 HN ARG 46 17.629 8.882 21.282
329 HA ARG 46 HA ARG 46 15.977 6.512 21.029
330 HB2 ARG 46 HB2 ARG 46 15.265 9.424 20.416
331 HB3 ARG 46 HB3 ARG 46 14.144 8.079 20.454
332 HG2 ARG 46 HG2 ARG 46 14.589 7.735 22.870
333 HG3 ARG 46 HG3 ARG 46 15.791 9.010 22.853
334 HD2 ARG 46 HD2 ARG 46 13.110 9.798 21.793
335 HD3 ARG 46 HD3 ARG 46 13.139 9.395 23.498
336 HE ARG 46 HE ARG 46 15.369 11.092 22.982
337 HH11 ARG 46 HH22 ARG 46 11.831 11.276 23.009
338 HH12 ARG 46 HH21 ARG 46 11.797 12.965 23.391
339 HH22 ARG 46 HH1 ARG 46 13.864 14.146 23.668
340 H TYR 47 HN TYR 47 16.072 5.420 19.092
341 HA TYR 47 HA TYR 47 17.201 6.834 16.800
342 HB2 TYR 47 HB2 TYR 47 18.111 4.613 17.598
343 HB3 TYR 47 HB3 TYR 47 16.511 3.908 17.484
344 HD1 TYR 47 HD2 TYR 47 17.774 6.229 14.909
345 HD2 TYR 47 HD1 TYR 47 17.219 2.128 15.993
346 HE1 TYR 47 HE2 TYR 47 18.251 5.524 12.513
347 HE2 TYR 47 HE1 TYR 47 17.698 1.436 13.594
348 HH TYR 47 HH TYR 47 18.790 2.241 11.675
349 H ARG 48 HN ARG 48 16.083 7.204 14.900
350 HA ARG 48 HA ARG 48 13.537 5.926 14.584
351 HB2 ARG 48 HB2 ARG 48 12.530 7.765 15.590
352 HB3 ARG 48 HB3 ARG 48 13.880 8.828 15.248
353 HG2 ARG 48 HG2 ARG 48 11.776 9.382 13.948
354 HG3 ARG 48 HG3 ARG 48 13.188 9.124 12.943
355 HD2 ARG 48 HD2 ARG 48 11.892 7.643 11.784
356 HD3 ARG 48 HD3 ARG 48 12.157 6.548 13.126
357 HE ARG 48 HE ARG 48 9.920 8.436 13.493
358 HH11 ARG 48 HH22 ARG 48 10.899 5.203 12.425
359 HH12 ARG 48 HH21 ARG 48 9.311 4.532 12.589
360 HH22 ARG 48 HH1 ARG 48 7.518 5.931 13.346
361 H ARG 49 HN ARG 49 13.671 5.153 12.500
362 HA ARG 49 HA ARG 49 14.376 7.000 10.443
363 HB2 ARG 49 HB2 ARG 49 16.578 5.938 11.220
364 HB3 ARG 49 HB3 ARG 49 15.949 4.389 10.693
365 HG2 ARG 49 HG2 ARG 49 16.031 6.770 8.801
366 HG3 ARG 49 HG3 ARG 49 17.438 5.750 9.029
367 HD2 ARG 49 HD2 ARG 49 15.162 4.018 8.631
368 HD3 ARG 49 HD3 ARG 49 15.114 5.249 7.386
369 HE ARG 49 HE ARG 49 17.209 3.201 7.755
370 HH11 ARG 49 HH22 ARG 49 16.269 6.198 6.115
371 HH12 ARG 49 HH21 ARG 49 17.429 6.013 4.843
372 HH22 ARG 49 HH1 ARG 49 18.872 4.099 4.841
373 H CYS 50 HN CYS 50 13.688 6.214 8.297
374 HA CYS 50 HA CYS 50 12.391 3.633 8.246
375 HB2 CYS 50 HB2 CYS 50 10.831 6.149 7.626
376 HB3 CYS 50 HB3 CYS 50 10.263 4.500 7.453
377 H TRP 51 HN TRP 51 12.481 2.762 6.141
378 HA TRP 51 HA TRP 51 13.022 4.547 3.926
379 HB2 TRP 51 HB2 TRP 51 15.246 4.329 4.375
380 HB3 TRP 51 HB3 TRP 51 15.071 2.757 5.130
381 HD1 TRP 51 HD1 TRP 51 15.488 4.348 1.647
382 HE1 TRP 51 HE1 TRP 51 16.184 2.547 -0.152
383 HE3 TRP 51 HE3 TRP 51 14.860 0.313 4.677
384 HZ2 TRP 51 HZ2 TRP 51 16.389 -0.299 -0.107
385 HZ3 TRP 51 HZ3 TRP 51 15.329 -1.941 3.721
386 HH2 TRP 51 HH2 TRP 51 16.070 -2.283 1.417
Start of MODEL 6
1 H1 ARG 1 HN ARG 1 10.132 -6.579 1.873
2 HA ARG 1 HA ARG 1 7.344 -5.835 1.776
3 HB2 ARG 1 HB2 ARG 1 9.022 -7.666 3.500
4 HB3 ARG 1 HB3 ARG 1 7.544 -7.024 4.188
5 HG2 ARG 1 HG2 ARG 1 7.358 -8.160 1.411
6 HG3 ARG 1 HG3 ARG 1 7.609 -9.305 2.714
7 HD2 ARG 1 HD2 ARG 1 5.624 -7.693 3.789
8 HD3 ARG 1 HD3 ARG 1 5.212 -7.652 2.086
9 HE ARG 1 HE ARG 1 5.127 -10.004 3.856
10 HH11 ARG 1 HH22 ARG 1 5.119 -8.859 0.503
11 HH12 ARG 1 HH21 ARG 1 4.398 -10.305 -0.120
12 HH22 ARG 1 HH1 ARG 1 3.851 -12.087 1.387
13 H TRP 2 HN TRP 2 6.555 -5.086 4.196
14 HA TRP 2 HA TRP 2 8.395 -2.925 4.973
15 HB2 TRP 2 HB2 TRP 2 5.428 -2.776 5.366
16 HB3 TRP 2 HB3 TRP 2 6.609 -1.483 5.296
17 HD1 TRP 2 HD1 TRP 2 3.875 -2.385 3.298
18 HE1 TRP 2 HE1 TRP 2 4.112 -1.968 0.703
19 HE3 TRP 2 HE3 TRP 2 8.946 -2.007 3.289
20 HZ2 TRP 2 HZ2 TRP 2 6.343 -1.537 -1.024
21 HZ3 TRP 2 HZ3 TRP 2 10.075 -1.588 1.107
22 HH2 TRP 2 HH2 TRP 2 8.858 -1.354 -1.000
23 H CYS 3 HN CYS 3 9.205 -3.168 7.012
24 HA CYS 3 HA CYS 3 7.526 -4.577 8.941
25 HB2 CYS 3 HB2 CYS 3 10.328 -5.252 8.132
26 HB3 CYS 3 HB3 CYS 3 9.850 -5.474 9.803
27 H VAL 4 HN VAL 4 8.749 -4.241 11.252
28 HA VAL 4 HA VAL 4 10.101 -1.685 11.358
29 HB VAL 4 HB VAL 4 8.514 -0.495 12.461
30 HG11 VAL 4 HG11 VAL 4 7.604 -0.880 10.258
31 HG12 VAL 4 HG12 VAL 4 6.875 -2.418 10.779
32 HG13 VAL 4 HG13 VAL 4 6.268 -0.879 11.435
33 HG21 VAL 4 HG21 VAL 4 6.487 -1.690 13.580
34 HG22 VAL 4 HG22 VAL 4 7.501 -3.148 13.465
35 HG23 VAL 4 HG23 VAL 4 8.075 -1.735 14.382
36 H TYR 5 HN TYR 5 11.658 -1.744 12.917
37 HA TYR 5 HA TYR 5 11.377 -3.852 14.952
38 HB2 TYR 5 HB2 TYR 5 13.570 -2.939 13.056
39 HB3 TYR 5 HB3 TYR 5 14.084 -3.464 14.647
40 HD1 TYR 5 HD1 TYR 5 12.137 -5.694 15.139
41 HD2 TYR 5 HD2 TYR 5 14.363 -4.640 11.641
42 HE1 TYR 5 HE1 TYR 5 12.068 -8.112 14.358
43 HE2 TYR 5 HE2 TYR 5 14.287 -7.063 10.872
44 HH TYR 5 HH TYR 5 12.237 -9.179 11.789
45 H ALA 6 HN ALA 6 11.597 -3.205 17.051
46 HA ALA 6 HA ALA 6 12.782 -0.552 17.485
47 HB1 ALA 6 HB1 ALA 6 10.756 0.155 18.156
48 HB2 ALA 6 HB2 ALA 6 10.071 -1.478 17.980
49 HB3 ALA 6 HB3 ALA 6 10.861 -1.004 19.503
50 H TYR 7 HN TYR 7 14.037 -0.333 19.391
51 HA TYR 7 HA TYR 7 14.364 -2.777 20.971
52 HB2 TYR 7 HB2 TYR 7 16.171 -2.793 19.307
53 HB3 TYR 7 HB3 TYR 7 16.388 -1.059 19.432
54 HD1 TYR 7 HD2 TYR 7 16.519 -4.051 21.707
55 HD2 TYR 7 HD1 TYR 7 18.286 -0.333 20.540
56 HE1 TYR 7 HE2 TYR 7 18.386 -4.399 23.398
57 HE2 TYR 7 HE1 TYR 7 20.146 -0.694 22.235
58 HH TYR 7 HH TYR 7 20.339 -3.701 24.088
59 H VAL 8 HN VAL 8 13.423 -1.934 22.836
60 HA VAL 8 HA VAL 8 14.471 0.634 23.765
61 HB VAL 8 HB VAL 8 12.073 -1.012 24.591
62 HG11 VAL 8 HG11 VAL 8 11.469 1.085 25.892
63 HG12 VAL 8 HG12 VAL 8 12.805 0.113 26.554
64 HG13 VAL 8 HG13 VAL 8 13.153 1.610 25.656
65 HG21 VAL 8 HG21 VAL 8 12.362 0.583 22.371
66 HG22 VAL 8 HG22 VAL 8 10.819 0.206 23.174
67 HG23 VAL 8 HG23 VAL 8 11.677 1.717 23.559
68 H ARG 9 HN ARG 9 15.575 0.831 25.729
69 HA ARG 9 HA ARG 9 15.816 -1.498 27.361
70 HB2 ARG 9 HB2 ARG 9 17.659 -2.124 26.039
71 HB3 ARG 9 HB3 ARG 9 18.063 -0.469 25.628
72 HG2 ARG 9 HG2 ARG 9 18.965 -0.061 27.871
73 HG3 ARG 9 HG3 ARG 9 18.390 -1.617 28.438
74 HD2 ARG 9 HD2 ARG 9 19.887 -2.489 26.348
75 HD3 ARG 9 HD3 ARG 9 20.738 -0.989 26.662
76 HE ARG 9 HE ARG 9 20.849 -3.363 28.280
77 HH11 ARG 9 HH22 ARG 9 20.758 0.165 28.600
78 HH12 ARG 9 HH21 ARG 9 21.589 0.173 30.120
79 HH22 ARG 9 HH1 ARG 9 22.278 -1.906 31.092
80 H ILE 10 HN ILE 10 15.503 -0.648 29.395
81 HA ILE 10 HA ILE 10 17.034 1.711 30.124
82 HB ILE 10 HB ILE 10 14.140 1.697 30.848
83 HG12 ILE 10 HG12 ILE 10 15.214 2.694 28.193
84 HG13 ILE 10 HG13 ILE 10 14.132 1.335 28.419
85 HG21 ILE 10 HG21 ILE 10 16.282 3.332 31.436
86 HG22 ILE 10 HG22 ILE 10 15.457 4.207 30.123
87 HG23 ILE 10 HG23 ILE 10 14.561 3.757 31.594
88 HD11 ILE 10 HD11 ILE 10 13.523 4.204 28.372
89 HD12 ILE 10 HD12 ILE 10 12.423 2.814 28.215
90 HD13 ILE 10 HD13 ILE 10 12.872 3.415 29.829
91 H ARG 11 HN ARG 11 17.286 1.931 32.454
92 HA ARG 11 HA ARG 11 17.687 1.139 34.423
93 HB2 ARG 11 HB2 ARG 11 15.018 -0.146 33.828
94 HB3 ARG 11 HB3 ARG 11 15.870 -0.675 35.265
95 HG2 ARG 11 HG2 ARG 11 15.031 1.142 36.333
96 HG3 ARG 11 HG3 ARG 11 16.095 2.132 35.354
97 HD2 ARG 11 HD2 ARG 11 14.400 2.708 33.833
98 HD3 ARG 11 HD3 ARG 11 13.485 1.242 34.125
99 HE ARG 11 HE ARG 11 13.616 2.890 36.513
100 HH11 ARG 11 HH22 ARG 11 11.937 2.551 33.412
101 HH12 ARG 11 HH21 ARG 11 10.512 3.375 33.952
102 HH22 ARG 11 HH1 ARG 11 10.416 4.205 36.198
103 H GLY 12 HN GLY 12 16.110 -1.926 33.337
104 HA2 GLY 12 HA1 GLY 12 18.607 -3.214 32.712
105 HA3 GLY 12 HA2 GLY 12 17.957 -3.689 34.269
106 H VAL 13 HN VAL 13 15.796 -2.665 31.633
107 HA VAL 13 HA VAL 13 15.089 -5.485 31.211
108 HB VAL 13 HB VAL 13 13.192 -3.139 31.429
109 HG11 VAL 13 HG11 VAL 13 11.667 -4.447 30.465
110 HG12 VAL 13 HG12 VAL 13 12.903 -5.705 30.222
111 HG13 VAL 13 HG13 VAL 13 11.926 -5.693 31.710
112 HG21 VAL 13 HG21 VAL 13 13.863 -3.489 33.636
113 HG22 VAL 13 HG22 VAL 13 12.416 -4.515 33.492
114 HG23 VAL 13 HG23 VAL 13 14.037 -5.246 33.413
115 H LEU 14 HN LEU 14 15.078 -6.109 29.101
116 HA LEU 14 HA LEU 14 15.437 -3.970 27.138
117 HB2 LEU 14 HB2 LEU 14 17.232 -5.555 27.225
118 HB3 LEU 14 HB3 LEU 14 16.124 -6.908 27.113
119 HG LEU 14 HG LEU 14 15.805 -6.665 24.851
120 HD11 LEU 14 HD11 LEU 14 16.406 -4.455 23.652
121 HD12 LEU 14 HD12 LEU 14 14.907 -4.535 24.609
122 HD13 LEU 14 HD13 LEU 14 16.350 -3.737 25.279
123 HD21 LEU 14 HD21 LEU 14 18.165 -7.192 25.307
124 HD22 LEU 14 HD22 LEU 14 17.953 -6.311 23.775
125 HD23 LEU 14 HD23 LEU 14 18.562 -5.459 25.214
126 H VAL 15 HN VAL 15 13.637 -3.318 26.101
127 HA VAL 15 HA VAL 15 11.558 -5.350 25.670
128 HB VAL 15 HB VAL 15 11.040 -2.408 25.555
129 HG11 VAL 15 HG11 VAL 15 9.127 -4.128 26.936
130 HG12 VAL 15 HG12 VAL 15 8.892 -3.039 25.548
131 HG13 VAL 15 HG13 VAL 15 9.483 -4.698 25.288
132 HG21 VAL 15 HG21 VAL 15 10.378 -2.971 28.141
133 HG22 VAL 15 HG22 VAL 15 11.881 -3.907 27.961
134 HG23 VAL 15 HG23 VAL 15 11.878 -2.157 27.637
135 H ARG 16 HN ARG 16 12.290 -6.190 23.696
136 HA ARG 16 HA ARG 16 12.819 -4.254 21.624
137 HB2 ARG 16 HB2 ARG 16 13.386 -7.183 22.038
138 HB3 ARG 16 HB3 ARG 16 13.209 -6.644 20.381
139 HG2 ARG 16 HG2 ARG 16 14.922 -4.828 20.845
140 HG3 ARG 16 HG3 ARG 16 15.157 -5.510 22.442
141 HD2 ARG 16 HD2 ARG 16 16.878 -6.542 21.196
142 HD3 ARG 16 HD3 ARG 16 15.626 -7.768 21.187
143 HE ARG 16 HE ARG 16 15.222 -7.348 18.886
144 HH11 ARG 16 HH22 ARG 16 17.513 -4.983 20.196
145 HH12 ARG 16 HH21 ARG 16 17.986 -4.393 18.637
146 HH22 ARG 16 HH1 ARG 16 16.993 -5.341 16.672
147 H TYR 17 HN TYR 17 11.032 -3.553 20.488
148 HA TYR 17 HA TYR 17 8.774 -5.385 20.223
149 HB2 TYR 17 HB2 TYR 17 8.981 -2.752 20.940
150 HB3 TYR 17 HB3 TYR 17 8.952 -2.519 19.203
151 HD1 TYR 17 HD1 TYR 17 7.018 -3.840 22.083
152 HD2 TYR 17 HD2 TYR 17 6.918 -2.714 17.956
153 HE1 TYR 17 HE1 TYR 17 4.479 -3.967 22.102
154 HE2 TYR 17 HE2 TYR 17 4.379 -2.845 17.990
155 HH TYR 17 HH TYR 17 2.626 -3.086 20.909
156 H ARG 18 HN ARG 18 7.644 -5.518 18.099
157 HA ARG 18 HA ARG 18 9.250 -4.803 15.841
158 HB2 ARG 18 HB2 ARG 18 8.871 -7.299 14.985
159 HB3 ARG 18 HB3 ARG 18 10.254 -6.915 15.991
160 HG2 ARG 18 HG2 ARG 18 8.810 -7.544 18.025
161 HG3 ARG 18 HG3 ARG 18 7.613 -8.146 16.896
162 HD2 ARG 18 HD2 ARG 18 9.147 -9.815 16.016
163 HD3 ARG 18 HD3 ARG 18 10.515 -9.088 16.836
164 HE ARG 18 HE ARG 18 8.853 -9.670 18.939
165 HH11 ARG 18 HH22 ARG 18 9.985 -11.627 16.211
166 HH12 ARG 18 HH21 ARG 18 9.904 -13.119 17.088
167 HH22 ARG 18 HH1 ARG 18 9.173 -13.102 19.370
168 H ARG 19 HN ARG 19 7.981 -5.700 13.726
169 HA ARG 19 HA ARG 19 5.326 -6.342 13.936
170 HB2 ARG 19 HB2 ARG 19 5.409 -3.850 14.854
171 HB3 ARG 19 HB3 ARG 19 5.559 -3.413 13.164
172 HG2 ARG 19 HG2 ARG 19 3.378 -5.349 13.949
173 HG3 ARG 19 HG3 ARG 19 3.157 -3.653 14.332
174 HD2 ARG 19 HD2 ARG 19 4.147 -3.960 11.591
175 HD3 ARG 19 HD3 ARG 19 2.697 -4.915 11.827
176 HE ARG 19 HE ARG 19 2.368 -2.278 12.974
177 HH11 ARG 19 HH22 ARG 19 2.383 -3.990 9.872
178 HH12 ARG 19 HH21 ARG 19 1.357 -2.835 9.088
179 HH22 ARG 19 HH1 ARG 19 0.565 -0.940 10.324
180 H CYS 20 HN CYS 20 4.290 -6.426 11.767
181 HA CYS 20 HA CYS 20 5.910 -5.529 9.556
182 HB2 CYS 20 HB2 CYS 20 5.419 -8.451 10.121
183 HB3 CYS 20 HB3 CYS 20 5.755 -7.853 8.509
184 H TRP 21 HN TRP 21 4.638 -5.806 7.464
185 HA TRP 21 HA TRP 21 1.793 -5.553 8.070
186 HB2 TRP 21 HB2 TRP 21 2.433 -3.680 6.909
187 HB3 TRP 21 HB3 TRP 21 3.606 -4.537 5.929
188 HD1 TRP 21 HD1 TRP 21 0.091 -3.255 5.777
189 HE1 TRP 21 HE1 TRP 21 -1.160 -3.951 3.560
190 HE3 TRP 21 HE3 TRP 21 3.524 -6.702 4.299
191 HZ2 TRP 21 HZ2 TRP 21 -0.586 -5.822 1.484
192 HZ3 TRP 21 HZ3 TRP 21 3.103 -7.919 2.165
193 HH2 TRP 21 HH2 TRP 21 1.132 -7.526 0.774
194 H1 ARG 31 HN ARG 31 6.701 0.220 4.355
195 HA ARG 31 HA ARG 31 9.392 0.983 3.707
196 HB2 ARG 31 HB2 ARG 31 7.269 2.041 5.615
197 HB3 ARG 31 HB3 ARG 31 8.924 2.603 5.734
198 HG2 ARG 31 HG2 ARG 31 8.166 4.176 4.223
199 HG3 ARG 31 HG3 ARG 31 8.611 2.934 3.071
200 HD2 ARG 31 HD2 ARG 31 6.387 3.586 2.456
201 HD3 ARG 31 HD3 ARG 31 6.200 2.045 3.269
202 HE ARG 31 HE ARG 31 6.005 4.094 5.243
203 HH11 ARG 31 HH22 ARG 31 4.183 2.888 2.454
204 HH12 ARG 31 HH21 ARG 31 2.652 3.409 3.072
205 HH22 ARG 31 HH1 ARG 31 2.559 4.522 5.193
206 H TRP 32 HN TRP 32 10.705 1.548 5.980
207 HA TRP 32 HA TRP 32 10.462 -0.819 7.698
208 HB2 TRP 32 HB2 TRP 32 12.785 0.075 6.080
209 HB3 TRP 32 HB3 TRP 32 13.122 -0.452 7.717
210 HD1 TRP 32 HD1 TRP 32 12.059 -1.835 4.316
211 HE1 TRP 32 HE1 TRP 32 12.061 -4.474 4.290
212 HE3 TRP 32 HE3 TRP 32 12.739 -2.406 9.323
213 HZ2 TRP 32 HZ2 TRP 32 12.341 -6.459 6.321
214 HZ3 TRP 32 HZ3 TRP 32 12.866 -4.728 10.220
215 HH2 TRP 32 HH2 TRP 32 12.679 -6.714 8.807
216 H CYS 33 HN CYS 33 9.729 0.121 9.579
217 HA CYS 33 HA CYS 33 10.707 2.751 10.269
218 HB2 CYS 33 HB2 CYS 33 8.461 1.007 11.131
219 HB3 CYS 33 HB3 CYS 33 9.123 2.090 12.340
220 H VAL 34 HN VAL 34 11.721 3.143 12.413
221 HA VAL 34 HA VAL 34 12.687 0.814 13.824
222 HB VAL 34 HB VAL 34 15.007 1.334 13.582
223 HG11 VAL 34 HG11 VAL 34 15.380 0.719 11.288
224 HG12 VAL 34 HG12 VAL 34 13.887 -0.081 11.837
225 HG13 VAL 34 HG13 VAL 34 13.794 1.364 10.801
226 HG21 VAL 34 HG21 VAL 34 14.938 3.747 13.445
227 HG22 VAL 34 HG22 VAL 34 15.797 3.112 12.021
228 HG23 VAL 34 HG23 VAL 34 14.116 3.676 11.868
229 H TYR 35 HN TYR 35 12.484 1.251 15.957
230 HA TYR 35 HA TYR 35 13.016 3.972 16.855
231 HB2 TYR 35 HB2 TYR 35 10.459 3.199 16.276
232 HB3 TYR 35 HB3 TYR 35 10.587 2.417 17.840
233 HD1 TYR 35 HD2 TYR 35 10.533 5.668 16.092
234 HD2 TYR 35 HD1 TYR 35 10.621 3.707 19.894
235 HE1 TYR 35 HE2 TYR 35 9.939 7.856 17.243
236 HE2 TYR 35 HE1 TYR 35 10.027 5.902 21.031
237 HH TYR 35 HH TYR 35 9.840 8.898 19.180
238 H ALA 36 HN ALA 36 14.506 3.770 18.445
239 HA ALA 36 HA ALA 36 14.117 1.572 20.347
240 HB1 ALA 36 HB1 ALA 36 16.657 2.382 18.889
241 HB2 ALA 36 HB2 ALA 36 16.665 1.407 20.378
242 HB3 ALA 36 HB3 ALA 36 15.866 0.788 18.913
243 H TYR 37 HN TYR 37 14.650 2.088 22.511
244 HA TYR 37 HA TYR 37 15.520 4.855 22.956
245 HB2 TYR 37 HB2 TYR 37 12.945 4.326 23.107
246 HB3 TYR 37 HB3 TYR 37 13.340 3.304 24.475
247 HD1 TYR 37 HD2 TYR 37 14.367 4.351 26.543
248 HD2 TYR 37 HD1 TYR 37 12.743 6.687 23.348
249 HE1 TYR 37 HE2 TYR 37 14.218 6.368 28.084
250 HE2 TYR 37 HE1 TYR 37 12.600 8.696 24.900
251 HH TYR 37 HH TYR 37 12.406 9.073 27.340
252 H VAL 38 HN VAL 38 17.636 3.872 23.387
253 HA VAL 38 HA VAL 38 17.680 2.232 25.811
254 HB VAL 38 HB VAL 38 19.762 2.779 23.686
255 HG11 VAL 38 HG11 VAL 38 21.156 1.130 24.803
256 HG12 VAL 38 HG12 VAL 38 20.759 2.446 25.934
257 HG13 VAL 38 HG13 VAL 38 19.915 0.884 26.055
258 HG21 VAL 38 HG21 VAL 38 18.824 1.104 22.555
259 HG22 VAL 38 HG22 VAL 38 19.117 0.016 23.933
260 HG23 VAL 38 HG23 VAL 38 17.586 0.917 23.820
261 H ARG 39 HN ARG 39 18.822 2.885 27.663
262 HA ARG 39 HA ARG 39 19.995 5.528 27.505
263 HB2 ARG 39 HB2 ARG 39 17.532 5.446 28.458
264 HB3 ARG 39 HB3 ARG 39 18.269 4.743 29.884
265 HG2 ARG 39 HG2 ARG 39 19.805 6.727 30.050
266 HG3 ARG 39 HG3 ARG 39 19.027 7.433 28.648
267 HD2 ARG 39 HD2 ARG 39 17.393 8.299 29.964
268 HD3 ARG 39 HD3 ARG 39 16.944 6.691 30.496
269 HE ARG 39 HE ARG 39 19.209 7.236 31.996
270 HH11 ARG 39 HH22 ARG 39 16.145 8.943 31.489
271 HH12 ARG 39 HH21 ARG 39 16.158 9.687 33.054
272 HH22 ARG 39 HH1 ARG 39 17.979 9.245 34.548
273 H ILE 40 HN ILE 40 21.849 5.776 28.831
274 HA ILE 40 HA ILE 40 22.365 3.796 30.869
275 HB ILE 40 HB ILE 40 23.854 3.916 28.275
276 HG12 ILE 40 HG12 ILE 40 22.313 1.955 29.815
277 HG13 ILE 40 HG13 ILE 40 22.664 2.022 28.099
278 HG21 ILE 40 HG21 ILE 40 25.037 3.000 30.911
279 HG22 ILE 40 HG22 ILE 40 25.767 2.788 29.302
280 HG23 ILE 40 HG23 ILE 40 25.540 4.423 29.968
281 HD11 ILE 40 HD11 ILE 40 23.703 0.027 29.135
282 HD12 ILE 40 HD12 ILE 40 24.953 1.133 28.517
283 HD13 ILE 40 HD13 ILE 40 24.602 1.072 30.261
284 H ARG 41 HN ARG 41 24.181 4.434 32.266
285 HA ARG 41 HA ARG 41 25.177 5.916 33.485
286 HB2 ARG 41 HB2 ARG 41 25.801 7.072 30.730
287 HB3 ARG 41 HB3 ARG 41 26.482 7.765 32.189
288 HG2 ARG 41 HG2 ARG 41 26.746 4.802 31.522
289 HG3 ARG 41 HG3 ARG 41 27.913 5.990 30.975
290 HD2 ARG 41 HD2 ARG 41 27.443 6.428 33.798
291 HD3 ARG 41 HD3 ARG 41 27.748 4.720 33.557
292 HE ARG 41 HE ARG 41 29.666 6.200 32.032
293 HH11 ARG 41 HH22 ARG 41 28.867 5.488 35.410
294 HH12 ARG 41 HH21 ARG 41 30.497 5.679 35.965
295 HH22 ARG 41 HH1 ARG 41 32.214 6.246 34.392
296 H GLY 42 HN GLY 42 24.332 8.327 30.924
297 HA2 GLY 42 HA1 GLY 42 22.083 9.365 32.401
298 HA3 GLY 42 HA2 GLY 42 23.516 10.368 32.510
299 H VAL 43 HN VAL 43 22.919 8.342 29.643
300 HA VAL 43 HA VAL 43 22.036 10.729 28.189
301 HB VAL 43 HB VAL 43 23.920 8.826 26.883
302 HG11 VAL 43 HG11 VAL 43 22.772 11.430 26.380
303 HG12 VAL 43 HG12 VAL 43 24.549 11.525 26.346
304 HG13 VAL 43 HG13 VAL 43 23.699 10.372 25.289
305 HG21 VAL 43 HG21 VAL 43 25.139 9.163 28.902
306 HG22 VAL 43 HG22 VAL 43 25.845 10.263 27.693
307 HG23 VAL 43 HG23 VAL 43 24.741 10.898 28.937
308 H LEU 44 HN LEU 44 20.270 10.360 26.926
309 HA LEU 44 HA LEU 44 19.427 7.568 26.705
310 HB2 LEU 44 HB2 LEU 44 17.667 8.597 27.663
311 HB3 LEU 44 HB3 LEU 44 18.064 10.170 27.001
312 HG LEU 44 HG LEU 44 17.171 9.441 24.795
313 HD11 LEU 44 HD11 LEU 44 17.182 6.861 26.075
314 HD12 LEU 44 HD12 LEU 44 15.540 7.262 25.518
315 HD13 LEU 44 HD13 LEU 44 16.899 7.282 24.369
316 HD21 LEU 44 HD21 LEU 44 14.735 9.339 25.572
317 HD22 LEU 44 HD22 LEU 44 15.385 9.430 27.226
318 HD23 LEU 44 HD23 LEU 44 15.702 10.748 26.072
319 H VAL 45 HN VAL 45 19.959 6.556 24.851
320 HA VAL 45 HA VAL 45 20.472 8.181 22.501
321 HB VAL 45 HB VAL 45 20.707 5.195 22.654
322 HG11 VAL 45 HG11 VAL 45 22.934 6.427 21.415
323 HG12 VAL 45 HG12 VAL 45 21.612 5.520 20.642
324 HG13 VAL 45 HG13 VAL 45 21.489 7.286 20.830
325 HG21 VAL 45 HG21 VAL 45 22.257 7.186 24.222
326 HG22 VAL 45 HG22 VAL 45 21.950 5.461 24.534
327 HG23 VAL 45 HG23 VAL 45 23.205 5.944 23.369
328 H ARG 46 HN ARG 46 18.510 8.867 21.664
329 HA ARG 46 HA ARG 46 16.487 6.829 21.337
330 HB2 ARG 46 HB2 ARG 46 16.510 9.857 21.271
331 HB3 ARG 46 HB3 ARG 46 15.220 9.015 20.435
332 HG2 ARG 46 HG2 ARG 46 14.752 7.731 22.582
333 HG3 ARG 46 HG3 ARG 46 15.941 8.733 23.389
334 HD2 ARG 46 HD2 ARG 46 13.267 9.562 22.214
335 HD3 ARG 46 HD3 ARG 46 13.866 9.817 23.841
336 HE ARG 46 HE ARG 46 15.684 11.248 22.409
337 HH11 ARG 46 HH22 ARG 46 12.148 11.169 22.208
338 HH12 ARG 46 HH21 ARG 46 12.018 12.806 21.658
339 HH22 ARG 46 HH1 ARG 46 14.010 14.104 21.357
340 H TYR 47 HN TYR 47 15.660 6.237 19.253
341 HA TYR 47 HA TYR 47 16.950 7.489 16.946
342 HB2 TYR 47 HB2 TYR 47 18.229 5.422 17.640
343 HB3 TYR 47 HB3 TYR 47 16.736 4.506 17.694
344 HD1 TYR 47 HD2 TYR 47 17.375 6.936 14.997
345 HD2 TYR 47 HD1 TYR 47 17.544 2.817 16.141
346 HE1 TYR 47 HE2 TYR 47 17.693 6.266 12.565
347 HE2 TYR 47 HE1 TYR 47 17.862 2.161 13.706
348 HH TYR 47 HH TYR 47 18.816 3.332 11.638
349 H ARG 48 HN ARG 48 15.598 7.717 15.188
350 HA ARG 48 HA ARG 48 13.243 6.086 15.097
351 HB2 ARG 48 HB2 ARG 48 12.083 7.752 16.228
352 HB3 ARG 48 HB3 ARG 48 13.231 9.000 15.787
353 HG2 ARG 48 HG2 ARG 48 11.602 7.818 13.555
354 HG3 ARG 48 HG3 ARG 48 10.747 8.834 14.698
355 HD2 ARG 48 HD2 ARG 48 12.895 10.438 14.287
356 HD3 ARG 48 HD3 ARG 48 12.933 9.573 12.764
357 HE ARG 48 HE ARG 48 10.287 10.259 12.932
358 HH11 ARG 48 HH22 ARG 48 13.239 12.170 13.362
359 HH12 ARG 48 HH21 ARG 48 12.508 13.648 12.830
360 HH22 ARG 48 HH1 ARG 48 10.204 13.646 12.170
361 H ARG 49 HN ARG 49 12.607 5.718 12.942
362 HA ARG 49 HA ARG 49 13.058 7.539 10.910
363 HB2 ARG 49 HB2 ARG 49 15.468 6.784 11.344
364 HB3 ARG 49 HB3 ARG 49 14.994 5.172 10.849
365 HG2 ARG 49 HG2 ARG 49 14.494 7.576 9.052
366 HG3 ARG 49 HG3 ARG 49 16.042 6.754 9.052
367 HD2 ARG 49 HD2 ARG 49 13.993 4.730 8.896
368 HD3 ARG 49 HD3 ARG 49 13.598 5.969 7.721
369 HE ARG 49 HE ARG 49 15.962 4.213 7.692
370 HH11 ARG 49 HH22 ARG 49 14.484 7.159 6.393
371 HH12 ARG 49 HH21 ARG 49 15.487 7.188 4.981
372 HH22 ARG 49 HH1 ARG 49 17.126 5.467 4.670
373 H CYS 50 HN CYS 50 12.179 6.732 8.852
374 HA CYS 50 HA CYS 50 11.286 3.989 8.821
375 HB2 CYS 50 HB2 CYS 50 9.297 6.265 8.675
376 HB3 CYS 50 HB3 CYS 50 8.945 4.575 8.373
377 H TRP 51 HN TRP 51 11.129 3.248 6.663
378 HA TRP 51 HA TRP 51 11.067 5.208 4.532
379 HB2 TRP 51 HB2 TRP 51 13.346 5.280 4.635
380 HB3 TRP 51 HB3 TRP 51 13.497 3.650 5.262
381 HD1 TRP 51 HD1 TRP 51 13.157 5.525 1.917
382 HE1 TRP 51 HE1 TRP 51 13.773 3.968 -0.122
383 HE3 TRP 51 HE3 TRP 51 13.509 1.234 4.623
384 HZ2 TRP 51 HZ2 TRP 51 14.326 1.180 -0.370
385 HZ3 TRP 51 HZ3 TRP 51 14.092 -0.862 3.405
386 HH2 TRP 51 HH2 TRP 51 14.495 -0.934 0.996
Start of MODEL 7
1 H1 ARG 1 HN ARG 1 10.278 -5.360 0.321
2 HA ARG 1 HA ARG 1 8.417 -6.768 2.022
3 HB2 ARG 1 HB2 ARG 1 10.935 -7.444 1.448
4 HB3 ARG 1 HB3 ARG 1 11.333 -6.297 2.711
5 HG2 ARG 1 HG2 ARG 1 11.147 -8.499 3.730
6 HG3 ARG 1 HG3 ARG 1 9.792 -7.533 4.280
7 HD2 ARG 1 HD2 ARG 1 9.333 -9.110 1.770
8 HD3 ARG 1 HD3 ARG 1 9.520 -10.049 3.238
9 HE ARG 1 HE ARG 1 7.741 -8.039 3.968
10 HH11 ARG 1 HH22 ARG 1 7.790 -10.490 1.409
11 HH12 ARG 1 HH21 ARG 1 6.065 -10.617 1.326
12 HH22 ARG 1 HH1 ARG 1 4.717 -9.265 2.776
13 H TRP 2 HN TRP 2 7.618 -5.878 3.940
14 HA TRP 2 HA TRP 2 8.745 -3.272 4.711
15 HB2 TRP 2 HB2 TRP 2 5.879 -3.975 5.207
16 HB3 TRP 2 HB3 TRP 2 6.644 -2.401 5.109
17 HD1 TRP 2 HD1 TRP 2 4.228 -4.138 3.194
18 HE1 TRP 2 HE1 TRP 2 4.199 -3.617 0.607
19 HE3 TRP 2 HE3 TRP 2 8.875 -2.081 3.023
20 HZ2 TRP 2 HZ2 TRP 2 6.080 -2.429 -1.180
21 HZ3 TRP 2 HZ3 TRP 2 9.703 -1.265 0.818
22 HH2 TRP 2 HH2 TRP 2 8.388 -1.413 -1.237
23 H CYS 3 HN CYS 3 9.478 -3.188 6.808
24 HA CYS 3 HA CYS 3 8.346 -5.024 8.732
25 HB2 CYS 3 HB2 CYS 3 11.107 -5.260 7.655
26 HB3 CYS 3 HB3 CYS 3 10.921 -5.413 9.391
27 H VAL 4 HN VAL 4 9.034 -4.367 10.987
28 HA VAL 4 HA VAL 4 10.307 -1.761 11.142
29 HB VAL 4 HB VAL 4 8.543 -0.669 12.189
30 HG11 VAL 4 HG11 VAL 4 6.745 -0.682 10.606
31 HG12 VAL 4 HG12 VAL 4 8.243 -1.040 9.714
32 HG13 VAL 4 HG13 VAL 4 7.110 -2.353 10.113
33 HG21 VAL 4 HG21 VAL 4 7.632 -2.020 13.804
34 HG22 VAL 4 HG22 VAL 4 6.326 -2.079 12.596
35 HG23 VAL 4 HG23 VAL 4 7.490 -3.421 12.714
36 H TYR 5 HN TYR 5 11.787 -1.837 12.750
37 HA TYR 5 HA TYR 5 11.348 -3.860 14.842
38 HB2 TYR 5 HB2 TYR 5 13.717 -2.699 13.303
39 HB3 TYR 5 HB3 TYR 5 14.010 -3.323 14.914
40 HD1 TYR 5 HD2 TYR 5 12.442 -5.735 15.115
41 HD2 TYR 5 HD1 TYR 5 14.543 -4.185 11.726
42 HE1 TYR 5 HE2 TYR 5 12.650 -8.083 14.161
43 HE2 TYR 5 HE1 TYR 5 14.744 -6.538 10.783
44 HH TYR 5 HH TYR 5 13.761 -9.324 12.669
45 H ALA 6 HN ALA 6 11.632 -3.286 17.014
46 HA ALA 6 HA ALA 6 12.359 -0.499 17.528
47 HB1 ALA 6 HB1 ALA 6 10.225 -1.356 19.289
48 HB2 ALA 6 HB2 ALA 6 10.291 0.056 18.208
49 HB3 ALA 6 HB3 ALA 6 9.710 -1.510 17.592
50 H TYR 7 HN TYR 7 13.497 -0.198 19.464
51 HA TYR 7 HA TYR 7 13.778 -2.538 21.192
52 HB2 TYR 7 HB2 TYR 7 15.638 -2.583 19.522
53 HB3 TYR 7 HB3 TYR 7 15.934 -0.872 19.757
54 HD1 TYR 7 HD2 TYR 7 15.211 -2.716 22.785
55 HD2 TYR 7 HD1 TYR 7 18.341 -1.577 20.100
56 HE1 TYR 7 HE2 TYR 7 16.944 -3.259 24.564
57 HE2 TYR 7 HE1 TYR 7 20.064 -2.123 21.889
58 HH TYR 7 HH TYR 7 19.888 -2.157 24.605
59 H VAL 8 HN VAL 8 12.655 -1.491 22.873
60 HA VAL 8 HA VAL 8 13.735 1.094 23.710
61 HB VAL 8 HB VAL 8 11.316 -0.269 24.854
62 HG11 VAL 8 HG11 VAL 8 12.560 2.034 25.553
63 HG12 VAL 8 HG12 VAL 8 11.413 2.652 24.339
64 HG13 VAL 8 HG13 VAL 8 10.814 1.751 25.752
65 HG21 VAL 8 HG21 VAL 8 11.608 0.970 22.143
66 HG22 VAL 8 HG22 VAL 8 10.605 -0.402 22.673
67 HG23 VAL 8 HG23 VAL 8 10.109 1.264 23.058
68 H ARG 9 HN ARG 9 15.099 1.233 25.420
69 HA ARG 9 HA ARG 9 14.955 -0.890 27.375
70 HB2 ARG 9 HB2 ARG 9 16.776 -1.643 25.954
71 HB3 ARG 9 HB3 ARG 9 17.461 -0.033 25.858
72 HG2 ARG 9 HG2 ARG 9 18.082 -0.081 28.228
73 HG3 ARG 9 HG3 ARG 9 17.215 -1.584 28.476
74 HD2 ARG 9 HD2 ARG 9 18.821 -2.500 26.558
75 HD3 ARG 9 HD3 ARG 9 19.817 -1.125 26.992
76 HE ARG 9 HE ARG 9 19.364 -3.525 28.599
77 HH11 ARG 9 HH22 ARG 9 20.262 -0.100 28.746
78 HH12 ARG 9 HH21 ARG 9 21.104 -0.258 30.252
79 HH22 ARG 9 HH1 ARG 9 21.217 -2.403 31.315
80 H ILE 10 HN ILE 10 15.060 -0.052 29.458
81 HA ILE 10 HA ILE 10 16.516 2.398 29.916
82 HB ILE 10 HB ILE 10 13.669 2.404 30.810
83 HG12 ILE 10 HG12 ILE 10 14.568 3.314 28.060
84 HG13 ILE 10 HG13 ILE 10 13.581 1.903 28.386
85 HG21 ILE 10 HG21 ILE 10 15.059 4.842 29.870
86 HG22 ILE 10 HG22 ILE 10 14.041 4.571 31.305
87 HG23 ILE 10 HG23 ILE 10 15.746 4.058 31.313
88 HD11 ILE 10 HD11 ILE 10 12.358 4.082 29.782
89 HD12 ILE 10 HD12 ILE 10 12.754 4.663 28.147
90 HD13 ILE 10 HD13 ILE 10 11.739 3.215 28.357
91 H ARG 11 HN ARG 11 16.900 2.773 32.211
92 HA ARG 11 HA ARG 11 17.500 2.071 34.167
93 HB2 ARG 11 HB2 ARG 11 14.776 0.715 33.974
94 HB3 ARG 11 HB3 ARG 11 15.738 0.607 35.434
95 HG2 ARG 11 HG2 ARG 11 14.628 3.125 34.128
96 HG3 ARG 11 HG3 ARG 11 14.239 2.486 35.713
97 HD2 ARG 11 HD2 ARG 11 16.966 2.770 35.962
98 HD3 ARG 11 HD3 ARG 11 16.621 4.070 34.838
99 HE ARG 11 HE ARG 11 14.691 4.153 36.959
100 HH11 ARG 11 HH22 ARG 11 18.131 4.784 36.389
101 HH12 ARG 11 HH21 ARG 11 18.253 5.958 37.656
102 HH22 ARG 11 HH1 ARG 11 16.312 6.483 38.961
103 H GLY 12 HN GLY 12 15.657 -0.971 33.617
104 HA2 GLY 12 HA1 GLY 12 18.057 -2.446 32.894
105 HA3 GLY 12 HA2 GLY 12 17.403 -2.791 34.483
106 H VAL 13 HN VAL 13 15.157 -1.737 31.975
107 HA VAL 13 HA VAL 13 14.204 -4.511 31.785
108 HB VAL 13 HB VAL 13 12.649 -1.932 31.507
109 HG11 VAL 13 HG11 VAL 13 10.698 -3.570 31.842
110 HG12 VAL 13 HG12 VAL 13 11.513 -3.577 30.260
111 HG13 VAL 13 HG13 VAL 13 11.868 -4.852 31.450
112 HG21 VAL 13 HG21 VAL 13 13.126 -1.944 33.772
113 HG22 VAL 13 HG22 VAL 13 11.614 -2.882 33.724
114 HG23 VAL 13 HG23 VAL 13 13.178 -3.721 33.864
115 H LEU 14 HN LEU 14 14.354 -5.466 29.821
116 HA LEU 14 HA LEU 14 14.957 -3.707 27.562
117 HB2 LEU 14 HB2 LEU 14 16.669 -5.283 27.930
118 HB3 LEU 14 HB3 LEU 14 15.534 -6.599 28.158
119 HG LEU 14 HG LEU 14 15.252 -6.954 25.923
120 HD11 LEU 14 HD11 LEU 14 14.290 -5.128 24.986
121 HD12 LEU 14 HD12 LEU 14 15.465 -3.997 25.699
122 HD13 LEU 14 HD13 LEU 14 15.910 -4.958 24.268
123 HD21 LEU 14 HD21 LEU 14 17.428 -6.544 24.703
124 HD22 LEU 14 HD22 LEU 14 17.983 -5.678 26.156
125 HD23 LEU 14 HD23 LEU 14 17.554 -7.403 26.257
126 H VAL 15 HN VAL 15 13.336 -3.220 26.194
127 HA VAL 15 HA VAL 15 11.265 -5.263 25.819
128 HB VAL 15 HB VAL 15 10.671 -2.315 25.867
129 HG11 VAL 15 HG11 VAL 15 9.124 -4.133 24.861
130 HG12 VAL 15 HG12 VAL 15 8.809 -4.589 26.553
131 HG13 VAL 15 HG13 VAL 15 8.421 -2.947 25.987
132 HG21 VAL 15 HG21 VAL 15 11.246 -4.075 28.161
133 HG22 VAL 15 HG22 VAL 15 11.191 -2.299 28.058
134 HG23 VAL 15 HG23 VAL 15 9.685 -3.225 28.261
135 H ARG 16 HN ARG 16 11.925 -6.010 23.823
136 HA ARG 16 HA ARG 16 12.460 -3.959 21.841
137 HB2 ARG 16 HB2 ARG 16 13.007 -6.968 21.703
138 HB3 ARG 16 HB3 ARG 16 13.533 -5.779 20.528
139 HG2 ARG 16 HG2 ARG 16 14.640 -4.622 22.679
140 HG3 ARG 16 HG3 ARG 16 14.536 -6.242 23.339
141 HD2 ARG 16 HD2 ARG 16 16.727 -5.728 22.149
142 HD3 ARG 16 HD3 ARG 16 15.906 -7.161 21.563
143 HE ARG 16 HE ARG 16 15.205 -4.696 20.117
144 HH11 ARG 16 HH22 ARG 16 17.377 -7.492 20.248
145 HH12 ARG 16 HH21 ARG 16 17.808 -7.392 18.573
146 HH22 ARG 16 HH1 ARG 16 16.853 -5.663 17.217
147 H TYR 17 HN TYR 17 10.883 -3.540 20.320
148 HA TYR 17 HA TYR 17 8.709 -5.491 20.094
149 HB2 TYR 17 HB2 TYR 17 8.715 -2.810 20.640
150 HB3 TYR 17 HB3 TYR 17 8.797 -2.693 18.894
151 HD1 TYR 17 HD1 TYR 17 6.906 -3.375 17.492
152 HD2 TYR 17 HD2 TYR 17 6.705 -3.657 21.756
153 HE1 TYR 17 HE1 TYR 17 4.383 -3.659 17.361
154 HE2 TYR 17 HE2 TYR 17 4.183 -3.940 21.611
155 HH TYR 17 HH TYR 17 2.526 -3.759 18.481
156 H ARG 18 HN ARG 18 7.788 -5.923 17.942
157 HA ARG 18 HA ARG 18 9.460 -5.206 15.733
158 HB2 ARG 18 HB2 ARG 18 9.375 -7.789 15.059
159 HB3 ARG 18 HB3 ARG 18 10.654 -7.187 16.095
160 HG2 ARG 18 HG2 ARG 18 9.182 -7.805 18.105
161 HG3 ARG 18 HG3 ARG 18 8.098 -8.599 16.980
162 HD2 ARG 18 HD2 ARG 18 10.895 -9.406 16.531
163 HD3 ARG 18 HD3 ARG 18 10.388 -9.731 18.177
164 HE ARG 18 HE ARG 18 8.398 -10.567 16.206
165 HH11 ARG 18 HH22 ARG 18 11.355 -11.550 17.892
166 HH12 ARG 18 HH21 ARG 18 11.059 -13.243 17.685
167 HH22 ARG 18 HH1 ARG 18 9.085 -13.957 16.528
168 H ARG 19 HN ARG 19 8.415 -5.976 13.598
169 HA ARG 19 HA ARG 19 5.917 -7.106 13.559
170 HB2 ARG 19 HB2 ARG 19 5.470 -4.762 14.706
171 HB3 ARG 19 HB3 ARG 19 5.661 -4.112 13.090
172 HG2 ARG 19 HG2 ARG 19 3.816 -6.474 13.472
173 HG3 ARG 19 HG3 ARG 19 3.264 -4.897 14.001
174 HD2 ARG 19 HD2 ARG 19 4.439 -4.538 11.401
175 HD3 ARG 19 HD3 ARG 19 3.402 -5.947 11.301
176 HE ARG 19 HE ARG 19 1.518 -4.581 11.656
177 HH11 ARG 19 HH22 ARG 19 4.460 -2.740 12.369
178 HH12 ARG 19 HH21 ARG 19 3.630 -1.226 12.498
179 HH22 ARG 19 HH1 ARG 19 1.256 -1.157 12.173
180 H CYS 20 HN CYS 20 5.026 -7.141 11.321
181 HA CYS 20 HA CYS 20 6.583 -5.758 9.324
182 HB2 CYS 20 HB2 CYS 20 6.515 -8.776 9.490
183 HB3 CYS 20 HB3 CYS 20 6.973 -7.887 8.051
184 H TRP 21 HN TRP 21 5.479 -5.946 7.156
185 HA TRP 21 HA TRP 21 2.831 -7.117 7.205
186 HB2 TRP 21 HB2 TRP 21 1.987 -5.170 7.987
187 HB3 TRP 21 HB3 TRP 21 3.330 -4.206 7.405
188 HD1 TRP 21 HD1 TRP 21 0.017 -5.744 6.109
189 HE1 TRP 21 HE1 TRP 21 -0.823 -4.489 3.945
190 HE3 TRP 21 HE3 TRP 21 4.147 -2.828 5.558
191 HZ2 TRP 21 HZ2 TRP 21 0.307 -2.463 2.283
192 HZ3 TRP 21 HZ3 TRP 21 4.198 -1.238 3.639
193 HH2 TRP 21 HH2 TRP 21 2.367 -1.029 2.033
194 H1 ARG 31 HN ARG 31 5.981 -0.682 4.325
195 HA ARG 31 HA ARG 31 8.357 0.629 3.308
196 HB2 ARG 31 HB2 ARG 31 6.074 1.440 5.088
197 HB3 ARG 31 HB3 ARG 31 7.631 2.154 5.460
198 HG2 ARG 31 HG2 ARG 31 7.060 3.697 3.868
199 HG3 ARG 31 HG3 ARG 31 7.595 2.476 2.731
200 HD2 ARG 31 HD2 ARG 31 5.390 3.192 2.020
201 HD3 ARG 31 HD3 ARG 31 5.218 1.573 2.669
202 HE ARG 31 HE ARG 31 4.809 3.362 4.830
203 HH11 ARG 31 HH22 ARG 31 3.240 2.553 1.758
204 HH12 ARG 31 HH21 ARG 31 1.658 2.998 2.306
205 HH22 ARG 31 HH1 ARG 31 1.378 3.817 4.541
206 H TRP 32 HN TRP 32 9.512 1.668 5.608
207 HA TRP 32 HA TRP 32 9.963 -0.671 7.324
208 HB2 TRP 32 HB2 TRP 32 11.923 0.864 5.700
209 HB3 TRP 32 HB3 TRP 32 12.408 0.421 7.325
210 HD1 TRP 32 HD1 TRP 32 11.752 -1.135 3.898
211 HE1 TRP 32 HE1 TRP 32 12.489 -3.668 3.817
212 HE3 TRP 32 HE3 TRP 32 12.590 -1.596 8.892
213 HZ2 TRP 32 HZ2 TRP 32 13.321 -5.537 5.806
214 HZ3 TRP 32 HZ3 TRP 32 13.363 -3.809 9.740
215 HH2 TRP 32 HH2 TRP 32 13.729 -5.739 8.286
216 H CYS 33 HN CYS 33 10.645 -0.072 9.520
217 HA CYS 33 HA CYS 33 10.511 2.744 10.154
218 HB2 CYS 33 HB2 CYS 33 8.378 0.798 10.848
219 HB3 CYS 33 HB3 CYS 33 8.896 1.880 12.125
220 H VAL 34 HN VAL 34 11.423 3.151 12.329
221 HA VAL 34 HA VAL 34 12.488 0.864 13.737
222 HB VAL 34 HB VAL 34 14.759 1.429 13.543
223 HG11 VAL 34 HG11 VAL 34 13.835 0.197 11.611
224 HG12 VAL 34 HG12 VAL 34 13.565 1.741 10.767
225 HG13 VAL 34 HG13 VAL 34 15.221 1.216 11.155
226 HG21 VAL 34 HG21 VAL 34 13.743 4.032 12.456
227 HG22 VAL 34 HG22 VAL 34 14.999 3.716 13.677
228 HG23 VAL 34 HG23 VAL 34 15.349 3.455 11.951
229 H TYR 35 HN TYR 35 12.099 1.247 15.851
230 HA TYR 35 HA TYR 35 12.419 3.987 16.814
231 HB2 TYR 35 HB2 TYR 35 9.957 3.010 16.142
232 HB3 TYR 35 HB3 TYR 35 10.102 2.216 17.698
233 HD1 TYR 35 HD1 TYR 35 10.294 3.588 19.787
234 HD2 TYR 35 HD2 TYR 35 9.494 5.361 15.977
235 HE1 TYR 35 HE1 TYR 35 9.479 5.705 20.935
236 HE2 TYR 35 HE2 TYR 35 8.682 7.472 17.137
237 HH TYR 35 HH TYR 35 7.759 7.615 20.177
238 H ALA 36 HN ALA 36 14.087 3.702 18.237
239 HA ALA 36 HA ALA 36 13.716 1.567 20.220
240 HB1 ALA 36 HB1 ALA 36 15.453 0.804 18.746
241 HB2 ALA 36 HB2 ALA 36 16.234 2.404 18.737
242 HB3 ALA 36 HB3 ALA 36 16.252 1.412 20.215
243 H TYR 37 HN TYR 37 14.697 2.062 22.341
244 HA TYR 37 HA TYR 37 15.465 4.827 22.753
245 HB2 TYR 37 HB2 TYR 37 12.835 4.325 22.877
246 HB3 TYR 37 HB3 TYR 37 13.227 3.495 24.370
247 HD1 TYR 37 HD1 TYR 37 14.432 4.845 26.212
248 HD2 TYR 37 HD2 TYR 37 12.506 6.658 22.851
249 HE1 TYR 37 HE1 TYR 37 14.315 7.055 27.463
250 HE2 TYR 37 HE2 TYR 37 12.395 8.863 24.112
251 HH TYR 37 HH TYR 37 13.213 9.050 27.488
252 H VAL 38 HN VAL 38 17.467 3.420 23.104
253 HA VAL 38 HA VAL 38 17.383 1.943 25.607
254 HB VAL 38 HB VAL 38 19.583 2.336 23.568
255 HG11 VAL 38 HG11 VAL 38 19.366 0.551 26.008
256 HG12 VAL 38 HG12 VAL 38 20.552 0.292 24.706
257 HG13 VAL 38 HG13 VAL 38 20.592 1.794 25.661
258 HG21 VAL 38 HG21 VAL 38 17.393 1.077 22.918
259 HG22 VAL 38 HG22 VAL 38 18.969 0.333 22.555
260 HG23 VAL 38 HG23 VAL 38 18.030 -0.214 23.965
261 H ARG 39 HN ARG 39 18.701 2.474 27.426
262 HA ARG 39 HA ARG 39 19.986 5.057 27.271
263 HB2 ARG 39 HB2 ARG 39 17.513 5.082 28.259
264 HB3 ARG 39 HB3 ARG 39 18.269 4.411 29.690
265 HG2 ARG 39 HG2 ARG 39 19.824 6.340 29.812
266 HG3 ARG 39 HG3 ARG 39 19.163 6.996 28.328
267 HD2 ARG 39 HD2 ARG 39 17.488 8.014 29.474
268 HD3 ARG 39 HD3 ARG 39 16.964 6.480 30.140
269 HE ARG 39 HE ARG 39 18.239 6.888 32.103
270 HH11 ARG 39 HH22 ARG 39 18.841 9.400 29.677
271 HH12 ARG 39 HH21 ARG 39 19.636 10.460 30.792
272 HH22 ARG 39 HH1 ARG 39 19.888 9.785 33.078
273 H ILE 40 HN ILE 40 21.873 5.173 28.558
274 HA ILE 40 HA ILE 40 22.273 3.190 30.617
275 HB ILE 40 HB ILE 40 23.732 3.161 28.003
276 HG12 ILE 40 HG12 ILE 40 22.068 1.338 29.592
277 HG13 ILE 40 HG13 ILE 40 22.378 1.373 27.868
278 HG21 ILE 40 HG21 ILE 40 25.469 3.551 29.679
279 HG22 ILE 40 HG22 ILE 40 24.866 2.177 30.636
280 HG23 ILE 40 HG23 ILE 40 25.562 1.900 29.021
281 HD11 ILE 40 HD11 ILE 40 24.610 0.320 28.241
282 HD12 ILE 40 HD12 ILE 40 24.279 0.271 29.989
283 HD13 ILE 40 HD13 ILE 40 23.288 -0.693 28.868
284 H ARG 41 HN ARG 41 24.132 3.719 31.990
285 HA ARG 41 HA ARG 41 25.259 5.139 33.167
286 HB2 ARG 41 HB2 ARG 41 25.938 6.198 30.387
287 HB3 ARG 41 HB3 ARG 41 26.690 6.855 31.827
288 HG2 ARG 41 HG2 ARG 41 26.701 3.865 31.248
289 HG3 ARG 41 HG3 ARG 41 27.930 4.929 30.594
290 HD2 ARG 41 HD2 ARG 41 27.366 5.142 33.545
291 HD3 ARG 41 HD3 ARG 41 28.207 3.707 32.995
292 HE ARG 41 HE ARG 41 29.553 5.792 31.731
293 HH11 ARG 41 HH22 ARG 41 28.786 5.012 35.101
294 HH12 ARG 41 HH21 ARG 41 30.189 5.807 35.734
295 HH22 ARG 41 HH1 ARG 41 31.714 6.876 34.225
296 H GLY 42 HN GLY 42 24.559 7.554 30.565
297 HA2 GLY 42 HA1 GLY 42 22.416 8.789 32.039
298 HA3 GLY 42 HA2 GLY 42 23.922 9.680 32.127
299 H VAL 43 HN VAL 43 23.152 7.664 29.295
300 HA VAL 43 HA VAL 43 22.448 10.089 27.808
301 HB VAL 43 HB VAL 43 24.173 8.029 26.522
302 HG11 VAL 43 HG11 VAL 43 23.224 10.704 25.985
303 HG12 VAL 43 HG12 VAL 43 25.003 10.666 25.945
304 HG13 VAL 43 HG13 VAL 43 24.066 9.565 24.907
305 HG21 VAL 43 HG21 VAL 43 26.192 9.413 27.307
306 HG22 VAL 43 HG22 VAL 43 25.125 10.006 28.601
307 HG23 VAL 43 HG23 VAL 43 25.479 8.267 28.467
308 H LEU 44 HN LEU 44 20.646 9.838 26.568
309 HA LEU 44 HA LEU 44 19.598 7.114 26.384
310 HB2 LEU 44 HB2 LEU 44 17.927 8.276 27.347
311 HB3 LEU 44 HB3 LEU 44 18.432 9.811 26.668
312 HG LEU 44 HG LEU 44 17.437 9.207 24.505
313 HD11 LEU 44 HD11 LEU 44 17.240 7.043 24.015
314 HD12 LEU 44 HD12 LEU 44 17.313 6.561 25.727
315 HD13 LEU 44 HD13 LEU 44 15.763 7.059 25.008
316 HD21 LEU 44 HD21 LEU 44 15.139 9.476 25.119
317 HD22 LEU 44 HD22 LEU 44 15.437 8.813 26.743
318 HD23 LEU 44 HD23 LEU 44 16.133 10.385 26.283
319 H VAL 45 HN VAL 45 19.891 6.035 24.516
320 HA VAL 45 HA VAL 45 20.403 7.643 22.123
321 HB VAL 45 HB VAL 45 20.856 4.687 22.381
322 HG11 VAL 45 HG11 VAL 45 22.357 6.829 20.841
323 HG12 VAL 45 HG12 VAL 45 22.558 5.066 20.708
324 HG13 VAL 45 HG13 VAL 45 21.044 5.832 20.170
325 HG21 VAL 45 HG21 VAL 45 22.506 6.901 23.589
326 HG22 VAL 45 HG22 VAL 45 22.029 5.335 24.289
327 HG23 VAL 45 HG23 VAL 45 23.274 5.401 23.018
328 H ARG 46 HN ARG 46 18.352 8.170 21.371
329 HA ARG 46 HA ARG 46 16.587 5.891 20.985
330 HB2 ARG 46 HB2 ARG 46 14.961 8.025 20.497
331 HB3 ARG 46 HB3 ARG 46 15.190 7.355 22.100
332 HG2 ARG 46 HG2 ARG 46 17.024 9.001 22.530
333 HG3 ARG 46 HG3 ARG 46 16.807 9.667 20.923
334 HD2 ARG 46 HD2 ARG 46 14.343 9.507 22.634
335 HD3 ARG 46 HD3 ARG 46 15.555 10.671 23.130
336 HE ARG 46 HE ARG 46 14.873 10.739 20.260
337 HH11 ARG 46 HH22 ARG 46 14.225 12.083 23.474
338 HH12 ARG 46 HH21 ARG 46 13.518 13.539 22.858
339 HH22 ARG 46 HH1 ARG 46 13.361 13.858 20.488
340 H TYR 47 HN TYR 47 15.450 5.714 18.889
341 HA TYR 47 HA TYR 47 16.550 7.389 16.759
342 HB2 TYR 47 HB2 TYR 47 17.854 5.200 17.050
343 HB3 TYR 47 HB3 TYR 47 16.352 4.313 16.876
344 HD1 TYR 47 HD1 TYR 47 17.027 7.299 14.826
345 HD2 TYR 47 HD2 TYR 47 17.178 3.027 14.980
346 HE1 TYR 47 HE1 TYR 47 17.366 7.214 12.308
347 HE2 TYR 47 HE2 TYR 47 17.517 2.955 12.461
348 HH TYR 47 HH TYR 47 17.112 5.771 10.508
349 H ARG 48 HN ARG 48 15.136 7.727 15.017
350 HA ARG 48 HA ARG 48 12.720 6.185 14.977
351 HB2 ARG 48 HB2 ARG 48 12.720 9.220 15.366
352 HB3 ARG 48 HB3 ARG 48 11.297 8.297 14.925
353 HG2 ARG 48 HG2 ARG 48 11.083 8.421 17.264
354 HG3 ARG 48 HG3 ARG 48 11.838 6.854 17.056
355 HD2 ARG 48 HD2 ARG 48 13.553 7.536 18.378
356 HD3 ARG 48 HD3 ARG 48 13.989 8.723 17.165
357 HE ARG 48 HE ARG 48 13.006 10.400 18.475
358 HH11 ARG 48 HH22 ARG 48 11.892 7.241 19.629
359 HH12 ARG 48 HH21 ARG 48 11.104 7.890 21.028
360 HH22 ARG 48 HH1 ARG 48 11.161 10.255 21.414
361 H ARG 49 HN ARG 49 12.626 5.582 12.834
362 HA ARG 49 HA ARG 49 12.637 7.613 10.865
363 HB2 ARG 49 HB2 ARG 49 15.122 7.097 11.226
364 HB3 ARG 49 HB3 ARG 49 14.807 5.466 10.670
365 HG2 ARG 49 HG2 ARG 49 14.017 7.874 8.988
366 HG3 ARG 49 HG3 ARG 49 15.643 7.225 8.926
367 HD2 ARG 49 HD2 ARG 49 13.813 5.003 8.718
368 HD3 ARG 49 HD3 ARG 49 13.274 6.239 7.599
369 HE ARG 49 HE ARG 49 15.829 4.762 7.491
370 HH11 ARG 49 HH22 ARG 49 13.947 7.499 6.257
371 HH12 ARG 49 HH21 ARG 49 14.899 7.665 4.819
372 HH22 ARG 49 HH1 ARG 49 16.738 6.173 4.451
373 H CYS 50 HN CYS 50 11.818 6.786 8.784
374 HA CYS 50 HA CYS 50 11.164 3.967 8.720
375 HB2 CYS 50 HB2 CYS 50 9.029 6.105 8.548
376 HB3 CYS 50 HB3 CYS 50 8.795 4.403 8.204
377 H TRP 51 HN TRP 51 10.986 3.219 6.543
378 HA TRP 51 HA TRP 51 10.994 5.225 4.438
379 HB2 TRP 51 HB2 TRP 51 13.312 5.091 4.748
380 HB3 TRP 51 HB3 TRP 51 13.279 3.360 5.019
381 HD1 TRP 51 HD1 TRP 51 13.801 5.853 2.271
382 HE1 TRP 51 HE1 TRP 51 14.081 4.724 -0.097
383 HE3 TRP 51 HE3 TRP 51 12.238 1.232 3.706
384 HZ2 TRP 51 HZ2 TRP 51 13.628 2.085 -1.083
385 HZ3 TRP 51 HZ3 TRP 51 12.186 -0.565 1.979
386 HH2 TRP 51 HH2 TRP 51 12.848 -0.197 -0.345
Start of MODEL 8
1 H1 ARG 1 HN ARG 1 9.346 -6.249 0.641
2 HA ARG 1 HA ARG 1 6.741 -6.330 1.891
3 HB2 ARG 1 HB2 ARG 1 9.411 -7.643 2.404
4 HB3 ARG 1 HB3 ARG 1 8.349 -7.414 3.780
5 HG2 ARG 1 HG2 ARG 1 6.860 -8.458 1.478
6 HG3 ARG 1 HG3 ARG 1 8.221 -9.494 1.860
7 HD2 ARG 1 HD2 ARG 1 6.671 -8.560 4.234
8 HD3 ARG 1 HD3 ARG 1 5.777 -9.598 3.142
9 HE ARG 1 HE ARG 1 8.385 -10.724 3.605
10 HH11 ARG 1 HH22 ARG 1 5.274 -10.242 5.231
11 HH12 ARG 1 HH21 ARG 1 5.464 -11.613 6.272
12 HH22 ARG 1 HH1 ARG 1 7.450 -12.945 6.107
13 H TRP 2 HN TRP 2 6.482 -5.424 4.122
14 HA TRP 2 HA TRP 2 8.440 -3.311 4.700
15 HB2 TRP 2 HB2 TRP 2 5.470 -2.960 5.061
16 HB3 TRP 2 HB3 TRP 2 6.733 -1.750 5.176
17 HD1 TRP 2 HD1 TRP 2 4.096 -2.454 2.904
18 HE1 TRP 2 HE1 TRP 2 4.527 -1.780 0.390
19 HE3 TRP 2 HE3 TRP 2 9.146 -2.040 3.332
20 HZ2 TRP 2 HZ2 TRP 2 6.879 -1.163 -1.105
21 HZ3 TRP 2 HZ3 TRP 2 10.435 -1.397 1.298
22 HH2 TRP 2 HH2 TRP 2 9.381 -0.965 -0.865
23 H CYS 3 HN CYS 3 9.204 -3.453 6.777
24 HA CYS 3 HA CYS 3 7.523 -4.884 8.695
25 HB2 CYS 3 HB2 CYS 3 10.314 -5.490 7.871
26 HB3 CYS 3 HB3 CYS 3 9.958 -5.583 9.584
27 H VAL 4 HN VAL 4 8.548 -4.434 11.036
28 HA VAL 4 HA VAL 4 9.876 -1.872 11.182
29 HB VAL 4 HB VAL 4 8.204 -0.704 12.288
30 HG11 VAL 4 HG11 VAL 4 6.764 -2.335 10.167
31 HG12 VAL 4 HG12 VAL 4 6.237 -0.762 10.812
32 HG13 VAL 4 HG13 VAL 4 7.751 -0.881 9.885
33 HG21 VAL 4 HG21 VAL 4 5.946 -1.976 12.801
34 HG22 VAL 4 HG22 VAL 4 7.009 -3.403 12.818
35 HG23 VAL 4 HG23 VAL 4 7.317 -2.051 13.934
36 H TYR 5 HN TYR 5 11.447 -2.131 12.675
37 HA TYR 5 HA TYR 5 10.933 -4.096 14.804
38 HB2 TYR 5 HB2 TYR 5 13.274 -3.215 13.074
39 HB3 TYR 5 HB3 TYR 5 13.655 -3.733 14.704
40 HD1 TYR 5 HD1 TYR 5 11.738 -5.962 15.106
41 HD2 TYR 5 HD2 TYR 5 14.081 -4.914 11.684
42 HE1 TYR 5 HE1 TYR 5 11.713 -8.386 14.337
43 HE2 TYR 5 HE2 TYR 5 14.048 -7.341 10.926
44 HH TYR 5 HH TYR 5 12.256 -9.783 12.783
45 H ALA 6 HN ALA 6 11.133 -3.469 16.928
46 HA ALA 6 HA ALA 6 12.214 -0.778 17.389
47 HB1 ALA 6 HB1 ALA 6 10.188 -1.315 19.311
48 HB2 ALA 6 HB2 ALA 6 10.170 -0.092 18.017
49 HB3 ALA 6 HB3 ALA 6 9.501 -1.715 17.718
50 H TYR 7 HN TYR 7 13.322 -0.505 19.395
51 HA TYR 7 HA TYR 7 13.561 -2.853 21.091
52 HB2 TYR 7 HB2 TYR 7 15.310 -3.032 19.273
53 HB3 TYR 7 HB3 TYR 7 15.818 -1.385 19.588
54 HD1 TYR 7 HD1 TYR 7 16.746 -0.873 21.971
55 HD2 TYR 7 HD2 TYR 7 16.365 -4.821 20.366
56 HE1 TYR 7 HE1 TYR 7 18.452 -1.728 23.650
57 HE2 TYR 7 HE2 TYR 7 18.073 -5.662 22.051
58 HH TYR 7 HH TYR 7 20.000 -4.616 23.333
59 H VAL 8 HN VAL 8 13.171 -2.071 23.099
60 HA VAL 8 HA VAL 8 14.235 0.603 23.697
61 HB VAL 8 HB VAL 8 11.889 -0.808 24.976
62 HG11 VAL 8 HG11 VAL 8 13.393 1.586 25.615
63 HG12 VAL 8 HG12 VAL 8 11.692 1.982 25.270
64 HG13 VAL 8 HG13 VAL 8 12.090 0.786 26.527
65 HG21 VAL 8 HG21 VAL 8 11.888 1.331 22.819
66 HG22 VAL 8 HG22 VAL 8 11.385 -0.365 22.624
67 HG23 VAL 8 HG23 VAL 8 10.454 0.724 23.681
68 H ARG 9 HN ARG 9 15.613 0.831 25.431
69 HA ARG 9 HA ARG 9 15.788 -1.363 27.276
70 HB2 ARG 9 HB2 ARG 9 17.526 -2.225 25.995
71 HB3 ARG 9 HB3 ARG 9 17.889 -0.681 25.251
72 HG2 ARG 9 HG2 ARG 9 19.053 0.097 27.255
73 HG3 ARG 9 HG3 ARG 9 18.519 -1.298 28.172
74 HD2 ARG 9 HD2 ARG 9 20.317 -2.490 27.467
75 HD3 ARG 9 HD3 ARG 9 19.842 -2.268 25.795
76 HE ARG 9 HE ARG 9 20.979 0.145 26.298
77 HH11 ARG 9 HH22 ARG 9 22.115 -3.118 27.082
78 HH12 ARG 9 HH21 ARG 9 23.791 -2.686 27.009
79 HH22 ARG 9 HH1 ARG 9 24.399 -0.427 26.491
80 H ILE 10 HN ILE 10 15.618 -0.319 29.235
81 HA ILE 10 HA ILE 10 17.367 1.948 29.710
82 HB ILE 10 HB ILE 10 14.512 2.258 30.518
83 HG12 ILE 10 HG12 ILE 10 15.567 2.994 27.772
84 HG13 ILE 10 HG13 ILE 10 14.433 1.702 28.108
85 HG21 ILE 10 HG21 ILE 10 16.931 3.801 30.610
86 HG22 ILE 10 HG22 ILE 10 15.711 4.663 29.643
87 HG23 ILE 10 HG23 ILE 10 15.333 4.159 31.308
88 HD11 ILE 10 HD11 ILE 10 14.013 4.690 28.501
89 HD12 ILE 10 HD12 ILE 10 13.096 3.582 27.453
90 HD13 ILE 10 HD13 ILE 10 12.930 3.476 29.222
91 H ARG 11 HN ARG 11 17.684 2.359 32.021
92 HA ARG 11 HA ARG 11 18.094 1.693 34.034
93 HB2 ARG 11 HB2 ARG 11 15.322 0.544 33.627
94 HB3 ARG 11 HB3 ARG 11 16.181 0.141 35.100
95 HG2 ARG 11 HG2 ARG 11 15.431 2.114 35.942
96 HG3 ARG 11 HG3 ARG 11 16.585 2.904 34.886
97 HD2 ARG 11 HD2 ARG 11 14.920 3.195 33.135
98 HD3 ARG 11 HD3 ARG 11 13.783 2.139 33.949
99 HE ARG 11 HE ARG 11 14.304 4.144 35.818
100 HH11 ARG 11 HH22 ARG 11 13.108 4.089 32.483
101 HH12 ARG 11 HH21 ARG 11 12.160 5.527 32.668
102 HH22 ARG 11 HH1 ARG 11 12.144 6.659 34.780
103 H GLY 12 HN GLY 12 16.242 -1.312 33.263
104 HA2 GLY 12 HA1 GLY 12 18.650 -2.836 32.749
105 HA3 GLY 12 HA2 GLY 12 17.894 -3.164 34.295
106 H VAL 13 HN VAL 13 15.886 -2.092 31.580
107 HA VAL 13 HA VAL 13 14.935 -4.859 31.294
108 HB VAL 13 HB VAL 13 13.308 -2.316 31.121
109 HG11 VAL 13 HG11 VAL 13 12.008 -3.742 29.922
110 HG12 VAL 13 HG12 VAL 13 12.751 -5.195 30.632
111 HG13 VAL 13 HG13 VAL 13 11.516 -4.293 31.542
112 HG21 VAL 13 HG21 VAL 13 13.572 -2.333 33.376
113 HG22 VAL 13 HG22 VAL 13 12.311 -3.586 33.289
114 HG23 VAL 13 HG23 VAL 13 14.023 -4.054 33.423
115 H LEU 14 HN LEU 14 14.091 -5.413 29.142
116 HA LEU 14 HA LEU 14 14.909 -3.565 27.040
117 HB2 LEU 14 HB2 LEU 14 16.842 -4.952 27.357
118 HB3 LEU 14 HB3 LEU 14 15.871 -6.411 27.332
119 HG LEU 14 HG LEU 14 15.590 -6.369 25.036
120 HD11 LEU 14 HD11 LEU 14 16.029 -4.334 23.625
121 HD12 LEU 14 HD12 LEU 14 14.634 -4.212 24.723
122 HD13 LEU 14 HD13 LEU 14 16.163 -3.400 25.134
123 HD21 LEU 14 HD21 LEU 14 18.297 -5.116 25.562
124 HD22 LEU 14 HD22 LEU 14 17.896 -6.849 25.502
125 HD23 LEU 14 HD23 LEU 14 17.810 -5.864 24.022
126 H VAL 15 HN VAL 15 13.059 -3.185 25.948
127 HA VAL 15 HA VAL 15 11.242 -5.469 25.610
128 HB VAL 15 HB VAL 15 10.396 -2.619 25.284
129 HG11 VAL 15 HG11 VAL 15 8.642 -4.455 26.727
130 HG12 VAL 15 HG12 VAL 15 8.336 -3.496 25.259
131 HG13 VAL 15 HG13 VAL 15 9.119 -5.090 25.134
132 HG21 VAL 15 HG21 VAL 15 11.136 -2.146 27.366
133 HG22 VAL 15 HG22 VAL 15 9.715 -3.086 27.883
134 HG23 VAL 15 HG23 VAL 15 11.315 -3.862 27.807
135 H ARG 16 HN ARG 16 12.092 -6.351 23.711
136 HA ARG 16 HA ARG 16 12.599 -4.540 21.545
137 HB2 ARG 16 HB2 ARG 16 12.876 -7.574 21.812
138 HB3 ARG 16 HB3 ARG 16 13.279 -6.701 20.347
139 HG2 ARG 16 HG2 ARG 16 14.874 -5.267 21.751
140 HG3 ARG 16 HG3 ARG 16 14.574 -6.358 23.089
141 HD2 ARG 16 HD2 ARG 16 15.269 -7.768 20.572
142 HD3 ARG 16 HD3 ARG 16 16.538 -6.700 21.136
143 HE ARG 16 HE ARG 16 15.382 -8.402 23.239
144 HH11 ARG 16 HH22 ARG 16 17.906 -8.120 20.767
145 HH12 ARG 16 HH21 ARG 16 18.939 -9.294 21.511
146 HH22 ARG 16 HH1 ARG 16 18.236 -10.359 23.540
147 H TYR 17 HN TYR 17 10.705 -3.811 20.568
148 HA TYR 17 HA TYR 17 8.497 -5.669 20.246
149 HB2 TYR 17 HB2 TYR 17 8.702 -3.017 20.882
150 HB3 TYR 17 HB3 TYR 17 8.700 -2.837 19.139
151 HD1 TYR 17 HD1 TYR 17 6.740 -4.535 21.852
152 HD2 TYR 17 HD2 TYR 17 6.662 -2.590 18.043
153 HE1 TYR 17 HE1 TYR 17 4.200 -4.651 21.837
154 HE2 TYR 17 HE2 TYR 17 4.122 -2.712 18.040
155 HH TYR 17 HH TYR 17 2.388 -4.224 20.752
156 H ARG 18 HN ARG 18 7.421 -5.947 18.136
157 HA ARG 18 HA ARG 18 9.025 -5.272 15.861
158 HB2 ARG 18 HB2 ARG 18 8.194 -8.179 16.136
159 HB3 ARG 18 HB3 ARG 18 9.414 -7.492 15.083
160 HG2 ARG 18 HG2 ARG 18 10.912 -7.068 16.967
161 HG3 ARG 18 HG3 ARG 18 9.664 -7.488 18.124
162 HD2 ARG 18 HD2 ARG 18 9.617 -9.830 17.037
163 HD3 ARG 18 HD3 ARG 18 11.061 -9.362 16.163
164 HE ARG 18 HE ARG 18 11.193 -8.954 19.082
165 HH11 ARG 18 HH22 ARG 18 11.906 -11.129 16.377
166 HH12 ARG 18 HH21 ARG 18 13.099 -12.029 17.253
167 HH22 ARG 18 HH1 ARG 18 13.588 -11.431 19.521
168 H ARG 19 HN ARG 19 7.808 -5.900 13.760
169 HA ARG 19 HA ARG 19 5.223 -6.804 13.830
170 HB2 ARG 19 HB2 ARG 19 5.105 -4.415 15.037
171 HB3 ARG 19 HB3 ARG 19 5.149 -3.806 13.394
172 HG2 ARG 19 HG2 ARG 19 3.218 -6.041 13.988
173 HG3 ARG 19 HG3 ARG 19 2.833 -4.455 14.628
174 HD2 ARG 19 HD2 ARG 19 3.699 -4.110 11.893
175 HD3 ARG 19 HD3 ARG 19 2.524 -5.409 11.921
176 HE ARG 19 HE ARG 19 0.851 -3.887 12.606
177 HH11 ARG 19 HH22 ARG 19 4.030 -2.327 12.727
178 HH12 ARG 19 HH21 ARG 19 3.380 -0.737 12.944
179 HH22 ARG 19 HH1 ARG 19 1.003 -0.444 13.039
180 H CYS 20 HN CYS 20 4.169 -6.594 11.641
181 HA CYS 20 HA CYS 20 5.798 -5.358 9.605
182 HB2 CYS 20 HB2 CYS 20 5.280 -8.338 9.631
183 HB3 CYS 20 HB3 CYS 20 5.847 -7.442 8.237
184 H TRP 21 HN TRP 21 4.568 -5.416 7.456
185 HA TRP 21 HA TRP 21 1.682 -5.573 8.002
186 HB2 TRP 21 HB2 TRP 21 2.150 -3.318 7.667
187 HB3 TRP 21 HB3 TRP 21 3.326 -3.635 6.407
188 HD1 TRP 21 HD1 TRP 21 -0.235 -2.649 6.806
189 HE1 TRP 21 HE1 TRP 21 -1.587 -2.678 4.540
190 HE3 TRP 21 HE3 TRP 21 3.248 -5.234 4.153
191 HZ2 TRP 21 HZ2 TRP 21 -1.059 -3.756 1.950
192 HZ3 TRP 21 HZ3 TRP 21 2.752 -5.734 1.762
193 HH2 TRP 21 HH2 TRP 21 0.685 -5.039 0.657
194 H1 ARG 31 HN ARG 31 6.683 0.530 4.567
195 HA ARG 31 HA ARG 31 9.237 0.270 3.243
196 HB2 ARG 31 HB2 ARG 31 8.598 2.177 5.529
197 HB3 ARG 31 HB3 ARG 31 9.840 2.345 4.304
198 HG2 ARG 31 HG2 ARG 31 7.369 2.124 2.888
199 HG3 ARG 31 HG3 ARG 31 7.060 3.218 4.222
200 HD2 ARG 31 HD2 ARG 31 9.511 3.535 2.437
201 HD3 ARG 31 HD3 ARG 31 7.969 4.253 2.015
202 HE ARG 31 HE ARG 31 8.736 4.884 4.752
203 HH11 ARG 31 HH22 ARG 31 9.251 5.818 1.373
204 HH12 ARG 31 HH21 ARG 31 9.710 7.442 1.762
205 HH22 ARG 31 HH1 ARG 31 9.757 8.131 4.057
206 H TRP 32 HN TRP 32 10.699 1.220 5.702
207 HA TRP 32 HA TRP 32 10.403 -1.140 7.418
208 HB2 TRP 32 HB2 TRP 32 12.774 -0.289 5.844
209 HB3 TRP 32 HB3 TRP 32 13.065 -0.819 7.489
210 HD1 TRP 32 HD1 TRP 32 11.976 -2.187 4.076
211 HE1 TRP 32 HE1 TRP 32 11.963 -4.825 4.048
212 HE3 TRP 32 HE3 TRP 32 12.724 -2.766 9.072
213 HZ2 TRP 32 HZ2 TRP 32 12.261 -6.814 6.073
214 HZ3 TRP 32 HZ3 TRP 32 12.851 -5.089 9.966
215 HH2 TRP 32 HH2 TRP 32 12.633 -7.073 8.554
216 H CYS 33 HN CYS 33 9.555 -0.090 9.209
217 HA CYS 33 HA CYS 33 10.647 2.485 9.930
218 HB2 CYS 33 HB2 CYS 33 8.256 0.886 10.676
219 HB3 CYS 33 HB3 CYS 33 8.905 1.951 11.907
220 H VAL 34 HN VAL 34 11.544 2.850 12.133
221 HA VAL 34 HA VAL 34 12.293 0.486 13.619
222 HB VAL 34 HB VAL 34 14.693 1.132 13.591
223 HG11 VAL 34 HG11 VAL 34 13.863 -0.738 12.236
224 HG12 VAL 34 HG12 VAL 34 13.514 0.379 10.895
225 HG13 VAL 34 HG13 VAL 34 15.195 0.109 11.413
226 HG21 VAL 34 HG21 VAL 34 13.806 2.962 11.337
227 HG22 VAL 34 HG22 VAL 34 14.551 3.437 12.883
228 HG23 VAL 34 HG23 VAL 34 15.497 2.526 11.681
229 H TYR 35 HN TYR 35 11.942 0.957 15.723
230 HA TYR 35 HA TYR 35 12.502 3.688 16.610
231 HB2 TYR 35 HB2 TYR 35 9.969 2.875 15.984
232 HB3 TYR 35 HB3 TYR 35 10.069 2.119 17.561
233 HD1 TYR 35 HD2 TYR 35 10.613 3.612 19.586
234 HD2 TYR 35 HD1 TYR 35 9.445 5.169 15.775
235 HE1 TYR 35 HE2 TYR 35 9.965 5.816 20.676
236 HE2 TYR 35 HE1 TYR 35 8.801 7.367 16.879
237 HH TYR 35 HH TYR 35 8.024 7.884 19.540
238 H ALA 36 HN ALA 36 14.103 3.386 18.090
239 HA ALA 36 HA ALA 36 13.620 1.307 20.106
240 HB1 ALA 36 HB1 ALA 36 16.196 1.104 20.106
241 HB2 ALA 36 HB2 ALA 36 15.315 0.356 18.752
242 HB3 ALA 36 HB3 ALA 36 16.133 1.921 18.526
243 H TYR 37 HN TYR 37 14.230 1.870 22.243
244 HA TYR 37 HA TYR 37 15.135 4.648 22.560
245 HB2 TYR 37 HB2 TYR 37 12.583 4.045 22.900
246 HB3 TYR 37 HB3 TYR 37 13.109 3.111 24.287
247 HD1 TYR 37 HD2 TYR 37 14.400 4.354 26.150
248 HD2 TYR 37 HD1 TYR 37 12.165 6.355 23.099
249 HE1 TYR 37 HE2 TYR 37 14.294 6.447 27.590
250 HE2 TYR 37 HE1 TYR 37 12.066 8.441 24.549
251 HH TYR 37 HH TYR 37 12.560 8.465 27.705
252 H VAL 38 HN VAL 38 17.295 3.728 22.876
253 HA VAL 38 HA VAL 38 17.553 2.079 25.271
254 HB VAL 38 HB VAL 38 19.470 2.835 23.061
255 HG11 VAL 38 HG11 VAL 38 19.947 1.694 25.737
256 HG12 VAL 38 HG12 VAL 38 20.652 0.754 24.400
257 HG13 VAL 38 HG13 VAL 38 21.075 2.471 24.600
258 HG21 VAL 38 HG21 VAL 38 19.284 0.104 23.083
259 HG22 VAL 38 HG22 VAL 38 17.629 0.578 23.537
260 HG23 VAL 38 HG23 VAL 38 18.344 1.181 22.022
261 H ARG 39 HN ARG 39 18.672 2.763 27.115
262 HA ARG 39 HA ARG 39 19.879 5.361 27.023
263 HB2 ARG 39 HB2 ARG 39 17.481 5.834 27.575
264 HB3 ARG 39 HB3 ARG 39 17.570 4.727 28.931
265 HG2 ARG 39 HG2 ARG 39 19.558 6.205 29.767
266 HG3 ARG 39 HG3 ARG 39 19.011 7.385 28.592
267 HD2 ARG 39 HD2 ARG 39 16.723 6.406 30.108
268 HD3 ARG 39 HD3 ARG 39 17.973 6.931 31.219
269 HE ARG 39 HE ARG 39 16.513 8.625 29.284
270 HH11 ARG 39 HH22 ARG 39 19.218 8.386 31.561
271 HH12 ARG 39 HH21 ARG 39 19.393 10.101 31.726
272 HH22 ARG 39 HH1 ARG 39 17.928 11.553 30.505
273 H ILE 40 HN ILE 40 21.741 5.290 28.265
274 HA ILE 40 HA ILE 40 21.768 3.639 30.642
275 HB ILE 40 HB ILE 40 23.317 3.031 28.161
276 HG12 ILE 40 HG12 ILE 40 21.381 1.716 29.875
277 HG13 ILE 40 HG13 ILE 40 21.910 1.305 28.256
278 HG21 ILE 40 HG21 ILE 40 25.051 3.548 29.798
279 HG22 ILE 40 HG22 ILE 40 24.293 2.444 30.970
280 HG23 ILE 40 HG23 ILE 40 24.990 1.801 29.463
281 HD11 ILE 40 HD11 ILE 40 23.901 0.153 29.151
282 HD12 ILE 40 HD12 ILE 40 23.455 0.637 30.804
283 HD13 ILE 40 HD13 ILE 40 22.426 -0.501 29.902
284 H ARG 41 HN ARG 41 23.796 4.055 31.940
285 HA ARG 41 HA ARG 41 25.034 5.492 32.982
286 HB2 ARG 41 HB2 ARG 41 25.755 6.210 30.107
287 HB3 ARG 41 HB3 ARG 41 26.568 6.964 31.463
288 HG2 ARG 41 HG2 ARG 41 26.358 3.937 31.263
289 HG3 ARG 41 HG3 ARG 41 27.624 4.806 30.418
290 HD2 ARG 41 HD2 ARG 41 27.143 5.245 33.392
291 HD3 ARG 41 HD3 ARG 41 28.138 3.919 32.825
292 HE ARG 41 HE ARG 41 29.057 6.249 31.496
293 HH11 ARG 41 HH22 ARG 41 28.878 5.020 34.814
294 HH12 ARG 41 HH21 ARG 41 30.267 5.906 35.349
295 HH22 ARG 41 HH1 ARG 41 31.433 7.310 33.796
296 H GLY 42 HN GLY 42 24.605 7.759 30.211
297 HA2 GLY 42 HA1 GLY 42 22.553 9.282 31.570
298 HA3 GLY 42 HA2 GLY 42 24.132 10.043 31.551
299 H VAL 43 HN VAL 43 23.234 7.846 28.919
300 HA VAL 43 HA VAL 43 22.721 10.183 27.216
301 HB VAL 43 HB VAL 43 24.111 7.797 26.107
302 HG11 VAL 43 HG11 VAL 43 25.314 10.161 25.231
303 HG12 VAL 43 HG12 VAL 43 24.089 9.201 24.367
304 HG13 VAL 43 HG13 VAL 43 23.589 10.571 25.388
305 HG21 VAL 43 HG21 VAL 43 25.484 9.875 27.842
306 HG22 VAL 43 HG22 VAL 43 25.399 8.120 28.125
307 HG23 VAL 43 HG23 VAL 43 26.328 8.755 26.746
308 H LEU 44 HN LEU 44 20.711 10.087 26.371
309 HA LEU 44 HA LEU 44 19.461 7.446 26.226
310 HB2 LEU 44 HB2 LEU 44 18.030 8.686 27.461
311 HB3 LEU 44 HB3 LEU 44 18.515 10.204 26.731
312 HG LEU 44 HG LEU 44 17.202 9.651 24.709
313 HD11 LEU 44 HD11 LEU 44 16.892 7.454 24.357
314 HD12 LEU 44 HD12 LEU 44 16.941 7.057 26.092
315 HD13 LEU 44 HD13 LEU 44 15.443 7.686 25.365
316 HD21 LEU 44 HD21 LEU 44 16.313 10.698 27.022
317 HD22 LEU 44 HD22 LEU 44 15.299 10.513 25.570
318 HD23 LEU 44 HD23 LEU 44 15.208 9.310 26.879
319 H VAL 45 HN VAL 45 19.646 6.450 24.296
320 HA VAL 45 HA VAL 45 19.815 8.155 21.923
321 HB VAL 45 HB VAL 45 20.298 5.210 21.889
322 HG11 VAL 45 HG11 VAL 45 22.271 6.256 20.434
323 HG12 VAL 45 HG12 VAL 45 20.632 6.030 19.777
324 HG13 VAL 45 HG13 VAL 45 21.146 7.633 20.356
325 HG21 VAL 45 HG21 VAL 45 21.586 5.592 23.789
326 HG22 VAL 45 HG22 VAL 45 22.760 5.838 22.474
327 HG23 VAL 45 HG23 VAL 45 22.027 7.242 23.287
328 H ARG 46 HN ARG 46 17.780 8.632 21.206
329 HA ARG 46 HA ARG 46 15.923 6.395 21.149
330 HB2 ARG 46 HB2 ARG 46 15.270 9.374 20.918
331 HB3 ARG 46 HB3 ARG 46 14.116 8.071 21.115
332 HG2 ARG 46 HG2 ARG 46 15.174 7.518 23.343
333 HG3 ARG 46 HG3 ARG 46 16.244 8.892 23.149
334 HD2 ARG 46 HD2 ARG 46 13.207 9.174 23.048
335 HD3 ARG 46 HD3 ARG 46 14.106 9.285 24.548
336 HE ARG 46 HE ARG 46 15.443 11.056 22.895
337 HH11 ARG 46 HH22 ARG 46 12.045 10.692 23.829
338 HH12 ARG 46 HH21 ARG 46 11.690 12.379 23.663
339 HH22 ARG 46 HH1 ARG 46 13.427 13.883 22.983
340 H TYR 47 HN TYR 47 15.763 5.465 19.132
341 HA TYR 47 HA TYR 47 16.360 7.146 16.812
342 HB2 TYR 47 HB2 TYR 47 17.552 4.934 17.271
343 HB3 TYR 47 HB3 TYR 47 16.001 4.119 17.276
344 HD1 TYR 47 HD2 TYR 47 16.538 6.801 14.847
345 HD2 TYR 47 HD1 TYR 47 16.826 2.585 15.518
346 HE1 TYR 47 HE2 TYR 47 16.733 6.409 12.343
347 HE2 TYR 47 HE1 TYR 47 17.020 2.207 13.011
348 HH TYR 47 HH TYR 47 17.213 4.946 10.785
349 H ARG 48 HN ARG 48 14.839 7.649 15.277
350 HA ARG 48 HA ARG 48 12.418 6.117 15.236
351 HB2 ARG 48 HB2 ARG 48 11.163 8.485 15.197
352 HB3 ARG 48 HB3 ARG 48 11.492 7.671 16.714
353 HG2 ARG 48 HG2 ARG 48 12.967 9.278 17.388
354 HG3 ARG 48 HG3 ARG 48 13.780 9.307 15.836
355 HD2 ARG 48 HD2 ARG 48 12.519 11.071 15.052
356 HD3 ARG 48 HD3 ARG 48 11.043 10.482 15.791
357 HE ARG 48 HE ARG 48 12.552 11.265 17.973
358 HH11 ARG 48 HH22 ARG 48 11.571 12.900 14.987
359 HH12 ARG 48 HH21 ARG 48 11.564 14.476 15.705
360 HH22 ARG 48 HH1 ARG 48 12.140 14.714 18.020
361 H ARG 49 HN ARG 49 12.348 5.611 13.064
362 HA ARG 49 HA ARG 49 11.930 7.552 11.173
363 HB2 ARG 49 HB2 ARG 49 14.498 7.833 11.666
364 HB3 ARG 49 HB3 ARG 49 14.693 6.327 10.792
365 HG2 ARG 49 HG2 ARG 49 14.896 8.537 9.436
366 HG3 ARG 49 HG3 ARG 49 13.921 7.253 8.749
367 HD2 ARG 49 HD2 ARG 49 12.849 9.574 8.692
368 HD3 ARG 49 HD3 ARG 49 11.857 8.318 9.406
369 HE ARG 49 HE ARG 49 13.374 9.481 11.510
370 HH11 ARG 49 HH22 ARG 49 10.816 10.438 9.253
371 HH12 ARG 49 HH21 ARG 49 10.146 11.625 10.321
372 HH22 ARG 49 HH1 ARG 49 11.147 11.966 12.472
373 H CYS 50 HN CYS 50 12.136 6.506 8.825
374 HA CYS 50 HA CYS 50 12.063 3.611 8.961
375 HB2 CYS 50 HB2 CYS 50 9.793 5.011 7.585
376 HB3 CYS 50 HB3 CYS 50 9.928 3.333 8.072
377 H TRP 51 HN TRP 51 12.956 2.732 7.079
378 HA TRP 51 HA TRP 51 13.757 4.685 5.053
379 HB2 TRP 51 HB2 TRP 51 15.630 3.579 5.913
380 HB3 TRP 51 HB3 TRP 51 14.832 2.019 5.928
381 HD1 TRP 51 HD1 TRP 51 17.021 4.156 3.737
382 HE1 TRP 51 HE1 TRP 51 17.522 3.035 1.401
383 HE3 TRP 51 HE3 TRP 51 13.536 0.479 4.165
384 HZ2 TRP 51 HZ2 TRP 51 16.428 0.787 0.025
385 HZ3 TRP 51 HZ3 TRP 51 13.316 -1.138 2.281
386 HH2 TRP 51 HH2 TRP 51 14.692 -1.027 0.263
Start of MODEL 9
1 H1 ARG 1 HN ARG 1 8.763 -7.076 1.281
2 HA ARG 1 HA ARG 1 6.111 -6.336 2.230
3 HB2 ARG 1 HB2 ARG 1 7.042 -8.807 2.479
4 HB3 ARG 1 HB3 ARG 1 8.006 -8.137 3.780
5 HG2 ARG 1 HG2 ARG 1 6.144 -8.678 5.029
6 HG3 ARG 1 HG3 ARG 1 5.615 -7.093 4.502
7 HD2 ARG 1 HD2 ARG 1 3.758 -8.261 3.790
8 HD3 ARG 1 HD3 ARG 1 4.746 -8.547 2.370
9 HE ARG 1 HE ARG 1 5.410 -10.580 4.222
10 HH11 ARG 1 HH22 ARG 1 2.552 -9.540 2.404
11 HH12 ARG 1 HH21 ARG 1 1.866 -11.128 2.333
12 HH22 ARG 1 HH1 ARG 1 3.032 -12.957 3.352
13 H TRP 2 HN TRP 2 5.998 -4.739 3.831
14 HA TRP 2 HA TRP 2 8.518 -3.473 4.521
15 HB2 TRP 2 HB2 TRP 2 5.890 -2.426 5.446
16 HB3 TRP 2 HB3 TRP 2 7.327 -1.569 4.926
17 HD1 TRP 2 HD1 TRP 2 4.186 -1.268 3.750
18 HE1 TRP 2 HE1 TRP 2 3.782 -1.267 1.142
19 HE3 TRP 2 HE3 TRP 2 8.584 -3.515 2.539
20 HZ2 TRP 2 HZ2 TRP 2 5.313 -2.186 -1.084
21 HZ3 TRP 2 HZ3 TRP 2 9.052 -3.927 0.126
22 HH2 TRP 2 HH2 TRP 2 7.501 -3.301 -1.657
23 H CYS 3 HN CYS 3 9.495 -3.751 6.494
24 HA CYS 3 HA CYS 3 7.868 -5.051 8.557
25 HB2 CYS 3 HB2 CYS 3 10.620 -5.606 7.580
26 HB3 CYS 3 HB3 CYS 3 10.359 -5.713 9.309
27 H VAL 4 HN VAL 4 8.915 -4.573 10.847
28 HA VAL 4 HA VAL 4 10.270 -2.021 10.958
29 HB VAL 4 HB VAL 4 8.630 -0.829 12.073
30 HG11 VAL 4 HG11 VAL 4 7.111 -2.496 10.038
31 HG12 VAL 4 HG12 VAL 4 6.620 -0.903 10.662
32 HG13 VAL 4 HG13 VAL 4 8.101 -1.060 9.687
33 HG21 VAL 4 HG21 VAL 4 7.445 -3.513 12.699
34 HG22 VAL 4 HG22 VAL 4 7.790 -2.137 13.774
35 HG23 VAL 4 HG23 VAL 4 6.384 -2.084 12.683
36 H TYR 5 HN TYR 5 11.816 -2.188 12.496
37 HA TYR 5 HA TYR 5 11.350 -4.180 14.613
38 HB2 TYR 5 HB2 TYR 5 13.676 -3.303 12.856
39 HB3 TYR 5 HB3 TYR 5 14.067 -3.836 14.479
40 HD1 TYR 5 HD2 TYR 5 12.168 -6.062 14.896
41 HD2 TYR 5 HD1 TYR 5 14.433 -4.989 11.429
42 HE1 TYR 5 HE2 TYR 5 12.120 -8.479 14.107
43 HE2 TYR 5 HE1 TYR 5 14.378 -7.409 10.652
44 HH TYR 5 HH TYR 5 12.449 -9.804 12.354
45 H ALA 6 HN ALA 6 11.467 -3.499 16.712
46 HA ALA 6 HA ALA 6 12.609 -0.827 17.153
47 HB1 ALA 6 HB1 ALA 6 10.524 -0.149 17.669
48 HB2 ALA 6 HB2 ALA 6 9.891 -1.810 17.580
49 HB3 ALA 6 HB3 ALA 6 10.620 -1.215 19.091
50 H TYR 7 HN TYR 7 13.721 -0.546 19.156
51 HA TYR 7 HA TYR 7 13.955 -2.903 20.850
52 HB2 TYR 7 HB2 TYR 7 15.731 -3.013 19.046
53 HB3 TYR 7 HB3 TYR 7 16.209 -1.367 19.412
54 HD1 TYR 7 HD1 TYR 7 17.159 -0.884 21.761
55 HD2 TYR 7 HD2 TYR 7 16.722 -4.833 20.172
56 HE1 TYR 7 HE1 TYR 7 18.849 -1.758 23.448
57 HE2 TYR 7 HE2 TYR 7 18.414 -5.693 21.864
58 HH TYR 7 HH TYR 7 20.245 -3.497 23.858
59 H VAL 8 HN VAL 8 13.408 -2.096 22.818
60 HA VAL 8 HA VAL 8 14.423 0.580 23.472
61 HB VAL 8 HB VAL 8 12.025 -0.987 24.423
62 HG11 VAL 8 HG11 VAL 8 11.776 1.479 25.593
63 HG12 VAL 8 HG12 VAL 8 12.355 0.011 26.417
64 HG13 VAL 8 HG13 VAL 8 13.523 1.179 25.752
65 HG21 VAL 8 HG21 VAL 8 11.494 1.720 23.603
66 HG22 VAL 8 HG22 VAL 8 12.414 0.884 22.329
67 HG23 VAL 8 HG23 VAL 8 10.882 0.195 22.918
68 H ARG 9 HN ARG 9 15.515 0.911 25.460
69 HA ARG 9 HA ARG 9 15.866 -1.325 27.181
70 HB2 ARG 9 HB2 ARG 9 17.686 -2.065 25.937
71 HB3 ARG 9 HB3 ARG 9 17.981 -0.490 25.229
72 HG2 ARG 9 HG2 ARG 9 19.062 0.315 27.257
73 HG3 ARG 9 HG3 ARG 9 18.551 -1.095 28.163
74 HD2 ARG 9 HD2 ARG 9 20.409 -2.229 27.517
75 HD3 ARG 9 HD3 ARG 9 19.991 -2.014 25.829
76 HE ARG 9 HE ARG 9 21.023 0.434 26.388
77 HH11 ARG 9 HH22 ARG 9 22.242 -2.794 27.197
78 HH12 ARG 9 HH21 ARG 9 23.903 -2.304 27.190
79 HH22 ARG 9 HH1 ARG 9 24.452 -0.021 26.708
80 H ILE 10 HN ILE 10 15.547 -0.307 29.138
81 HA ILE 10 HA ILE 10 17.140 2.068 29.679
82 HB ILE 10 HB ILE 10 14.270 2.114 30.492
83 HG12 ILE 10 HG12 ILE 10 15.303 2.756 27.722
84 HG13 ILE 10 HG13 ILE 10 14.017 1.651 28.163
85 HG21 ILE 10 HG21 ILE 10 15.316 4.622 29.636
86 HG22 ILE 10 HG22 ILE 10 14.878 4.094 31.279
87 HG23 ILE 10 HG23 ILE 10 16.533 3.838 30.673
88 HD11 ILE 10 HD11 ILE 10 12.781 3.526 27.521
89 HD12 ILE 10 HD12 ILE 10 12.932 3.819 29.270
90 HD13 ILE 10 HD13 ILE 10 14.003 4.668 28.130
91 H ARG 11 HN ARG 11 17.581 2.374 31.937
92 HA ARG 11 HA ARG 11 18.026 1.714 33.945
93 HB2 ARG 11 HB2 ARG 11 15.431 0.113 33.692
94 HB3 ARG 11 HB3 ARG 11 16.296 0.325 35.201
95 HG2 ARG 11 HG2 ARG 11 14.649 2.288 33.665
96 HG3 ARG 11 HG3 ARG 11 14.859 2.125 35.398
97 HD2 ARG 11 HD2 ARG 11 17.202 3.084 35.146
98 HD3 ARG 11 HD3 ARG 11 16.864 3.361 33.449
99 HE ARG 11 HE ARG 11 14.780 4.510 35.099
100 HH11 ARG 11 HH22 ARG 11 18.101 5.074 33.999
101 HH12 ARG 11 HH21 ARG 11 18.001 6.793 34.180
102 HH22 ARG 11 HH1 ARG 11 15.961 7.774 34.969
103 H GLY 12 HN GLY 12 16.346 -1.354 32.982
104 HA2 GLY 12 HA1 GLY 12 18.781 -2.741 32.389
105 HA3 GLY 12 HA2 GLY 12 18.177 -3.120 33.989
106 H VAL 13 HN VAL 13 15.975 -2.182 31.346
107 HA VAL 13 HA VAL 13 15.156 -4.996 31.137
108 HB VAL 13 HB VAL 13 13.354 -2.567 31.185
109 HG11 VAL 13 HG11 VAL 13 11.752 -3.895 30.387
110 HG12 VAL 13 HG12 VAL 13 12.948 -5.198 30.192
111 HG13 VAL 13 HG13 VAL 13 12.023 -5.059 31.706
112 HG21 VAL 13 HG21 VAL 13 14.006 -2.726 33.406
113 HG22 VAL 13 HG22 VAL 13 12.569 -3.776 33.371
114 HG23 VAL 13 HG23 VAL 13 14.198 -4.494 33.337
115 H LEU 14 HN LEU 14 15.223 -5.771 29.089
116 HA LEU 14 HA LEU 14 15.524 -3.787 26.960
117 HB2 LEU 14 HB2 LEU 14 17.359 -5.340 27.220
118 HB3 LEU 14 HB3 LEU 14 16.269 -6.709 27.119
119 HG LEU 14 HG LEU 14 16.051 -6.570 24.845
120 HD11 LEU 14 HD11 LEU 14 16.545 -4.417 23.554
121 HD12 LEU 14 HD12 LEU 14 15.069 -4.461 24.549
122 HD13 LEU 14 HD13 LEU 14 16.513 -3.603 25.137
123 HD21 LEU 14 HD21 LEU 14 18.751 -5.288 25.345
124 HD22 LEU 14 HD22 LEU 14 18.382 -7.029 25.305
125 HD23 LEU 14 HD23 LEU 14 18.240 -6.055 23.822
126 H VAL 15 HN VAL 15 13.688 -3.268 25.906
127 HA VAL 15 HA VAL 15 11.694 -5.407 25.611
128 HB VAL 15 HB VAL 15 11.110 -2.470 25.402
129 HG11 VAL 15 HG11 VAL 15 9.135 -4.194 26.676
130 HG12 VAL 15 HG12 VAL 15 8.976 -3.129 25.258
131 HG13 VAL 15 HG13 VAL 15 9.592 -4.787 25.061
132 HG21 VAL 15 HG21 VAL 15 11.750 -2.176 27.533
133 HG22 VAL 15 HG22 VAL 15 10.323 -3.148 27.964
134 HG23 VAL 15 HG23 VAL 15 11.918 -3.925 27.818
135 H ARG 16 HN ARG 16 12.506 -6.312 23.685
136 HA ARG 16 HA ARG 16 12.958 -4.483 21.512
137 HB2 ARG 16 HB2 ARG 16 13.264 -7.521 21.712
138 HB3 ARG 16 HB3 ARG 16 13.684 -6.587 20.291
139 HG2 ARG 16 HG2 ARG 16 15.272 -5.221 21.748
140 HG3 ARG 16 HG3 ARG 16 14.934 -6.327 23.065
141 HD2 ARG 16 HD2 ARG 16 16.522 -6.783 20.561
142 HD3 ARG 16 HD3 ARG 16 16.815 -7.373 22.185
143 HE ARG 16 HE ARG 16 15.162 -8.659 20.126
144 HH11 ARG 16 HH22 ARG 16 15.881 -8.486 23.591
145 HH12 ARG 16 HH21 ARG 16 15.253 -10.065 23.927
146 HH22 ARG 16 HH1 ARG 16 14.347 -11.373 22.135
147 H TYR 17 HN TYR 17 11.218 -3.890 20.256
148 HA TYR 17 HA TYR 17 8.965 -5.755 20.101
149 HB2 TYR 17 HB2 TYR 17 9.114 -3.099 20.744
150 HB3 TYR 17 HB3 TYR 17 9.081 -2.916 19.002
151 HD1 TYR 17 HD1 TYR 17 7.179 -4.278 21.894
152 HD2 TYR 17 HD2 TYR 17 7.048 -3.109 17.781
153 HE1 TYR 17 HE1 TYR 17 4.643 -4.459 21.916
154 HE2 TYR 17 HE2 TYR 17 4.513 -3.294 17.816
155 HH TYR 17 HH TYR 17 2.723 -3.146 19.514
156 H ARG 18 HN ARG 18 7.860 -6.021 17.994
157 HA ARG 18 HA ARG 18 9.440 -5.316 15.711
158 HB2 ARG 18 HB2 ARG 18 9.967 -7.481 14.976
159 HB3 ARG 18 HB3 ARG 18 10.133 -7.683 16.708
160 HG2 ARG 18 HG2 ARG 18 7.727 -8.486 16.794
161 HG3 ARG 18 HG3 ARG 18 7.671 -8.393 15.045
162 HD2 ARG 18 HD2 ARG 18 10.030 -9.892 16.010
163 HD3 ARG 18 HD3 ARG 18 8.523 -10.604 16.552
164 HE ARG 18 HE ARG 18 9.521 -10.547 13.823
165 HH11 ARG 18 HH22 ARG 18 6.540 -10.593 15.738
166 HH12 ARG 18 HH21 ARG 18 5.594 -11.310 14.476
167 HH22 ARG 18 HH1 ARG 18 6.634 -11.830 12.380
168 H ARG 19 HN ARG 19 8.211 -5.997 13.613
169 HA ARG 19 HA ARG 19 5.625 -6.895 13.722
170 HB2 ARG 19 HB2 ARG 19 5.501 -4.502 14.895
171 HB3 ARG 19 HB3 ARG 19 5.573 -3.898 13.252
172 HG2 ARG 19 HG2 ARG 19 3.608 -6.107 13.855
173 HG3 ARG 19 HG3 ARG 19 3.232 -4.497 14.437
174 HD2 ARG 19 HD2 ARG 19 4.135 -4.178 11.737
175 HD3 ARG 19 HD3 ARG 19 3.035 -5.543 11.728
176 HE ARG 19 HE ARG 19 1.259 -4.094 12.218
177 HH11 ARG 19 HH22 ARG 19 4.315 -2.430 12.884
178 HH12 ARG 19 HH21 ARG 19 3.562 -0.894 13.159
179 HH22 ARG 19 HH1 ARG 19 1.180 -0.705 12.976
180 H CYS 20 HN CYS 20 4.570 -6.764 11.541
181 HA CYS 20 HA CYS 20 6.157 -5.541 9.465
182 HB2 CYS 20 HB2 CYS 20 5.713 -8.530 9.575
183 HB3 CYS 20 HB3 CYS 20 6.229 -7.661 8.144
184 H TRP 21 HN TRP 21 4.898 -5.454 7.410
185 HA TRP 21 HA TRP 21 2.031 -5.614 7.979
186 HB2 TRP 21 HB2 TRP 21 2.516 -3.445 7.357
187 HB3 TRP 21 HB3 TRP 21 3.727 -3.924 6.184
188 HD1 TRP 21 HD1 TRP 21 0.094 -2.997 6.401
189 HE1 TRP 21 HE1 TRP 21 -1.151 -3.204 4.083
190 HE3 TRP 21 HE3 TRP 21 3.804 -5.551 4.041
191 HZ2 TRP 21 HZ2 TRP 21 -0.460 -4.386 1.579
192 HZ3 TRP 21 HZ3 TRP 21 3.439 -6.193 1.660
193 HH2 TRP 21 HH2 TRP 21 1.396 -5.652 0.433
194 H1 ARG 31 HN ARG 31 8.393 -1.598 3.298
195 HA ARG 31 HA ARG 31 9.947 0.809 3.405
196 HB2 ARG 31 HB2 ARG 31 7.343 1.279 3.677
197 HB3 ARG 31 HB3 ARG 31 7.567 0.614 5.282
198 HG2 ARG 31 HG2 ARG 31 8.381 2.605 5.989
199 HG3 ARG 31 HG3 ARG 31 9.725 2.447 4.876
200 HD2 ARG 31 HD2 ARG 31 8.480 4.557 4.464
201 HD3 ARG 31 HD3 ARG 31 8.397 3.503 3.066
202 HE ARG 31 HE ARG 31 6.143 2.806 4.531
203 HH11 ARG 31 HH22 ARG 31 7.394 5.862 3.247
204 HH12 ARG 31 HH21 ARG 31 5.824 6.568 3.055
205 HH22 ARG 31 HH1 ARG 31 3.884 5.300 3.668
206 H TRP 32 HN TRP 32 11.040 1.056 5.552
207 HA TRP 32 HA TRP 32 10.838 -1.320 7.248
208 HB2 TRP 32 HB2 TRP 32 13.196 -0.436 5.675
209 HB3 TRP 32 HB3 TRP 32 13.492 -0.933 7.329
210 HD1 TRP 32 HD1 TRP 32 12.648 -2.379 3.914
211 HE1 TRP 32 HE1 TRP 32 12.626 -5.018 3.935
212 HE3 TRP 32 HE3 TRP 32 12.919 -2.864 8.969
213 HZ2 TRP 32 HZ2 TRP 32 12.723 -6.968 6.017
214 HZ3 TRP 32 HZ3 TRP 32 12.951 -5.170 9.914
215 HH2 TRP 32 HH2 TRP 32 12.858 -7.180 8.526
216 H CYS 33 HN CYS 33 9.945 -0.259 9.013
217 HA CYS 33 HA CYS 33 10.985 2.342 9.715
218 HB2 CYS 33 HB2 CYS 33 8.610 0.716 10.446
219 HB3 CYS 33 HB3 CYS 33 9.229 1.797 11.679
220 H VAL 34 HN VAL 34 11.859 2.750 11.917
221 HA VAL 34 HA VAL 34 12.621 0.421 13.448
222 HB VAL 34 HB VAL 34 14.993 0.948 13.402
223 HG11 VAL 34 HG11 VAL 34 15.512 -0.033 11.313
224 HG12 VAL 34 HG12 VAL 34 13.888 -0.635 11.726
225 HG13 VAL 34 HG13 VAL 34 14.076 0.670 10.531
226 HG21 VAL 34 HG21 VAL 34 15.895 2.522 11.693
227 HG22 VAL 34 HG22 VAL 34 14.231 3.052 11.350
228 HG23 VAL 34 HG23 VAL 34 14.939 3.327 12.960
229 H TYR 35 HN TYR 35 12.259 0.923 15.545
230 HA TYR 35 HA TYR 35 12.796 3.668 16.395
231 HB2 TYR 35 HB2 TYR 35 10.270 2.858 15.733
232 HB3 TYR 35 HB3 TYR 35 10.336 2.126 17.324
233 HD1 TYR 35 HD2 TYR 35 10.548 3.551 19.354
234 HD2 TYR 35 HD1 TYR 35 10.065 5.248 15.456
235 HE1 TYR 35 HE2 TYR 35 9.893 5.776 20.396
236 HE2 TYR 35 HE1 TYR 35 9.411 7.467 16.511
237 HH TYR 35 HH TYR 35 9.620 8.646 18.493
238 H ALA 36 HN ALA 36 14.223 3.518 18.047
239 HA ALA 36 HA ALA 36 13.754 1.396 20.013
240 HB1 ALA 36 HB1 ALA 36 16.245 2.006 18.432
241 HB2 ALA 36 HB2 ALA 36 16.395 1.406 20.101
242 HB3 ALA 36 HB3 ALA 36 15.543 0.432 18.879
243 H TYR 37 HN TYR 37 14.251 1.986 22.172
244 HA TYR 37 HA TYR 37 15.043 4.796 22.512
245 HB2 TYR 37 HB2 TYR 37 12.506 4.087 22.764
246 HB3 TYR 37 HB3 TYR 37 13.021 3.184 24.174
247 HD1 TYR 37 HD1 TYR 37 14.147 4.470 26.093
248 HD2 TYR 37 HD2 TYR 37 12.032 6.398 22.912
249 HE1 TYR 37 HE1 TYR 37 13.903 6.563 27.515
250 HE2 TYR 37 HE2 TYR 37 11.795 8.485 24.345
251 HH TYR 37 HH TYR 37 13.126 8.568 27.642
252 H VAL 38 HN VAL 38 17.227 3.915 22.885
253 HA VAL 38 HA VAL 38 17.472 2.275 25.278
254 HB VAL 38 HB VAL 38 19.480 3.216 23.220
255 HG11 VAL 38 HG11 VAL 38 20.940 2.822 24.907
256 HG12 VAL 38 HG12 VAL 38 19.785 1.823 25.822
257 HG13 VAL 38 HG13 VAL 38 20.680 1.120 24.453
258 HG21 VAL 38 HG21 VAL 38 18.733 0.345 23.580
259 HG22 VAL 38 HG22 VAL 38 17.571 1.410 22.752
260 HG23 VAL 38 HG23 VAL 38 19.223 1.228 22.114
261 H ARG 39 HN ARG 39 18.479 2.977 27.183
262 HA ARG 39 HA ARG 39 19.530 5.642 27.203
263 HB2 ARG 39 HB2 ARG 39 17.073 5.941 27.651
264 HB3 ARG 39 HB3 ARG 39 17.192 4.840 29.009
265 HG2 ARG 39 HG2 ARG 39 19.057 6.456 29.897
266 HG3 ARG 39 HG3 ARG 39 18.437 7.598 28.721
267 HD2 ARG 39 HD2 ARG 39 16.198 6.440 30.168
268 HD3 ARG 39 HD3 ARG 39 17.383 7.014 31.324
269 HE ARG 39 HE ARG 39 15.865 8.662 29.397
270 HH11 ARG 39 HH22 ARG 39 18.525 8.536 31.734
271 HH12 ARG 39 HH21 ARG 39 18.585 10.254 31.946
272 HH22 ARG 39 HH1 ARG 39 17.058 11.641 30.726
273 H ILE 40 HN ILE 40 21.349 5.626 28.504
274 HA ILE 40 HA ILE 40 21.359 3.951 30.864
275 HB ILE 40 HB ILE 40 23.018 3.430 28.436
276 HG12 ILE 40 HG12 ILE 40 21.084 2.021 30.076
277 HG13 ILE 40 HG13 ILE 40 21.685 1.642 28.474
278 HG21 ILE 40 HG21 ILE 40 23.925 2.874 31.274
279 HG22 ILE 40 HG22 ILE 40 24.694 2.257 29.792
280 HG23 ILE 40 HG23 ILE 40 24.676 4.006 30.124
281 HD11 ILE 40 HD11 ILE 40 23.687 0.565 29.425
282 HD12 ILE 40 HD12 ILE 40 23.179 1.030 31.066
283 HD13 ILE 40 HD13 ILE 40 22.220 -0.147 30.138
284 H ARG 41 HN ARG 41 23.305 4.445 32.247
285 HA ARG 41 HA ARG 41 24.437 5.925 33.347
286 HB2 ARG 41 HB2 ARG 41 25.261 6.680 30.509
287 HB3 ARG 41 HB3 ARG 41 25.985 7.456 31.904
288 HG2 ARG 41 HG2 ARG 41 25.894 4.424 31.669
289 HG3 ARG 41 HG3 ARG 41 27.172 5.350 30.906
290 HD2 ARG 41 HD2 ARG 41 26.509 5.725 33.855
291 HD3 ARG 41 HD3 ARG 41 27.588 4.450 33.325
292 HE ARG 41 HE ARG 41 28.232 7.139 32.291
293 HH11 ARG 41 HH22 ARG 41 28.855 4.715 34.799
294 HH12 ARG 41 HH21 ARG 41 30.384 5.392 35.249
295 HH22 ARG 41 HH1 ARG 41 31.184 7.343 34.110
296 H GLY 42 HN GLY 42 24.038 8.175 30.556
297 HA2 GLY 42 HA1 GLY 42 21.875 9.619 31.823
298 HA3 GLY 42 HA2 GLY 42 23.423 10.439 31.879
299 H VAL 43 HN VAL 43 22.736 8.218 29.204
300 HA VAL 43 HA VAL 43 22.217 10.540 27.482
301 HB VAL 43 HB VAL 43 23.738 8.204 26.437
302 HG11 VAL 43 HG11 VAL 43 23.728 9.614 24.698
303 HG12 VAL 43 HG12 VAL 43 23.166 10.970 25.705
304 HG13 VAL 43 HG13 VAL 43 24.903 10.595 25.606
305 HG21 VAL 43 HG21 VAL 43 24.833 10.206 28.409
306 HG22 VAL 43 HG22 VAL 43 25.057 8.441 28.351
307 HG23 VAL 43 HG23 VAL 43 25.875 9.482 27.161
308 H LEU 44 HN LEU 44 20.261 10.377 26.528
309 HA LEU 44 HA LEU 44 19.103 7.697 26.336
310 HB2 LEU 44 HB2 LEU 44 17.570 8.892 27.488
311 HB3 LEU 44 HB3 LEU 44 18.047 10.424 26.784
312 HG LEU 44 HG LEU 44 16.861 9.831 24.694
313 HD11 LEU 44 HD11 LEU 44 16.615 7.233 26.061
314 HD12 LEU 44 HD12 LEU 44 15.123 7.816 25.284
315 HD13 LEU 44 HD13 LEU 44 16.612 7.632 24.326
316 HD21 LEU 44 HD21 LEU 44 14.882 10.629 25.449
317 HD22 LEU 44 HD22 LEU 44 14.776 9.444 26.773
318 HD23 LEU 44 HD23 LEU 44 15.825 10.872 26.939
319 H VAL 45 HN VAL 45 19.413 6.700 24.422
320 HA VAL 45 HA VAL 45 19.650 8.401 22.052
321 HB VAL 45 HB VAL 45 20.233 5.465 22.112
322 HG11 VAL 45 HG11 VAL 45 20.320 7.196 20.090
323 HG12 VAL 45 HG12 VAL 45 21.936 7.519 20.761
324 HG13 VAL 45 HG13 VAL 45 21.499 5.873 20.246
325 HG21 VAL 45 HG21 VAL 45 21.436 6.052 24.043
326 HG22 VAL 45 HG22 VAL 45 22.637 6.157 22.734
327 HG23 VAL 45 HG23 VAL 45 21.900 7.640 23.386
328 H ARG 46 HN ARG 46 17.633 8.817 21.245
329 HA ARG 46 HA ARG 46 15.843 6.530 21.117
330 HB2 ARG 46 HB2 ARG 46 15.141 9.490 20.797
331 HB3 ARG 46 HB3 ARG 46 14.003 8.165 20.946
332 HG2 ARG 46 HG2 ARG 46 14.938 7.666 23.240
333 HG3 ARG 46 HG3 ARG 46 15.992 9.058 23.087
334 HD2 ARG 46 HD2 ARG 46 12.967 9.295 22.787
335 HD3 ARG 46 HD3 ARG 46 13.752 9.410 24.349
336 HE ARG 46 HE ARG 46 15.050 11.168 22.461
337 HH11 ARG 46 HH22 ARG 46 12.111 10.889 24.421
338 HH12 ARG 46 HH21 ARG 46 11.867 12.601 24.521
339 HH22 ARG 46 HH1 ARG 46 13.418 14.073 23.440
340 H TYR 47 HN TYR 47 15.758 5.566 19.113
341 HA TYR 47 HA TYR 47 16.480 7.199 16.794
342 HB2 TYR 47 HB2 TYR 47 17.636 4.990 17.366
343 HB3 TYR 47 HB3 TYR 47 16.083 4.181 17.290
344 HD1 TYR 47 HD1 TYR 47 16.785 6.824 14.858
345 HD2 TYR 47 HD2 TYR 47 16.999 2.617 15.608
346 HE1 TYR 47 HE1 TYR 47 17.129 6.392 12.377
347 HE2 TYR 47 HE2 TYR 47 17.342 2.200 13.124
348 HH TYR 47 HH TYR 47 16.828 4.645 10.798
349 H ARG 48 HN ARG 48 15.049 7.655 15.156
350 HA ARG 48 HA ARG 48 12.619 6.140 15.044
351 HB2 ARG 48 HB2 ARG 48 11.270 8.352 14.944
352 HB3 ARG 48 HB3 ARG 48 11.811 7.834 16.529
353 HG2 ARG 48 HG2 ARG 48 13.974 9.312 15.862
354 HG3 ARG 48 HG3 ARG 48 12.806 10.115 14.832
355 HD2 ARG 48 HD2 ARG 48 11.379 9.943 17.195
356 HD3 ARG 48 HD3 ARG 48 13.013 10.104 17.808
357 HE ARG 48 HE ARG 48 11.461 12.186 16.572
358 HH11 ARG 48 HH22 ARG 48 14.784 10.964 16.712
359 HH12 ARG 48 HH21 ARG 48 15.497 12.503 16.363
360 HH22 ARG 48 HH1 ARG 48 14.077 14.402 16.012
361 H ARG 49 HN ARG 49 12.588 5.572 12.889
362 HA ARG 49 HA ARG 49 12.338 7.459 10.916
363 HB2 ARG 49 HB2 ARG 49 14.892 7.649 11.512
364 HB3 ARG 49 HB3 ARG 49 15.059 6.105 10.702
365 HG2 ARG 49 HG2 ARG 49 15.419 8.245 9.276
366 HG3 ARG 49 HG3 ARG 49 14.410 6.985 8.595
367 HD2 ARG 49 HD2 ARG 49 13.460 9.355 8.413
368 HD3 ARG 49 HD3 ARG 49 12.378 8.173 9.122
369 HE ARG 49 HE ARG 49 14.052 9.656 11.052
370 HH11 ARG 49 HH22 ARG 49 10.921 9.449 9.407
371 HH12 ARG 49 HH21 ARG 49 10.102 10.431 10.575
372 HH22 ARG 49 HH1 ARG 49 11.328 11.303 12.441
373 H CYS 50 HN CYS 50 12.579 6.325 8.620
374 HA CYS 50 HA CYS 50 12.400 3.441 8.840
375 HB2 CYS 50 HB2 CYS 50 10.200 4.929 7.422
376 HB3 CYS 50 HB3 CYS 50 10.285 3.226 7.826
377 H TRP 51 HN TRP 51 12.004 2.625 6.365
378 HA TRP 51 HA TRP 51 13.461 4.427 4.570
379 HB2 TRP 51 HB2 TRP 51 14.194 1.625 5.350
380 HB3 TRP 51 HB3 TRP 51 14.569 2.215 3.743
381 HD1 TRP 51 HD1 TRP 51 16.198 4.557 3.734
382 HE1 TRP 51 HE1 TRP 51 18.220 5.260 5.277
383 HE3 TRP 51 HE3 TRP 51 15.041 1.427 7.570
384 HZ2 TRP 51 HZ2 TRP 51 19.090 4.446 7.870
385 HZ3 TRP 51 HZ3 TRP 51 16.528 1.443 9.571
386 HH2 TRP 51 HH2 TRP 51 18.493 2.884 9.758
Start of MODEL 10
1 H1 ARG 1 HN ARG 1 9.017 -7.812 2.356
2 HA ARG 1 HA ARG 1 6.817 -6.014 1.887
3 HB2 ARG 1 HB2 ARG 1 7.436 -8.175 3.921
4 HB3 ARG 1 HB3 ARG 1 6.221 -6.974 4.312
5 HG2 ARG 1 HG2 ARG 1 5.909 -8.066 1.579
6 HG3 ARG 1 HG3 ARG 1 5.800 -9.301 2.817
7 HD2 ARG 1 HD2 ARG 1 4.281 -7.156 3.857
8 HD3 ARG 1 HD3 ARG 1 3.889 -7.166 2.149
9 HE ARG 1 HE ARG 1 3.844 -9.854 3.245
10 HH11 ARG 1 HH22 ARG 1 1.943 -6.873 3.021
11 HH12 ARG 1 HH21 ARG 1 0.424 -7.679 3.229
12 HH22 ARG 1 HH1 ARG 1 0.388 -10.058 3.521
13 H TRP 2 HN TRP 2 6.136 -4.677 3.989
14 HA TRP 2 HA TRP 2 8.509 -3.178 4.752
15 HB2 TRP 2 HB2 TRP 2 5.765 -2.368 5.574
16 HB3 TRP 2 HB3 TRP 2 7.141 -1.387 5.111
17 HD1 TRP 2 HD1 TRP 2 4.027 -1.378 3.812
18 HE1 TRP 2 HE1 TRP 2 3.730 -1.396 1.190
19 HE3 TRP 2 HE3 TRP 2 8.667 -3.178 2.774
20 HZ2 TRP 2 HZ2 TRP 2 5.431 -2.144 -0.975
21 HZ3 TRP 2 HZ3 TRP 2 9.270 -3.523 0.380
22 HH2 TRP 2 HH2 TRP 2 7.739 -3.038 -1.463
23 H CYS 3 HN CYS 3 9.475 -3.500 6.714
24 HA CYS 3 HA CYS 3 7.841 -4.816 8.761
25 HB2 CYS 3 HB2 CYS 3 10.598 -5.374 7.801
26 HB3 CYS 3 HB3 CYS 3 10.328 -5.478 9.530
27 H VAL 4 HN VAL 4 8.859 -4.330 11.057
28 HA VAL 4 HA VAL 4 10.223 -1.784 11.175
29 HB VAL 4 HB VAL 4 8.575 -0.591 12.292
30 HG11 VAL 4 HG11 VAL 4 8.108 -0.788 9.886
31 HG12 VAL 4 HG12 VAL 4 7.084 -2.211 10.197
32 HG13 VAL 4 HG13 VAL 4 6.607 -0.615 10.827
33 HG21 VAL 4 HG21 VAL 4 7.360 -3.274 12.849
34 HG22 VAL 4 HG22 VAL 4 7.675 -1.910 13.949
35 HG23 VAL 4 HG23 VAL 4 6.302 -1.844 12.818
36 H TYR 5 HN TYR 5 11.788 -2.019 12.681
37 HA TYR 5 HA TYR 5 11.270 -3.969 14.825
38 HB2 TYR 5 HB2 TYR 5 13.605 -3.160 13.053
39 HB3 TYR 5 HB3 TYR 5 13.999 -3.654 14.688
40 HD1 TYR 5 HD2 TYR 5 11.999 -4.835 11.739
41 HD2 TYR 5 HD1 TYR 5 14.415 -5.905 15.104
42 HE1 TYR 5 HE2 TYR 5 11.922 -7.275 11.028
43 HE2 TYR 5 HE1 TYR 5 14.329 -8.341 14.382
44 HH TYR 5 HH TYR 5 12.496 -9.720 12.921
45 H ALA 6 HN ALA 6 11.421 -3.286 16.925
46 HA ALA 6 HA ALA 6 12.593 -0.624 17.345
47 HB1 ALA 6 HB1 ALA 6 9.866 -1.588 17.812
48 HB2 ALA 6 HB2 ALA 6 10.618 -0.951 19.294
49 HB3 ALA 6 HB3 ALA 6 10.507 0.072 17.842
50 H TYR 7 HN TYR 7 13.820 -0.379 19.249
51 HA TYR 7 HA TYR 7 14.051 -2.771 20.926
52 HB2 TYR 7 HB2 TYR 7 15.851 -2.628 19.108
53 HB3 TYR 7 HB3 TYR 7 16.272 -1.028 19.686
54 HD1 TYR 7 HD2 TYR 7 16.945 -0.895 22.251
55 HD2 TYR 7 HD1 TYR 7 17.052 -4.464 19.893
56 HE1 TYR 7 HE2 TYR 7 18.608 -1.926 23.874
57 HE2 TYR 7 HE1 TYR 7 18.715 -5.482 21.524
58 HH TYR 7 HH TYR 7 20.475 -3.786 23.596
59 H VAL 8 HN VAL 8 13.356 -2.057 22.891
60 HA VAL 8 HA VAL 8 14.277 0.606 23.716
61 HB VAL 8 HB VAL 8 11.915 -1.028 24.664
62 HG11 VAL 8 HG11 VAL 8 13.142 1.539 25.575
63 HG12 VAL 8 HG12 VAL 8 11.366 1.432 25.548
64 HG13 VAL 8 HG13 VAL 8 12.313 0.269 26.506
65 HG21 VAL 8 HG21 VAL 8 11.883 -0.010 22.282
66 HG22 VAL 8 HG22 VAL 8 10.507 0.315 23.365
67 HG23 VAL 8 HG23 VAL 8 11.757 1.557 23.116
68 H ARG 9 HN ARG 9 15.242 0.861 25.783
69 HA ARG 9 HA ARG 9 15.521 -1.421 27.438
70 HB2 ARG 9 HB2 ARG 9 17.374 -2.144 26.214
71 HB3 ARG 9 HB3 ARG 9 17.752 -0.536 25.629
72 HG2 ARG 9 HG2 ARG 9 18.797 0.097 27.701
73 HG3 ARG 9 HG3 ARG 9 18.099 -1.259 28.564
74 HD2 ARG 9 HD2 ARG 9 19.857 -2.592 28.015
75 HD3 ARG 9 HD3 ARG 9 19.634 -2.267 26.307
76 HE ARG 9 HE ARG 9 20.844 0.038 27.099
77 HH11 ARG 9 HH22 ARG 9 21.652 -3.340 27.802
78 HH12 ARG 9 HH21 ARG 9 23.348 -3.029 27.966
79 HH22 ARG 9 HH1 ARG 9 24.166 -0.795 27.676
80 H ILE 10 HN ILE 10 15.127 -0.444 29.403
81 HA ILE 10 HA ILE 10 16.796 1.783 30.169
82 HB ILE 10 HB ILE 10 13.864 2.195 30.537
83 HG12 ILE 10 HG12 ILE 10 15.349 2.947 28.002
84 HG13 ILE 10 HG13 ILE 10 14.146 1.680 28.127
85 HG21 ILE 10 HG21 ILE 10 14.630 4.045 31.487
86 HG22 ILE 10 HG22 ILE 10 16.300 3.636 31.026
87 HG23 ILE 10 HG23 ILE 10 15.270 4.564 29.910
88 HD11 ILE 10 HD11 ILE 10 13.789 4.661 28.228
89 HD12 ILE 10 HD12 ILE 10 12.773 3.421 27.454
90 HD13 ILE 10 HD13 ILE 10 12.688 3.669 29.215
91 H ARG 11 HN ARG 11 16.778 2.124 32.508
92 HA ARG 11 HA ARG 11 16.599 1.524 34.585
93 HB2 ARG 11 HB2 ARG 11 14.252 0.030 33.456
94 HB3 ARG 11 HB3 ARG 11 14.838 -0.536 35.007
95 HG2 ARG 11 HG2 ARG 11 13.669 1.148 35.979
96 HG3 ARG 11 HG3 ARG 11 14.817 2.272 35.277
97 HD2 ARG 11 HD2 ARG 11 13.418 2.764 33.429
98 HD3 ARG 11 HD3 ARG 11 12.525 1.264 33.572
99 HE ARG 11 HE ARG 11 12.159 2.842 35.957
100 HH11 ARG 11 HH22 ARG 11 11.158 2.700 32.561
101 HH12 ARG 11 HH21 ARG 11 9.661 3.525 32.838
102 HH22 ARG 11 HH1 ARG 11 9.108 4.239 35.058
103 H GLY 12 HN GLY 12 16.465 -1.211 32.232
104 HA2 GLY 12 HA1 GLY 12 18.832 -2.344 32.529
105 HA3 GLY 12 HA2 GLY 12 18.058 -2.906 33.997
106 H VAL 13 HN VAL 13 15.369 -2.645 32.288
107 HA VAL 13 HA VAL 13 15.509 -5.398 31.387
108 HB VAL 13 HB VAL 13 13.185 -3.470 31.567
109 HG11 VAL 13 HG11 VAL 13 13.444 -6.349 30.797
110 HG12 VAL 13 HG12 VAL 13 12.019 -5.857 31.744
111 HG13 VAL 13 HG13 VAL 13 12.353 -5.089 30.173
112 HG21 VAL 13 HG21 VAL 13 14.491 -5.259 33.575
113 HG22 VAL 13 HG22 VAL 13 13.701 -3.678 33.789
114 HG23 VAL 13 HG23 VAL 13 12.714 -5.146 33.586
115 H LEU 14 HN LEU 14 15.358 -6.070 29.256
116 HA LEU 14 HA LEU 14 15.580 -3.908 27.297
117 HB2 LEU 14 HB2 LEU 14 17.453 -5.397 27.350
118 HB3 LEU 14 HB3 LEU 14 16.416 -6.806 27.254
119 HG LEU 14 HG LEU 14 16.081 -6.603 25.000
120 HD11 LEU 14 HD11 LEU 14 16.516 -4.313 23.817
121 HD12 LEU 14 HD12 LEU 14 14.996 -4.592 24.701
122 HD13 LEU 14 HD13 LEU 14 16.303 -3.646 25.453
123 HD21 LEU 14 HD21 LEU 14 18.449 -6.968 25.319
124 HD22 LEU 14 HD22 LEU 14 18.189 -5.940 23.890
125 HD23 LEU 14 HD23 LEU 14 18.742 -5.215 25.419
126 H VAL 15 HN VAL 15 13.749 -3.352 26.259
127 HA VAL 15 HA VAL 15 11.789 -5.497 25.813
128 HB VAL 15 HB VAL 15 11.130 -2.568 25.922
129 HG11 VAL 15 HG11 VAL 15 9.648 -4.788 25.255
130 HG12 VAL 15 HG12 VAL 15 9.244 -4.568 26.975
131 HG13 VAL 15 HG13 VAL 15 8.984 -3.237 25.822
132 HG21 VAL 15 HG21 VAL 15 11.817 -2.516 28.064
133 HG22 VAL 15 HG22 VAL 15 10.372 -3.503 28.394
134 HG23 VAL 15 HG23 VAL 15 11.953 -4.288 28.165
135 H ARG 16 HN ARG 16 12.515 -6.190 23.786
136 HA ARG 16 HA ARG 16 12.866 -4.120 21.803
137 HB2 ARG 16 HB2 ARG 16 13.371 -7.137 21.670
138 HB3 ARG 16 HB3 ARG 16 13.738 -6.013 20.377
139 HG2 ARG 16 HG2 ARG 16 15.284 -4.766 21.915
140 HG3 ARG 16 HG3 ARG 16 14.933 -5.918 23.188
141 HD2 ARG 16 HD2 ARG 16 17.057 -6.484 22.015
142 HD3 ARG 16 HD3 ARG 16 15.874 -7.765 21.838
143 HE ARG 16 HE ARG 16 15.598 -5.931 19.645
144 HH11 ARG 16 HH22 ARG 16 17.807 -8.422 20.856
145 HH12 ARG 16 HH21 ARG 16 18.411 -8.827 19.284
146 HH22 ARG 16 HH1 ARG 16 17.566 -7.662 17.367
147 H TYR 17 HN TYR 17 11.107 -3.560 20.559
148 HA TYR 17 HA TYR 17 8.910 -5.472 20.373
149 HB2 TYR 17 HB2 TYR 17 9.040 -2.801 20.961
150 HB3 TYR 17 HB3 TYR 17 9.000 -2.656 19.216
151 HD1 TYR 17 HD1 TYR 17 7.106 -3.788 22.185
152 HD2 TYR 17 HD2 TYR 17 6.978 -3.076 17.968
153 HE1 TYR 17 HE1 TYR 17 4.572 -3.992 22.220
154 HE2 TYR 17 HE2 TYR 17 4.444 -3.282 18.017
155 HH TYR 17 HH TYR 17 2.742 -3.860 21.084
156 H ARG 18 HN ARG 18 7.810 -5.791 18.271
157 HA ARG 18 HA ARG 18 9.405 -5.130 15.980
158 HB2 ARG 18 HB2 ARG 18 8.780 -8.007 16.803
159 HB3 ARG 18 HB3 ARG 18 9.272 -7.574 15.178
160 HG2 ARG 18 HG2 ARG 18 11.430 -6.793 15.922
161 HG3 ARG 18 HG3 ARG 18 10.931 -6.775 17.602
162 HD2 ARG 18 HD2 ARG 18 10.586 -9.329 17.393
163 HD3 ARG 18 HD3 ARG 18 11.399 -9.225 15.845
164 HE ARG 18 HE ARG 18 12.878 -7.953 18.040
165 HH11 ARG 18 HH22 ARG 18 12.327 -10.973 16.271
166 HH12 ARG 18 HH21 ARG 18 13.845 -11.667 16.735
167 HH22 ARG 18 HH1 ARG 18 15.331 -10.411 18.135
168 H ARG 19 HN ARG 19 8.181 -5.768 13.890
169 HA ARG 19 HA ARG 19 5.595 -6.666 13.970
170 HB2 ARG 19 HB2 ARG 19 5.481 -4.271 15.162
171 HB3 ARG 19 HB3 ARG 19 5.527 -3.671 13.517
172 HG2 ARG 19 HG2 ARG 19 3.590 -5.897 14.123
173 HG3 ARG 19 HG3 ARG 19 3.209 -4.306 14.752
174 HD2 ARG 19 HD2 ARG 19 4.075 -3.970 12.020
175 HD3 ARG 19 HD3 ARG 19 2.912 -5.281 12.046
176 HE ARG 19 HE ARG 19 1.224 -3.777 12.774
177 HH11 ARG 19 HH22 ARG 19 4.380 -2.167 12.698
178 HH12 ARG 19 HH21 ARG 19 3.711 -0.578 12.861
179 HH22 ARG 19 HH1 ARG 19 1.335 -0.315 13.031
180 H CYS 20 HN CYS 20 4.544 -6.486 11.783
181 HA CYS 20 HA CYS 20 6.159 -5.253 9.734
182 HB2 CYS 20 HB2 CYS 20 5.703 -8.240 9.834
183 HB3 CYS 20 HB3 CYS 20 6.179 -7.376 8.385
184 H TRP 21 HN TRP 21 4.928 -5.356 7.583
185 HA TRP 21 HA TRP 21 2.045 -5.630 8.107
186 HB2 TRP 21 HB2 TRP 21 2.368 -3.336 7.945
187 HB3 TRP 21 HB3 TRP 21 3.595 -3.481 6.702
188 HD1 TRP 21 HD1 TRP 21 -0.057 -2.812 7.074
189 HE1 TRP 21 HE1 TRP 21 -1.333 -2.724 4.766
190 HE3 TRP 21 HE3 TRP 21 3.716 -4.815 4.314
191 HZ2 TRP 21 HZ2 TRP 21 -0.637 -3.485 2.105
192 HZ3 TRP 21 HZ3 TRP 21 3.336 -5.108 1.868
193 HH2 TRP 21 HH2 TRP 21 1.250 -4.481 0.760
194 H1 ARG 31 HN ARG 31 8.326 -1.349 3.568
195 HA ARG 31 HA ARG 31 9.472 1.257 3.905
196 HB2 ARG 31 HB2 ARG 31 6.832 1.299 4.160
197 HB3 ARG 31 HB3 ARG 31 7.133 0.519 5.700
198 HG2 ARG 31 HG2 ARG 31 7.236 2.726 6.400
199 HG3 ARG 31 HG3 ARG 31 8.921 2.505 5.974
200 HD2 ARG 31 HD2 ARG 31 8.375 4.512 4.854
201 HD3 ARG 31 HD3 ARG 31 8.214 3.319 3.581
202 HE ARG 31 HE ARG 31 5.688 3.535 4.885
203 HH11 ARG 31 HH22 ARG 31 7.816 5.500 2.844
204 HH12 ARG 31 HH21 ARG 31 6.516 6.420 2.162
205 HH22 ARG 31 HH1 ARG 31 4.266 5.961 2.847
206 H TRP 32 HN TRP 32 10.812 1.366 5.795
207 HA TRP 32 HA TRP 32 10.803 -1.032 7.483
208 HB2 TRP 32 HB2 TRP 32 13.005 0.016 5.788
209 HB3 TRP 32 HB3 TRP 32 13.432 -0.506 7.405
210 HD1 TRP 32 HD1 TRP 32 12.595 -1.904 3.998
211 HE1 TRP 32 HE1 TRP 32 12.659 -4.542 3.950
212 HE3 TRP 32 HE3 TRP 32 12.864 -2.512 9.039
213 HZ2 TRP 32 HZ2 TRP 32 12.811 -6.541 5.981
214 HZ3 TRP 32 HZ3 TRP 32 12.967 -4.840 9.925
215 HH2 TRP 32 HH2 TRP 32 12.944 -6.815 8.484
216 H CYS 33 HN CYS 33 9.853 0.042 9.243
217 HA CYS 33 HA CYS 33 10.911 2.623 9.985
218 HB2 CYS 33 HB2 CYS 33 8.542 0.986 10.713
219 HB3 CYS 33 HB3 CYS 33 9.177 2.043 11.959
220 H VAL 34 HN VAL 34 11.815 2.990 12.180
221 HA VAL 34 HA VAL 34 12.588 0.635 13.664
222 HB VAL 34 HB VAL 34 14.917 0.961 13.518
223 HG11 VAL 34 HG11 VAL 34 13.883 -0.252 11.619
224 HG12 VAL 34 HG12 VAL 34 13.832 1.271 10.699
225 HG13 VAL 34 HG13 VAL 34 15.398 0.566 11.166
226 HG21 VAL 34 HG21 VAL 34 14.231 3.565 12.154
227 HG22 VAL 34 HG22 VAL 34 15.260 3.277 13.578
228 HG23 VAL 34 HG23 VAL 34 15.831 2.810 11.959
229 H TYR 35 HN TYR 35 12.209 1.110 15.762
230 HA TYR 35 HA TYR 35 12.778 3.840 16.651
231 HB2 TYR 35 HB2 TYR 35 10.255 3.120 16.005
232 HB3 TYR 35 HB3 TYR 35 10.320 2.238 17.518
233 HD1 TYR 35 HD1 TYR 35 10.707 3.505 19.675
234 HD2 TYR 35 HD2 TYR 35 9.908 5.480 15.964
235 HE1 TYR 35 HE1 TYR 35 10.071 5.623 20.930
236 HE2 TYR 35 HE2 TYR 35 9.275 7.591 17.232
237 HH TYR 35 HH TYR 35 8.891 8.472 19.177
238 H ALA 36 HN ALA 36 14.261 3.641 18.251
239 HA ALA 36 HA ALA 36 13.829 1.471 20.179
240 HB1 ALA 36 HB1 ALA 36 16.408 1.419 20.287
241 HB2 ALA 36 HB2 ALA 36 15.635 0.668 18.871
242 HB3 ALA 36 HB3 ALA 36 16.366 2.285 18.733
243 H TYR 37 HN TYR 37 14.492 1.977 22.359
244 HA TYR 37 HA TYR 37 15.220 4.776 22.802
245 HB2 TYR 37 HB2 TYR 37 12.645 4.134 22.917
246 HB3 TYR 37 HB3 TYR 37 13.072 3.217 24.348
247 HD1 TYR 37 HD2 TYR 37 14.227 4.503 26.284
248 HD2 TYR 37 HD1 TYR 37 12.151 6.427 23.076
249 HE1 TYR 37 HE2 TYR 37 13.980 6.604 27.694
250 HE2 TYR 37 HE1 TYR 37 11.911 8.521 24.496
251 HH TYR 37 HH TYR 37 12.961 8.543 27.867
252 H VAL 38 HN VAL 38 17.347 3.773 23.239
253 HA VAL 38 HA VAL 38 17.376 2.198 25.706
254 HB VAL 38 HB VAL 38 19.470 2.672 23.576
255 HG11 VAL 38 HG11 VAL 38 19.555 1.177 26.197
256 HG12 VAL 38 HG12 VAL 38 20.598 0.710 24.833
257 HG13 VAL 38 HG13 VAL 38 20.721 2.344 25.528
258 HG21 VAL 38 HG21 VAL 38 18.161 1.156 22.510
259 HG22 VAL 38 HG22 VAL 38 19.019 0.005 23.562
260 HG23 VAL 38 HG23 VAL 38 17.400 0.588 24.015
261 H ARG 39 HN ARG 39 18.472 2.910 27.552
262 HA ARG 39 HA ARG 39 19.745 5.497 27.323
263 HB2 ARG 39 HB2 ARG 39 17.280 5.688 28.113
264 HB3 ARG 39 HB3 ARG 39 17.785 4.871 29.579
265 HG2 ARG 39 HG2 ARG 39 19.506 6.665 29.965
266 HG3 ARG 39 HG3 ARG 39 18.951 7.491 28.522
267 HD2 ARG 39 HD2 ARG 39 17.321 8.511 29.726
268 HD3 ARG 39 HD3 ARG 39 16.618 6.952 30.107
269 HE ARG 39 HE ARG 39 17.736 6.952 32.202
270 HH11 ARG 39 HH22 ARG 39 18.764 9.717 30.239
271 HH12 ARG 39 HH21 ARG 39 19.541 10.524 31.560
272 HH22 ARG 39 HH1 ARG 39 19.527 9.507 33.730
273 H ILE 40 HN ILE 40 21.572 5.694 28.675
274 HA ILE 40 HA ILE 40 21.879 3.849 30.875
275 HB ILE 40 HB ILE 40 23.400 3.629 28.319
276 HG12 ILE 40 HG12 ILE 40 21.738 1.952 30.009
277 HG13 ILE 40 HG13 ILE 40 22.235 1.727 28.343
278 HG21 ILE 40 HG21 ILE 40 25.272 2.539 29.480
279 HG22 ILE 40 HG22 ILE 40 25.131 4.261 29.906
280 HG23 ILE 40 HG23 ILE 40 24.572 3.014 31.046
281 HD11 ILE 40 HD11 ILE 40 24.398 0.790 29.063
282 HD12 ILE 40 HD12 ILE 40 23.989 1.109 30.766
283 HD13 ILE 40 HD13 ILE 40 23.065 -0.098 29.840
284 H ARG 41 HN ARG 41 23.810 4.426 32.214
285 HA ARG 41 HA ARG 41 24.900 5.912 33.345
286 HB2 ARG 41 HB2 ARG 41 25.487 6.949 30.535
287 HB3 ARG 41 HB3 ARG 41 26.240 7.656 31.951
288 HG2 ARG 41 HG2 ARG 41 26.349 4.655 31.497
289 HG3 ARG 41 HG3 ARG 41 27.481 5.713 30.679
290 HD2 ARG 41 HD2 ARG 41 27.073 5.595 33.708
291 HD3 ARG 41 HD3 ARG 41 28.394 4.835 32.844
292 HE ARG 41 HE ARG 41 28.278 7.629 32.154
293 HH11 ARG 41 HH22 ARG 41 29.208 5.490 34.821
294 HH12 ARG 41 HH21 ARG 41 30.367 6.600 35.472
295 HH22 ARG 41 HH1 ARG 41 30.703 8.713 34.392
296 H GLY 42 HN GLY 42 24.081 8.262 30.721
297 HA2 GLY 42 HA1 GLY 42 21.898 9.429 32.191
298 HA3 GLY 42 HA2 GLY 42 23.370 10.377 32.270
299 H VAL 43 HN VAL 43 22.683 8.313 29.453
300 HA VAL 43 HA VAL 43 21.867 10.693 27.951
301 HB VAL 43 HB VAL 43 23.701 8.724 26.675
302 HG11 VAL 43 HG11 VAL 43 24.409 11.391 26.097
303 HG12 VAL 43 HG12 VAL 43 23.511 10.255 25.062
304 HG13 VAL 43 HG13 VAL 43 22.630 11.358 26.145
305 HG21 VAL 43 HG21 VAL 43 24.889 9.082 28.735
306 HG22 VAL 43 HG22 VAL 43 25.678 10.049 27.467
307 HG23 VAL 43 HG23 VAL 43 24.611 10.838 28.653
308 H LEU 44 HN LEU 44 20.011 10.334 26.847
309 HA LEU 44 HA LEU 44 19.187 7.543 26.560
310 HB2 LEU 44 HB2 LEU 44 17.477 8.511 27.665
311 HB3 LEU 44 HB3 LEU 44 17.809 10.112 27.035
312 HG LEU 44 HG LEU 44 16.766 9.504 24.890
313 HD11 LEU 44 HD11 LEU 44 16.792 6.809 26.097
314 HD12 LEU 44 HD12 LEU 44 15.293 7.253 25.246
315 HD13 LEU 44 HD13 LEU 44 16.853 7.314 24.391
316 HD21 LEU 44 HD21 LEU 44 15.438 10.540 26.692
317 HD22 LEU 44 HD22 LEU 44 14.462 9.479 25.647
318 HD23 LEU 44 HD23 LEU 44 14.968 8.919 27.259
319 H VAL 45 HN VAL 45 19.542 6.602 24.629
320 HA VAL 45 HA VAL 45 19.813 8.365 22.313
321 HB VAL 45 HB VAL 45 20.448 5.427 22.421
322 HG11 VAL 45 HG11 VAL 45 20.732 6.033 20.239
323 HG12 VAL 45 HG12 VAL 45 21.059 7.738 20.636
324 HG13 VAL 45 HG13 VAL 45 22.332 6.513 20.854
325 HG21 VAL 45 HG21 VAL 45 22.879 6.500 22.845
326 HG22 VAL 45 HG22 VAL 45 21.888 7.668 23.752
327 HG23 VAL 45 HG23 VAL 45 21.822 5.937 24.162
328 H ARG 46 HN ARG 46 17.872 8.765 21.356
329 HA ARG 46 HA ARG 46 16.076 6.487 21.155
330 HB2 ARG 46 HB2 ARG 46 15.401 9.449 20.795
331 HB3 ARG 46 HB3 ARG 46 14.253 8.129 20.889
332 HG2 ARG 46 HG2 ARG 46 14.787 7.701 23.215
333 HG3 ARG 46 HG3 ARG 46 16.200 8.736 23.153
334 HD2 ARG 46 HD2 ARG 46 13.836 10.239 22.322
335 HD3 ARG 46 HD3 ARG 46 13.544 9.481 23.875
336 HE ARG 46 HE ARG 46 16.148 10.853 23.620
337 HH11 ARG 46 HH22 ARG 46 12.777 11.091 24.686
338 HH12 ARG 46 HH21 ARG 46 13.077 12.425 25.749
339 HH22 ARG 46 HH1 ARG 46 15.299 13.304 25.931
340 H TYR 47 HN TYR 47 16.105 5.515 19.153
341 HA TYR 47 HA TYR 47 16.933 7.146 16.868
342 HB2 TYR 47 HB2 TYR 47 18.101 4.974 17.448
343 HB3 TYR 47 HB3 TYR 47 16.564 4.134 17.414
344 HD1 TYR 47 HD1 TYR 47 17.355 6.712 14.905
345 HD2 TYR 47 HD2 TYR 47 17.335 2.520 15.759
346 HE1 TYR 47 HE1 TYR 47 17.685 6.200 12.437
347 HE2 TYR 47 HE2 TYR 47 17.665 2.022 13.288
348 HH TYR 47 HH TYR 47 18.388 2.979 11.343
349 H ARG 48 HN ARG 48 15.599 7.548 15.128
350 HA ARG 48 HA ARG 48 13.168 6.041 14.935
351 HB2 ARG 48 HB2 ARG 48 12.198 7.732 16.262
352 HB3 ARG 48 HB3 ARG 48 13.287 8.970 15.670
353 HG2 ARG 48 HG2 ARG 48 11.596 7.808 13.534
354 HG3 ARG 48 HG3 ARG 48 10.660 8.562 14.808
355 HD2 ARG 48 HD2 ARG 48 12.959 9.902 13.301
356 HD3 ARG 48 HD3 ARG 48 11.257 10.178 12.986
357 HE ARG 48 HE ARG 48 11.464 10.705 15.690
358 HH11 ARG 48 HH22 ARG 48 13.228 11.887 12.853
359 HH12 ARG 48 HH21 ARG 48 13.581 13.428 13.561
360 HH22 ARG 48 HH1 ARG 48 12.809 13.906 15.779
361 H ARG 49 HN ARG 49 12.893 5.571 12.772
362 HA ARG 49 HA ARG 49 13.115 7.511 10.806
363 HB2 ARG 49 HB2 ARG 49 15.596 7.118 11.310
364 HB3 ARG 49 HB3 ARG 49 15.391 5.468 10.757
365 HG2 ARG 49 HG2 ARG 49 14.587 7.821 9.003
366 HG3 ARG 49 HG3 ARG 49 16.243 7.248 9.043
367 HD2 ARG 49 HD2 ARG 49 14.535 4.940 8.757
368 HD3 ARG 49 HD3 ARG 49 14.000 6.138 7.596
369 HE ARG 49 HE ARG 49 16.611 4.770 7.634
370 HH11 ARG 49 HH22 ARG 49 14.723 7.462 6.313
371 HH12 ARG 49 HH21 ARG 49 15.756 7.675 4.939
372 HH22 ARG 49 HH1 ARG 49 17.661 6.246 4.670
373 H CYS 50 HN CYS 50 12.444 6.644 8.693
374 HA CYS 50 HA CYS 50 11.839 3.796 8.690
375 HB2 CYS 50 HB2 CYS 50 9.783 5.911 8.018
376 HB3 CYS 50 HB3 CYS 50 9.571 4.175 7.896
377 H TRP 51 HN TRP 51 12.093 2.894 6.611
378 HA TRP 51 HA TRP 51 12.907 4.813 4.540
379 HB2 TRP 51 HB2 TRP 51 14.771 3.520 4.973
380 HB3 TRP 51 HB3 TRP 51 13.841 2.065 5.270
381 HD1 TRP 51 HD1 TRP 51 15.786 3.744 2.553
382 HE1 TRP 51 HE1 TRP 51 15.616 2.488 0.239
383 HE3 TRP 51 HE3 TRP 51 11.927 0.712 3.885
384 HZ2 TRP 51 HZ2 TRP 51 13.925 0.414 -0.753
385 HZ3 TRP 51 HZ3 TRP 51 11.076 -0.899 2.184
386 HH2 TRP 51 HH2 TRP 51 12.011 -1.077 -0.067
Start of MODEL 11
1 H1 ARG 1 HN ARG 1 10.147 -6.926 1.594
2 HA ARG 1 HA ARG 1 7.296 -6.668 1.720
3 HB2 ARG 1 HB2 ARG 1 6.902 -8.121 3.519
4 HB3 ARG 1 HB3 ARG 1 8.138 -9.015 2.657
5 HG2 ARG 1 HG2 ARG 1 8.525 -7.235 5.103
6 HG3 ARG 1 HG3 ARG 1 8.750 -8.971 5.012
7 HD2 ARG 1 HD2 ARG 1 10.471 -8.170 3.027
8 HD3 ARG 1 HD3 ARG 1 10.555 -6.772 4.080
9 HE ARG 1 HE ARG 1 11.750 -8.056 5.618
10 HH11 ARG 1 HH22 ARG 1 9.959 -10.251 3.490
11 HH12 ARG 1 HH21 ARG 1 10.666 -11.681 4.165
12 HH22 ARG 1 HH1 ARG 1 12.265 -11.476 5.938
13 H TRP 2 HN TRP 2 6.850 -5.819 4.248
14 HA TRP 2 HA TRP 2 9.032 -3.983 4.924
15 HB2 TRP 2 HB2 TRP 2 6.241 -2.953 5.041
16 HB3 TRP 2 HB3 TRP 2 7.756 -2.093 4.842
17 HD1 TRP 2 HD1 TRP 2 4.921 -3.546 2.815
18 HE1 TRP 2 HE1 TRP 2 5.255 -3.193 0.221
19 HE3 TRP 2 HE3 TRP 2 9.766 -2.029 3.112
20 HZ2 TRP 2 HZ2 TRP 2 7.458 -2.339 -1.380
21 HZ3 TRP 2 HZ3 TRP 2 10.935 -1.455 0.987
22 HH2 TRP 2 HH2 TRP 2 9.860 -1.590 -1.204
23 H CYS 3 HN CYS 3 9.203 -3.603 7.178
24 HA CYS 3 HA CYS 3 7.126 -4.686 8.871
25 HB2 CYS 3 HB2 CYS 3 9.940 -5.774 8.826
26 HB3 CYS 3 HB3 CYS 3 8.896 -5.919 10.226
27 H VAL 4 HN VAL 4 8.298 -4.397 11.337
28 HA VAL 4 HA VAL 4 9.745 -1.872 11.326
29 HB VAL 4 HB VAL 4 8.186 -0.646 12.423
30 HG11 VAL 4 HG11 VAL 4 7.197 -1.107 10.276
31 HG12 VAL 4 HG12 VAL 4 6.511 -2.640 10.865
32 HG13 VAL 4 HG13 VAL 4 5.902 -1.092 11.497
33 HG21 VAL 4 HG21 VAL 4 6.209 -1.788 13.666
34 HG22 VAL 4 HG22 VAL 4 7.204 -3.260 13.559
35 HG23 VAL 4 HG23 VAL 4 7.828 -1.824 14.405
36 H TYR 5 HN TYR 5 11.346 -1.889 12.841
37 HA TYR 5 HA TYR 5 11.136 -3.963 14.921
38 HB2 TYR 5 HB2 TYR 5 13.327 -2.943 13.052
39 HB3 TYR 5 HB3 TYR 5 13.808 -3.590 14.608
40 HD1 TYR 5 HD2 TYR 5 12.243 -5.921 15.079
41 HD2 TYR 5 HD1 TYR 5 13.726 -4.452 11.345
42 HE1 TYR 5 HE2 TYR 5 12.170 -8.273 14.117
43 HE2 TYR 5 HE1 TYR 5 13.649 -6.809 10.395
44 HH TYR 5 HH TYR 5 11.941 -9.097 11.395
45 H ALA 6 HN ALA 6 11.173 -3.214 16.981
46 HA ALA 6 HA ALA 6 12.406 -0.580 17.405
47 HB1 ALA 6 HB1 ALA 6 10.404 -0.953 19.357
48 HB2 ALA 6 HB2 ALA 6 10.365 0.170 17.976
49 HB3 ALA 6 HB3 ALA 6 9.665 -1.459 17.819
50 H TYR 7 HN TYR 7 13.557 -0.324 19.383
51 HA TYR 7 HA TYR 7 13.756 -2.699 21.068
52 HB2 TYR 7 HB2 TYR 7 15.530 -2.742 19.234
53 HB3 TYR 7 HB3 TYR 7 16.036 -1.132 19.706
54 HD1 TYR 7 HD1 TYR 7 16.800 -0.868 22.224
55 HD2 TYR 7 HD2 TYR 7 16.638 -4.592 20.124
56 HE1 TYR 7 HE1 TYR 7 18.452 -1.878 23.872
57 HE2 TYR 7 HE2 TYR 7 18.291 -5.589 21.779
58 HH TYR 7 HH TYR 7 20.040 -4.789 23.276
59 H VAL 8 HN VAL 8 13.203 -1.921 23.047
60 HA VAL 8 HA VAL 8 14.270 0.723 23.759
61 HB VAL 8 HB VAL 8 11.913 -0.672 25.018
62 HG11 VAL 8 HG11 VAL 8 11.806 2.211 24.951
63 HG12 VAL 8 HG12 VAL 8 11.829 1.114 26.352
64 HG13 VAL 8 HG13 VAL 8 13.359 1.677 25.638
65 HG21 VAL 8 HG21 VAL 8 11.546 -0.396 22.558
66 HG22 VAL 8 HG22 VAL 8 10.419 0.543 23.565
67 HG23 VAL 8 HG23 VAL 8 11.784 1.356 22.762
68 H ARG 9 HN ARG 9 15.685 0.859 25.447
69 HA ARG 9 HA ARG 9 15.731 -1.335 27.309
70 HB2 ARG 9 HB2 ARG 9 17.445 -2.214 25.967
71 HB3 ARG 9 HB3 ARG 9 17.950 -0.638 25.389
72 HG2 ARG 9 HG2 ARG 9 19.041 -0.120 27.509
73 HG3 ARG 9 HG3 ARG 9 18.348 -1.534 28.278
74 HD2 ARG 9 HD2 ARG 9 20.081 -2.821 27.572
75 HD3 ARG 9 HD3 ARG 9 19.760 -2.400 25.902
76 HE ARG 9 HE ARG 9 21.036 -0.148 26.791
77 HH11 ARG 9 HH22 ARG 9 21.858 -3.582 27.084
78 HH12 ARG 9 HH21 ARG 9 23.566 -3.297 27.124
79 HH22 ARG 9 HH1 ARG 9 24.385 -1.049 26.981
80 H ILE 10 HN ILE 10 15.677 -0.372 29.315
81 HA ILE 10 HA ILE 10 17.443 1.855 29.828
82 HB ILE 10 HB ILE 10 14.579 2.277 30.557
83 HG12 ILE 10 HG12 ILE 10 15.752 3.009 27.858
84 HG13 ILE 10 HG13 ILE 10 14.563 1.752 28.135
85 HG21 ILE 10 HG21 ILE 10 16.056 4.595 29.705
86 HG22 ILE 10 HG22 ILE 10 15.356 4.217 31.297
87 HG23 ILE 10 HG23 ILE 10 17.003 3.673 30.897
88 HD11 ILE 10 HD11 ILE 10 13.083 3.557 29.225
89 HD12 ILE 10 HD12 ILE 10 14.232 4.747 28.568
90 HD13 ILE 10 HD13 ILE 10 13.318 3.690 27.465
91 H ARG 11 HN ARG 11 17.728 2.230 32.145
92 HA ARG 11 HA ARG 11 18.037 1.547 34.171
93 HB2 ARG 11 HB2 ARG 11 15.233 0.598 33.639
94 HB3 ARG 11 HB3 ARG 11 16.009 -0.049 35.071
95 HG2 ARG 11 HG2 ARG 11 15.488 1.872 36.155
96 HG3 ARG 11 HG3 ARG 11 16.626 2.714 35.122
97 HD2 ARG 11 HD2 ARG 11 14.961 3.523 33.695
98 HD3 ARG 11 HD3 ARG 11 13.905 2.151 33.964
99 HE ARG 11 HE ARG 11 14.169 3.590 36.428
100 HH11 ARG 11 HH22 ARG 11 12.693 3.949 33.226
101 HH12 ARG 11 HH21 ARG 11 11.433 4.996 33.788
102 HH22 ARG 11 HH1 ARG 11 11.343 5.584 36.110
103 H GLY 12 HN GLY 12 16.143 -1.398 33.260
104 HA2 GLY 12 HA1 GLY 12 18.515 -2.980 32.807
105 HA3 GLY 12 HA2 GLY 12 17.733 -3.298 34.343
106 H VAL 13 HN VAL 13 15.822 -2.175 31.566
107 HA VAL 13 HA VAL 13 14.809 -4.916 31.254
108 HB VAL 13 HB VAL 13 13.250 -2.324 31.198
109 HG11 VAL 13 HG11 VAL 13 12.459 -5.206 30.727
110 HG12 VAL 13 HG12 VAL 13 11.280 -3.964 31.210
111 HG13 VAL 13 HG13 VAL 13 12.182 -3.790 29.685
112 HG21 VAL 13 HG21 VAL 13 13.862 -4.264 33.349
113 HG22 VAL 13 HG22 VAL 13 13.390 -2.550 33.443
114 HG23 VAL 13 HG23 VAL 13 12.149 -3.803 33.201
115 H LEU 14 HN LEU 14 13.967 -5.417 29.088
116 HA LEU 14 HA LEU 14 14.819 -3.541 27.024
117 HB2 LEU 14 HB2 LEU 14 16.735 -4.957 27.332
118 HB3 LEU 14 HB3 LEU 14 15.747 -6.403 27.263
119 HG LEU 14 HG LEU 14 15.505 -6.318 24.970
120 HD11 LEU 14 HD11 LEU 14 14.527 -4.183 24.663
121 HD12 LEU 14 HD12 LEU 14 16.018 -3.344 25.154
122 HD13 LEU 14 HD13 LEU 14 15.963 -4.233 23.613
123 HD21 LEU 14 HD21 LEU 14 18.193 -5.029 25.513
124 HD22 LEU 14 HD22 LEU 14 17.821 -6.770 25.473
125 HD23 LEU 14 HD23 LEU 14 17.719 -5.803 23.981
126 H VAL 15 HN VAL 15 12.976 -3.120 25.936
127 HA VAL 15 HA VAL 15 11.151 -5.387 25.524
128 HB VAL 15 HB VAL 15 10.302 -2.528 25.311
129 HG11 VAL 15 HG11 VAL 15 8.243 -3.405 25.249
130 HG12 VAL 15 HG12 VAL 15 9.027 -4.993 25.063
131 HG13 VAL 15 HG13 VAL 15 8.549 -4.420 26.679
132 HG21 VAL 15 HG21 VAL 15 11.031 -2.133 27.411
133 HG22 VAL 15 HG22 VAL 15 9.622 -3.109 27.891
134 HG23 VAL 15 HG23 VAL 15 11.230 -3.863 27.780
135 H ARG 16 HN ARG 16 11.997 -6.193 23.590
136 HA ARG 16 HA ARG 16 12.498 -4.295 21.497
137 HB2 ARG 16 HB2 ARG 16 12.902 -7.296 21.806
138 HB3 ARG 16 HB3 ARG 16 13.053 -6.540 20.232
139 HG2 ARG 16 HG2 ARG 16 14.658 -4.845 21.490
140 HG3 ARG 16 HG3 ARG 16 14.748 -6.102 22.707
141 HD2 ARG 16 HD2 ARG 16 16.590 -6.385 21.099
142 HD3 ARG 16 HD3 ARG 16 15.489 -7.741 20.967
143 HE ARG 16 HE ARG 16 14.749 -5.615 19.134
144 HH11 ARG 16 HH22 ARG 16 17.021 -8.301 19.558
145 HH12 ARG 16 HH21 ARG 16 17.273 -8.519 17.858
146 HH22 ARG 16 HH1 ARG 16 16.122 -7.098 16.309
147 H TYR 17 HN TYR 17 10.612 -3.545 20.526
148 HA TYR 17 HA TYR 17 8.403 -5.391 20.153
149 HB2 TYR 17 HB2 TYR 17 8.613 -2.755 20.849
150 HB3 TYR 17 HB3 TYR 17 8.613 -2.536 19.110
151 HD1 TYR 17 HD1 TYR 17 6.638 -4.104 21.872
152 HD2 TYR 17 HD2 TYR 17 6.586 -2.447 17.928
153 HE1 TYR 17 HE1 TYR 17 4.098 -4.215 21.851
154 HE2 TYR 17 HE2 TYR 17 4.046 -2.563 17.921
155 HH TYR 17 HH TYR 17 2.241 -2.558 19.652
156 H ARG 18 HN ARG 18 7.286 -5.493 18.006
157 HA ARG 18 HA ARG 18 8.952 -4.841 15.772
158 HB2 ARG 18 HB2 ARG 18 8.501 -7.333 14.927
159 HB3 ARG 18 HB3 ARG 18 9.885 -6.982 15.943
160 HG2 ARG 18 HG2 ARG 18 8.412 -7.551 17.969
161 HG3 ARG 18 HG3 ARG 18 7.198 -8.116 16.838
162 HD2 ARG 18 HD2 ARG 18 9.960 -9.191 16.403
163 HD3 ARG 18 HD3 ARG 18 9.169 -9.717 17.876
164 HE ARG 18 HE ARG 18 7.382 -9.916 15.593
165 HH11 ARG 18 HH22 ARG 18 10.065 -11.556 17.227
166 HH12 ARG 18 HH21 ARG 18 9.643 -13.121 16.616
167 HH22 ARG 18 HH1 ARG 18 7.735 -13.346 15.183
168 H ARG 19 HN ARG 19 7.672 -5.852 13.656
169 HA ARG 19 HA ARG 19 4.977 -6.310 13.875
170 HB2 ARG 19 HB2 ARG 19 5.267 -3.739 14.580
171 HB3 ARG 19 HB3 ARG 19 5.362 -3.485 12.849
172 HG2 ARG 19 HG2 ARG 19 3.124 -5.225 13.866
173 HG3 ARG 19 HG3 ARG 19 3.006 -3.505 14.177
174 HD2 ARG 19 HD2 ARG 19 3.837 -3.779 11.445
175 HD3 ARG 19 HD3 ARG 19 2.541 -4.933 11.688
176 HE ARG 19 HE ARG 19 1.033 -3.158 11.937
177 HH11 ARG 19 HH22 ARG 19 4.330 -1.918 12.322
178 HH12 ARG 19 HH21 ARG 19 3.834 -0.258 12.360
179 HH22 ARG 19 HH1 ARG 19 1.506 0.276 12.160
180 H CYS 20 HN CYS 20 3.916 -6.336 11.668
181 HA CYS 20 HA CYS 20 5.719 -5.850 9.460
182 HB2 CYS 20 HB2 CYS 20 4.753 -8.586 10.250
183 HB3 CYS 20 HB3 CYS 20 5.057 -8.198 8.568
184 H TRP 21 HN TRP 21 4.496 -5.838 7.379
185 HA TRP 21 HA TRP 21 1.667 -5.263 7.877
186 HB2 TRP 21 HB2 TRP 21 2.652 -3.370 6.968
187 HB3 TRP 21 HB3 TRP 21 3.677 -4.285 5.881
188 HD1 TRP 21 HD1 TRP 21 0.200 -2.735 6.070
189 HE1 TRP 21 HE1 TRP 21 -1.072 -2.888 3.764
190 HE3 TRP 21 HE3 TRP 21 3.537 -5.855 3.838
191 HZ2 TRP 21 HZ2 TRP 21 -0.552 -4.266 1.319
192 HZ3 TRP 21 HZ3 TRP 21 3.080 -6.557 1.490
193 HH2 TRP 21 HH2 TRP 21 1.118 -5.813 0.236
194 H1 ARG 31 HN ARG 31 5.765 -0.445 6.802
195 HA ARG 31 HA ARG 31 7.444 -0.146 4.455
196 HB2 ARG 31 HB2 ARG 31 7.571 1.957 6.623
197 HB3 ARG 31 HB3 ARG 31 7.984 2.102 4.926
198 HG2 ARG 31 HG2 ARG 31 5.149 1.815 6.032
199 HG3 ARG 31 HG3 ARG 31 5.871 3.313 5.480
200 HD2 ARG 31 HD2 ARG 31 4.844 2.738 3.495
201 HD3 ARG 31 HD3 ARG 31 6.312 1.810 3.257
202 HE ARG 31 HE ARG 31 5.126 -0.195 3.718
203 HH11 ARG 31 HH22 ARG 31 3.066 2.630 4.294
204 HH12 ARG 31 HH21 ARG 31 1.608 1.701 4.396
205 HH22 ARG 31 HH1 ARG 31 1.712 -0.679 4.133
206 H TRP 32 HN TRP 32 9.602 1.157 6.007
207 HA TRP 32 HA TRP 32 10.317 -1.102 7.751
208 HB2 TRP 32 HB2 TRP 32 11.821 0.386 5.666
209 HB3 TRP 32 HB3 TRP 32 12.703 -0.050 7.116
210 HD1 TRP 32 HD1 TRP 32 11.866 -1.471 3.833
211 HE1 TRP 32 HE1 TRP 32 12.261 -4.075 3.660
212 HE3 TRP 32 HE3 TRP 32 12.280 -2.271 8.837
213 HZ2 TRP 32 HZ2 TRP 32 12.692 -6.130 5.592
214 HZ3 TRP 32 HZ3 TRP 32 12.688 -4.605 9.610
215 HH2 TRP 32 HH2 TRP 32 12.893 -6.499 8.078
216 H CYS 33 HN CYS 33 9.266 -0.023 9.570
217 HA CYS 33 HA CYS 33 10.280 2.592 10.259
218 HB2 CYS 33 HB2 CYS 33 8.035 0.864 11.143
219 HB3 CYS 33 HB3 CYS 33 8.729 1.920 12.356
220 H VAL 34 HN VAL 34 11.383 2.975 12.342
221 HA VAL 34 HA VAL 34 12.328 0.642 13.760
222 HB VAL 34 HB VAL 34 14.608 0.946 13.373
223 HG11 VAL 34 HG11 VAL 34 13.445 -0.153 11.502
224 HG12 VAL 34 HG12 VAL 34 13.258 1.422 10.693
225 HG13 VAL 34 HG13 VAL 34 14.882 0.739 10.949
226 HG21 VAL 34 HG21 VAL 34 13.897 3.596 12.079
227 HG22 VAL 34 HG22 VAL 34 14.828 3.325 13.572
228 HG23 VAL 34 HG23 VAL 34 15.512 2.853 11.998
229 H TYR 35 HN TYR 35 12.024 1.137 15.863
230 HA TYR 35 HA TYR 35 12.705 3.849 16.720
231 HB2 TYR 35 HB2 TYR 35 10.143 3.268 16.197
232 HB3 TYR 35 HB3 TYR 35 10.233 2.292 17.650
233 HD1 TYR 35 HD1 TYR 35 10.490 3.344 19.863
234 HD2 TYR 35 HD2 TYR 35 10.150 5.702 16.310
235 HE1 TYR 35 HE1 TYR 35 9.988 5.403 21.269
236 HE2 TYR 35 HE2 TYR 35 9.649 7.752 17.727
237 HH TYR 35 HH TYR 35 10.211 8.463 20.125
238 H ALA 36 HN ALA 36 14.299 3.562 18.199
239 HA ALA 36 HA ALA 36 13.866 1.453 20.193
240 HB1 ALA 36 HB1 ALA 36 15.516 0.537 18.730
241 HB2 ALA 36 HB2 ALA 36 16.373 2.092 18.603
242 HB3 ALA 36 HB3 ALA 36 16.409 1.178 20.130
243 H TYR 37 HN TYR 37 14.502 1.999 22.320
244 HA TYR 37 HA TYR 37 15.483 4.748 22.647
245 HB2 TYR 37 HB2 TYR 37 12.913 4.250 22.981
246 HB3 TYR 37 HB3 TYR 37 13.393 3.271 24.353
247 HD1 TYR 37 HD2 TYR 37 14.721 4.425 26.245
248 HD2 TYR 37 HD1 TYR 37 12.598 6.574 23.215
249 HE1 TYR 37 HE2 TYR 37 14.696 6.495 27.720
250 HE2 TYR 37 HE1 TYR 37 12.581 8.637 24.701
251 HH TYR 37 HH TYR 37 13.714 8.480 28.016
252 H VAL 38 HN VAL 38 17.611 3.793 22.986
253 HA VAL 38 HA VAL 38 17.807 2.112 25.366
254 HB VAL 38 HB VAL 38 19.816 2.841 23.226
255 HG11 VAL 38 HG11 VAL 38 20.014 1.059 25.664
256 HG12 VAL 38 HG12 VAL 38 21.096 0.887 24.261
257 HG13 VAL 38 HG13 VAL 38 21.071 2.408 25.185
258 HG21 VAL 38 HG21 VAL 38 17.784 1.312 22.681
259 HG22 VAL 38 HG22 VAL 38 19.417 0.775 22.220
260 HG23 VAL 38 HG23 VAL 38 18.636 0.103 23.672
261 H ARG 39 HN ARG 39 18.946 2.751 27.216
262 HA ARG 39 HA ARG 39 20.228 5.313 27.140
263 HB2 ARG 39 HB2 ARG 39 17.792 5.770 27.698
264 HB3 ARG 39 HB3 ARG 39 17.960 4.755 29.117
265 HG2 ARG 39 HG2 ARG 39 19.980 6.318 29.734
266 HG3 ARG 39 HG3 ARG 39 19.311 7.416 28.543
267 HD2 ARG 39 HD2 ARG 39 17.154 6.475 30.241
268 HD3 ARG 39 HD3 ARG 39 18.463 7.037 31.262
269 HE ARG 39 HE ARG 39 16.880 8.670 29.372
270 HH11 ARG 39 HH22 ARG 39 19.713 8.508 31.494
271 HH12 ARG 39 HH21 ARG 39 19.885 10.228 31.603
272 HH22 ARG 39 HH1 ARG 39 18.341 11.638 30.431
273 H ILE 40 HN ILE 40 22.114 5.121 28.321
274 HA ILE 40 HA ILE 40 22.080 3.354 30.644
275 HB ILE 40 HB ILE 40 24.212 3.234 28.511
276 HG12 ILE 40 HG12 ILE 40 23.001 0.758 28.582
277 HG13 ILE 40 HG13 ILE 40 21.632 1.841 28.740
278 HG21 ILE 40 HG21 ILE 40 24.764 1.100 29.831
279 HG22 ILE 40 HG22 ILE 40 25.223 2.666 30.540
280 HG23 ILE 40 HG23 ILE 40 23.779 1.810 31.132
281 HD11 ILE 40 HD11 ILE 40 22.285 1.280 26.344
282 HD12 ILE 40 HD12 ILE 40 22.209 3.021 26.704
283 HD13 ILE 40 HD13 ILE 40 23.785 2.200 26.611
284 H ARG 41 HN ARG 41 23.961 3.779 32.110
285 HA ARG 41 HA ARG 41 25.068 5.175 33.335
286 HB2 ARG 41 HB2 ARG 41 25.917 6.161 30.578
287 HB3 ARG 41 HB3 ARG 41 26.598 6.855 32.035
288 HG2 ARG 41 HG2 ARG 41 26.730 3.929 31.176
289 HG3 ARG 41 HG3 ARG 41 28.066 5.060 31.247
290 HD2 ARG 41 HD2 ARG 41 26.576 3.746 33.533
291 HD3 ARG 41 HD3 ARG 41 28.305 3.840 33.262
292 HE ARG 41 HE ARG 41 26.619 5.878 34.532
293 HH11 ARG 41 HH22 ARG 41 29.702 5.280 32.892
294 HH12 ARG 41 HH21 ARG 41 30.479 6.668 33.577
295 HH22 ARG 41 HH1 ARG 41 29.249 8.082 35.071
296 H GLY 42 HN GLY 42 24.654 7.636 30.729
297 HA2 GLY 42 HA1 GLY 42 22.454 8.936 32.083
298 HA3 GLY 42 HA2 GLY 42 23.986 9.775 32.224
299 H VAL 43 HN VAL 43 23.347 7.765 29.372
300 HA VAL 43 HA VAL 43 22.817 10.212 27.837
301 HB VAL 43 HB VAL 43 24.382 7.986 26.627
302 HG11 VAL 43 HG11 VAL 43 25.495 10.487 26.019
303 HG12 VAL 43 HG12 VAL 43 24.409 9.515 24.998
304 HG13 VAL 43 HG13 VAL 43 23.738 10.764 26.073
305 HG21 VAL 43 HG21 VAL 43 26.499 9.177 27.460
306 HG22 VAL 43 HG22 VAL 43 25.457 9.892 28.713
307 HG23 VAL 43 HG23 VAL 43 25.644 8.125 28.613
308 H LEU 44 HN LEU 44 20.945 10.107 26.707
309 HA LEU 44 HA LEU 44 19.752 7.453 26.407
310 HB2 LEU 44 HB2 LEU 44 18.186 8.668 27.498
311 HB3 LEU 44 HB3 LEU 44 18.723 10.196 26.830
312 HG LEU 44 HG LEU 44 17.631 9.646 24.683
313 HD11 LEU 44 HD11 LEU 44 17.175 7.534 24.181
314 HD12 LEU 44 HD12 LEU 44 17.482 7.015 25.856
315 HD13 LEU 44 HD13 LEU 44 15.861 7.578 25.381
316 HD21 LEU 44 HD21 LEU 44 15.721 9.407 27.021
317 HD22 LEU 44 HD22 LEU 44 16.469 10.925 26.472
318 HD23 LEU 44 HD23 LEU 44 15.368 10.035 25.394
319 H VAL 45 HN VAL 45 19.961 6.468 24.478
320 HA VAL 45 HA VAL 45 20.430 8.197 22.156
321 HB VAL 45 HB VAL 45 20.930 5.241 22.244
322 HG11 VAL 45 HG11 VAL 45 22.888 6.123 20.749
323 HG12 VAL 45 HG12 VAL 45 21.240 6.026 20.082
324 HG13 VAL 45 HG13 VAL 45 21.889 7.591 20.629
325 HG21 VAL 45 HG21 VAL 45 23.360 5.977 22.860
326 HG22 VAL 45 HG22 VAL 45 22.558 7.400 23.566
327 HG23 VAL 45 HG23 VAL 45 22.151 5.769 24.149
328 H ARG 46 HN ARG 46 18.414 8.708 21.363
329 HA ARG 46 HA ARG 46 16.534 6.517 21.164
330 HB2 ARG 46 HB2 ARG 46 16.074 9.490 20.608
331 HB3 ARG 46 HB3 ARG 46 14.833 8.263 20.762
332 HG2 ARG 46 HG2 ARG 46 15.508 7.867 23.135
333 HG3 ARG 46 HG3 ARG 46 16.765 9.078 22.985
334 HD2 ARG 46 HD2 ARG 46 14.092 10.058 22.144
335 HD3 ARG 46 HD3 ARG 46 14.150 9.564 23.825
336 HE ARG 46 HE ARG 46 16.453 11.084 23.526
337 HH11 ARG 46 HH22 ARG 46 13.018 11.681 22.894
338 HH12 ARG 46 HH21 ARG 46 13.134 13.385 23.182
339 HH22 ARG 46 HH1 ARG 46 15.253 14.334 23.776
340 H TYR 47 HN TYR 47 15.492 6.015 19.102
341 HA TYR 47 HA TYR 47 16.689 7.288 16.757
342 HB2 TYR 47 HB2 TYR 47 17.941 5.166 17.381
343 HB3 TYR 47 HB3 TYR 47 16.425 4.289 17.424
344 HD1 TYR 47 HD2 TYR 47 17.027 6.805 14.810
345 HD2 TYR 47 HD1 TYR 47 17.223 2.646 15.797
346 HE1 TYR 47 HE2 TYR 47 17.289 6.225 12.348
347 HE2 TYR 47 HE1 TYR 47 17.484 2.081 13.332
348 HH TYR 47 HH TYR 47 18.464 4.039 11.130
349 H ARG 48 HN ARG 48 15.257 7.576 15.072
350 HA ARG 48 HA ARG 48 12.869 5.994 15.063
351 HB2 ARG 48 HB2 ARG 48 11.455 8.155 14.832
352 HB3 ARG 48 HB3 ARG 48 12.014 7.752 16.443
353 HG2 ARG 48 HG2 ARG 48 14.131 9.250 15.672
354 HG3 ARG 48 HG3 ARG 48 12.931 9.956 14.608
355 HD2 ARG 48 HD2 ARG 48 11.532 9.875 16.995
356 HD3 ARG 48 HD3 ARG 48 13.166 10.129 17.576
357 HE ARG 48 HE ARG 48 13.023 12.316 16.794
358 HH11 ARG 48 HH22 ARG 48 10.798 10.327 14.886
359 HH12 ARG 48 HH21 ARG 48 10.193 11.664 13.967
360 HH22 ARG 48 HH1 ARG 48 11.047 13.863 14.393
361 H ARG 49 HN ARG 49 12.274 5.579 12.931
362 HA ARG 49 HA ARG 49 12.528 7.466 10.917
363 HB2 ARG 49 HB2 ARG 49 15.009 6.576 11.400
364 HB3 ARG 49 HB3 ARG 49 14.485 5.200 10.450
365 HG2 ARG 49 HG2 ARG 49 13.943 7.962 9.360
366 HG3 ARG 49 HG3 ARG 49 15.588 7.363 9.300
367 HD2 ARG 49 HD2 ARG 49 15.102 5.794 7.684
368 HD3 ARG 49 HD3 ARG 49 13.555 5.384 8.398
369 HE ARG 49 HE ARG 49 12.512 7.126 7.154
370 HH11 ARG 49 HH22 ARG 49 16.023 7.157 6.678
371 HH12 ARG 49 HH21 ARG 49 15.953 8.222 5.314
372 HH22 ARG 49 HH1 ARG 49 13.824 9.017 4.553
373 H CYS 50 HN CYS 50 11.760 6.567 8.800
374 HA CYS 50 HA CYS 50 10.910 3.810 8.857
375 HB2 CYS 50 HB2 CYS 50 8.903 6.059 8.591
376 HB3 CYS 50 HB3 CYS 50 8.573 4.362 8.305
377 H TRP 51 HN TRP 51 10.741 2.985 6.715
378 HA TRP 51 HA TRP 51 11.248 4.964 4.598
379 HB2 TRP 51 HB2 TRP 51 12.599 2.372 5.212
380 HB3 TRP 51 HB3 TRP 51 12.396 2.833 3.534
381 HD1 TRP 51 HD1 TRP 51 13.315 5.640 3.162
382 HE1 TRP 51 HE1 TRP 51 15.626 6.687 3.888
383 HE3 TRP 51 HE3 TRP 51 14.371 2.162 6.718
384 HZ2 TRP 51 HZ2 TRP 51 17.592 5.960 5.823
385 HZ3 TRP 51 HZ3 TRP 51 16.508 2.404 7.980
386 HH2 TRP 51 HH2 TRP 51 18.092 4.222 7.581
Start of MODEL 12
1 H1 ARG 1 HN ARG 1 9.914 -6.791 1.459
2 HA ARG 1 HA ARG 1 7.116 -5.989 1.486
3 HB2 ARG 1 HB2 ARG 1 8.684 -8.032 3.056
4 HB3 ARG 1 HB3 ARG 1 7.385 -7.208 3.896
5 HG2 ARG 1 HG2 ARG 1 6.617 -8.124 1.183
6 HG3 ARG 1 HG3 ARG 1 7.090 -9.437 2.242
7 HD2 ARG 1 HD2 ARG 1 5.454 -7.740 3.841
8 HD3 ARG 1 HD3 ARG 1 4.647 -7.828 2.287
9 HE ARG 1 HE ARG 1 4.013 -9.987 2.874
10 HH11 ARG 1 HH22 ARG 1 7.141 -9.322 4.400
11 HH12 ARG 1 HH21 ARG 1 7.245 -10.879 5.152
12 HH22 ARG 1 HH1 ARG 1 5.476 -12.461 4.824
13 H TRP 2 HN TRP 2 6.534 -5.105 3.881
14 HA TRP 2 HA TRP 2 8.646 -3.170 4.543
15 HB2 TRP 2 HB2 TRP 2 5.778 -2.722 5.242
16 HB3 TRP 2 HB3 TRP 2 7.057 -1.561 4.947
17 HD1 TRP 2 HD1 TRP 2 4.005 -2.220 3.380
18 HE1 TRP 2 HE1 TRP 2 3.926 -1.952 0.756
19 HE3 TRP 2 HE3 TRP 2 9.036 -2.459 2.678
20 HZ2 TRP 2 HZ2 TRP 2 5.932 -1.871 -1.273
21 HZ3 TRP 2 HZ3 TRP 2 9.893 -2.277 0.345
22 HH2 TRP 2 HH2 TRP 2 8.430 -1.993 -1.593
23 H CYS 3 HN CYS 3 9.556 -3.404 6.546
24 HA CYS 3 HA CYS 3 7.998 -4.921 8.510
25 HB2 CYS 3 HB2 CYS 3 10.804 -5.278 7.597
26 HB3 CYS 3 HB3 CYS 3 10.507 -5.435 9.316
27 H VAL 4 HN VAL 4 8.938 -4.418 10.836
28 HA VAL 4 HA VAL 4 10.132 -1.793 11.033
29 HB VAL 4 HB VAL 4 8.388 -0.730 12.136
30 HG11 VAL 4 HG11 VAL 4 7.988 -0.899 9.717
31 HG12 VAL 4 HG12 VAL 4 7.054 -2.392 9.971
32 HG13 VAL 4 HG13 VAL 4 6.458 -0.847 10.625
33 HG21 VAL 4 HG21 VAL 4 7.313 -3.495 12.591
34 HG22 VAL 4 HG22 VAL 4 7.552 -2.159 13.743
35 HG23 VAL 4 HG23 VAL 4 6.190 -2.114 12.597
36 H TYR 5 HN TYR 5 11.730 -2.056 12.496
37 HA TYR 5 HA TYR 5 11.271 -4.044 14.615
38 HB2 TYR 5 HB2 TYR 5 13.582 -3.057 12.904
39 HB3 TYR 5 HB3 TYR 5 13.979 -3.560 14.534
40 HD1 TYR 5 HD1 TYR 5 12.080 -5.858 14.873
41 HD2 TYR 5 HD2 TYR 5 14.548 -4.730 11.566
42 HE1 TYR 5 HE1 TYR 5 12.163 -8.279 14.100
43 HE2 TYR 5 HE2 TYR 5 14.623 -7.154 10.804
44 HH TYR 5 HH TYR 5 14.023 -9.184 11.207
45 H ALA 6 HN ALA 6 11.357 -3.409 16.735
46 HA ALA 6 HA ALA 6 12.359 -0.694 17.240
47 HB1 ALA 6 HB1 ALA 6 9.678 -1.769 17.563
48 HB2 ALA 6 HB2 ALA 6 10.343 -1.259 19.133
49 HB3 ALA 6 HB3 ALA 6 10.260 -0.102 17.783
50 H TYR 7 HN TYR 7 13.508 -0.420 19.196
51 HA TYR 7 HA TYR 7 13.797 -2.791 20.875
52 HB2 TYR 7 HB2 TYR 7 15.579 -2.706 19.027
53 HB3 TYR 7 HB3 TYR 7 16.033 -1.106 19.582
54 HD1 TYR 7 HD2 TYR 7 16.810 -0.917 22.079
55 HD2 TYR 7 HD1 TYR 7 16.669 -4.589 19.888
56 HE1 TYR 7 HE2 TYR 7 18.466 -1.958 23.703
57 HE2 TYR 7 HE1 TYR 7 18.326 -5.618 21.520
58 HH TYR 7 HH TYR 7 20.146 -3.791 23.630
59 H VAL 8 HN VAL 8 13.279 -2.090 22.886
60 HA VAL 8 HA VAL 8 14.167 0.619 23.601
61 HB VAL 8 HB VAL 8 11.771 -1.014 24.439
62 HG11 VAL 8 HG11 VAL 8 12.110 -0.101 26.486
63 HG12 VAL 8 HG12 VAL 8 13.172 1.183 25.859
64 HG13 VAL 8 HG13 VAL 8 11.405 1.345 25.724
65 HG21 VAL 8 HG21 VAL 8 12.095 1.672 23.063
66 HG22 VAL 8 HG22 VAL 8 11.431 0.172 22.371
67 HG23 VAL 8 HG23 VAL 8 10.546 1.028 23.657
68 H ARG 9 HN ARG 9 15.185 0.926 25.637
69 HA ARG 9 HA ARG 9 15.513 -1.298 27.350
70 HB2 ARG 9 HB2 ARG 9 17.322 -2.108 26.136
71 HB3 ARG 9 HB3 ARG 9 17.662 -0.555 25.400
72 HG2 ARG 9 HG2 ARG 9 18.805 0.250 27.364
73 HG3 ARG 9 HG3 ARG 9 18.176 -1.048 28.359
74 HD2 ARG 9 HD2 ARG 9 19.930 -2.385 27.817
75 HD3 ARG 9 HD3 ARG 9 19.589 -2.214 26.107
76 HE ARG 9 HE ARG 9 20.804 0.164 26.602
77 HH11 ARG 9 HH22 ARG 9 21.719 -3.117 27.579
78 HH12 ARG 9 HH21 ARG 9 23.415 -2.768 27.611
79 HH22 ARG 9 HH1 ARG 9 24.170 -0.562 27.057
80 H ILE 10 HN ILE 10 15.145 -0.205 29.262
81 HA ILE 10 HA ILE 10 16.828 2.114 29.798
82 HB ILE 10 HB ILE 10 13.948 2.272 30.560
83 HG12 ILE 10 HG12 ILE 10 15.047 2.772 27.791
84 HG13 ILE 10 HG13 ILE 10 13.672 1.789 28.255
85 HG21 ILE 10 HG21 ILE 10 16.224 3.891 30.857
86 HG22 ILE 10 HG22 ILE 10 15.208 4.699 29.639
87 HG23 ILE 10 HG23 ILE 10 14.534 4.301 31.238
88 HD11 ILE 10 HD11 ILE 10 12.734 4.063 29.258
89 HD12 ILE 10 HD12 ILE 10 13.898 4.798 28.130
90 HD13 ILE 10 HD13 ILE 10 12.609 3.738 27.512
91 H ARG 11 HN ARG 11 17.234 2.449 32.059
92 HA ARG 11 HA ARG 11 17.606 1.822 34.092
93 HB2 ARG 11 HB2 ARG 11 14.999 0.245 33.803
94 HB3 ARG 11 HB3 ARG 11 15.827 0.487 35.329
95 HG2 ARG 11 HG2 ARG 11 14.239 2.426 33.703
96 HG3 ARG 11 HG3 ARG 11 14.401 2.302 35.444
97 HD2 ARG 11 HD2 ARG 11 16.763 3.232 35.229
98 HD3 ARG 11 HD3 ARG 11 16.464 3.479 33.520
99 HE ARG 11 HE ARG 11 14.399 4.674 35.215
100 HH11 ARG 11 HH22 ARG 11 17.584 5.201 33.754
101 HH12 ARG 11 HH21 ARG 11 17.459 6.928 33.805
102 HH22 ARG 11 HH1 ARG 11 15.481 7.935 34.708
103 H GLY 12 HN GLY 12 15.912 -1.233 33.104
104 HA2 GLY 12 HA1 GLY 12 18.343 -2.661 32.607
105 HA3 GLY 12 HA2 GLY 12 17.687 -3.013 34.193
106 H VAL 13 HN VAL 13 15.580 -2.078 31.471
107 HA VAL 13 HA VAL 13 14.728 -4.882 31.270
108 HB VAL 13 HB VAL 13 12.957 -2.431 31.246
109 HG11 VAL 13 HG11 VAL 13 12.554 -5.220 30.481
110 HG12 VAL 13 HG12 VAL 13 11.412 -4.695 31.742
111 HG13 VAL 13 HG13 VAL 13 11.519 -3.798 30.209
112 HG21 VAL 13 HG21 VAL 13 12.096 -3.612 33.420
113 HG22 VAL 13 HG22 VAL 13 13.717 -4.348 33.437
114 HG23 VAL 13 HG23 VAL 13 13.543 -2.577 33.486
115 H LEU 14 HN LEU 14 14.872 -5.677 29.236
116 HA LEU 14 HA LEU 14 15.232 -3.715 27.095
117 HB2 LEU 14 HB2 LEU 14 17.065 -5.247 27.408
118 HB3 LEU 14 HB3 LEU 14 15.990 -6.628 27.328
119 HG LEU 14 HG LEU 14 15.792 -6.544 25.044
120 HD11 LEU 14 HD11 LEU 14 14.837 -4.433 24.681
121 HD12 LEU 14 HD12 LEU 14 16.282 -3.575 25.267
122 HD13 LEU 14 HD13 LEU 14 16.327 -4.431 23.707
123 HD21 LEU 14 HD21 LEU 14 18.495 -5.265 25.542
124 HD22 LEU 14 HD22 LEU 14 18.116 -7.004 25.573
125 HD23 LEU 14 HD23 LEU 14 17.999 -6.094 24.047
126 H VAL 15 HN VAL 15 13.422 -3.209 25.991
127 HA VAL 15 HA VAL 15 11.462 -5.369 25.627
128 HB VAL 15 HB VAL 15 10.825 -2.440 25.461
129 HG11 VAL 15 HG11 VAL 15 9.359 -4.766 25.029
130 HG12 VAL 15 HG12 VAL 15 8.868 -4.248 26.660
131 HG13 VAL 15 HG13 VAL 15 8.702 -3.131 25.284
132 HG21 VAL 15 HG21 VAL 15 11.402 -2.166 27.611
133 HG22 VAL 15 HG22 VAL 15 10.001 -3.195 27.996
134 HG23 VAL 15 HG23 VAL 15 11.624 -3.914 27.865
135 H ARG 16 HN ARG 16 12.306 -6.223 23.699
136 HA ARG 16 HA ARG 16 12.753 -4.329 21.572
137 HB2 ARG 16 HB2 ARG 16 13.187 -7.358 21.689
138 HB3 ARG 16 HB3 ARG 16 13.642 -6.340 20.337
139 HG2 ARG 16 HG2 ARG 16 15.117 -4.999 21.903
140 HG3 ARG 16 HG3 ARG 16 14.726 -6.129 23.185
141 HD2 ARG 16 HD2 ARG 16 16.332 -6.623 20.659
142 HD3 ARG 16 HD3 ARG 16 16.778 -6.959 22.320
143 HE ARG 16 HE ARG 16 14.638 -8.609 22.046
144 HH11 ARG 16 HH22 ARG 16 17.394 -8.062 19.887
145 HH12 ARG 16 HH21 ARG 16 17.355 -9.663 19.229
146 HH22 ARG 16 HH1 ARG 16 15.696 -11.210 20.002
147 H TYR 17 HN TYR 17 11.026 -3.812 20.266
148 HA TYR 17 HA TYR 17 8.859 -5.770 20.052
149 HB2 TYR 17 HB2 TYR 17 8.883 -3.111 20.695
150 HB3 TYR 17 HB3 TYR 17 8.887 -2.929 18.952
151 HD1 TYR 17 HD1 TYR 17 6.984 -4.491 21.758
152 HD2 TYR 17 HD2 TYR 17 6.880 -3.082 17.720
153 HE1 TYR 17 HE1 TYR 17 4.458 -4.776 21.716
154 HE2 TYR 17 HE2 TYR 17 4.354 -3.372 17.691
155 HH TYR 17 HH TYR 17 2.695 -4.801 18.902
156 H ARG 18 HN ARG 18 7.820 -6.083 17.918
157 HA ARG 18 HA ARG 18 9.421 -5.310 15.673
158 HB2 ARG 18 HB2 ARG 18 9.236 -7.863 14.901
159 HB3 ARG 18 HB3 ARG 18 10.576 -7.331 15.897
160 HG2 ARG 18 HG2 ARG 18 9.848 -8.496 17.742
161 HG3 ARG 18 HG3 ARG 18 8.162 -8.116 17.448
162 HD2 ARG 18 HD2 ARG 18 7.899 -9.904 15.884
163 HD3 ARG 18 HD3 ARG 18 9.625 -10.060 15.627
164 HE ARG 18 HE ARG 18 9.354 -10.606 18.326
165 HH11 ARG 18 HH22 ARG 18 7.810 -11.911 15.416
166 HH12 ARG 18 HH21 ARG 18 7.548 -13.477 16.107
167 HH22 ARG 18 HH1 ARG 18 8.260 -13.902 18.355
168 H ARG 19 HN ARG 19 8.271 -5.945 13.554
169 HA ARG 19 HA ARG 19 5.751 -7.022 13.558
170 HB2 ARG 19 HB2 ARG 19 5.455 -4.681 14.824
171 HB3 ARG 19 HB3 ARG 19 5.486 -4.025 13.200
172 HG2 ARG 19 HG2 ARG 19 3.694 -6.394 13.717
173 HG3 ARG 19 HG3 ARG 19 3.195 -4.842 14.359
174 HD2 ARG 19 HD2 ARG 19 4.079 -4.367 11.670
175 HD3 ARG 19 HD3 ARG 19 3.063 -5.794 11.618
176 HE ARG 19 HE ARG 19 2.197 -3.072 12.188
177 HH11 ARG 19 HH22 ARG 19 1.436 -6.480 12.789
178 HH12 ARG 19 HH21 ARG 19 -0.243 -6.181 13.090
179 HH22 ARG 19 HH1 ARG 19 -1.076 -3.937 12.965
180 H CYS 20 HN CYS 20 4.723 -6.835 11.358
181 HA CYS 20 HA CYS 20 6.283 -5.430 9.380
182 HB2 CYS 20 HB2 CYS 20 6.006 -8.441 9.333
183 HB3 CYS 20 HB3 CYS 20 6.513 -7.472 7.964
184 H TRP 21 HN TRP 21 5.021 -5.087 7.431
185 HA TRP 21 HA TRP 21 2.389 -6.289 7.320
186 HB2 TRP 21 HB2 TRP 21 1.490 -3.850 6.970
187 HB3 TRP 21 HB3 TRP 21 1.564 -4.585 8.559
188 HD1 TRP 21 HD1 TRP 21 3.004 -3.299 10.368
189 HE1 TRP 21 HE1 TRP 21 4.539 -1.154 10.460
190 HE3 TRP 21 HE3 TRP 21 3.190 -2.573 5.338
191 HZ2 TRP 21 HZ2 TRP 21 5.634 0.567 8.463
192 HZ3 TRP 21 HZ3 TRP 21 4.514 -0.637 4.493
193 HH2 TRP 21 HH2 TRP 21 5.709 0.904 5.965
194 H1 ARG 31 HN ARG 31 7.089 -0.059 3.720
195 HA ARG 31 HA ARG 31 9.798 0.754 3.241
196 HB2 ARG 31 HB2 ARG 31 7.569 1.757 5.062
197 HB3 ARG 31 HB3 ARG 31 9.200 2.382 5.201
198 HG2 ARG 31 HG2 ARG 31 8.584 2.427 2.413
199 HG3 ARG 31 HG3 ARG 31 7.154 3.029 3.227
200 HD2 ARG 31 HD2 ARG 31 9.631 4.144 4.382
201 HD3 ARG 31 HD3 ARG 31 9.487 4.499 2.672
202 HE ARG 31 HE ARG 31 7.750 5.496 4.821
203 HH11 ARG 31 HH22 ARG 31 8.046 4.962 1.330
204 HH12 ARG 31 HH21 ARG 31 6.852 6.148 0.922
205 HH22 ARG 31 HH1 ARG 31 5.765 7.371 2.673
206 H TRP 32 HN TRP 32 11.034 1.294 5.520
207 HA TRP 32 HA TRP 32 10.708 -1.055 7.254
208 HB2 TRP 32 HB2 TRP 32 13.103 -0.143 5.751
209 HB3 TRP 32 HB3 TRP 32 13.358 -0.680 7.399
210 HD1 TRP 32 HD1 TRP 32 12.339 -2.044 3.954
211 HE1 TRP 32 HE1 TRP 32 12.404 -4.682 3.904
212 HE3 TRP 32 HE3 TRP 32 13.091 -2.643 8.948
213 HZ2 TRP 32 HZ2 TRP 32 12.755 -6.678 5.914
214 HZ3 TRP 32 HZ3 TRP 32 13.284 -4.970 9.822
215 HH2 TRP 32 HH2 TRP 32 13.128 -6.947 8.393
216 H CYS 33 HN CYS 33 9.782 -0.026 9.020
217 HA CYS 33 HA CYS 33 10.791 2.570 9.778
218 HB2 CYS 33 HB2 CYS 33 8.433 0.899 10.472
219 HB3 CYS 33 HB3 CYS 33 9.023 1.986 11.713
220 H VAL 34 HN VAL 34 11.606 2.949 12.018
221 HA VAL 34 HA VAL 34 12.406 0.599 13.498
222 HB VAL 34 HB VAL 34 14.775 1.300 13.537
223 HG11 VAL 34 HG11 VAL 34 15.366 0.115 11.623
224 HG12 VAL 34 HG12 VAL 34 13.690 -0.419 11.900
225 HG13 VAL 34 HG13 VAL 34 14.040 0.807 10.658
226 HG21 VAL 34 HG21 VAL 34 13.990 3.141 11.251
227 HG22 VAL 34 HG22 VAL 34 14.458 3.658 12.889
228 HG23 VAL 34 HG23 VAL 34 15.641 2.837 11.843
229 H TYR 35 HN TYR 35 12.011 1.027 15.606
230 HA TYR 35 HA TYR 35 12.423 3.772 16.529
231 HB2 TYR 35 HB2 TYR 35 9.945 2.883 15.842
232 HB3 TYR 35 HB3 TYR 35 10.043 2.063 17.388
233 HD1 TYR 35 HD2 TYR 35 10.100 3.347 19.496
234 HD2 TYR 35 HD1 TYR 35 9.705 5.301 15.710
235 HE1 TYR 35 HE2 TYR 35 9.335 5.472 20.664
236 HE2 TYR 35 HE1 TYR 35 8.941 7.419 16.891
237 HH TYR 35 HH TYR 35 8.029 7.433 20.153
238 H ALA 36 HN ALA 36 13.992 3.543 18.052
239 HA ALA 36 HA ALA 36 13.590 1.391 20.010
240 HB1 ALA 36 HB1 ALA 36 16.098 2.236 18.533
241 HB2 ALA 36 HB2 ALA 36 16.174 1.390 20.097
242 HB3 ALA 36 HB3 ALA 36 15.398 0.608 18.699
243 H TYR 37 HN TYR 37 14.176 1.926 22.183
244 HA TYR 37 HA TYR 37 14.864 4.746 22.607
245 HB2 TYR 37 HB2 TYR 37 12.318 3.958 22.789
246 HB3 TYR 37 HB3 TYR 37 12.836 3.118 24.237
247 HD1 TYR 37 HD2 TYR 37 13.959 4.529 26.097
248 HD2 TYR 37 HD1 TYR 37 11.713 6.231 22.878
249 HE1 TYR 37 HE2 TYR 37 13.634 6.662 27.442
250 HE2 TYR 37 HE1 TYR 37 11.396 8.358 24.234
251 HH TYR 37 HH TYR 37 11.394 9.059 26.506
252 H VAL 38 HN VAL 38 17.038 3.714 22.934
253 HA VAL 38 HA VAL 38 17.190 2.191 25.423
254 HB VAL 38 HB VAL 38 19.165 2.706 23.194
255 HG11 VAL 38 HG11 VAL 38 20.592 2.504 25.008
256 HG12 VAL 38 HG12 VAL 38 19.494 1.415 25.889
257 HG13 VAL 38 HG13 VAL 38 20.422 0.807 24.497
258 HG21 VAL 38 HG21 VAL 38 17.203 0.582 23.784
259 HG22 VAL 38 HG22 VAL 38 17.966 1.049 22.245
260 HG23 VAL 38 HG23 VAL 38 18.836 -0.005 23.385
261 H ARG 39 HN ARG 39 18.311 2.945 27.236
262 HA ARG 39 HA ARG 39 19.561 5.530 26.969
263 HB2 ARG 39 HB2 ARG 39 17.096 5.798 27.696
264 HB3 ARG 39 HB3 ARG 39 17.528 4.979 29.183
265 HG2 ARG 39 HG2 ARG 39 19.274 6.729 29.627
266 HG3 ARG 39 HG3 ARG 39 18.810 7.555 28.153
267 HD2 ARG 39 HD2 ARG 39 17.148 8.630 29.262
268 HD3 ARG 39 HD3 ARG 39 16.397 7.096 29.652
269 HE ARG 39 HE ARG 39 17.440 7.119 31.786
270 HH11 ARG 39 HH22 ARG 39 18.593 9.819 29.803
271 HH12 ARG 39 HH21 ARG 39 19.338 10.641 31.133
272 HH22 ARG 39 HH1 ARG 39 19.225 9.672 33.322
273 H ILE 40 HN ILE 40 21.373 5.735 28.333
274 HA ILE 40 HA ILE 40 21.614 3.961 30.601
275 HB ILE 40 HB ILE 40 23.182 3.641 28.082
276 HG12 ILE 40 HG12 ILE 40 21.454 2.040 29.781
277 HG13 ILE 40 HG13 ILE 40 21.973 1.767 28.130
278 HG21 ILE 40 HG21 ILE 40 24.888 4.283 29.691
279 HG22 ILE 40 HG22 ILE 40 24.277 3.079 30.852
280 HG23 ILE 40 HG23 ILE 40 25.005 2.546 29.317
281 HD11 ILE 40 HD11 ILE 40 23.676 1.172 30.594
282 HD12 ILE 40 HD12 ILE 40 22.743 -0.038 29.682
283 HD13 ILE 40 HD13 ILE 40 24.105 0.805 28.906
284 H ARG 41 HN ARG 41 23.537 4.551 31.949
285 HA ARG 41 HA ARG 41 24.612 6.065 33.059
286 HB2 ARG 41 HB2 ARG 41 25.309 6.957 30.226
287 HB3 ARG 41 HB3 ARG 41 26.029 7.723 31.628
288 HG2 ARG 41 HG2 ARG 41 26.096 4.700 31.327
289 HG3 ARG 41 HG3 ARG 41 27.275 5.698 30.499
290 HD2 ARG 41 HD2 ARG 41 26.923 6.427 33.356
291 HD3 ARG 41 HD3 ARG 41 27.498 4.788 33.124
292 HE ARG 41 HE ARG 41 29.005 7.209 32.655
293 HH11 ARG 41 HH22 ARG 41 28.585 3.914 31.422
294 HH12 ARG 41 HH21 ARG 41 30.186 3.821 30.769
295 HH22 ARG 41 HH1 ARG 41 31.659 5.698 30.999
296 H GLY 42 HN GLY 42 23.961 8.339 30.329
297 HA2 GLY 42 HA1 GLY 42 21.762 9.617 31.696
298 HA3 GLY 42 HA2 GLY 42 23.256 10.532 31.742
299 H VAL 43 HN VAL 43 22.588 8.342 29.025
300 HA VAL 43 HA VAL 43 21.861 10.664 27.387
301 HB VAL 43 HB VAL 43 23.599 8.537 26.239
302 HG11 VAL 43 HG11 VAL 43 22.690 11.214 25.579
303 HG12 VAL 43 HG12 VAL 43 24.464 11.102 25.501
304 HG13 VAL 43 HG13 VAL 43 23.459 9.987 24.545
305 HG21 VAL 43 HG21 VAL 43 24.589 10.689 28.133
306 HG22 VAL 43 HG22 VAL 43 24.813 8.928 28.264
307 HG23 VAL 43 HG23 VAL 43 25.634 9.836 26.972
308 H LEU 44 HN LEU 44 19.960 10.334 26.360
309 HA LEU 44 HA LEU 44 19.035 7.566 26.171
310 HB2 LEU 44 HB2 LEU 44 17.380 8.626 27.277
311 HB3 LEU 44 HB3 LEU 44 17.754 10.195 26.591
312 HG LEU 44 HG LEU 44 16.671 9.511 24.466
313 HD11 LEU 44 HD11 LEU 44 16.575 6.910 25.843
314 HD12 LEU 44 HD12 LEU 44 15.060 7.385 25.039
315 HD13 LEU 44 HD13 LEU 44 16.573 7.300 24.106
316 HD21 LEU 44 HD21 LEU 44 14.727 10.328 25.202
317 HD22 LEU 44 HD22 LEU 44 14.480 8.979 26.336
318 HD23 LEU 44 HD23 LEU 44 15.497 10.362 26.806
319 H VAL 45 HN VAL 45 19.309 6.557 24.262
320 HA VAL 45 HA VAL 45 19.557 8.251 21.887
321 HB VAL 45 HB VAL 45 20.215 5.325 22.041
322 HG11 VAL 45 HG11 VAL 45 22.083 6.345 20.454
323 HG12 VAL 45 HG12 VAL 45 20.452 5.969 19.848
324 HG13 VAL 45 HG13 VAL 45 20.882 7.645 20.268
325 HG21 VAL 45 HG21 VAL 45 21.512 5.948 23.847
326 HG22 VAL 45 HG22 VAL 45 22.632 6.267 22.501
327 HG23 VAL 45 HG23 VAL 45 21.739 7.610 23.253
328 H ARG 46 HN ARG 46 17.630 8.578 20.891
329 HA ARG 46 HA ARG 46 15.895 6.244 20.737
330 HB2 ARG 46 HB2 ARG 46 15.039 9.177 20.590
331 HB3 ARG 46 HB3 ARG 46 13.973 7.788 20.651
332 HG2 ARG 46 HG2 ARG 46 14.956 7.200 22.917
333 HG3 ARG 46 HG3 ARG 46 15.887 8.683 22.856
334 HD2 ARG 46 HD2 ARG 46 12.836 8.536 22.717
335 HD3 ARG 46 HD3 ARG 46 13.752 8.942 24.154
336 HE ARG 46 HE ARG 46 14.384 10.616 21.819
337 HH11 ARG 46 HH22 ARG 46 12.332 10.259 24.686
338 HH12 ARG 46 HH21 ARG 46 11.954 11.947 24.778
339 HH22 ARG 46 HH1 ARG 46 12.878 13.447 23.153
340 H TYR 47 HN TYR 47 15.922 5.394 18.679
341 HA TYR 47 HA TYR 47 16.529 7.214 16.469
342 HB2 TYR 47 HB2 TYR 47 17.784 4.995 17.028
343 HB3 TYR 47 HB3 TYR 47 16.297 4.148 16.651
344 HD1 TYR 47 HD2 TYR 47 15.259 4.928 14.240
345 HD2 TYR 47 HD1 TYR 47 19.387 5.034 15.360
346 HE1 TYR 47 HE2 TYR 47 15.933 4.845 11.790
347 HE2 TYR 47 HE1 TYR 47 20.047 4.951 12.906
348 HH TYR 47 HH TYR 47 18.716 5.743 10.657
349 H ARG 48 HN ARG 48 15.125 7.552 14.753
350 HA ARG 48 HA ARG 48 12.779 5.915 14.613
351 HB2 ARG 48 HB2 ARG 48 12.602 8.944 15.022
352 HB3 ARG 48 HB3 ARG 48 11.243 7.919 14.606
353 HG2 ARG 48 HG2 ARG 48 11.019 8.007 16.931
354 HG3 ARG 48 HG3 ARG 48 11.958 6.539 16.753
355 HD2 ARG 48 HD2 ARG 48 13.644 7.435 17.979
356 HD3 ARG 48 HD3 ARG 48 13.812 8.749 16.832
357 HE ARG 48 HE ARG 48 11.568 9.026 18.731
358 HH11 ARG 48 HH22 ARG 48 14.941 9.834 18.009
359 HH12 ARG 48 HH21 ARG 48 14.976 11.190 19.086
360 HH22 ARG 48 HH1 ARG 48 13.009 11.749 20.335
361 H ARG 49 HN ARG 49 12.687 5.391 12.452
362 HA ARG 49 HA ARG 49 12.705 7.466 10.539
363 HB2 ARG 49 HB2 ARG 49 15.219 6.868 11.035
364 HB3 ARG 49 HB3 ARG 49 14.893 5.378 10.172
365 HG2 ARG 49 HG2 ARG 49 15.832 7.343 8.781
366 HG3 ARG 49 HG3 ARG 49 14.436 6.511 8.124
367 HD2 ARG 49 HD2 ARG 49 14.323 9.078 8.084
368 HD3 ARG 49 HD3 ARG 49 12.933 8.269 8.779
369 HE ARG 49 HE ARG 49 14.985 8.932 10.763
370 HH11 ARG 49 HH22 ARG 49 12.140 10.146 9.035
371 HH12 ARG 49 HH21 ARG 49 11.763 11.335 10.237
372 HH22 ARG 49 HH1 ARG 49 13.157 11.524 12.177
373 H CYS 50 HN CYS 50 12.292 6.526 8.271
374 HA CYS 50 HA CYS 50 11.539 3.745 8.253
375 HB2 CYS 50 HB2 CYS 50 9.458 5.863 7.680
376 HB3 CYS 50 HB3 CYS 50 9.252 4.128 7.548
377 H TRP 51 HN TRP 51 11.741 2.915 6.138
378 HA TRP 51 HA TRP 51 11.994 4.859 3.972
379 HB2 TRP 51 HB2 TRP 51 14.097 4.300 3.351
380 HB3 TRP 51 HB3 TRP 51 14.253 4.134 5.089
381 HD1 TRP 51 HD1 TRP 51 13.768 1.857 1.967
382 HE1 TRP 51 HE1 TRP 51 14.747 -0.553 2.409
383 HE3 TRP 51 HE3 TRP 51 14.912 2.647 6.859
384 HZ2 TRP 51 HZ2 TRP 51 15.865 -1.830 4.704
385 HZ3 TRP 51 HZ3 TRP 51 15.944 0.766 8.128
386 HH2 TRP 51 HH2 TRP 51 16.422 -1.412 7.127
Start of MODEL 13
1 H1 ARG 1 HN ARG 1 8.065 -5.346 -0.053
2 HA ARG 1 HA ARG 1 6.224 -6.013 2.100
3 HB2 ARG 1 HB2 ARG 1 7.929 -7.755 1.037
4 HB3 ARG 1 HB3 ARG 1 9.122 -6.919 2.012
5 HG2 ARG 1 HG2 ARG 1 6.525 -7.944 3.225
6 HG3 ARG 1 HG3 ARG 1 7.926 -8.984 3.061
7 HD2 ARG 1 HD2 ARG 1 8.937 -6.585 4.195
8 HD3 ARG 1 HD3 ARG 1 7.419 -6.865 5.024
9 HE ARG 1 HE ARG 1 8.309 -8.824 5.993
10 HH11 ARG 1 HH22 ARG 1 10.492 -7.642 3.464
11 HH12 ARG 1 HH21 ARG 1 11.781 -8.712 3.904
12 HH22 ARG 1 HH1 ARG 1 11.475 -10.228 5.734
13 H TRP 2 HN TRP 2 6.403 -4.883 4.047
14 HA TRP 2 HA TRP 2 8.780 -3.183 4.355
15 HB2 TRP 2 HB2 TRP 2 7.451 -1.366 5.126
16 HB3 TRP 2 HB3 TRP 2 6.871 -1.851 3.545
17 HD1 TRP 2 HD1 TRP 2 4.576 -3.662 3.775
18 HE1 TRP 2 HE1 TRP 2 2.420 -3.411 5.276
19 HE3 TRP 2 HE3 TRP 2 6.642 -0.441 7.123
20 HZ2 TRP 2 HZ2 TRP 2 1.834 -1.927 7.642
21 HZ3 TRP 2 HZ3 TRP 2 5.209 0.361 8.999
22 HH2 TRP 2 HH2 TRP 2 2.883 -0.330 9.288
23 H CYS 3 HN CYS 3 9.679 -3.266 6.417
24 HA CYS 3 HA CYS 3 8.150 -4.815 8.380
25 HB2 CYS 3 HB2 CYS 3 10.965 -5.080 7.463
26 HB3 CYS 3 HB3 CYS 3 10.673 -5.267 9.181
27 H VAL 4 HN VAL 4 9.043 -4.301 10.710
28 HA VAL 4 HA VAL 4 10.185 -1.656 10.941
29 HB VAL 4 HB VAL 4 8.408 -0.575 11.854
30 HG11 VAL 4 HG11 VAL 4 7.108 -2.595 9.999
31 HG12 VAL 4 HG12 VAL 4 6.326 -1.103 10.574
32 HG13 VAL 4 HG13 VAL 4 7.787 -1.009 9.562
33 HG21 VAL 4 HG21 VAL 4 6.360 -1.858 12.765
34 HG22 VAL 4 HG22 VAL 4 7.412 -3.293 12.712
35 HG23 VAL 4 HG23 VAL 4 7.864 -1.894 13.715
36 H TYR 5 HN TYR 5 11.649 -1.714 12.569
37 HA TYR 5 HA TYR 5 11.263 -3.809 14.600
38 HB2 TYR 5 HB2 TYR 5 13.575 -2.689 12.975
39 HB3 TYR 5 HB3 TYR 5 13.945 -3.194 14.612
40 HD1 TYR 5 HD1 TYR 5 12.153 -5.586 14.865
41 HD2 TYR 5 HD2 TYR 5 14.660 -4.295 11.648
42 HE1 TYR 5 HE1 TYR 5 12.378 -7.989 14.066
43 HE2 TYR 5 HE2 TYR 5 14.877 -6.702 10.860
44 HH TYR 5 HH TYR 5 12.848 -9.106 11.835
45 H ALA 6 HN ALA 6 11.612 -3.279 16.780
46 HA ALA 6 HA ALA 6 12.382 -0.518 17.339
47 HB1 ALA 6 HB1 ALA 6 10.322 0.089 17.997
48 HB2 ALA 6 HB2 ALA 6 9.701 -1.464 17.390
49 HB3 ALA 6 HB3 ALA 6 10.222 -1.316 19.085
50 H TYR 7 HN TYR 7 13.508 -0.283 19.295
51 HA TYR 7 HA TYR 7 13.695 -2.644 20.999
52 HB2 TYR 7 HB2 TYR 7 15.524 -2.673 19.222
53 HB3 TYR 7 HB3 TYR 7 15.988 -1.050 19.691
54 HD1 TYR 7 HD2 TYR 7 16.622 -0.769 22.264
55 HD2 TYR 7 HD1 TYR 7 16.690 -4.473 20.125
56 HE1 TYR 7 HE2 TYR 7 18.244 -1.732 23.969
57 HE2 TYR 7 HE1 TYR 7 18.311 -5.424 21.837
58 HH TYR 7 HH TYR 7 19.572 -3.390 24.449
59 H VAL 8 HN VAL 8 13.119 -1.888 22.976
60 HA VAL 8 HA VAL 8 14.151 0.764 23.713
61 HB VAL 8 HB VAL 8 11.668 -0.591 24.768
62 HG11 VAL 8 HG11 VAL 8 11.595 2.259 24.919
63 HG12 VAL 8 HG12 VAL 8 11.637 1.075 26.248
64 HG13 VAL 8 HG13 VAL 8 13.157 1.713 25.575
65 HG21 VAL 8 HG21 VAL 8 11.535 -0.129 22.300
66 HG22 VAL 8 HG22 VAL 8 10.337 0.744 23.284
67 HG23 VAL 8 HG23 VAL 8 11.774 1.596 22.669
68 H ARG 9 HN ARG 9 15.410 0.902 25.532
69 HA ARG 9 HA ARG 9 15.315 -1.299 27.376
70 HB2 ARG 9 HB2 ARG 9 17.101 -2.207 26.152
71 HB3 ARG 9 HB3 ARG 9 17.666 -0.641 25.606
72 HG2 ARG 9 HG2 ARG 9 18.596 -0.131 27.817
73 HG3 ARG 9 HG3 ARG 9 17.873 -1.570 28.507
74 HD2 ARG 9 HD2 ARG 9 19.685 -2.799 27.908
75 HD3 ARG 9 HD3 ARG 9 19.428 -2.396 26.222
76 HE ARG 9 HE ARG 9 20.618 -0.113 27.123
77 HH11 ARG 9 HH22 ARG 9 21.491 -3.517 27.576
78 HH12 ARG 9 HH21 ARG 9 23.187 -3.193 27.710
79 HH22 ARG 9 HH1 ARG 9 23.967 -0.933 27.545
80 H ILE 10 HN ILE 10 15.175 -0.352 29.385
81 HA ILE 10 HA ILE 10 16.921 1.865 29.999
82 HB ILE 10 HB ILE 10 14.026 2.301 30.580
83 HG12 ILE 10 HG12 ILE 10 15.338 3.032 27.945
84 HG13 ILE 10 HG13 ILE 10 14.133 1.778 28.159
85 HG21 ILE 10 HG21 ILE 10 16.454 3.693 31.008
86 HG22 ILE 10 HG22 ILE 10 15.519 4.625 29.815
87 HG23 ILE 10 HG23 ILE 10 14.796 4.215 31.389
88 HD11 ILE 10 HD11 ILE 10 12.816 3.832 29.361
89 HD12 ILE 10 HD12 ILE 10 13.812 4.752 28.208
90 HD13 ILE 10 HD13 ILE 10 12.697 3.497 27.617
91 H ARG 11 HN ARG 11 17.104 2.218 32.324
92 HA ARG 11 HA ARG 11 17.272 1.547 34.370
93 HB2 ARG 11 HB2 ARG 11 14.630 0.103 33.822
94 HB3 ARG 11 HB3 ARG 11 15.330 0.273 35.420
95 HG2 ARG 11 HG2 ARG 11 13.986 2.319 33.710
96 HG3 ARG 11 HG3 ARG 11 13.993 2.156 35.455
97 HD2 ARG 11 HD2 ARG 11 16.402 2.975 35.464
98 HD3 ARG 11 HD3 ARG 11 16.271 3.257 33.739
99 HE ARG 11 HE ARG 11 14.095 4.538 35.171
100 HH11 ARG 11 HH22 ARG 11 17.523 4.905 34.352
101 HH12 ARG 11 HH21 ARG 11 17.501 6.630 34.497
102 HH22 ARG 11 HH1 ARG 11 15.457 7.732 35.092
103 H GLY 12 HN GLY 12 15.530 -1.418 33.214
104 HA2 GLY 12 HA1 GLY 12 17.943 -2.948 32.926
105 HA3 GLY 12 HA2 GLY 12 17.097 -3.296 34.420
106 H VAL 13 HN VAL 13 15.332 -2.206 31.525
107 HA VAL 13 HA VAL 13 14.394 -4.965 31.152
108 HB VAL 13 HB VAL 13 12.724 -2.453 30.961
109 HG11 VAL 13 HG11 VAL 13 12.060 -4.444 29.563
110 HG12 VAL 13 HG12 VAL 13 11.833 -5.350 31.079
111 HG13 VAL 13 HG13 VAL 13 10.838 -3.913 30.743
112 HG21 VAL 13 HG21 VAL 13 12.961 -2.513 33.233
113 HG22 VAL 13 HG22 VAL 13 11.648 -3.702 33.067
114 HG23 VAL 13 HG23 VAL 13 13.328 -4.254 33.264
115 H LEU 14 HN LEU 14 13.676 -5.462 28.944
116 HA LEU 14 HA LEU 14 14.554 -3.528 26.947
117 HB2 LEU 14 HB2 LEU 14 16.505 -4.868 27.306
118 HB3 LEU 14 HB3 LEU 14 15.580 -6.353 27.210
119 HG LEU 14 HG LEU 14 15.410 -6.282 24.908
120 HD11 LEU 14 HD11 LEU 14 14.369 -4.206 24.524
121 HD12 LEU 14 HD12 LEU 14 15.775 -3.292 25.122
122 HD13 LEU 14 HD13 LEU 14 15.874 -4.165 23.574
123 HD21 LEU 14 HD21 LEU 14 17.642 -5.668 23.996
124 HD22 LEU 14 HD22 LEU 14 18.031 -4.910 25.559
125 HD23 LEU 14 HD23 LEU 14 17.717 -6.660 25.472
126 H VAL 15 HN VAL 15 12.757 -3.157 25.769
127 HA VAL 15 HA VAL 15 11.025 -5.475 25.255
128 HB VAL 15 HB VAL 15 10.100 -2.641 25.016
129 HG11 VAL 15 HG11 VAL 15 8.075 -3.580 24.852
130 HG12 VAL 15 HG12 VAL 15 8.915 -5.141 24.694
131 HG13 VAL 15 HG13 VAL 15 8.343 -4.595 26.289
132 HG21 VAL 15 HG21 VAL 15 9.313 -3.236 27.552
133 HG22 VAL 15 HG22 VAL 15 10.932 -3.976 27.525
134 HG23 VAL 15 HG23 VAL 15 10.737 -2.247 27.150
135 H ARG 16 HN ARG 16 11.985 -6.243 23.360
136 HA ARG 16 HA ARG 16 12.540 -4.319 21.306
137 HB2 ARG 16 HB2 ARG 16 12.893 -7.354 21.448
138 HB3 ARG 16 HB3 ARG 16 13.337 -6.403 20.045
139 HG2 ARG 16 HG2 ARG 16 14.829 -4.997 21.575
140 HG3 ARG 16 HG3 ARG 16 14.489 -6.140 22.860
141 HD2 ARG 16 HD2 ARG 16 15.346 -7.438 20.329
142 HD3 ARG 16 HD3 ARG 16 16.559 -6.372 21.008
143 HE ARG 16 HE ARG 16 15.410 -8.056 23.067
144 HH11 ARG 16 HH22 ARG 16 17.731 -8.096 20.389
145 HH12 ARG 16 HH21 ARG 16 18.669 -9.390 21.058
146 HH22 ARG 16 HH1 ARG 16 18.014 -10.354 23.152
147 H TYR 17 HN TYR 17 10.712 -3.607 20.213
148 HA TYR 17 HA TYR 17 8.544 -5.479 19.746
149 HB2 TYR 17 HB2 TYR 17 8.696 -2.831 20.421
150 HB3 TYR 17 HB3 TYR 17 8.777 -2.634 18.682
151 HD1 TYR 17 HD1 TYR 17 6.857 -3.303 17.249
152 HD2 TYR 17 HD2 TYR 17 6.639 -3.465 21.519
153 HE1 TYR 17 HE1 TYR 17 4.321 -3.444 17.122
154 HE2 TYR 17 HE2 TYR 17 4.104 -3.606 21.377
155 HH TYR 17 HH TYR 17 2.496 -4.188 18.406
156 H ARG 18 HN ARG 18 7.631 -5.843 17.605
157 HA ARG 18 HA ARG 18 9.272 -5.049 15.399
158 HB2 ARG 18 HB2 ARG 18 9.178 -7.603 14.629
159 HB3 ARG 18 HB3 ARG 18 10.469 -7.044 15.674
160 HG2 ARG 18 HG2 ARG 18 9.010 -7.738 17.672
161 HG3 ARG 18 HG3 ARG 18 7.923 -8.494 16.525
162 HD2 ARG 18 HD2 ARG 18 10.902 -9.153 16.673
163 HD3 ARG 18 HD3 ARG 18 9.682 -10.047 17.559
164 HE ARG 18 HE ARG 18 8.803 -9.969 14.874
165 HH11 ARG 18 HH22 ARG 18 11.562 -11.281 16.669
166 HH12 ARG 18 HH21 ARG 18 11.823 -12.585 15.559
167 HH22 ARG 18 HH1 ARG 18 10.391 -12.805 13.649
168 H ARG 19 HN ARG 19 8.198 -5.827 13.250
169 HA ARG 19 HA ARG 19 5.680 -6.907 13.242
170 HB2 ARG 19 HB2 ARG 19 5.229 -4.615 14.417
171 HB3 ARG 19 HB3 ARG 19 5.524 -3.886 12.852
172 HG2 ARG 19 HG2 ARG 19 3.567 -6.186 13.041
173 HG3 ARG 19 HG3 ARG 19 3.057 -4.599 13.581
174 HD2 ARG 19 HD2 ARG 19 4.309 -4.060 11.125
175 HD3 ARG 19 HD3 ARG 19 3.503 -5.587 10.831
176 HE ARG 19 HE ARG 19 2.220 -3.031 11.123
177 HH11 ARG 19 HH22 ARG 19 1.766 -6.436 11.993
178 HH12 ARG 19 HH21 ARG 19 0.038 -6.318 12.053
179 HH22 ARG 19 HH1 ARG 19 -1.012 -4.216 11.585
180 H CYS 20 HN CYS 20 4.827 -7.030 11.027
181 HA CYS 20 HA CYS 20 6.296 -5.602 8.997
182 HB2 CYS 20 HB2 CYS 20 6.347 -8.623 9.145
183 HB3 CYS 20 HB3 CYS 20 6.827 -7.683 7.746
184 H TRP 21 HN TRP 21 4.983 -5.316 7.142
185 HA TRP 21 HA TRP 21 2.616 -6.951 6.852
186 HB2 TRP 21 HB2 TRP 21 1.635 -5.440 8.328
187 HB3 TRP 21 HB3 TRP 21 2.513 -4.068 7.681
188 HD1 TRP 21 HD1 TRP 21 0.077 -2.820 7.312
189 HE1 TRP 21 HE1 TRP 21 -1.743 -2.915 5.405
190 HE3 TRP 21 HE3 TRP 21 1.706 -7.174 5.253
191 HZ2 TRP 21 HZ2 TRP 21 -2.285 -4.760 3.295
192 HZ3 TRP 21 HZ3 TRP 21 0.475 -8.054 3.271
193 HH2 TRP 21 HH2 TRP 21 -1.457 -6.921 2.293
194 H1 ARG 31 HN ARG 31 7.471 -0.011 3.749
195 HA ARG 31 HA ARG 31 10.132 0.991 3.200
196 HB2 ARG 31 HB2 ARG 31 9.413 2.509 5.284
197 HB3 ARG 31 HB3 ARG 31 8.825 2.871 3.673
198 HG2 ARG 31 HG2 ARG 31 7.249 0.969 5.426
199 HG3 ARG 31 HG3 ARG 31 7.129 2.693 5.715
200 HD2 ARG 31 HD2 ARG 31 6.884 1.914 2.847
201 HD3 ARG 31 HD3 ARG 31 5.603 1.299 3.872
202 HE ARG 31 HE ARG 31 6.201 4.142 4.308
203 HH11 ARG 31 HH22 ARG 31 4.268 1.827 2.449
204 HH12 ARG 31 HH21 ARG 31 3.042 2.984 2.049
205 HH22 ARG 31 HH1 ARG 31 3.248 5.235 2.843
206 H TRP 32 HN TRP 32 11.108 1.644 5.697
207 HA TRP 32 HA TRP 32 10.867 -0.771 7.329
208 HB2 TRP 32 HB2 TRP 32 13.284 0.167 5.880
209 HB3 TRP 32 HB3 TRP 32 13.511 -0.362 7.535
210 HD1 TRP 32 HD1 TRP 32 12.487 -1.754 4.089
211 HE1 TRP 32 HE1 TRP 32 12.620 -4.389 4.044
212 HE3 TRP 32 HE3 TRP 32 13.366 -2.318 9.065
213 HZ2 TRP 32 HZ2 TRP 32 13.068 -6.369 6.049
214 HZ3 TRP 32 HZ3 TRP 32 13.639 -4.636 9.940
215 HH2 TRP 32 HH2 TRP 32 13.503 -6.621 8.521
216 H CYS 33 HN CYS 33 9.993 0.150 9.156
217 HA CYS 33 HA CYS 33 10.864 2.800 9.908
218 HB2 CYS 33 HB2 CYS 33 8.609 1.003 10.625
219 HB3 CYS 33 HB3 CYS 33 9.164 2.103 11.871
220 H VAL 34 HN VAL 34 11.674 3.201 12.156
221 HA VAL 34 HA VAL 34 12.637 0.885 13.590
222 HB VAL 34 HB VAL 34 14.944 1.531 13.546
223 HG11 VAL 34 HG11 VAL 34 14.022 0.083 11.705
224 HG12 VAL 34 HG12 VAL 34 13.963 1.534 10.675
225 HG13 VAL 34 HG13 VAL 34 15.524 0.944 11.294
226 HG21 VAL 34 HG21 VAL 34 13.892 3.973 12.190
227 HG22 VAL 34 HG22 VAL 34 15.197 3.796 13.388
228 HG23 VAL 34 HG23 VAL 34 15.491 3.374 11.684
229 H TYR 35 HN TYR 35 12.268 1.260 15.713
230 HA TYR 35 HA TYR 35 12.577 3.989 16.694
231 HB2 TYR 35 HB2 TYR 35 10.117 3.068 15.936
232 HB3 TYR 35 HB3 TYR 35 10.194 2.264 17.492
233 HD1 TYR 35 HD1 TYR 35 11.189 5.695 16.315
234 HD2 TYR 35 HD2 TYR 35 8.868 3.357 19.045
235 HE1 TYR 35 HE1 TYR 35 10.380 7.818 17.457
236 HE2 TYR 35 HE2 TYR 35 8.067 5.487 20.178
237 HH TYR 35 HH TYR 35 7.948 8.213 19.005
238 H ALA 36 HN ALA 36 14.142 3.706 18.218
239 HA ALA 36 HA ALA 36 13.666 1.568 20.170
240 HB1 ALA 36 HB1 ALA 36 16.202 2.254 18.659
241 HB2 ALA 36 HB2 ALA 36 16.248 1.419 20.230
242 HB3 ALA 36 HB3 ALA 36 15.412 0.670 18.848
243 H TYR 37 HN TYR 37 14.598 2.041 22.315
244 HA TYR 37 HA TYR 37 15.384 4.818 22.713
245 HB2 TYR 37 HB2 TYR 37 12.788 4.325 22.903
246 HB3 TYR 37 HB3 TYR 37 13.196 3.375 24.318
247 HD1 TYR 37 HD1 TYR 37 14.332 4.538 26.286
248 HD2 TYR 37 HD2 TYR 37 12.564 6.683 23.034
249 HE1 TYR 37 HE1 TYR 37 14.238 6.639 27.714
250 HE2 TYR 37 HE2 TYR 37 12.475 8.777 24.473
251 HH TYR 37 HH TYR 37 12.539 8.849 27.553
252 H VAL 38 HN VAL 38 17.470 3.713 23.104
253 HA VAL 38 HA VAL 38 17.495 2.130 25.561
254 HB VAL 38 HB VAL 38 19.551 2.588 23.391
255 HG11 VAL 38 HG11 VAL 38 19.730 1.258 26.070
256 HG12 VAL 38 HG12 VAL 38 20.602 0.535 24.697
257 HG13 VAL 38 HG13 VAL 38 20.942 2.213 25.184
258 HG21 VAL 38 HG21 VAL 38 18.130 1.097 22.401
259 HG22 VAL 38 HG22 VAL 38 19.118 -0.050 23.337
260 HG23 VAL 38 HG23 VAL 38 17.528 0.464 23.952
261 H ARG 39 HN ARG 39 18.580 2.804 27.417
262 HA ARG 39 HA ARG 39 19.964 5.331 27.220
263 HB2 ARG 39 HB2 ARG 39 17.499 5.662 27.943
264 HB3 ARG 39 HB3 ARG 39 17.907 4.806 29.417
265 HG2 ARG 39 HG2 ARG 39 19.776 6.507 29.793
266 HG3 ARG 39 HG3 ARG 39 19.163 7.405 28.418
267 HD2 ARG 39 HD2 ARG 39 17.609 8.395 29.743
268 HD3 ARG 39 HD3 ARG 39 16.911 6.831 30.115
269 HE ARG 39 HE ARG 39 19.045 6.827 31.796
270 HH11 ARG 39 HH22 ARG 39 16.655 9.359 31.141
271 HH12 ARG 39 HH21 ARG 39 16.770 10.050 32.725
272 HH22 ARG 39 HH1 ARG 39 18.270 9.081 34.323
273 H ILE 40 HN ILE 40 21.766 5.437 28.614
274 HA ILE 40 HA ILE 40 21.923 3.590 30.828
275 HB ILE 40 HB ILE 40 23.492 3.278 28.311
276 HG12 ILE 40 HG12 ILE 40 21.704 1.699 29.964
277 HG13 ILE 40 HG13 ILE 40 22.231 1.439 28.312
278 HG21 ILE 40 HG21 ILE 40 25.216 3.827 29.934
279 HG22 ILE 40 HG22 ILE 40 24.564 2.620 31.068
280 HG23 ILE 40 HG23 ILE 40 25.276 2.096 29.523
281 HD11 ILE 40 HD11 ILE 40 22.926 -0.418 29.840
282 HD12 ILE 40 HD12 ILE 40 24.322 0.393 29.090
283 HD13 ILE 40 HD13 ILE 40 23.890 0.745 30.781
284 H ARG 41 HN ARG 41 23.838 4.076 32.218
285 HA ARG 41 HA ARG 41 24.989 5.502 33.363
286 HB2 ARG 41 HB2 ARG 41 25.670 6.527 30.569
287 HB3 ARG 41 HB3 ARG 41 26.438 7.179 32.003
288 HG2 ARG 41 HG2 ARG 41 26.396 4.180 31.546
289 HG3 ARG 41 HG3 ARG 41 27.576 5.172 30.712
290 HD2 ARG 41 HD2 ARG 41 27.330 5.735 33.633
291 HD3 ARG 41 HD3 ARG 41 27.924 4.132 33.249
292 HE ARG 41 HE ARG 41 29.331 5.968 31.593
293 HH11 ARG 41 HH22 ARG 41 29.046 5.187 35.037
294 HH12 ARG 41 HH21 ARG 41 30.649 5.723 35.418
295 HH22 ARG 41 HH1 ARG 41 32.041 6.594 33.673
296 H GLY 42 HN GLY 42 24.308 7.884 30.726
297 HA2 GLY 42 HA1 GLY 42 22.161 9.149 32.160
298 HA3 GLY 42 HA2 GLY 42 23.673 10.029 32.275
299 H VAL 43 HN VAL 43 22.943 8.010 29.435
300 HA VAL 43 HA VAL 43 22.269 10.430 27.928
301 HB VAL 43 HB VAL 43 24.046 8.390 26.682
302 HG11 VAL 43 HG11 VAL 43 23.093 11.065 26.137
303 HG12 VAL 43 HG12 VAL 43 24.873 11.030 26.133
304 HG13 VAL 43 HG13 VAL 43 23.958 9.931 25.071
305 HG21 VAL 43 HG21 VAL 43 26.064 9.565 27.526
306 HG22 VAL 43 HG22 VAL 43 25.031 10.492 28.640
307 HG23 VAL 43 HG23 VAL 43 25.164 8.725 28.812
308 H LEU 44 HN LEU 44 20.451 10.158 26.732
309 HA LEU 44 HA LEU 44 19.487 7.411 26.451
310 HB2 LEU 44 HB2 LEU 44 17.793 8.491 27.475
311 HB3 LEU 44 HB3 LEU 44 18.235 10.060 26.831
312 HG LEU 44 HG LEU 44 17.267 9.412 24.635
313 HD11 LEU 44 HD11 LEU 44 17.040 7.236 24.211
314 HD12 LEU 44 HD12 LEU 44 17.116 6.805 25.936
315 HD13 LEU 44 HD13 LEU 44 15.569 7.302 25.211
316 HD21 LEU 44 HD21 LEU 44 15.914 10.727 26.096
317 HD22 LEU 44 HD22 LEU 44 14.875 9.468 25.384
318 HD23 LEU 44 HD23 LEU 44 15.457 9.301 27.058
319 H VAL 45 HN VAL 45 19.837 6.417 24.547
320 HA VAL 45 HA VAL 45 20.309 8.123 22.220
321 HB VAL 45 HB VAL 45 20.756 5.156 22.369
322 HG11 VAL 45 HG11 VAL 45 21.567 7.413 20.612
323 HG12 VAL 45 HG12 VAL 45 22.798 6.165 20.921
324 HG13 VAL 45 HG13 VAL 45 21.228 5.711 20.216
325 HG21 VAL 45 HG21 VAL 45 22.387 7.331 23.656
326 HG22 VAL 45 HG22 VAL 45 21.974 5.709 24.262
327 HG23 VAL 45 HG23 VAL 45 23.194 5.896 22.979
328 H ARG 46 HN ARG 46 18.351 8.660 21.323
329 HA ARG 46 HA ARG 46 16.439 6.496 21.071
330 HB2 ARG 46 HB2 ARG 46 15.867 9.395 20.361
331 HB3 ARG 46 HB3 ARG 46 14.737 8.161 20.881
332 HG2 ARG 46 HG2 ARG 46 15.643 8.198 23.160
333 HG3 ARG 46 HG3 ARG 46 16.947 9.262 22.675
334 HD2 ARG 46 HD2 ARG 46 14.639 10.638 21.836
335 HD3 ARG 46 HD3 ARG 46 14.155 9.925 23.361
336 HE ARG 46 HE ARG 46 16.774 11.101 23.627
337 HH11 ARG 46 HH22 ARG 46 13.357 12.002 23.372
338 HH12 ARG 46 HH21 ARG 46 13.559 13.495 24.226
339 HH22 ARG 46 HH1 ARG 46 15.733 14.103 25.030
340 H TYR 47 HN TYR 47 15.434 6.056 18.970
341 HA TYR 47 HA TYR 47 16.726 7.341 16.682
342 HB2 TYR 47 HB2 TYR 47 17.915 5.181 17.311
343 HB3 TYR 47 HB3 TYR 47 16.379 4.336 17.285
344 HD1 TYR 47 HD1 TYR 47 17.063 6.884 14.736
345 HD2 TYR 47 HD2 TYR 47 17.258 2.712 15.662
346 HE1 TYR 47 HE1 TYR 47 17.397 6.346 12.274
347 HE2 TYR 47 HE2 TYR 47 17.591 2.188 13.196
348 HH TYR 47 HH TYR 47 17.506 4.778 10.776
349 H ARG 48 HN ARG 48 15.330 7.737 15.001
350 HA ARG 48 HA ARG 48 12.931 6.178 14.855
351 HB2 ARG 48 HB2 ARG 48 11.542 8.360 14.683
352 HB3 ARG 48 HB3 ARG 48 12.053 7.880 16.289
353 HG2 ARG 48 HG2 ARG 48 14.203 9.391 15.647
354 HG3 ARG 48 HG3 ARG 48 13.041 10.154 14.580
355 HD2 ARG 48 HD2 ARG 48 11.554 10.013 16.891
356 HD3 ARG 48 HD3 ARG 48 13.163 10.162 17.568
357 HE ARG 48 HE ARG 48 13.354 12.340 16.651
358 HH11 ARG 48 HH22 ARG 48 10.396 10.768 15.495
359 HH12 ARG 48 HH21 ARG 48 9.725 12.228 14.849
360 HH22 ARG 48 HH1 ARG 48 10.961 14.273 15.039
361 H ARG 49 HN ARG 49 12.931 5.587 12.707
362 HA ARG 49 HA ARG 49 13.052 7.643 10.755
363 HB2 ARG 49 HB2 ARG 49 15.503 7.038 11.211
364 HB3 ARG 49 HB3 ARG 49 15.154 5.425 10.623
365 HG2 ARG 49 HG2 ARG 49 14.514 7.877 8.940
366 HG3 ARG 49 HG3 ARG 49 16.119 7.173 8.935
367 HD2 ARG 49 HD2 ARG 49 14.223 5.017 8.629
368 HD3 ARG 49 HD3 ARG 49 13.773 6.283 7.504
369 HE ARG 49 HE ARG 49 16.283 4.725 7.486
370 HH11 ARG 49 HH22 ARG 49 14.526 7.516 6.190
371 HH12 ARG 49 HH21 ARG 49 15.535 7.658 4.790
372 HH22 ARG 49 HH1 ARG 49 17.345 6.116 4.485
373 H CYS 50 HN CYS 50 12.292 6.858 8.635
374 HA CYS 50 HA CYS 50 11.550 4.065 8.518
375 HB2 CYS 50 HB2 CYS 50 9.478 6.253 8.252
376 HB3 CYS 50 HB3 CYS 50 9.219 4.545 7.956
377 H TRP 51 HN TRP 51 11.576 3.335 6.355
378 HA TRP 51 HA TRP 51 11.535 5.302 4.231
379 HB2 TRP 51 HB2 TRP 51 13.784 5.507 4.389
380 HB3 TRP 51 HB3 TRP 51 14.002 3.942 5.147
381 HD1 TRP 51 HD1 TRP 51 13.630 5.502 1.629
382 HE1 TRP 51 HE1 TRP 51 14.526 3.864 -0.235
383 HE3 TRP 51 HE3 TRP 51 14.390 1.545 4.731
384 HZ2 TRP 51 HZ2 TRP 51 15.431 1.158 -0.205
385 HZ3 TRP 51 HZ3 TRP 51 15.282 -0.558 3.733
386 HH2 TRP 51 HH2 TRP 51 15.799 -0.789 1.356
Start of MODEL 14
1 H1 ARG 1 HN ARG 1 10.698 -7.271 2.461
2 HA ARG 1 HA ARG 1 8.272 -6.042 1.433
3 HB2 ARG 1 HB2 ARG 1 8.590 -8.110 3.637
4 HB3 ARG 1 HB3 ARG 1 7.245 -6.988 3.691
5 HG2 ARG 1 HG2 ARG 1 7.562 -8.151 1.008
6 HG3 ARG 1 HG3 ARG 1 7.370 -9.398 2.225
7 HD2 ARG 1 HD2 ARG 1 5.511 -7.091 2.542
8 HD3 ARG 1 HD3 ARG 1 5.282 -7.998 1.060
9 HE ARG 1 HE ARG 1 5.529 -9.641 3.500
10 HH11 ARG 1 HH22 ARG 1 3.324 -8.039 1.236
11 HH12 ARG 1 HH21 ARG 1 1.962 -9.014 1.679
12 HH22 ARG 1 HH1 ARG 1 2.226 -10.706 3.356
13 H TRP 2 HN TRP 2 7.137 -4.960 3.648
14 HA TRP 2 HA TRP 2 9.235 -3.180 4.620
15 HB2 TRP 2 HB2 TRP 2 6.348 -2.713 5.174
16 HB3 TRP 2 HB3 TRP 2 7.639 -1.567 4.874
17 HD1 TRP 2 HD1 TRP 2 4.679 -1.922 3.263
18 HE1 TRP 2 HE1 TRP 2 4.654 -1.873 0.624
19 HE3 TRP 2 HE3 TRP 2 9.606 -3.032 2.673
20 HZ2 TRP 2 HZ2 TRP 2 6.653 -2.295 -1.369
21 HZ3 TRP 2 HZ3 TRP 2 10.489 -3.195 0.347
22 HH2 TRP 2 HH2 TRP 2 9.099 -2.847 -1.633
23 H CYS 3 HN CYS 3 10.010 -3.396 6.682
24 HA CYS 3 HA CYS 3 8.333 -4.913 8.546
25 HB2 CYS 3 HB2 CYS 3 11.188 -5.286 7.807
26 HB3 CYS 3 HB3 CYS 3 10.785 -5.440 9.505
27 H VAL 4 HN VAL 4 9.216 -4.429 10.927
28 HA VAL 4 HA VAL 4 10.350 -1.781 11.169
29 HB VAL 4 HB VAL 4 8.557 -0.734 12.159
30 HG11 VAL 4 HG11 VAL 4 6.589 -1.054 10.692
31 HG12 VAL 4 HG12 VAL 4 8.116 -1.009 9.778
32 HG13 VAL 4 HG13 VAL 4 7.307 -2.565 10.082
33 HG21 VAL 4 HG21 VAL 4 7.797 -2.104 13.857
34 HG22 VAL 4 HG22 VAL 4 6.415 -2.150 12.736
35 HG23 VAL 4 HG23 VAL 4 7.572 -3.502 12.780
36 H TYR 5 HN TYR 5 11.755 -1.790 12.855
37 HA TYR 5 HA TYR 5 11.349 -3.889 14.879
38 HB2 TYR 5 HB2 TYR 5 13.693 -2.789 13.283
39 HB3 TYR 5 HB3 TYR 5 14.033 -3.297 14.925
40 HD1 TYR 5 HD2 TYR 5 12.237 -5.677 15.164
41 HD2 TYR 5 HD1 TYR 5 14.767 -4.401 11.958
42 HE1 TYR 5 HE2 TYR 5 12.456 -8.082 14.369
43 HE2 TYR 5 HE1 TYR 5 14.977 -6.811 11.174
44 HH TYR 5 HH TYR 5 13.058 -9.062 11.744
45 H ALA 6 HN ALA 6 11.585 -3.325 17.049
46 HA ALA 6 HA ALA 6 12.398 -0.572 17.602
47 HB1 ALA 6 HB1 ALA 6 10.319 0.057 18.168
48 HB2 ALA 6 HB2 ALA 6 9.705 -1.523 17.626
49 HB3 ALA 6 HB3 ALA 6 10.206 -1.296 19.319
50 H TYR 7 HN TYR 7 13.443 -0.316 19.610
51 HA TYR 7 HA TYR 7 13.553 -2.635 21.362
52 HB2 TYR 7 HB2 TYR 7 15.391 -2.803 19.592
53 HB3 TYR 7 HB3 TYR 7 15.939 -1.199 20.035
54 HD1 TYR 7 HD1 TYR 7 16.506 -0.920 22.645
55 HD2 TYR 7 HD2 TYR 7 16.497 -4.628 20.510
56 HE1 TYR 7 HE1 TYR 7 18.052 -1.937 24.389
57 HE2 TYR 7 HE2 TYR 7 18.043 -5.632 22.261
58 HH TYR 7 HH TYR 7 19.723 -3.768 24.461
59 H VAL 8 HN VAL 8 12.973 -1.763 23.292
60 HA VAL 8 HA VAL 8 14.126 0.862 23.939
61 HB VAL 8 HB VAL 8 11.582 -0.363 25.014
62 HG11 VAL 8 HG11 VAL 8 11.563 1.344 26.447
63 HG12 VAL 8 HG12 VAL 8 13.161 1.847 25.848
64 HG13 VAL 8 HG13 VAL 8 11.684 2.507 25.105
65 HG21 VAL 8 HG21 VAL 8 11.146 -0.034 22.706
66 HG22 VAL 8 HG22 VAL 8 10.462 1.384 23.535
67 HG23 VAL 8 HG23 VAL 8 12.017 1.518 22.681
68 H ARG 9 HN ARG 9 15.395 1.016 25.748
69 HA ARG 9 HA ARG 9 15.205 -1.099 27.683
70 HB2 ARG 9 HB2 ARG 9 16.938 -2.130 26.465
71 HB3 ARG 9 HB3 ARG 9 17.599 -0.606 25.907
72 HG2 ARG 9 HG2 ARG 9 18.548 -0.123 28.106
73 HG3 ARG 9 HG3 ARG 9 17.706 -1.479 28.829
74 HD2 ARG 9 HD2 ARG 9 19.436 -2.852 28.307
75 HD3 ARG 9 HD3 ARG 9 19.212 -2.511 26.603
76 HE ARG 9 HE ARG 9 20.557 -0.268 27.572
77 HH11 ARG 9 HH22 ARG 9 21.205 -3.751 27.553
78 HH12 ARG 9 HH21 ARG 9 22.926 -3.556 27.538
79 HH22 ARG 9 HH1 ARG 9 23.858 -1.348 27.537
80 H ILE 10 HN ILE 10 15.098 -0.050 29.644
81 HA ILE 10 HA ILE 10 16.956 2.097 30.170
82 HB ILE 10 HB ILE 10 14.087 2.711 30.712
83 HG12 ILE 10 HG12 ILE 10 15.445 3.223 28.049
84 HG13 ILE 10 HG13 ILE 10 14.148 2.078 28.326
85 HG21 ILE 10 HG21 ILE 10 14.911 4.667 31.365
86 HG22 ILE 10 HG22 ILE 10 16.541 3.978 31.171
87 HG23 ILE 10 HG23 ILE 10 15.790 4.879 29.832
88 HD11 ILE 10 HD11 ILE 10 13.300 4.242 27.424
89 HD12 ILE 10 HD12 ILE 10 12.638 3.901 29.041
90 HD13 ILE 10 HD13 ILE 10 13.958 5.081 28.850
91 H ARG 11 HN ARG 11 17.137 2.552 32.481
92 HA ARG 11 HA ARG 11 17.275 1.954 34.551
93 HB2 ARG 11 HB2 ARG 11 14.473 1.050 33.892
94 HB3 ARG 11 HB3 ARG 11 15.143 0.525 35.424
95 HG2 ARG 11 HG2 ARG 11 14.562 2.544 36.279
96 HG3 ARG 11 HG3 ARG 11 15.828 3.255 35.298
97 HD2 ARG 11 HD2 ARG 11 14.341 3.973 33.635
98 HD3 ARG 11 HD3 ARG 11 13.193 2.687 33.949
99 HE ARG 11 HE ARG 11 13.513 4.640 36.141
100 HH11 ARG 11 HH22 ARG 11 11.653 3.696 33.277
101 HH12 ARG 11 HH21 ARG 11 10.259 4.621 33.724
102 HH22 ARG 11 HH1 ARG 11 10.293 5.886 35.760
103 H GLY 12 HN GLY 12 15.315 -0.941 33.608
104 HA2 GLY 12 HA1 GLY 12 17.634 -2.642 33.387
105 HA3 GLY 12 HA2 GLY 12 16.739 -2.864 34.877
106 H VAL 13 HN VAL 13 15.078 -1.775 31.928
107 HA VAL 13 HA VAL 13 13.946 -4.475 31.667
108 HB VAL 13 HB VAL 13 12.569 -1.792 31.442
109 HG11 VAL 13 HG11 VAL 13 11.654 -4.592 30.773
110 HG12 VAL 13 HG12 VAL 13 10.497 -3.319 31.234
111 HG13 VAL 13 HG13 VAL 13 11.530 -3.107 29.800
112 HG21 VAL 13 HG21 VAL 13 12.977 -3.620 33.648
113 HG22 VAL 13 HG22 VAL 13 12.203 -2.017 33.631
114 HG23 VAL 13 HG23 VAL 13 11.243 -3.473 33.273
115 H LEU 14 HN LEU 14 13.335 -5.106 29.489
116 HA LEU 14 HA LEU 14 14.358 -3.361 27.389
117 HB2 LEU 14 HB2 LEU 14 16.245 -4.729 27.900
118 HB3 LEU 14 HB3 LEU 14 15.270 -6.186 27.917
119 HG LEU 14 HG LEU 14 15.178 -6.340 25.622
120 HD11 LEU 14 HD11 LEU 14 14.180 -4.374 24.909
121 HD12 LEU 14 HD12 LEU 14 15.453 -3.346 25.611
122 HD13 LEU 14 HD13 LEU 14 15.785 -4.296 24.142
123 HD21 LEU 14 HD21 LEU 14 17.420 -5.909 24.711
124 HD22 LEU 14 HD22 LEU 14 17.794 -4.895 26.125
125 HD23 LEU 14 HD23 LEU 14 17.484 -6.635 26.335
126 H VAL 15 HN VAL 15 12.660 -3.034 26.064
127 HA VAL 15 HA VAL 15 10.872 -5.329 25.638
128 HB VAL 15 HB VAL 15 9.989 -2.495 25.275
129 HG11 VAL 15 HG11 VAL 15 8.785 -4.999 25.019
130 HG12 VAL 15 HG12 VAL 15 8.167 -4.370 26.565
131 HG13 VAL 15 HG13 VAL 15 7.963 -3.421 25.073
132 HG21 VAL 15 HG21 VAL 15 10.556 -2.026 27.410
133 HG22 VAL 15 HG22 VAL 15 9.125 -3.006 27.811
134 HG23 VAL 15 HG23 VAL 15 10.746 -3.741 27.848
135 H ARG 16 HN ARG 16 11.877 -6.172 23.799
136 HA ARG 16 HA ARG 16 12.514 -4.327 21.698
137 HB2 ARG 16 HB2 ARG 16 12.829 -7.357 21.961
138 HB3 ARG 16 HB3 ARG 16 13.315 -6.467 20.532
139 HG2 ARG 16 HG2 ARG 16 14.808 -5.030 22.004
140 HG3 ARG 16 HG3 ARG 16 14.394 -6.060 23.360
141 HD2 ARG 16 HD2 ARG 16 16.133 -6.650 20.986
142 HD3 ARG 16 HD3 ARG 16 16.336 -7.134 22.658
143 HE ARG 16 HE ARG 16 14.761 -8.542 20.600
144 HH11 ARG 16 HH22 ARG 16 15.474 -8.228 24.056
145 HH12 ARG 16 HH21 ARG 16 14.883 -9.808 24.449
146 HH22 ARG 16 HH1 ARG 16 14.009 -11.201 22.705
147 H TYR 17 HN TYR 17 10.707 -3.625 20.557
148 HA TYR 17 HA TYR 17 8.546 -5.500 20.071
149 HB2 TYR 17 HB2 TYR 17 8.690 -2.840 20.698
150 HB3 TYR 17 HB3 TYR 17 8.814 -2.678 18.957
151 HD1 TYR 17 HD2 TYR 17 6.643 -4.021 21.671
152 HD2 TYR 17 HD1 TYR 17 6.889 -2.797 17.579
153 HE1 TYR 17 HE2 TYR 17 4.112 -4.157 21.470
154 HE2 TYR 17 HE1 TYR 17 4.358 -2.937 17.392
155 HH TYR 17 HH TYR 17 2.378 -2.754 19.587
156 H ARG 18 HN ARG 18 7.681 -5.889 17.911
157 HA ARG 18 HA ARG 18 9.401 -5.159 15.740
158 HB2 ARG 18 HB2 ARG 18 8.723 -8.106 16.008
159 HB3 ARG 18 HB3 ARG 18 9.977 -7.361 15.036
160 HG2 ARG 18 HG2 ARG 18 11.300 -6.824 17.022
161 HG3 ARG 18 HG3 ARG 18 9.996 -7.308 18.088
162 HD2 ARG 18 HD2 ARG 18 10.172 -9.660 17.044
163 HD3 ARG 18 HD3 ARG 18 11.641 -9.116 16.260
164 HE ARG 18 HE ARG 18 11.544 -8.668 19.177
165 HH11 ARG 18 HH22 ARG 18 12.592 -10.807 16.554
166 HH12 ARG 18 HH21 ARG 18 13.780 -11.616 17.521
167 HH22 ARG 18 HH1 ARG 18 14.068 -10.969 19.811
168 H ARG 19 HN ARG 19 8.373 -5.923 13.572
169 HA ARG 19 HA ARG 19 5.839 -6.961 13.495
170 HB2 ARG 19 HB2 ARG 19 5.509 -4.553 14.614
171 HB3 ARG 19 HB3 ARG 19 5.649 -3.983 12.963
172 HG2 ARG 19 HG2 ARG 19 3.788 -6.296 13.479
173 HG3 ARG 19 HG3 ARG 19 3.279 -4.713 14.032
174 HD2 ARG 19 HD2 ARG 19 4.340 -4.413 11.360
175 HD3 ARG 19 HD3 ARG 19 3.226 -5.765 11.345
176 HE ARG 19 HE ARG 19 1.437 -4.306 11.888
177 HH11 ARG 19 HH22 ARG 19 4.529 -2.582 12.037
178 HH12 ARG 19 HH21 ARG 19 3.794 -1.016 12.111
179 HH22 ARG 19 HH1 ARG 19 1.404 -0.838 12.081
180 H CYS 20 HN CYS 20 4.947 -6.902 11.236
181 HA CYS 20 HA CYS 20 6.625 -5.620 9.272
182 HB2 CYS 20 HB2 CYS 20 6.354 -8.626 9.428
183 HB3 CYS 20 HB3 CYS 20 6.874 -7.771 7.989
184 H TRP 21 HN TRP 21 5.559 -5.842 7.047
185 HA TRP 21 HA TRP 21 2.678 -6.350 7.354
186 HB2 TRP 21 HB2 TRP 21 2.655 -4.076 7.210
187 HB3 TRP 21 HB3 TRP 21 4.129 -3.992 6.266
188 HD1 TRP 21 HD1 TRP 21 0.442 -3.749 5.837
189 HE1 TRP 21 HE1 TRP 21 -0.311 -3.695 3.308
190 HE3 TRP 21 HE3 TRP 21 4.919 -5.220 3.926
191 HZ2 TRP 21 HZ2 TRP 21 1.020 -4.260 0.848
192 HZ3 TRP 21 HZ3 TRP 21 5.107 -5.444 1.450
193 HH2 TRP 21 HH2 TRP 21 3.251 -4.991 -0.073
194 H1 ARG 31 HN ARG 31 8.897 -1.253 3.428
195 HA ARG 31 HA ARG 31 9.617 1.462 4.004
196 HB2 ARG 31 HB2 ARG 31 6.987 1.090 4.082
197 HB3 ARG 31 HB3 ARG 31 7.319 0.269 5.594
198 HG2 ARG 31 HG2 ARG 31 7.080 2.398 6.450
199 HG3 ARG 31 HG3 ARG 31 8.782 2.502 6.043
200 HD2 ARG 31 HD2 ARG 31 7.610 4.480 5.166
201 HD3 ARG 31 HD3 ARG 31 8.194 3.511 3.827
202 HE ARG 31 HE ARG 31 5.975 3.010 3.230
203 HH11 ARG 31 HH22 ARG 31 6.021 4.448 6.468
204 HH12 ARG 31 HH21 ARG 31 4.300 4.622 6.550
205 HH22 ARG 31 HH1 ARG 31 2.957 3.904 4.699
206 H TRP 32 HN TRP 32 10.797 1.634 5.998
207 HA TRP 32 HA TRP 32 11.010 -0.821 7.574
208 HB2 TRP 32 HB2 TRP 32 13.162 0.477 5.989
209 HB3 TRP 32 HB3 TRP 32 13.580 -0.053 7.607
210 HD1 TRP 32 HD1 TRP 32 12.855 -1.436 4.141
211 HE1 TRP 32 HE1 TRP 32 13.217 -4.047 4.022
212 HE3 TRP 32 HE3 TRP 32 13.337 -2.126 9.155
213 HZ2 TRP 32 HZ2 TRP 32 13.654 -6.063 5.994
214 HZ3 TRP 32 HZ3 TRP 32 13.729 -4.447 9.976
215 HH2 TRP 32 HH2 TRP 32 13.889 -6.378 8.485
216 H CYS 33 HN CYS 33 9.975 0.055 9.376
217 HA CYS 33 HA CYS 33 10.692 2.730 10.193
218 HB2 CYS 33 HB2 CYS 33 8.550 0.784 10.867
219 HB3 CYS 33 HB3 CYS 33 9.040 1.886 12.139
220 H VAL 34 HN VAL 34 11.529 3.144 12.409
221 HA VAL 34 HA VAL 34 12.597 0.863 13.826
222 HB VAL 34 HB VAL 34 14.880 1.662 13.785
223 HG11 VAL 34 HG11 VAL 34 15.486 0.937 11.602
224 HG12 VAL 34 HG12 VAL 34 13.985 0.074 12.016
225 HG13 VAL 34 HG13 VAL 34 13.934 1.470 10.913
226 HG21 VAL 34 HG21 VAL 34 14.437 4.064 13.497
227 HG22 VAL 34 HG22 VAL 34 15.608 3.469 12.295
228 HG23 VAL 34 HG23 VAL 34 13.920 3.770 11.819
229 H TYR 35 HN TYR 35 12.349 1.219 15.977
230 HA TYR 35 HA TYR 35 12.536 3.946 16.962
231 HB2 TYR 35 HB2 TYR 35 10.098 3.079 16.212
232 HB3 TYR 35 HB3 TYR 35 10.190 2.112 17.670
233 HD1 TYR 35 HD1 TYR 35 11.377 5.616 17.096
234 HD2 TYR 35 HD2 TYR 35 8.608 3.056 19.115
235 HE1 TYR 35 HE1 TYR 35 10.540 7.589 18.464
236 HE2 TYR 35 HE2 TYR 35 7.779 5.037 20.476
237 HH TYR 35 HH TYR 35 7.746 7.276 20.553
238 H ALA 36 HN ALA 36 14.156 3.656 18.436
239 HA ALA 36 HA ALA 36 13.721 1.524 20.404
240 HB1 ALA 36 HB1 ALA 36 16.280 1.334 20.419
241 HB2 ALA 36 HB2 ALA 36 15.441 0.651 19.006
242 HB3 ALA 36 HB3 ALA 36 16.249 2.232 18.882
243 H TYR 37 HN TYR 37 14.813 1.994 22.512
244 HA TYR 37 HA TYR 37 15.577 4.767 22.894
245 HB2 TYR 37 HB2 TYR 37 12.964 4.249 23.124
246 HB3 TYR 37 HB3 TYR 37 13.417 3.397 24.586
247 HD1 TYR 37 HD1 TYR 37 15.070 4.871 26.177
248 HD2 TYR 37 HD2 TYR 37 12.235 6.432 23.378
249 HE1 TYR 37 HE1 TYR 37 14.987 7.059 27.470
250 HE2 TYR 37 HE2 TYR 37 12.161 8.614 24.681
251 HH TYR 37 HH TYR 37 13.408 8.898 27.792
252 H VAL 38 HN VAL 38 17.642 3.568 23.236
253 HA VAL 38 HA VAL 38 17.663 2.101 25.771
254 HB VAL 38 HB VAL 38 19.661 2.255 23.505
255 HG11 VAL 38 HG11 VAL 38 20.896 1.931 25.529
256 HG12 VAL 38 HG12 VAL 38 19.727 0.728 26.124
257 HG13 VAL 38 HG13 VAL 38 20.766 0.345 24.731
258 HG21 VAL 38 HG21 VAL 38 18.956 -0.336 23.607
259 HG22 VAL 38 HG22 VAL 38 17.439 0.392 24.189
260 HG23 VAL 38 HG23 VAL 38 18.101 0.860 22.605
261 H ARG 39 HN ARG 39 18.826 2.839 27.537
262 HA ARG 39 HA ARG 39 20.385 5.240 27.092
263 HB2 ARG 39 HB2 ARG 39 17.942 5.630 28.025
264 HB3 ARG 39 HB3 ARG 39 18.581 4.998 29.529
265 HG2 ARG 39 HG2 ARG 39 20.438 6.741 29.389
266 HG3 ARG 39 HG3 ARG 39 19.625 7.424 27.995
267 HD2 ARG 39 HD2 ARG 39 18.249 8.602 29.361
268 HD3 ARG 39 HD3 ARG 39 17.635 7.111 30.046
269 HE ARG 39 HE ARG 39 19.984 7.356 31.399
270 HH11 ARG 39 HH22 ARG 39 17.446 9.739 30.741
271 HH12 ARG 39 HH21 ARG 39 17.751 10.646 32.185
272 HH22 ARG 39 HH1 ARG 39 19.485 9.931 33.677
273 H ILE 40 HN ILE 40 22.286 5.318 28.353
274 HA ILE 40 HA ILE 40 22.511 3.578 30.644
275 HB ILE 40 HB ILE 40 23.859 3.038 28.040
276 HG12 ILE 40 HG12 ILE 40 22.127 1.659 29.918
277 HG13 ILE 40 HG13 ILE 40 22.501 1.281 28.248
278 HG21 ILE 40 HG21 ILE 40 25.668 1.824 29.177
279 HG22 ILE 40 HG22 ILE 40 25.733 3.574 29.496
280 HG23 ILE 40 HG23 ILE 40 25.109 2.466 30.741
281 HD11 ILE 40 HD11 ILE 40 24.315 0.622 30.615
282 HD12 ILE 40 HD12 ILE 40 23.217 -0.530 29.818
283 HD13 ILE 40 HD13 ILE 40 24.590 0.158 28.918
284 H ARG 41 HN ARG 41 24.482 4.059 31.908
285 HA ARG 41 HA ARG 41 25.753 5.499 32.902
286 HB2 ARG 41 HB2 ARG 41 26.461 6.158 30.007
287 HB3 ARG 41 HB3 ARG 41 27.307 6.901 31.350
288 HG2 ARG 41 HG2 ARG 41 27.018 3.879 31.166
289 HG3 ARG 41 HG3 ARG 41 28.302 4.713 30.314
290 HD2 ARG 41 HD2 ARG 41 27.936 5.403 33.221
291 HD3 ARG 41 HD3 ARG 41 28.585 3.815 32.861
292 HE ARG 41 HE ARG 41 29.917 5.900 31.323
293 HH11 ARG 41 HH22 ARG 41 29.844 4.311 34.490
294 HH12 ARG 41 HH21 ARG 41 31.487 4.708 34.865
295 HH22 ARG 41 HH1 ARG 41 32.787 5.951 33.280
296 H GLY 42 HN GLY 42 25.234 7.657 30.046
297 HA2 GLY 42 HA1 GLY 42 23.249 9.254 31.395
298 HA3 GLY 42 HA2 GLY 42 24.834 10.000 31.347
299 H VAL 43 HN VAL 43 23.814 7.745 28.791
300 HA VAL 43 HA VAL 43 23.319 10.040 27.032
301 HB VAL 43 HB VAL 43 24.734 7.639 25.978
302 HG11 VAL 43 HG11 VAL 43 24.700 8.976 24.189
303 HG12 VAL 43 HG12 VAL 43 24.130 10.358 25.155
304 HG13 VAL 43 HG13 VAL 43 25.873 10.019 25.027
305 HG21 VAL 43 HG21 VAL 43 26.906 9.048 26.546
306 HG22 VAL 43 HG22 VAL 43 25.910 9.600 27.914
307 HG23 VAL 43 HG23 VAL 43 26.242 7.865 27.698
308 H LEU 44 HN LEU 44 21.453 9.866 25.879
309 HA LEU 44 HA LEU 44 20.080 7.290 26.058
310 HB2 LEU 44 HB2 LEU 44 18.601 8.758 26.914
311 HB3 LEU 44 HB3 LEU 44 19.256 10.124 26.033
312 HG LEU 44 HG LEU 44 18.121 9.333 23.977
313 HD11 LEU 44 HD11 LEU 44 17.093 7.360 23.765
314 HD12 LEU 44 HD12 LEU 44 17.982 6.894 25.235
315 HD13 LEU 44 HD13 LEU 44 16.308 7.488 25.358
316 HD21 LEU 44 HD21 LEU 44 15.997 10.166 24.529
317 HD22 LEU 44 HD22 LEU 44 16.097 9.566 26.202
318 HD23 LEU 44 HD23 LEU 44 17.108 10.937 25.686
319 H VAL 45 HN VAL 45 20.466 5.973 24.356
320 HA VAL 45 HA VAL 45 20.934 7.222 21.761
321 HB VAL 45 HB VAL 45 21.163 4.293 22.370
322 HG11 VAL 45 HG11 VAL 45 23.253 5.525 20.766
323 HG12 VAL 45 HG12 VAL 45 22.143 4.193 20.364
324 HG13 VAL 45 HG13 VAL 45 21.635 5.880 20.113
325 HG21 VAL 45 HG21 VAL 45 23.024 6.491 23.269
326 HG22 VAL 45 HG22 VAL 45 22.421 5.083 24.175
327 HG23 VAL 45 HG23 VAL 45 23.637 4.862 22.894
328 H ARG 46 HN ARG 46 18.766 7.883 21.290
329 HA ARG 46 HA ARG 46 16.982 5.614 20.907
330 HB2 ARG 46 HB2 ARG 46 15.699 6.941 22.312
331 HB3 ARG 46 HB3 ARG 46 16.547 8.411 21.874
332 HG2 ARG 46 HG2 ARG 46 15.333 8.519 19.721
333 HG3 ARG 46 HG3 ARG 46 14.556 6.983 20.049
334 HD2 ARG 46 HD2 ARG 46 14.214 9.006 22.211
335 HD3 ARG 46 HD3 ARG 46 13.484 9.458 20.683
336 HE ARG 46 HE ARG 46 12.917 6.701 21.583
337 HH11 ARG 46 HH22 ARG 46 11.802 10.062 21.468
338 HH12 ARG 46 HH21 ARG 46 10.146 9.653 21.769
339 HH22 ARG 46 HH1 ARG 46 9.540 7.354 22.067
340 H TYR 47 HN TYR 47 15.712 5.569 18.900
341 HA TYR 47 HA TYR 47 16.543 7.503 16.869
342 HB2 TYR 47 HB2 TYR 47 17.760 5.067 17.098
343 HB3 TYR 47 HB3 TYR 47 16.304 4.520 16.290
344 HD1 TYR 47 HD2 TYR 47 18.184 7.705 15.739
345 HD2 TYR 47 HD1 TYR 47 17.061 3.893 14.157
346 HE1 TYR 47 HE2 TYR 47 19.189 8.335 13.491
347 HE2 TYR 47 HE1 TYR 47 18.070 4.535 11.913
348 HH TYR 47 HH TYR 47 19.615 5.994 10.988
349 H ARG 48 HN ARG 48 14.980 7.903 15.263
350 HA ARG 48 HA ARG 48 12.640 6.248 15.284
351 HB2 ARG 48 HB2 ARG 48 11.708 7.713 16.845
352 HB3 ARG 48 HB3 ARG 48 12.722 9.055 16.356
353 HG2 ARG 48 HG2 ARG 48 10.785 8.103 14.286
354 HG3 ARG 48 HG3 ARG 48 10.061 8.825 15.710
355 HD2 ARG 48 HD2 ARG 48 12.392 10.335 14.622
356 HD3 ARG 48 HD3 ARG 48 11.016 10.253 13.539
357 HE ARG 48 HE ARG 48 11.181 11.862 15.891
358 HH11 ARG 48 HH22 ARG 48 8.869 9.731 14.259
359 HH12 ARG 48 HH21 ARG 48 7.479 10.544 14.897
360 HH22 ARG 48 HH1 ARG 48 7.785 12.426 16.349
361 H ARG 49 HN ARG 49 12.232 5.878 13.128
362 HA ARG 49 HA ARG 49 11.820 7.909 11.333
363 HB2 ARG 49 HB2 ARG 49 14.431 7.978 11.617
364 HB3 ARG 49 HB3 ARG 49 14.438 6.489 10.695
365 HG2 ARG 49 HG2 ARG 49 14.707 8.708 9.374
366 HG3 ARG 49 HG3 ARG 49 13.571 7.531 8.745
367 HD2 ARG 49 HD2 ARG 49 12.705 9.938 8.835
368 HD3 ARG 49 HD3 ARG 49 11.670 8.747 9.598
369 HE ARG 49 HE ARG 49 13.262 9.565 11.693
370 HH11 ARG 49 HH22 ARG 49 11.319 11.344 9.322
371 HH12 ARG 49 HH21 ARG 49 11.001 12.668 10.392
372 HH22 ARG 49 HH1 ARG 49 11.907 12.629 12.611
373 H CYS 50 HN CYS 50 11.735 6.937 8.953
374 HA CYS 50 HA CYS 50 11.493 4.054 8.978
375 HB2 CYS 50 HB2 CYS 50 9.151 5.794 8.183
376 HB3 CYS 50 HB3 CYS 50 9.234 4.046 8.097
377 H TRP 51 HN TRP 51 11.973 3.207 6.913
378 HA TRP 51 HA TRP 51 12.737 5.220 4.933
379 HB2 TRP 51 HB2 TRP 51 14.571 3.884 5.377
380 HB3 TRP 51 HB3 TRP 51 13.616 2.423 5.543
381 HD1 TRP 51 HD1 TRP 51 15.644 4.299 2.998
382 HE1 TRP 51 HE1 TRP 51 15.589 3.166 0.615
383 HE3 TRP 51 HE3 TRP 51 11.829 1.099 4.029
384 HZ2 TRP 51 HZ2 TRP 51 13.992 1.105 -0.545
385 HZ3 TRP 51 HZ3 TRP 51 11.083 -0.440 2.216
386 HH2 TRP 51 HH2 TRP 51 12.099 -0.472 -0.007
Start of MODEL 15
1 H1 ARG 1 HN ARG 1 6.029 -4.268 0.186
2 HA ARG 1 HA ARG 1 5.196 -5.535 2.670
3 HB2 ARG 1 HB2 ARG 1 7.391 -6.099 0.693
4 HB3 ARG 1 HB3 ARG 1 7.779 -6.373 2.379
5 HG2 ARG 1 HG2 ARG 1 5.156 -7.473 1.899
6 HG3 ARG 1 HG3 ARG 1 6.207 -8.029 0.612
7 HD2 ARG 1 HD2 ARG 1 7.906 -8.500 2.630
8 HD3 ARG 1 HD3 ARG 1 6.440 -8.507 3.589
9 HE ARG 1 HE ARG 1 5.739 -10.493 2.511
10 HH11 ARG 1 HH22 ARG 1 8.614 -9.184 0.905
11 HH12 ARG 1 HH21 ARG 1 8.891 -10.613 -0.034
12 HH22 ARG 1 HH1 ARG 1 7.404 -12.477 0.197
13 H TRP 2 HN TRP 2 5.748 -4.470 4.553
14 HA TRP 2 HA TRP 2 8.165 -2.856 4.575
15 HB2 TRP 2 HB2 TRP 2 6.883 -0.973 5.657
16 HB3 TRP 2 HB3 TRP 2 6.712 -1.154 3.922
17 HD1 TRP 2 HD1 TRP 2 4.286 -2.433 3.137
18 HE1 TRP 2 HE1 TRP 2 1.841 -2.244 4.111
19 HE3 TRP 2 HE3 TRP 2 5.671 -0.617 7.680
20 HZ2 TRP 2 HZ2 TRP 2 0.784 -1.376 6.615
21 HZ3 TRP 2 HZ3 TRP 2 3.871 -0.125 9.332
22 HH2 TRP 2 HH2 TRP 2 1.498 -0.476 8.860
23 H CYS 3 HN CYS 3 9.133 -2.907 6.624
24 HA CYS 3 HA CYS 3 7.544 -4.185 8.724
25 HB2 CYS 3 HB2 CYS 3 10.181 -4.990 7.614
26 HB3 CYS 3 HB3 CYS 3 10.002 -5.065 9.355
27 H VAL 4 HN VAL 4 8.488 -3.675 10.957
28 HA VAL 4 HA VAL 4 10.224 -1.357 11.019
29 HB VAL 4 HB VAL 4 8.742 0.092 12.070
30 HG11 VAL 4 HG11 VAL 4 8.315 -0.179 9.634
31 HG12 VAL 4 HG12 VAL 4 7.019 -1.338 10.018
32 HG13 VAL 4 HG13 VAL 4 6.879 0.358 10.539
33 HG21 VAL 4 HG21 VAL 4 7.630 -1.044 13.736
34 HG22 VAL 4 HG22 VAL 4 6.305 -0.800 12.573
35 HG23 VAL 4 HG23 VAL 4 7.137 -2.372 12.658
36 H TYR 5 HN TYR 5 11.741 -1.838 12.513
37 HA TYR 5 HA TYR 5 11.011 -3.757 14.597
38 HB2 TYR 5 HB2 TYR 5 13.522 -2.671 13.229
39 HB3 TYR 5 HB3 TYR 5 13.690 -3.445 14.792
40 HD1 TYR 5 HD1 TYR 5 11.681 -5.650 14.544
41 HD2 TYR 5 HD2 TYR 5 14.561 -4.169 11.750
42 HE1 TYR 5 HE1 TYR 5 11.756 -7.922 13.406
43 HE2 TYR 5 HE2 TYR 5 14.627 -6.446 10.621
44 HH TYR 5 HH TYR 5 12.851 -8.418 10.445
45 H ALA 6 HN ALA 6 11.881 -3.392 16.818
46 HA ALA 6 HA ALA 6 12.506 -0.643 17.468
47 HB1 ALA 6 HB1 ALA 6 9.828 -1.659 17.634
48 HB2 ALA 6 HB2 ALA 6 10.445 -1.443 19.289
49 HB3 ALA 6 HB3 ALA 6 10.447 -0.073 18.153
50 H TYR 7 HN TYR 7 13.567 -0.461 19.509
51 HA TYR 7 HA TYR 7 13.850 -2.888 21.075
52 HB2 TYR 7 HB2 TYR 7 15.612 -2.919 19.242
53 HB3 TYR 7 HB3 TYR 7 16.114 -1.304 19.704
54 HD1 TYR 7 HD1 TYR 7 17.199 -0.946 21.963
55 HD2 TYR 7 HD2 TYR 7 16.451 -4.845 20.369
56 HE1 TYR 7 HE1 TYR 7 18.878 -1.942 23.593
57 HE2 TYR 7 HE2 TYR 7 18.131 -5.828 22.004
58 HH TYR 7 HH TYR 7 20.229 -3.820 23.857
59 H VAL 8 HN VAL 8 13.114 -2.017 22.982
60 HA VAL 8 HA VAL 8 14.237 0.575 23.760
61 HB VAL 8 HB VAL 8 11.802 -0.969 24.663
62 HG11 VAL 8 HG11 VAL 8 12.055 0.066 26.639
63 HG12 VAL 8 HG12 VAL 8 13.321 1.148 26.012
64 HG13 VAL 8 HG13 VAL 8 11.604 1.555 25.775
65 HG21 VAL 8 HG21 VAL 8 12.193 0.792 22.517
66 HG22 VAL 8 HG22 VAL 8 10.640 0.250 23.195
67 HG23 VAL 8 HG23 VAL 8 11.382 1.763 23.769
68 H ARG 9 HN ARG 9 15.323 0.827 25.754
69 HA ARG 9 HA ARG 9 15.605 -1.486 27.403
70 HB2 ARG 9 HB2 ARG 9 17.445 -2.117 26.090
71 HB3 ARG 9 HB3 ARG 9 17.813 -0.470 25.619
72 HG2 ARG 9 HG2 ARG 9 18.937 0.008 27.650
73 HG3 ARG 9 HG3 ARG 9 18.127 -1.279 28.521
74 HD2 ARG 9 HD2 ARG 9 19.723 -2.804 27.947
75 HD3 ARG 9 HD3 ARG 9 19.653 -2.354 26.254
76 HE ARG 9 HE ARG 9 21.405 -0.783 26.593
77 HH11 ARG 9 HH22 ARG 9 20.389 -2.212 29.673
78 HH12 ARG 9 HH21 ARG 9 21.766 -1.621 30.543
79 HH22 ARG 9 HH1 ARG 9 23.417 -0.325 29.387
80 H ILE 10 HN ILE 10 15.205 -0.564 29.393
81 HA ILE 10 HA ILE 10 16.760 1.793 30.103
82 HB ILE 10 HB ILE 10 13.869 1.775 30.834
83 HG12 ILE 10 HG12 ILE 10 14.964 2.557 28.124
84 HG13 ILE 10 HG13 ILE 10 13.688 1.409 28.478
85 HG21 ILE 10 HG21 ILE 10 16.071 3.473 31.253
86 HG22 ILE 10 HG22 ILE 10 15.021 4.310 30.085
87 HG23 ILE 10 HG23 ILE 10 14.363 3.777 31.651
88 HD11 ILE 10 HD11 ILE 10 12.701 3.659 29.724
89 HD12 ILE 10 HD12 ILE 10 13.583 4.377 28.354
90 HD13 ILE 10 HD13 ILE 10 12.300 3.179 28.058
91 H ARG 11 HN ARG 11 17.155 1.974 32.375
92 HA ARG 11 HA ARG 11 17.567 1.208 34.351
93 HB2 ARG 11 HB2 ARG 11 14.943 -0.323 33.981
94 HB3 ARG 11 HB3 ARG 11 15.788 -0.208 35.512
95 HG2 ARG 11 HG2 ARG 11 14.213 1.869 34.053
96 HG3 ARG 11 HG3 ARG 11 14.387 1.610 35.778
97 HD2 ARG 11 HD2 ARG 11 16.757 2.525 35.616
98 HD3 ARG 11 HD3 ARG 11 16.453 2.902 33.932
99 HE ARG 11 HE ARG 11 14.349 4.019 35.540
100 HH11 ARG 11 HH22 ARG 11 17.775 4.520 34.786
101 HH12 ARG 11 HH21 ARG 11 17.728 6.219 35.119
102 HH22 ARG 11 HH1 ARG 11 15.667 7.221 35.820
103 H GLY 12 HN GLY 12 15.841 -1.783 33.246
104 HA2 GLY 12 HA1 GLY 12 18.268 -3.188 32.631
105 HA3 GLY 12 HA2 GLY 12 17.611 -3.632 34.194
106 H VAL 13 HN VAL 13 15.489 -2.516 31.559
107 HA VAL 13 HA VAL 13 14.609 -5.298 31.204
108 HB VAL 13 HB VAL 13 12.885 -2.815 31.255
109 HG11 VAL 13 HG11 VAL 13 12.438 -5.578 30.404
110 HG12 VAL 13 HG12 VAL 13 11.281 -5.046 31.648
111 HG13 VAL 13 HG13 VAL 13 11.450 -4.123 30.136
112 HG21 VAL 13 HG21 VAL 13 13.598 -4.814 33.384
113 HG22 VAL 13 HG22 VAL 13 13.427 -3.046 33.494
114 HG23 VAL 13 HG23 VAL 13 11.979 -4.074 33.374
115 H LEU 14 HN LEU 14 14.795 -6.010 29.145
116 HA LEU 14 HA LEU 14 15.186 -3.966 27.088
117 HB2 LEU 14 HB2 LEU 14 17.018 -5.512 27.381
118 HB3 LEU 14 HB3 LEU 14 15.945 -6.886 27.205
119 HG LEU 14 HG LEU 14 15.836 -6.713 24.931
120 HD11 LEU 14 HD11 LEU 14 16.361 -4.490 23.725
121 HD12 LEU 14 HD12 LEU 14 14.808 -4.656 24.578
122 HD13 LEU 14 HD13 LEU 14 16.141 -3.744 25.326
123 HD21 LEU 14 HD21 LEU 14 18.174 -7.084 25.526
124 HD22 LEU 14 HD22 LEU 14 18.037 -6.168 24.006
125 HD23 LEU 14 HD23 LEU 14 18.469 -5.328 25.515
126 H VAL 15 HN VAL 15 13.408 -3.433 25.946
127 HA VAL 15 HA VAL 15 11.429 -5.564 25.527
128 HB VAL 15 HB VAL 15 10.894 -2.609 25.356
129 HG11 VAL 15 HG11 VAL 15 8.756 -3.203 25.050
130 HG12 VAL 15 HG12 VAL 15 9.365 -4.852 24.768
131 HG13 VAL 15 HG13 VAL 15 8.805 -4.375 26.389
132 HG21 VAL 15 HG21 VAL 15 11.328 -2.399 27.543
133 HG22 VAL 15 HG22 VAL 15 9.897 -3.421 27.821
134 HG23 VAL 15 HG23 VAL 15 11.517 -4.156 27.756
135 H ARG 16 HN ARG 16 12.331 -6.451 23.634
136 HA ARG 16 HA ARG 16 12.896 -4.603 21.505
137 HB2 ARG 16 HB2 ARG 16 13.143 -7.653 21.621
138 HB3 ARG 16 HB3 ARG 16 13.720 -6.651 20.304
139 HG2 ARG 16 HG2 ARG 16 15.191 -5.415 21.978
140 HG3 ARG 16 HG3 ARG 16 14.695 -6.573 23.197
141 HD2 ARG 16 HD2 ARG 16 16.824 -7.319 22.265
142 HD3 ARG 16 HD3 ARG 16 15.581 -8.440 21.745
143 HE ARG 16 HE ARG 16 15.590 -6.658 19.671
144 HH11 ARG 16 HH22 ARG 16 18.238 -8.341 21.318
145 HH12 ARG 16 HH21 ARG 16 19.258 -8.367 19.918
146 HH22 ARG 16 HH1 ARG 16 18.471 -7.393 17.874
147 H TYR 17 HN TYR 17 11.272 -4.020 20.099
148 HA TYR 17 HA TYR 17 9.029 -5.893 19.798
149 HB2 TYR 17 HB2 TYR 17 9.082 -3.276 20.602
150 HB3 TYR 17 HB3 TYR 17 9.117 -2.992 18.874
151 HD1 TYR 17 HD1 TYR 17 7.202 -3.719 17.444
152 HD2 TYR 17 HD2 TYR 17 7.074 -4.011 21.710
153 HE1 TYR 17 HE1 TYR 17 4.673 -3.967 17.358
154 HE2 TYR 17 HE2 TYR 17 4.545 -4.258 21.610
155 HH TYR 17 HH TYR 17 2.791 -4.286 20.358
156 H ARG 18 HN ARG 18 8.080 -6.160 17.649
157 HA ARG 18 HA ARG 18 9.668 -5.205 15.468
158 HB2 ARG 18 HB2 ARG 18 9.627 -7.714 14.561
159 HB3 ARG 18 HB3 ARG 18 10.918 -7.180 15.620
160 HG2 ARG 18 HG2 ARG 18 10.272 -8.592 17.286
161 HG3 ARG 18 HG3 ARG 18 8.597 -8.091 17.170
162 HD2 ARG 18 HD2 ARG 18 9.719 -9.871 14.996
163 HD3 ARG 18 HD3 ARG 18 9.331 -10.590 16.547
164 HE ARG 18 HE ARG 18 7.095 -9.019 15.850
165 HH11 ARG 18 HH22 ARG 18 8.800 -11.821 14.511
166 HH12 ARG 18 HH21 ARG 18 7.388 -12.473 13.750
167 HH22 ARG 18 HH1 ARG 18 5.300 -11.314 13.960
168 H ARG 19 HN ARG 19 7.793 -4.109 14.713
169 HA ARG 19 HA ARG 19 5.455 -5.767 14.309
170 HB2 ARG 19 HB2 ARG 19 5.542 -3.323 15.403
171 HB3 ARG 19 HB3 ARG 19 5.526 -2.792 13.733
172 HG2 ARG 19 HG2 ARG 19 3.514 -4.895 14.429
173 HG3 ARG 19 HG3 ARG 19 3.262 -3.335 15.186
174 HD2 ARG 19 HD2 ARG 19 3.540 -2.293 12.836
175 HD3 ARG 19 HD3 ARG 19 3.458 -3.923 12.199
176 HE ARG 19 HE ARG 19 1.228 -3.831 13.799
177 HH11 ARG 19 HH22 ARG 19 2.433 -1.649 11.281
178 HH12 ARG 19 HH21 ARG 19 0.854 -1.107 10.821
179 HH22 ARG 19 HH1 ARG 19 -1.066 -1.983 11.958
180 H CYS 20 HN CYS 20 4.334 -5.709 12.181
181 HA CYS 20 HA CYS 20 5.837 -4.586 9.990
182 HB2 CYS 20 HB2 CYS 20 5.421 -7.560 10.302
183 HB3 CYS 20 HB3 CYS 20 5.737 -6.800 8.755
184 H TRP 21 HN TRP 21 4.472 -5.302 7.843
185 HA TRP 21 HA TRP 21 1.751 -4.549 8.477
186 HB2 TRP 21 HB2 TRP 21 1.652 -3.696 6.411
187 HB3 TRP 21 HB3 TRP 21 3.400 -3.738 6.536
188 HD1 TRP 21 HD1 TRP 21 1.490 -4.135 3.786
189 HE1 TRP 21 HE1 TRP 21 2.008 -6.130 2.139
190 HE3 TRP 21 HE3 TRP 21 4.085 -6.929 7.150
191 HZ2 TRP 21 HZ2 TRP 21 3.414 -8.598 2.421
192 HZ3 TRP 21 HZ3 TRP 21 4.997 -9.118 6.383
193 HH2 TRP 21 HH2 TRP 21 4.697 -9.963 4.109
194 H1 ARG 31 HN ARG 31 8.369 -0.968 2.924
195 HA ARG 31 HA ARG 31 9.390 1.679 3.340
196 HB2 ARG 31 HB2 ARG 31 6.582 0.835 4.003
197 HB3 ARG 31 HB3 ARG 31 7.415 1.768 5.230
198 HG2 ARG 31 HG2 ARG 31 6.177 3.268 3.707
199 HG3 ARG 31 HG3 ARG 31 7.900 3.559 3.577
200 HD2 ARG 31 HD2 ARG 31 6.921 3.477 1.324
201 HD3 ARG 31 HD3 ARG 31 7.990 2.105 1.536
202 HE ARG 31 HE ARG 31 5.179 1.576 2.238
203 HH11 ARG 31 HH22 ARG 31 7.632 1.471 -0.316
204 HH12 ARG 31 HH21 ARG 31 6.778 0.295 -1.259
205 HH22 ARG 31 HH1 ARG 31 4.676 -0.541 -0.469
206 H TRP 32 HN TRP 32 10.473 1.874 5.392
207 HA TRP 32 HA TRP 32 10.321 -0.466 7.141
208 HB2 TRP 32 HB2 TRP 32 12.686 0.465 5.604
209 HB3 TRP 32 HB3 TRP 32 12.956 0.016 7.276
210 HD1 TRP 32 HD1 TRP 32 12.258 -1.536 3.876
211 HE1 TRP 32 HE1 TRP 32 12.326 -4.173 3.959
212 HE3 TRP 32 HE3 TRP 32 12.401 -1.897 8.946
213 HZ2 TRP 32 HZ2 TRP 32 12.431 -6.070 6.087
214 HZ3 TRP 32 HZ3 TRP 32 12.485 -4.179 9.946
215 HH2 TRP 32 HH2 TRP 32 12.501 -6.221 8.603
216 H CYS 33 HN CYS 33 10.951 0.058 9.360
217 HA CYS 33 HA CYS 33 11.504 2.841 9.898
218 HB2 CYS 33 HB2 CYS 33 8.889 1.548 10.462
219 HB3 CYS 33 HB3 CYS 33 9.571 2.533 11.741
220 H VAL 34 HN VAL 34 12.190 3.107 12.218
221 HA VAL 34 HA VAL 34 12.593 0.659 13.698
222 HB VAL 34 HB VAL 34 14.982 0.887 13.847
223 HG11 VAL 34 HG11 VAL 34 13.932 -0.411 11.949
224 HG12 VAL 34 HG12 VAL 34 14.254 0.993 10.905
225 HG13 VAL 34 HG13 VAL 34 15.606 0.124 11.670
226 HG21 VAL 34 HG21 VAL 34 14.543 3.372 12.195
227 HG22 VAL 34 HG22 VAL 34 15.471 3.166 13.700
228 HG23 VAL 34 HG23 VAL 34 16.105 2.518 12.168
229 H TYR 35 HN TYR 35 12.106 1.112 15.780
230 HA TYR 35 HA TYR 35 12.707 3.825 16.731
231 HB2 TYR 35 HB2 TYR 35 10.198 2.959 16.048
232 HB3 TYR 35 HB3 TYR 35 10.282 2.223 17.636
233 HD1 TYR 35 HD2 TYR 35 11.642 5.529 16.532
234 HD2 TYR 35 HD1 TYR 35 8.758 3.460 18.921
235 HE1 TYR 35 HE2 TYR 35 10.933 7.728 17.595
236 HE2 TYR 35 HE1 TYR 35 8.060 5.665 19.975
237 HH TYR 35 HH TYR 35 8.257 8.288 18.958
238 H ALA 36 HN ALA 36 14.218 3.597 18.305
239 HA ALA 36 HA ALA 36 13.773 1.428 20.234
240 HB1 ALA 36 HB1 ALA 36 16.336 1.354 20.360
241 HB2 ALA 36 HB2 ALA 36 15.591 0.659 18.900
242 HB3 ALA 36 HB3 ALA 36 16.331 2.277 18.838
243 H TYR 37 HN TYR 37 14.468 1.923 22.419
244 HA TYR 37 HA TYR 37 15.136 4.736 22.871
245 HB2 TYR 37 HB2 TYR 37 12.585 4.064 23.018
246 HB3 TYR 37 HB3 TYR 37 13.037 3.095 24.406
247 HD1 TYR 37 HD1 TYR 37 14.087 4.269 26.423
248 HD2 TYR 37 HD2 TYR 37 12.175 6.387 23.236
249 HE1 TYR 37 HE1 TYR 37 13.831 6.307 27.922
250 HE2 TYR 37 HE2 TYR 37 11.924 8.418 24.745
251 HH TYR 37 HH TYR 37 12.579 8.233 28.137
252 H VAL 38 HN VAL 38 17.294 3.847 23.301
253 HA VAL 38 HA VAL 38 17.398 2.245 25.754
254 HB VAL 38 HB VAL 38 19.440 2.751 23.581
255 HG11 VAL 38 HG11 VAL 38 20.578 2.504 25.709
256 HG12 VAL 38 HG12 VAL 38 19.624 1.051 26.090
257 HG13 VAL 38 HG13 VAL 38 20.793 1.021 24.748
258 HG21 VAL 38 HG21 VAL 38 19.018 0.051 23.662
259 HG22 VAL 38 HG22 VAL 38 17.392 0.672 24.034
260 HG23 VAL 38 HG23 VAL 38 18.214 1.172 22.537
261 H ARG 39 HN ARG 39 18.635 2.947 27.546
262 HA ARG 39 HA ARG 39 19.640 5.659 27.296
263 HB2 ARG 39 HB2 ARG 39 17.292 5.341 28.495
264 HB3 ARG 39 HB3 ARG 39 18.248 4.741 29.835
265 HG2 ARG 39 HG2 ARG 39 19.534 6.850 29.920
266 HG3 ARG 39 HG3 ARG 39 18.708 7.447 28.495
267 HD2 ARG 39 HD2 ARG 39 17.222 8.397 29.944
268 HD3 ARG 39 HD3 ARG 39 16.570 6.784 30.150
269 HE ARG 39 HE ARG 39 17.590 6.647 32.267
270 HH11 ARG 39 HH22 ARG 39 18.892 9.435 30.510
271 HH12 ARG 39 HH21 ARG 39 19.724 10.073 31.889
272 HH22 ARG 39 HH1 ARG 39 19.590 8.911 33.981
273 H ILE 40 HN ILE 40 21.592 6.040 28.435
274 HA ILE 40 HA ILE 40 22.479 3.974 30.284
275 HB ILE 40 HB ILE 40 23.982 4.800 27.800
276 HG12 ILE 40 HG12 ILE 40 22.400 2.426 28.587
277 HG13 ILE 40 HG13 ILE 40 22.718 3.099 27.001
278 HG21 ILE 40 HG21 ILE 40 25.428 4.698 29.835
279 HG22 ILE 40 HG22 ILE 40 24.955 2.993 30.026
280 HG23 ILE 40 HG23 ILE 40 25.846 3.513 28.575
281 HD11 ILE 40 HD11 ILE 40 25.120 2.239 27.220
282 HD12 ILE 40 HD12 ILE 40 24.584 1.371 28.678
283 HD13 ILE 40 HD13 ILE 40 23.868 0.981 27.096
284 H ARG 41 HN ARG 41 24.099 4.725 31.779
285 HA ARG 41 HA ARG 41 24.836 6.205 33.179
286 HB2 ARG 41 HB2 ARG 41 25.551 7.543 30.537
287 HB3 ARG 41 HB3 ARG 41 26.038 8.253 32.063
288 HG2 ARG 41 HG2 ARG 41 26.696 5.393 31.212
289 HG3 ARG 41 HG3 ARG 41 27.793 6.749 31.041
290 HD2 ARG 41 HD2 ARG 41 26.720 6.603 33.773
291 HD3 ARG 41 HD3 ARG 41 27.489 5.095 33.319
292 HE ARG 41 HE ARG 41 29.319 6.971 32.463
293 HH11 ARG 41 HH22 ARG 41 27.682 6.453 35.563
294 HH12 ARG 41 HH21 ARG 41 28.980 7.116 36.500
295 HH22 ARG 41 HH1 ARG 41 30.939 7.927 35.383
296 H GLY 42 HN GLY 42 24.082 8.796 30.799
297 HA2 GLY 42 HA1 GLY 42 21.644 9.541 32.205
298 HA3 GLY 42 HA2 GLY 42 22.992 10.649 32.364
299 H VAL 43 HN VAL 43 22.375 8.617 29.468
300 HA VAL 43 HA VAL 43 21.442 11.002 28.054
301 HB VAL 43 HB VAL 43 23.386 9.200 26.695
302 HG11 VAL 43 HG11 VAL 43 23.888 11.951 26.233
303 HG12 VAL 43 HG12 VAL 43 23.129 10.773 25.136
304 HG13 VAL 43 HG13 VAL 43 22.120 11.744 26.235
305 HG21 VAL 43 HG21 VAL 43 24.117 11.198 28.843
306 HG22 VAL 43 HG22 VAL 43 24.667 9.516 28.645
307 HG23 VAL 43 HG23 VAL 43 25.238 10.778 27.526
308 H LEU 44 HN LEU 44 19.637 10.577 26.880
309 HA LEU 44 HA LEU 44 18.943 7.755 26.561
310 HB2 LEU 44 HB2 LEU 44 17.165 8.645 27.621
311 HB3 LEU 44 HB3 LEU 44 17.451 10.263 27.010
312 HG LEU 44 HG LEU 44 16.511 9.589 24.816
313 HD11 LEU 44 HD11 LEU 44 15.063 7.266 25.455
314 HD12 LEU 44 HD12 LEU 44 16.389 7.440 24.280
315 HD13 LEU 44 HD13 LEU 44 16.742 6.949 25.954
316 HD21 LEU 44 HD21 LEU 44 14.792 9.263 27.280
317 HD22 LEU 44 HD22 LEU 44 15.031 10.714 26.278
318 HD23 LEU 44 HD23 LEU 44 14.129 9.324 25.630
319 H VAL 45 HN VAL 45 19.198 6.802 24.619
320 HA VAL 45 HA VAL 45 19.517 8.585 22.315
321 HB VAL 45 HB VAL 45 20.256 5.673 22.441
322 HG11 VAL 45 HG11 VAL 45 20.864 8.013 20.673
323 HG12 VAL 45 HG12 VAL 45 22.103 6.751 20.870
324 HG13 VAL 45 HG13 VAL 45 20.490 6.325 20.250
325 HG21 VAL 45 HG21 VAL 45 22.636 6.719 22.918
326 HG22 VAL 45 HG22 VAL 45 21.673 8.008 23.680
327 HG23 VAL 45 HG23 VAL 45 21.522 6.329 24.251
328 H ARG 46 HN ARG 46 17.573 8.918 21.335
329 HA ARG 46 HA ARG 46 15.847 6.590 21.133
330 HB2 ARG 46 HB2 ARG 46 15.119 9.525 20.676
331 HB3 ARG 46 HB3 ARG 46 13.996 8.184 20.779
332 HG2 ARG 46 HG2 ARG 46 14.523 7.816 23.131
333 HG3 ARG 46 HG3 ARG 46 15.872 8.933 23.065
334 HD2 ARG 46 HD2 ARG 46 13.314 10.151 22.187
335 HD3 ARG 46 HD3 ARG 46 13.270 9.581 23.843
336 HE ARG 46 HE ARG 46 15.693 11.106 23.202
337 HH11 ARG 46 HH22 ARG 46 12.340 11.329 24.327
338 HH12 ARG 46 HH21 ARG 46 12.576 12.854 25.114
339 HH22 ARG 46 HH1 ARG 46 14.738 13.886 25.051
340 H TYR 47 HN TYR 47 15.913 5.567 19.157
341 HA TYR 47 HA TYR 47 16.783 7.140 16.849
342 HB2 TYR 47 HB2 TYR 47 17.857 4.916 17.648
343 HB3 TYR 47 HB3 TYR 47 16.330 4.126 17.308
344 HD1 TYR 47 HD1 TYR 47 17.852 6.787 15.203
345 HD2 TYR 47 HD2 TYR 47 17.073 2.602 15.633
346 HE1 TYR 47 HE1 TYR 47 18.584 6.397 12.800
347 HE2 TYR 47 HE2 TYR 47 17.808 2.226 13.228
348 HH TYR 47 HH TYR 47 19.585 4.313 11.541
349 H ARG 48 HN ARG 48 15.529 7.386 14.998
350 HA ARG 48 HA ARG 48 13.064 5.929 14.870
351 HB2 ARG 48 HB2 ARG 48 12.002 8.360 14.288
352 HB3 ARG 48 HB3 ARG 48 11.968 7.687 15.906
353 HG2 ARG 48 HG2 ARG 48 14.490 9.122 15.269
354 HG3 ARG 48 HG3 ARG 48 13.069 10.146 15.214
355 HD2 ARG 48 HD2 ARG 48 12.456 9.556 17.504
356 HD3 ARG 48 HD3 ARG 48 13.672 8.295 17.567
357 HE ARG 48 HE ARG 48 15.348 9.926 17.898
358 HH11 ARG 48 HH22 ARG 48 12.292 11.499 17.036
359 HH12 ARG 48 HH21 ARG 48 12.853 13.087 17.438
360 HH22 ARG 48 HH1 ARG 48 15.089 13.371 18.254
361 H ARG 49 HN ARG 49 14.530 5.110 13.055
362 HA ARG 49 HA ARG 49 14.699 7.022 10.885
363 HB2 ARG 49 HB2 ARG 49 16.738 5.652 11.629
364 HB3 ARG 49 HB3 ARG 49 15.915 4.220 11.043
365 HG2 ARG 49 HG2 ARG 49 16.328 6.640 9.245
366 HG3 ARG 49 HG3 ARG 49 17.580 5.429 9.432
367 HD2 ARG 49 HD2 ARG 49 15.099 4.035 8.966
368 HD3 ARG 49 HD3 ARG 49 15.212 5.316 7.776
369 HE ARG 49 HE ARG 49 16.982 2.979 8.010
370 HH11 ARG 49 HH22 ARG 49 16.589 6.218 6.629
371 HH12 ARG 49 HH21 ARG 49 17.749 5.957 5.369
372 HH22 ARG 49 HH1 ARG 49 18.868 3.842 5.223
373 H CYS 50 HN CYS 50 13.911 6.420 8.720
374 HA CYS 50 HA CYS 50 12.324 4.019 8.548
375 HB2 CYS 50 HB2 CYS 50 11.090 6.769 8.340
376 HB3 CYS 50 HB3 CYS 50 10.341 5.322 7.696
377 H TRP 51 HN TRP 51 11.978 3.423 6.304
378 HA TRP 51 HA TRP 51 13.220 5.223 4.353
379 HB2 TRP 51 HB2 TRP 51 14.990 3.762 4.762
380 HB3 TRP 51 HB3 TRP 51 13.942 2.367 4.930
381 HD1 TRP 51 HD1 TRP 51 16.144 3.973 2.420
382 HE1 TRP 51 HE1 TRP 51 15.873 2.975 -0.008
383 HE3 TRP 51 HE3 TRP 51 11.822 1.465 3.364
384 HZ2 TRP 51 HZ2 TRP 51 13.927 1.287 -1.233
385 HZ3 TRP 51 HZ3 TRP 51 10.802 0.166 1.497
386 HH2 TRP 51 HH2 TRP 51 11.784 0.052 -0.739
Start of MODEL 16
1 H1 ARG 1 HN ARG 1 10.207 -7.336 0.896
2 HA ARG 1 HA ARG 1 7.464 -7.059 1.791
3 HB2 ARG 1 HB2 ARG 1 9.846 -8.668 2.707
4 HB3 ARG 1 HB3 ARG 1 8.687 -8.190 3.931
5 HG2 ARG 1 HG2 ARG 1 7.369 -9.229 1.503
6 HG3 ARG 1 HG3 ARG 1 8.465 -10.400 2.209
7 HD2 ARG 1 HD2 ARG 1 7.258 -9.586 4.493
8 HD3 ARG 1 HD3 ARG 1 5.965 -9.192 3.378
9 HE ARG 1 HE ARG 1 5.572 -11.477 3.059
10 HH11 ARG 1 HH22 ARG 1 8.783 -11.066 4.500
11 HH12 ARG 1 HH21 ARG 1 9.025 -12.763 4.747
12 HH22 ARG 1 HH1 ARG 1 7.313 -14.303 4.084
13 H TRP 2 HN TRP 2 7.113 -6.026 3.986
14 HA TRP 2 HA TRP 2 9.254 -4.156 4.699
15 HB2 TRP 2 HB2 TRP 2 6.443 -3.175 4.759
16 HB3 TRP 2 HB3 TRP 2 7.945 -2.289 4.588
17 HD1 TRP 2 HD1 TRP 2 5.200 -3.854 2.502
18 HE1 TRP 2 HE1 TRP 2 5.574 -3.480 -0.083
19 HE3 TRP 2 HE3 TRP 2 9.961 -2.114 2.907
20 HZ2 TRP 2 HZ2 TRP 2 7.769 -2.520 -1.634
21 HZ3 TRP 2 HZ3 TRP 2 11.149 -1.481 0.809
22 HH2 TRP 2 HH2 TRP 2 10.129 -1.661 -1.405
23 H CYS 3 HN CYS 3 9.361 -3.741 6.956
24 HA CYS 3 HA CYS 3 7.276 -4.843 8.618
25 HB2 CYS 3 HB2 CYS 3 10.092 -5.928 8.620
26 HB3 CYS 3 HB3 CYS 3 9.024 -6.072 10.002
27 H VAL 4 HN VAL 4 8.417 -4.549 11.101
28 HA VAL 4 HA VAL 4 9.808 -1.983 11.084
29 HB VAL 4 HB VAL 4 8.227 -0.835 12.217
30 HG11 VAL 4 HG11 VAL 4 5.924 -1.415 11.414
31 HG12 VAL 4 HG12 VAL 4 7.155 -1.372 10.129
32 HG13 VAL 4 HG13 VAL 4 6.585 -2.934 10.764
33 HG21 VAL 4 HG21 VAL 4 7.486 -3.481 13.445
34 HG22 VAL 4 HG22 VAL 4 8.003 -1.969 14.230
35 HG23 VAL 4 HG23 VAL 4 6.364 -2.103 13.550
36 H TYR 5 HN TYR 5 11.383 -1.863 12.646
37 HA TYR 5 HA TYR 5 11.354 -4.005 14.663
38 HB2 TYR 5 HB2 TYR 5 13.394 -2.934 12.682
39 HB3 TYR 5 HB3 TYR 5 14.012 -3.410 14.251
40 HD1 TYR 5 HD2 TYR 5 11.474 -4.879 11.895
41 HD2 TYR 5 HD1 TYR 5 15.047 -5.477 14.170
42 HE1 TYR 5 HE2 TYR 5 11.562 -7.303 11.132
43 HE2 TYR 5 HE1 TYR 5 15.124 -7.899 13.399
44 HH TYR 5 HH TYR 5 13.967 -9.066 11.015
45 H ALA 6 HN ALA 6 11.366 -3.257 16.722
46 HA ALA 6 HA ALA 6 12.604 -0.634 17.175
47 HB1 ALA 6 HB1 ALA 6 10.458 -1.019 19.020
48 HB2 ALA 6 HB2 ALA 6 10.605 0.214 17.744
49 HB3 ALA 6 HB3 ALA 6 9.823 -1.345 17.389
50 H TYR 7 HN TYR 7 13.739 -0.432 19.146
51 HA TYR 7 HA TYR 7 13.719 -2.749 20.915
52 HB2 TYR 7 HB2 TYR 7 15.506 -3.007 19.096
53 HB3 TYR 7 HB3 TYR 7 16.162 -1.447 19.554
54 HD1 TYR 7 HD2 TYR 7 16.791 -1.248 22.157
55 HD2 TYR 7 HD1 TYR 7 16.509 -4.912 19.966
56 HE1 TYR 7 HE2 TYR 7 18.300 -2.389 23.856
57 HE2 TYR 7 HE1 TYR 7 18.018 -6.041 21.672
58 HH TYR 7 HH TYR 7 19.644 -4.194 24.141
59 H VAL 8 HN VAL 8 13.200 -1.831 22.844
60 HA VAL 8 HA VAL 8 14.494 0.733 23.465
61 HB VAL 8 HB VAL 8 11.873 -0.478 24.350
62 HG11 VAL 8 HG11 VAL 8 13.587 1.482 25.689
63 HG12 VAL 8 HG12 VAL 8 11.955 2.109 25.350
64 HG13 VAL 8 HG13 VAL 8 12.156 0.610 26.290
65 HG21 VAL 8 HG21 VAL 8 10.810 1.171 23.110
66 HG22 VAL 8 HG22 VAL 8 12.236 2.236 23.102
67 HG23 VAL 8 HG23 VAL 8 12.207 0.779 22.080
68 H ARG 9 HN ARG 9 15.512 0.987 25.505
69 HA ARG 9 HA ARG 9 15.492 -1.236 27.283
70 HB2 ARG 9 HB2 ARG 9 17.285 -2.194 26.146
71 HB3 ARG 9 HB3 ARG 9 17.810 -0.667 25.465
72 HG2 ARG 9 HG2 ARG 9 18.863 0.010 27.541
73 HG3 ARG 9 HG3 ARG 9 18.098 -1.290 28.434
74 HD2 ARG 9 HD2 ARG 9 19.802 -2.705 27.931
75 HD3 ARG 9 HD3 ARG 9 19.566 -2.444 26.214
76 HE ARG 9 HE ARG 9 20.892 -0.168 26.875
77 HH11 ARG 9 HH22 ARG 9 21.554 -3.535 27.760
78 HH12 ARG 9 HH21 ARG 9 23.263 -3.292 27.897
79 HH22 ARG 9 HH1 ARG 9 24.178 -1.117 27.479
80 H ILE 10 HN ILE 10 15.191 -0.164 29.213
81 HA ILE 10 HA ILE 10 16.994 2.042 29.811
82 HB ILE 10 HB ILE 10 14.102 2.395 30.461
83 HG12 ILE 10 HG12 ILE 10 15.356 2.818 27.748
84 HG13 ILE 10 HG13 ILE 10 13.872 1.976 28.148
85 HG21 ILE 10 HG21 ILE 10 15.683 4.700 29.618
86 HG22 ILE 10 HG22 ILE 10 14.740 4.431 31.104
87 HG23 ILE 10 HG23 ILE 10 16.410 3.825 30.988
88 HD11 ILE 10 HD11 ILE 10 13.073 4.038 27.345
89 HD12 ILE 10 HD12 ILE 10 13.088 4.307 29.104
90 HD13 ILE 10 HD13 ILE 10 14.402 4.956 28.094
91 H ARG 11 HN ARG 11 17.375 2.318 32.075
92 HA ARG 11 HA ARG 11 17.645 1.649 34.110
93 HB2 ARG 11 HB2 ARG 11 14.876 0.418 33.713
94 HB3 ARG 11 HB3 ARG 11 15.693 0.416 35.264
95 HG2 ARG 11 HG2 ARG 11 14.916 2.880 33.635
96 HG3 ARG 11 HG3 ARG 11 14.164 2.343 35.124
97 HD2 ARG 11 HD2 ARG 11 16.918 2.511 35.756
98 HD3 ARG 11 HD3 ARG 11 16.619 3.914 34.750
99 HE ARG 11 HE ARG 11 15.412 3.356 37.395
100 HH11 ARG 11 HH22 ARG 11 15.427 5.413 34.511
101 HH12 ARG 11 HH21 ARG 11 14.598 6.721 35.287
102 HH22 ARG 11 HH1 ARG 11 13.956 6.504 37.586
103 H GLY 12 HN GLY 12 15.667 -1.226 33.123
104 HA2 GLY 12 HA1 GLY 12 17.956 -2.890 32.659
105 HA3 GLY 12 HA2 GLY 12 17.235 -3.170 34.231
106 H VAL 13 HN VAL 13 15.284 -2.033 31.472
107 HA VAL 13 HA VAL 13 14.161 -4.739 31.253
108 HB VAL 13 HB VAL 13 12.648 -2.121 31.188
109 HG11 VAL 13 HG11 VAL 13 10.782 -4.044 31.601
110 HG12 VAL 13 HG12 VAL 13 11.229 -3.424 29.994
111 HG13 VAL 13 HG13 VAL 13 11.943 -4.941 30.592
112 HG21 VAL 13 HG21 VAL 13 11.625 -3.205 33.343
113 HG22 VAL 13 HG22 VAL 13 13.164 -4.099 33.396
114 HG23 VAL 13 HG23 VAL 13 13.166 -2.319 33.440
115 H LEU 14 HN LEU 14 14.221 -5.549 29.217
116 HA LEU 14 HA LEU 14 14.858 -3.648 27.086
117 HB2 LEU 14 HB2 LEU 14 16.475 -5.415 27.460
118 HB3 LEU 14 HB3 LEU 14 15.231 -6.638 27.296
119 HG LEU 14 HG LEU 14 15.163 -6.491 25.015
120 HD11 LEU 14 HD11 LEU 14 14.458 -4.278 24.673
121 HD12 LEU 14 HD12 LEU 14 15.967 -3.599 25.328
122 HD13 LEU 14 HD13 LEU 14 15.973 -4.424 23.751
123 HD21 LEU 14 HD21 LEU 14 17.425 -6.327 24.117
124 HD22 LEU 14 HD22 LEU 14 17.966 -5.492 25.593
125 HD23 LEU 14 HD23 LEU 14 17.419 -7.184 25.678
126 H VAL 15 HN VAL 15 13.151 -2.930 25.938
127 HA VAL 15 HA VAL 15 10.921 -4.811 25.583
128 HB VAL 15 HB VAL 15 10.725 -1.833 25.263
129 HG11 VAL 15 HG11 VAL 15 8.523 -2.209 25.082
130 HG12 VAL 15 HG12 VAL 15 8.943 -3.928 24.891
131 HG13 VAL 15 HG13 VAL 15 8.507 -3.291 26.495
132 HG21 VAL 15 HG21 VAL 15 11.333 -1.560 27.411
133 HG22 VAL 15 HG22 VAL 15 9.755 -2.285 27.801
134 HG23 VAL 15 HG23 VAL 15 11.217 -3.300 27.764
135 H ARG 16 HN ARG 16 11.671 -5.873 23.720
136 HA ARG 16 HA ARG 16 12.431 -4.170 21.521
137 HB2 ARG 16 HB2 ARG 16 12.454 -7.213 21.844
138 HB3 ARG 16 HB3 ARG 16 13.004 -6.382 20.403
139 HG2 ARG 16 HG2 ARG 16 14.612 -5.063 21.943
140 HG3 ARG 16 HG3 ARG 16 14.193 -6.206 23.203
141 HD2 ARG 16 HD2 ARG 16 16.087 -6.539 21.049
142 HD3 ARG 16 HD3 ARG 16 15.749 -7.636 22.374
143 HE ARG 16 HE ARG 16 14.777 -7.873 19.642
144 HH11 ARG 16 HH22 ARG 16 13.988 -8.658 23.006
145 HH12 ARG 16 HH21 ARG 16 12.976 -9.999 22.586
146 HH22 ARG 16 HH1 ARG 16 12.670 -10.560 20.276
147 H TYR 17 HN TYR 17 10.821 -3.478 20.149
148 HA TYR 17 HA TYR 17 8.410 -5.132 19.954
149 HB2 TYR 17 HB2 TYR 17 8.772 -2.480 20.514
150 HB3 TYR 17 HB3 TYR 17 8.841 -2.359 18.767
151 HD1 TYR 17 HD1 TYR 17 6.683 -3.371 21.615
152 HD2 TYR 17 HD2 TYR 17 6.860 -2.474 17.435
153 HE1 TYR 17 HE1 TYR 17 4.143 -3.320 21.511
154 HE2 TYR 17 HE2 TYR 17 4.320 -2.426 17.345
155 HH TYR 17 HH TYR 17 2.401 -2.984 20.287
156 H ARG 18 HN ARG 18 7.391 -5.406 17.815
157 HA ARG 18 HA ARG 18 9.130 -4.928 15.585
158 HB2 ARG 18 HB2 ARG 18 8.237 -7.730 16.424
159 HB3 ARG 18 HB3 ARG 18 8.842 -7.367 14.820
160 HG2 ARG 18 HG2 ARG 18 10.440 -6.656 17.311
161 HG3 ARG 18 HG3 ARG 18 10.540 -8.249 16.590
162 HD2 ARG 18 HD2 ARG 18 10.833 -5.981 14.666
163 HD3 ARG 18 HD3 ARG 18 12.119 -6.115 15.849
164 HE ARG 18 HE ARG 18 11.528 -8.008 13.686
165 HH11 ARG 18 HH22 ARG 18 13.155 -7.580 16.804
166 HH12 ARG 18 HH21 ARG 18 14.255 -8.895 16.551
167 HH22 ARG 18 HH1 ARG 18 14.132 -10.152 14.514
168 H ARG 19 HN ARG 19 7.872 -6.022 13.499
169 HA ARG 19 HA ARG 19 5.158 -6.376 13.669
170 HB2 ARG 19 HB2 ARG 19 5.521 -3.776 14.221
171 HB3 ARG 19 HB3 ARG 19 5.667 -3.637 12.480
172 HG2 ARG 19 HG2 ARG 19 3.403 -3.611 12.357
173 HG3 ARG 19 HG3 ARG 19 3.406 -5.291 12.855
174 HD2 ARG 19 HD2 ARG 19 2.882 -4.790 15.074
175 HD3 ARG 19 HD3 ARG 19 3.701 -3.242 15.036
176 HE ARG 19 HE ARG 19 1.690 -2.250 14.401
177 HH11 ARG 19 HH22 ARG 19 1.548 -5.685 13.543
178 HH12 ARG 19 HH21 ARG 19 -0.099 -5.611 13.010
179 HH22 ARG 19 HH1 ARG 19 -1.273 -3.524 13.111
180 H CYS 20 HN CYS 20 4.145 -6.452 11.423
181 HA CYS 20 HA CYS 20 6.012 -6.168 9.244
182 HB2 CYS 20 HB2 CYS 20 5.087 -8.819 10.265
183 HB3 CYS 20 HB3 CYS 20 5.214 -8.594 8.532
184 H TRP 21 HN TRP 21 4.840 -6.245 7.141
185 HA TRP 21 HA TRP 21 2.028 -5.548 7.532
186 HB2 TRP 21 HB2 TRP 21 3.111 -3.815 6.435
187 HB3 TRP 21 HB3 TRP 21 4.094 -4.891 5.462
188 HD1 TRP 21 HD1 TRP 21 0.802 -3.036 5.371
189 HE1 TRP 21 HE1 TRP 21 -0.506 -3.422 3.112
190 HE3 TRP 21 HE3 TRP 21 3.740 -6.839 3.710
191 HZ2 TRP 21 HZ2 TRP 21 -0.172 -5.234 0.933
192 HZ3 TRP 21 HZ3 TRP 21 3.180 -7.862 1.507
193 HH2 TRP 21 HH2 TRP 21 1.301 -7.119 0.133
194 H1 ARG 31 HN ARG 31 6.019 -1.028 6.087
195 HA ARG 31 HA ARG 31 7.893 -0.067 4.096
196 HB2 ARG 31 HB2 ARG 31 6.459 1.528 6.203
197 HB3 ARG 31 HB3 ARG 31 8.160 1.892 5.985
198 HG2 ARG 31 HG2 ARG 31 7.454 3.259 4.297
199 HG3 ARG 31 HG3 ARG 31 7.323 1.785 3.358
200 HD2 ARG 31 HD2 ARG 31 5.212 3.012 3.181
201 HD3 ARG 31 HD3 ARG 31 4.927 1.547 4.099
202 HE ARG 31 HE ARG 31 5.622 3.702 5.888
203 HH11 ARG 31 HH22 ARG 31 2.944 2.520 3.892
204 HH12 ARG 31 HH21 ARG 31 1.723 3.267 4.868
205 HH22 ARG 31 HH1 ARG 31 2.375 4.537 6.793
206 H TRP 32 HN TRP 32 9.869 0.994 5.732
207 HA TRP 32 HA TRP 32 10.469 -1.247 7.541
208 HB2 TRP 32 HB2 TRP 32 12.085 0.142 5.472
209 HB3 TRP 32 HB3 TRP 32 12.904 -0.278 6.963
210 HD1 TRP 32 HD1 TRP 32 12.044 -1.778 3.696
211 HE1 TRP 32 HE1 TRP 32 12.407 -4.390 3.603
212 HE3 TRP 32 HE3 TRP 32 12.494 -2.421 8.720
213 HZ2 TRP 32 HZ2 TRP 32 12.832 -6.387 5.597
214 HZ3 TRP 32 HZ3 TRP 32 12.882 -4.734 9.564
215 HH2 TRP 32 HH2 TRP 32 13.052 -6.678 8.092
216 H CYS 33 HN CYS 33 9.497 -0.183 9.366
217 HA CYS 33 HA CYS 33 10.448 2.472 9.988
218 HB2 CYS 33 HB2 CYS 33 8.272 0.695 10.951
219 HB3 CYS 33 HB3 CYS 33 8.955 1.802 12.125
220 H VAL 34 HN VAL 34 11.587 2.927 12.033
221 HA VAL 34 HA VAL 34 12.617 0.650 13.484
222 HB VAL 34 HB VAL 34 14.877 0.991 13.038
223 HG11 VAL 34 HG11 VAL 34 15.108 0.762 10.610
224 HG12 VAL 34 HG12 VAL 34 13.703 -0.155 11.204
225 HG13 VAL 34 HG13 VAL 34 13.464 1.405 10.381
226 HG21 VAL 34 HG21 VAL 34 14.030 3.659 11.917
227 HG22 VAL 34 HG22 VAL 34 15.238 3.293 13.172
228 HG23 VAL 34 HG23 VAL 34 15.591 2.933 11.465
229 H TYR 35 HN TYR 35 12.333 1.186 15.580
230 HA TYR 35 HA TYR 35 13.028 3.901 16.390
231 HB2 TYR 35 HB2 TYR 35 10.433 3.250 15.831
232 HB3 TYR 35 HB3 TYR 35 10.516 2.517 17.420
233 HD1 TYR 35 HD2 TYR 35 12.042 4.352 19.044
234 HD2 TYR 35 HD1 TYR 35 9.221 5.224 15.948
235 HE1 TYR 35 HE2 TYR 35 11.565 6.612 20.105
236 HE2 TYR 35 HE1 TYR 35 8.753 7.481 17.020
237 HH TYR 35 HH TYR 35 8.903 8.491 19.222
238 H ALA 36 HN ALA 36 14.412 3.750 18.078
239 HA ALA 36 HA ALA 36 13.923 1.627 20.029
240 HB1 ALA 36 HB1 ALA 36 16.488 1.355 20.072
241 HB2 ALA 36 HB2 ALA 36 15.617 0.632 18.699
242 HB3 ALA 36 HB3 ALA 36 16.479 2.176 18.493
243 H TYR 37 HN TYR 37 14.719 2.143 22.169
244 HA TYR 37 HA TYR 37 15.704 4.874 22.495
245 HB2 TYR 37 HB2 TYR 37 13.084 4.526 22.663
246 HB3 TYR 37 HB3 TYR 37 13.422 3.595 24.109
247 HD1 TYR 37 HD2 TYR 37 14.578 4.745 26.066
248 HD2 TYR 37 HD1 TYR 37 13.002 6.899 22.723
249 HE1 TYR 37 HE2 TYR 37 14.579 6.887 27.436
250 HE2 TYR 37 HE1 TYR 37 13.009 9.034 24.104
251 HH TYR 37 HH TYR 37 13.331 9.028 27.427
252 H VAL 38 HN VAL 38 17.718 3.634 22.927
253 HA VAL 38 HA VAL 38 17.629 2.143 25.438
254 HB VAL 38 HB VAL 38 19.722 2.406 23.273
255 HG11 VAL 38 HG11 VAL 38 20.616 0.323 24.679
256 HG12 VAL 38 HG12 VAL 38 21.099 1.995 25.057
257 HG13 VAL 38 HG13 VAL 38 19.820 1.201 26.007
258 HG21 VAL 38 HG21 VAL 38 18.291 0.936 22.301
259 HG22 VAL 38 HG22 VAL 38 19.108 -0.225 23.375
260 HG23 VAL 38 HG23 VAL 38 17.540 0.473 23.847
261 H ARG 39 HN ARG 39 18.803 2.780 27.268
262 HA ARG 39 HA ARG 39 20.263 5.262 27.002
263 HB2 ARG 39 HB2 ARG 39 17.801 5.592 27.834
264 HB3 ARG 39 HB3 ARG 39 18.330 4.827 29.319
265 HG2 ARG 39 HG2 ARG 39 20.148 6.559 29.536
266 HG3 ARG 39 HG3 ARG 39 19.554 7.340 28.084
267 HD2 ARG 39 HD2 ARG 39 17.983 8.455 29.287
268 HD3 ARG 39 HD3 ARG 39 17.304 6.943 29.855
269 HE ARG 39 HE ARG 39 19.472 7.153 31.483
270 HH11 ARG 39 HH22 ARG 39 17.039 9.567 30.583
271 HH12 ARG 39 HH21 ARG 39 17.174 10.440 32.073
272 HH22 ARG 39 HH1 ARG 39 18.716 9.680 33.743
273 H ILE 40 HN ILE 40 22.109 5.342 28.344
274 HA ILE 40 HA ILE 40 22.303 3.498 30.556
275 HB ILE 40 HB ILE 40 23.728 3.110 27.974
276 HG12 ILE 40 HG12 ILE 40 22.029 1.609 29.757
277 HG13 ILE 40 HG13 ILE 40 22.526 1.243 28.116
278 HG21 ILE 40 HG21 ILE 40 24.998 2.581 30.675
279 HG22 ILE 40 HG22 ILE 40 25.583 1.940 29.121
280 HG23 ILE 40 HG23 ILE 40 25.578 3.696 29.415
281 HD11 ILE 40 HD11 ILE 40 24.607 0.220 28.902
282 HD12 ILE 40 HD12 ILE 40 24.262 0.726 30.573
283 HD13 ILE 40 HD13 ILE 40 23.240 -0.501 29.786
284 H ARG 41 HN ARG 41 24.263 3.952 31.884
285 HA ARG 41 HA ARG 41 25.429 5.388 33.009
286 HB2 ARG 41 HB2 ARG 41 26.213 6.205 30.176
287 HB3 ARG 41 HB3 ARG 41 26.979 6.925 31.578
288 HG2 ARG 41 HG2 ARG 41 26.998 3.994 30.752
289 HG3 ARG 41 HG3 ARG 41 28.372 5.071 30.902
290 HD2 ARG 41 HD2 ARG 41 28.575 3.986 32.939
291 HD3 ARG 41 HD3 ARG 41 27.489 5.265 33.444
292 HE ARG 41 HE ARG 41 26.019 2.981 32.409
293 HH11 ARG 41 HH22 ARG 41 27.701 4.189 35.285
294 HH12 ARG 41 HH21 ARG 41 26.800 3.197 36.381
295 HH22 ARG 41 HH1 ARG 41 25.116 1.725 35.519
296 H GLY 42 HN GLY 42 24.982 7.698 30.269
297 HA2 GLY 42 HA1 GLY 42 22.885 9.153 31.622
298 HA3 GLY 42 HA2 GLY 42 24.447 9.946 31.666
299 H VAL 43 HN VAL 43 23.545 7.799 28.969
300 HA VAL 43 HA VAL 43 23.051 10.168 27.313
301 HB VAL 43 HB VAL 43 24.563 7.868 26.178
302 HG11 VAL 43 HG11 VAL 43 24.592 9.297 24.465
303 HG12 VAL 43 HG12 VAL 43 23.891 10.590 25.468
304 HG13 VAL 43 HG13 VAL 43 25.655 10.355 25.425
305 HG21 VAL 43 HG21 VAL 43 25.818 9.972 27.972
306 HG22 VAL 43 HG22 VAL 43 25.778 8.214 28.247
307 HG23 VAL 43 HG23 VAL 43 26.720 8.882 26.893
308 H LEU 44 HN LEU 44 21.163 10.017 26.214
309 HA LEU 44 HA LEU 44 19.924 7.369 26.122
310 HB2 LEU 44 HB2 LEU 44 18.377 8.654 27.135
311 HB3 LEU 44 HB3 LEU 44 18.955 10.142 26.411
312 HG LEU 44 HG LEU 44 17.835 9.569 24.297
313 HD11 LEU 44 HD11 LEU 44 16.047 7.525 25.062
314 HD12 LEU 44 HD12 LEU 44 17.324 7.464 23.823
315 HD13 LEU 44 HD13 LEU 44 17.679 6.958 25.493
316 HD21 LEU 44 HD21 LEU 44 16.676 10.915 25.997
317 HD22 LEU 44 HD22 LEU 44 15.547 9.934 25.033
318 HD23 LEU 44 HD23 LEU 44 15.974 9.430 26.686
319 H VAL 45 HN VAL 45 20.194 6.250 24.273
320 HA VAL 45 HA VAL 45 20.583 7.809 21.823
321 HB VAL 45 HB VAL 45 21.096 4.869 22.097
322 HG11 VAL 45 HG11 VAL 45 23.110 5.914 20.598
323 HG12 VAL 45 HG12 VAL 45 21.566 5.331 19.932
324 HG13 VAL 45 HG13 VAL 45 21.802 7.068 20.241
325 HG21 VAL 45 HG21 VAL 45 23.526 5.633 22.658
326 HG22 VAL 45 HG22 VAL 45 22.736 7.105 23.271
327 HG23 VAL 45 HG23 VAL 45 22.322 5.519 23.964
328 H ARG 46 HN ARG 46 18.453 8.291 21.231
329 HA ARG 46 HA ARG 46 16.760 5.948 20.898
330 HB2 ARG 46 HB2 ARG 46 15.009 8.016 20.599
331 HB3 ARG 46 HB3 ARG 46 15.378 7.307 22.158
332 HG2 ARG 46 HG2 ARG 46 17.178 9.025 22.501
333 HG3 ARG 46 HG3 ARG 46 16.776 9.743 20.954
334 HD2 ARG 46 HD2 ARG 46 14.784 9.441 23.253
335 HD3 ARG 46 HD3 ARG 46 15.706 10.900 22.948
336 HE ARG 46 HE ARG 46 14.483 10.309 20.498
337 HH11 ARG 46 HH22 ARG 46 13.356 10.960 23.794
338 HH12 ARG 46 HH21 ARG 46 11.848 11.637 23.277
339 HH22 ARG 46 HH1 ARG 46 11.362 11.769 20.934
340 H TYR 47 HN TYR 47 15.464 5.820 18.880
341 HA TYR 47 HA TYR 47 16.374 7.599 16.745
342 HB2 TYR 47 HB2 TYR 47 17.660 5.307 17.013
343 HB3 TYR 47 HB3 TYR 47 16.148 4.537 16.574
344 HD1 TYR 47 HD2 TYR 47 17.543 7.687 15.139
345 HD2 TYR 47 HD1 TYR 47 16.708 3.539 14.507
346 HE1 TYR 47 HE2 TYR 47 18.126 7.937 12.677
347 HE2 TYR 47 HE1 TYR 47 17.293 3.803 12.047
348 HH TYR 47 HH TYR 47 19.013 6.239 10.857
349 H ARG 48 HN ARG 48 14.850 7.917 15.077
350 HA ARG 48 HA ARG 48 12.468 6.331 15.167
351 HB2 ARG 48 HB2 ARG 48 11.042 8.498 15.199
352 HB3 ARG 48 HB3 ARG 48 11.731 7.989 16.727
353 HG2 ARG 48 HG2 ARG 48 13.780 9.544 15.881
354 HG3 ARG 48 HG3 ARG 48 12.493 10.317 14.979
355 HD2 ARG 48 HD2 ARG 48 11.280 10.104 17.433
356 HD3 ARG 48 HD3 ARG 48 12.954 10.237 17.936
357 HE ARG 48 HE ARG 48 12.966 12.470 17.233
358 HH11 ARG 48 HH22 ARG 48 10.193 10.827 15.759
359 HH12 ARG 48 HH21 ARG 48 9.522 12.283 15.102
360 HH22 ARG 48 HH1 ARG 48 10.648 14.366 15.472
361 H ARG 49 HN ARG 49 12.264 5.778 13.018
362 HA ARG 49 HA ARG 49 11.791 7.666 11.089
363 HB2 ARG 49 HB2 ARG 49 14.434 7.815 11.522
364 HB3 ARG 49 HB3 ARG 49 14.475 6.393 10.500
365 HG2 ARG 49 HG2 ARG 49 14.757 8.501 9.186
366 HG3 ARG 49 HG3 ARG 49 13.347 7.592 8.678
367 HD2 ARG 49 HD2 ARG 49 11.934 9.285 9.255
368 HD3 ARG 49 HD3 ARG 49 12.649 9.436 10.847
369 HE ARG 49 HE ARG 49 14.567 10.599 9.270
370 HH11 ARG 49 HH22 ARG 49 11.061 11.076 9.461
371 HH12 ARG 49 HH21 ARG 49 11.135 12.735 8.969
372 HH22 ARG 49 HH1 ARG 49 13.265 13.720 8.480
373 H CYS 50 HN CYS 50 11.690 6.587 8.820
374 HA CYS 50 HA CYS 50 11.765 3.695 8.947
375 HB2 CYS 50 HB2 CYS 50 9.247 4.985 7.940
376 HB3 CYS 50 HB3 CYS 50 9.538 3.310 8.367
377 H TRP 51 HN TRP 51 11.474 2.784 6.659
378 HA TRP 51 HA TRP 51 12.509 4.746 4.734
379 HB2 TRP 51 HB2 TRP 51 12.743 1.796 4.334
380 HB3 TRP 51 HB3 TRP 51 13.767 3.093 3.751
381 HD1 TRP 51 HD1 TRP 51 14.392 0.365 5.796
382 HE1 TRP 51 HE1 TRP 51 16.018 0.728 7.842
383 HE3 TRP 51 HE3 TRP 51 13.981 5.432 5.898
384 HZ2 TRP 51 HZ2 TRP 51 16.930 3.042 9.242
385 HZ3 TRP 51 HZ3 TRP 51 15.272 6.667 7.636
386 HH2 TRP 51 HH2 TRP 51 16.708 5.554 9.271
Start of MODEL 17
1 H1 ARG 1 HN ARG 1 11.158 -6.037 1.982
2 HA ARG 1 HA ARG 1 8.323 -6.131 1.414
3 HB2 ARG 1 HB2 ARG 1 9.858 -7.925 3.295
4 HB3 ARG 1 HB3 ARG 1 8.272 -7.388 3.811
5 HG2 ARG 1 HG2 ARG 1 8.190 -8.249 1.016
6 HG3 ARG 1 HG3 ARG 1 8.868 -9.515 2.021
7 HD2 ARG 1 HD2 ARG 1 6.913 -9.661 3.382
8 HD3 ARG 1 HD3 ARG 1 6.341 -8.077 2.900
9 HE ARG 1 HE ARG 1 6.471 -9.627 0.536
10 HH11 ARG 1 HH22 ARG 1 4.687 -9.684 3.597
11 HH12 ARG 1 HH21 ARG 1 3.301 -10.470 2.917
12 HH22 ARG 1 HH1 ARG 1 3.297 -11.036 0.588
13 H TRP 2 HN TRP 2 7.204 -5.641 3.841
14 HA TRP 2 HA TRP 2 8.611 -3.225 4.742
15 HB2 TRP 2 HB2 TRP 2 5.714 -3.680 5.277
16 HB3 TRP 2 HB3 TRP 2 6.597 -2.182 5.060
17 HD1 TRP 2 HD1 TRP 2 3.940 -3.623 3.343
18 HE1 TRP 2 HE1 TRP 2 3.903 -3.343 0.720
19 HE3 TRP 2 HE3 TRP 2 8.869 -2.467 2.871
20 HZ2 TRP 2 HZ2 TRP 2 5.894 -2.684 -1.215
21 HZ3 TRP 2 HZ3 TRP 2 9.742 -2.019 0.579
22 HH2 TRP 2 HH2 TRP 2 8.342 -2.113 -1.422
23 H CYS 3 HN CYS 3 9.407 -3.248 6.808
24 HA CYS 3 HA CYS 3 8.111 -4.965 8.747
25 HB2 CYS 3 HB2 CYS 3 10.846 -5.413 7.672
26 HB3 CYS 3 HB3 CYS 3 10.647 -5.551 9.408
27 H VAL 4 HN VAL 4 8.869 -4.369 11.004
28 HA VAL 4 HA VAL 4 10.316 -1.853 11.146
29 HB VAL 4 HB VAL 4 8.638 -0.671 12.263
30 HG11 VAL 4 HG11 VAL 4 6.875 -0.481 10.664
31 HG12 VAL 4 HG12 VAL 4 8.338 -0.950 9.766
32 HG13 VAL 4 HG13 VAL 4 7.088 -2.164 10.128
33 HG21 VAL 4 HG21 VAL 4 7.584 -1.968 13.816
34 HG22 VAL 4 HG22 VAL 4 6.318 -1.980 12.565
35 HG23 VAL 4 HG23 VAL 4 7.432 -3.360 12.717
36 H TYR 5 HN TYR 5 11.810 -2.024 12.734
37 HA TYR 5 HA TYR 5 11.275 -4.023 14.827
38 HB2 TYR 5 HB2 TYR 5 13.656 -3.061 13.196
39 HB3 TYR 5 HB3 TYR 5 13.986 -3.584 14.835
40 HD1 TYR 5 HD2 TYR 5 12.102 -5.866 15.129
41 HD2 TYR 5 HD1 TYR 5 14.583 -4.726 11.835
42 HE1 TYR 5 HE2 TYR 5 12.175 -8.281 14.338
43 HE2 TYR 5 HE1 TYR 5 14.648 -7.145 11.056
44 HH TYR 5 HH TYR 5 12.730 -9.254 11.574
45 H ALA 6 HN ALA 6 11.648 -3.478 16.997
46 HA ALA 6 HA ALA 6 12.514 -0.724 17.490
47 HB1 ALA 6 HB1 ALA 6 10.512 -0.109 18.309
48 HB2 ALA 6 HB2 ALA 6 9.844 -1.619 17.646
49 HB3 ALA 6 HB3 ALA 6 10.422 -1.565 19.328
50 H TYR 7 HN TYR 7 13.840 -0.501 19.287
51 HA TYR 7 HA TYR 7 14.133 -2.878 20.982
52 HB2 TYR 7 HB2 TYR 7 15.965 -2.915 19.342
53 HB3 TYR 7 HB3 TYR 7 16.166 -1.176 19.435
54 HD1 TYR 7 HD1 TYR 7 16.181 -4.025 21.893
55 HD2 TYR 7 HD2 TYR 7 18.136 -0.508 20.441
56 HE1 TYR 7 HE1 TYR 7 18.019 -4.324 23.624
57 HE2 TYR 7 HE2 TYR 7 19.967 -0.818 22.177
58 HH TYR 7 HH TYR 7 20.861 -3.119 23.458
59 H VAL 8 HN VAL 8 13.142 -1.984 22.798
60 HA VAL 8 HA VAL 8 14.174 0.611 23.678
61 HB VAL 8 HB VAL 8 11.715 -0.979 24.426
62 HG11 VAL 8 HG11 VAL 8 12.286 0.099 26.431
63 HG12 VAL 8 HG12 VAL 8 12.876 1.554 25.592
64 HG13 VAL 8 HG13 VAL 8 11.131 1.212 25.660
65 HG21 VAL 8 HG21 VAL 8 10.491 0.885 23.391
66 HG22 VAL 8 HG22 VAL 8 12.033 1.663 22.961
67 HG23 VAL 8 HG23 VAL 8 11.590 0.103 22.228
68 H ARG 9 HN ARG 9 15.177 0.857 25.697
69 HA ARG 9 HA ARG 9 15.312 -1.396 27.425
70 HB2 ARG 9 HB2 ARG 9 17.167 -2.206 26.264
71 HB3 ARG 9 HB3 ARG 9 17.607 -0.626 25.646
72 HG2 ARG 9 HG2 ARG 9 18.473 0.043 27.868
73 HG3 ARG 9 HG3 ARG 9 17.948 -1.479 28.560
74 HD2 ARG 9 HD2 ARG 9 19.454 -2.531 26.614
75 HD3 ARG 9 HD3 ARG 9 20.224 -0.957 26.634
76 HE ARG 9 HE ARG 9 19.900 -2.229 29.281
77 HH11 ARG 9 HH22 ARG 9 22.043 -1.669 26.515
78 HH12 ARG 9 HH21 ARG 9 23.486 -2.032 27.401
79 HH22 ARG 9 HH1 ARG 9 23.322 -2.641 29.713
80 H ILE 10 HN ILE 10 14.970 -0.407 29.390
81 HA ILE 10 HA ILE 10 16.619 1.888 30.053
82 HB ILE 10 HB ILE 10 13.701 2.111 30.634
83 HG12 ILE 10 HG12 ILE 10 14.982 2.802 27.975
84 HG13 ILE 10 HG13 ILE 10 13.703 1.637 28.256
85 HG21 ILE 10 HG21 ILE 10 15.187 4.494 29.850
86 HG22 ILE 10 HG22 ILE 10 14.245 4.158 31.322
87 HG23 ILE 10 HG23 ILE 10 15.943 3.634 31.213
88 HD11 ILE 10 HD11 ILE 10 12.529 3.803 29.392
89 HD12 ILE 10 HD12 ILE 10 13.577 4.630 28.214
90 HD13 ILE 10 HD13 ILE 10 12.383 3.433 27.657
91 H ARG 11 HN ARG 11 16.821 2.208 32.365
92 HA ARG 11 HA ARG 11 17.048 1.527 34.402
93 HB2 ARG 11 HB2 ARG 11 14.457 -0.012 33.873
94 HB3 ARG 11 HB3 ARG 11 15.172 0.160 35.464
95 HG2 ARG 11 HG2 ARG 11 13.727 2.179 33.807
96 HG3 ARG 11 HG3 ARG 11 13.771 1.994 35.549
97 HD2 ARG 11 HD2 ARG 11 16.143 2.905 35.533
98 HD3 ARG 11 HD3 ARG 11 15.982 3.195 33.812
99 HE ARG 11 HE ARG 11 13.755 4.398 35.166
100 HH11 ARG 11 HH22 ARG 11 17.242 4.848 34.729
101 HH12 ARG 11 HH21 ARG 11 17.178 6.561 34.981
102 HH22 ARG 11 HH1 ARG 11 15.068 7.602 35.433
103 H GLY 12 HN GLY 12 15.404 -1.503 33.279
104 HA2 GLY 12 HA1 GLY 12 17.849 -2.940 32.889
105 HA3 GLY 12 HA2 GLY 12 17.115 -3.301 34.439
106 H VAL 13 HN VAL 13 15.146 -2.333 31.628
107 HA VAL 13 HA VAL 13 14.315 -5.133 31.333
108 HB VAL 13 HB VAL 13 12.519 -2.700 31.344
109 HG11 VAL 13 HG11 VAL 13 11.010 -3.998 30.342
110 HG12 VAL 13 HG12 VAL 13 12.169 -5.349 30.303
111 HG13 VAL 13 HG13 VAL 13 11.094 -5.138 31.706
112 HG21 VAL 13 HG21 VAL 13 13.212 -4.710 33.476
113 HG22 VAL 13 HG22 VAL 13 13.050 -2.941 33.593
114 HG23 VAL 13 HG23 VAL 13 11.598 -3.960 33.439
115 H LEU 14 HN LEU 14 14.422 -5.866 29.265
116 HA LEU 14 HA LEU 14 14.910 -3.842 27.210
117 HB2 LEU 14 HB2 LEU 14 16.675 -5.446 27.485
118 HB3 LEU 14 HB3 LEU 14 15.553 -6.786 27.365
119 HG LEU 14 HG LEU 14 15.372 -6.637 25.081
120 HD11 LEU 14 HD11 LEU 14 14.522 -4.492 24.726
121 HD12 LEU 14 HD12 LEU 14 15.968 -3.701 25.398
122 HD13 LEU 14 HD13 LEU 14 16.050 -4.506 23.813
123 HD21 LEU 14 HD21 LEU 14 17.657 -7.231 25.596
124 HD22 LEU 14 HD22 LEU 14 17.616 -6.242 24.117
125 HD23 LEU 14 HD23 LEU 14 18.127 -5.515 25.659
126 H VAL 15 HN VAL 15 13.164 -3.227 26.060
127 HA VAL 15 HA VAL 15 11.095 -5.267 25.622
128 HB VAL 15 HB VAL 15 10.602 -2.328 25.365
129 HG11 VAL 15 HG11 VAL 15 8.454 -2.950 25.265
130 HG12 VAL 15 HG12 VAL 15 9.044 -4.622 25.108
131 HG13 VAL 15 HG13 VAL 15 8.605 -3.981 26.709
132 HG21 VAL 15 HG21 VAL 15 9.803 -2.786 27.932
133 HG22 VAL 15 HG22 VAL 15 11.302 -3.743 27.866
134 HG23 VAL 15 HG23 VAL 15 11.337 -2.006 27.477
135 H ARG 16 HN ARG 16 11.959 -6.186 23.729
136 HA ARG 16 HA ARG 16 12.574 -4.338 21.603
137 HB2 ARG 16 HB2 ARG 16 13.132 -7.242 22.173
138 HB3 ARG 16 HB3 ARG 16 13.029 -6.780 20.486
139 HG2 ARG 16 HG2 ARG 16 14.711 -4.934 20.944
140 HG3 ARG 16 HG3 ARG 16 14.874 -5.539 22.580
141 HD2 ARG 16 HD2 ARG 16 16.658 -6.611 21.457
142 HD3 ARG 16 HD3 ARG 16 15.417 -7.849 21.463
143 HE ARG 16 HE ARG 16 14.959 -6.430 19.102
144 HH11 ARG 16 HH22 ARG 16 17.716 -8.180 20.477
145 HH12 ARG 16 HH21 ARG 16 18.368 -8.616 18.933
146 HH22 ARG 16 HH1 ARG 16 17.237 -7.914 16.940
147 H TYR 17 HN TYR 17 10.840 -3.693 20.356
148 HA TYR 17 HA TYR 17 8.601 -5.542 20.060
149 HB2 TYR 17 HB2 TYR 17 8.774 -2.879 20.658
150 HB3 TYR 17 HB3 TYR 17 8.834 -2.729 18.913
151 HD1 TYR 17 HD1 TYR 17 6.890 -3.381 17.524
152 HD2 TYR 17 HD2 TYR 17 6.730 -3.519 21.798
153 HE1 TYR 17 HE1 TYR 17 4.353 -3.512 17.432
154 HE2 TYR 17 HE2 TYR 17 4.193 -3.649 21.691
155 HH TYR 17 HH TYR 17 2.517 -3.618 18.554
156 H ARG 18 HN ARG 18 7.618 -5.881 17.921
157 HA ARG 18 HA ARG 18 9.289 -5.219 15.692
158 HB2 ARG 18 HB2 ARG 18 9.029 -7.781 14.975
159 HB3 ARG 18 HB3 ARG 18 10.367 -7.273 15.986
160 HG2 ARG 18 HG2 ARG 18 9.013 -7.881 18.029
161 HG3 ARG 18 HG3 ARG 18 7.733 -8.459 16.981
162 HD2 ARG 18 HD2 ARG 18 8.894 -10.453 17.387
163 HD3 ARG 18 HD3 ARG 18 9.652 -9.938 15.893
164 HE ARG 18 HE ARG 18 11.098 -8.759 18.050
165 HH11 ARG 18 HH22 ARG 18 10.490 -11.968 16.677
166 HH12 ARG 18 HH21 ARG 18 11.997 -12.624 17.224
167 HH22 ARG 18 HH1 ARG 18 13.507 -11.229 18.454
168 H ARG 19 HN ARG 19 8.161 -5.927 13.562
169 HA ARG 19 HA ARG 19 5.589 -6.877 13.570
170 HB2 ARG 19 HB2 ARG 19 5.318 -4.518 14.725
171 HB3 ARG 19 HB3 ARG 19 5.549 -3.869 13.114
172 HG2 ARG 19 HG2 ARG 19 3.533 -6.088 13.486
173 HG3 ARG 19 HG3 ARG 19 3.104 -4.478 14.029
174 HD2 ARG 19 HD2 ARG 19 4.335 -4.448 11.345
175 HD3 ARG 19 HD3 ARG 19 2.897 -5.448 11.398
176 HE ARG 19 HE ARG 19 3.025 -2.529 11.814
177 HH11 ARG 19 HH22 ARG 19 1.060 -5.463 12.102
178 HH12 ARG 19 HH21 ARG 19 -0.442 -4.602 12.156
179 HH22 ARG 19 HH1 ARG 19 -0.427 -2.209 12.027
180 H CYS 20 HN CYS 20 4.668 -6.870 11.350
181 HA CYS 20 HA CYS 20 6.270 -5.591 9.321
182 HB2 CYS 20 HB2 CYS 20 6.008 -8.600 9.479
183 HB3 CYS 20 HB3 CYS 20 6.528 -7.729 8.050
184 H TRP 21 HN TRP 21 5.155 -6.066 7.082
185 HA TRP 21 HA TRP 21 2.262 -6.317 7.557
186 HB2 TRP 21 HB2 TRP 21 3.850 -4.389 5.915
187 HB3 TRP 21 HB3 TRP 21 2.262 -4.870 5.353
188 HD1 TRP 21 HD1 TRP 21 0.210 -4.445 7.345
189 HE1 TRP 21 HE1 TRP 21 -0.179 -2.394 8.960
190 HE3 TRP 21 HE3 TRP 21 4.969 -2.673 7.093
191 HZ2 TRP 21 HZ2 TRP 21 1.510 -0.308 9.928
192 HZ3 TRP 21 HZ3 TRP 21 5.516 -0.624 8.403
193 HH2 TRP 21 HH2 TRP 21 3.877 0.550 9.785
194 H1 ARG 31 HN ARG 31 6.218 -0.618 3.907
195 HA ARG 31 HA ARG 31 8.692 0.716 3.324
196 HB2 ARG 31 HB2 ARG 31 6.265 1.302 5.036
197 HB3 ARG 31 HB3 ARG 31 7.760 2.143 5.400
198 HG2 ARG 31 HG2 ARG 31 6.438 3.497 3.843
199 HG3 ARG 31 HG3 ARG 31 7.887 2.940 3.029
200 HD2 ARG 31 HD2 ARG 31 6.713 1.615 1.555
201 HD3 ARG 31 HD3 ARG 31 5.579 1.078 2.779
202 HE ARG 31 HE ARG 31 4.953 3.774 2.383
203 HH11 ARG 31 HH22 ARG 31 5.117 0.900 0.318
204 HH12 ARG 31 HH21 ARG 31 3.899 1.465 -0.777
205 HH22 ARG 31 HH1 ARG 31 2.872 3.596 -0.393
206 H TRP 32 HN TRP 32 9.963 1.488 5.451
207 HA TRP 32 HA TRP 32 10.116 -0.809 7.281
208 HB2 TRP 32 HB2 TRP 32 12.236 0.506 5.665
209 HB3 TRP 32 HB3 TRP 32 12.648 0.068 7.312
210 HD1 TRP 32 HD1 TRP 32 11.939 -1.519 3.911
211 HE1 TRP 32 HE1 TRP 32 12.451 -4.108 3.914
212 HE3 TRP 32 HE3 TRP 32 12.608 -1.915 8.936
213 HZ2 TRP 32 HZ2 TRP 32 13.064 -5.988 5.971
214 HZ3 TRP 32 HZ3 TRP 32 13.160 -4.163 9.861
215 HH2 TRP 32 HH2 TRP 32 13.390 -6.157 8.466
216 H CYS 33 HN CYS 33 10.824 -0.214 9.476
217 HA CYS 33 HA CYS 33 10.921 2.615 10.042
218 HB2 CYS 33 HB2 CYS 33 8.605 0.887 10.730
219 HB3 CYS 33 HB3 CYS 33 9.191 1.950 11.994
220 H VAL 34 HN VAL 34 11.761 2.982 12.275
221 HA VAL 34 HA VAL 34 12.628 0.630 13.713
222 HB VAL 34 HB VAL 34 14.979 1.326 13.715
223 HG11 VAL 34 HG11 VAL 34 15.560 0.318 11.673
224 HG12 VAL 34 HG12 VAL 34 13.940 -0.328 12.034
225 HG13 VAL 34 HG13 VAL 34 14.133 0.974 10.836
226 HG21 VAL 34 HG21 VAL 34 15.161 3.568 13.246
227 HG22 VAL 34 HG22 VAL 34 15.549 2.890 11.647
228 HG23 VAL 34 HG23 VAL 34 13.917 3.520 11.974
229 H TYR 35 HN TYR 35 12.337 1.020 15.850
230 HA TYR 35 HA TYR 35 12.684 3.763 16.793
231 HB2 TYR 35 HB2 TYR 35 10.207 2.806 16.140
232 HB3 TYR 35 HB3 TYR 35 10.353 2.024 17.702
233 HD1 TYR 35 HD1 TYR 35 11.292 5.448 16.466
234 HD2 TYR 35 HD2 TYR 35 9.047 3.123 19.270
235 HE1 TYR 35 HE1 TYR 35 10.504 7.577 17.612
236 HE2 TYR 35 HE2 TYR 35 8.267 5.260 20.406
237 HH TYR 35 HH TYR 35 9.332 7.698 20.577
238 H ALA 36 HN ALA 36 14.320 3.504 18.248
239 HA ALA 36 HA ALA 36 13.950 1.370 20.229
240 HB1 ALA 36 HB1 ALA 36 16.465 1.156 20.221
241 HB2 ALA 36 HB2 ALA 36 15.680 0.612 18.719
242 HB3 ALA 36 HB3 ALA 36 16.493 2.195 18.776
243 H TYR 37 HN TYR 37 14.259 1.997 22.357
244 HA TYR 37 HA TYR 37 15.234 4.744 22.749
245 HB2 TYR 37 HB2 TYR 37 12.640 4.189 22.872
246 HB3 TYR 37 HB3 TYR 37 13.034 3.286 24.322
247 HD1 TYR 37 HD2 TYR 37 14.127 4.537 26.274
248 HD2 TYR 37 HD1 TYR 37 12.320 6.532 22.949
249 HE1 TYR 37 HE2 TYR 37 13.946 6.671 27.644
250 HE2 TYR 37 HE1 TYR 37 12.146 8.660 24.330
251 HH TYR 37 HH TYR 37 12.036 9.285 26.662
252 H VAL 38 HN VAL 38 17.323 3.624 23.184
253 HA VAL 38 HA VAL 38 17.300 2.118 25.690
254 HB VAL 38 HB VAL 38 19.386 2.485 23.532
255 HG11 VAL 38 HG11 VAL 38 20.688 0.768 24.759
256 HG12 VAL 38 HG12 VAL 38 20.497 2.276 25.685
257 HG13 VAL 38 HG13 VAL 38 19.508 0.852 26.089
258 HG21 VAL 38 HG21 VAL 38 18.653 -0.241 23.992
259 HG22 VAL 38 HG22 VAL 38 17.164 0.711 23.778
260 HG23 VAL 38 HG23 VAL 38 18.429 0.743 22.526
261 H ARG 39 HN ARG 39 18.466 2.804 27.516
262 HA ARG 39 HA ARG 39 19.762 5.377 27.252
263 HB2 ARG 39 HB2 ARG 39 17.303 5.545 28.122
264 HB3 ARG 39 HB3 ARG 39 17.893 4.787 29.587
265 HG2 ARG 39 HG2 ARG 39 19.559 6.614 29.884
266 HG3 ARG 39 HG3 ARG 39 19.024 7.362 28.392
267 HD2 ARG 39 HD2 ARG 39 17.381 8.453 29.516
268 HD3 ARG 39 HD3 ARG 39 16.676 6.921 29.993
269 HE ARG 39 HE ARG 39 17.722 7.094 32.101
270 HH11 ARG 39 HH22 ARG 39 19.000 9.578 29.922
271 HH12 ARG 39 HH21 ARG 39 19.827 10.433 31.181
272 HH22 ARG 39 HH1 ARG 39 19.703 9.618 33.431
273 H ILE 40 HN ILE 40 21.620 5.568 28.567
274 HA ILE 40 HA ILE 40 21.973 3.707 30.747
275 HB ILE 40 HB ILE 40 23.464 3.524 28.165
276 HG12 ILE 40 HG12 ILE 40 21.805 1.813 29.844
277 HG13 ILE 40 HG13 ILE 40 22.228 1.661 28.151
278 HG21 ILE 40 HG21 ILE 40 25.201 4.089 29.777
279 HG22 ILE 40 HG22 ILE 40 24.627 2.806 30.870
280 HG23 ILE 40 HG23 ILE 40 25.323 2.382 29.288
281 HD11 ILE 40 HD11 ILE 40 24.421 0.680 28.750
282 HD12 ILE 40 HD12 ILE 40 24.048 0.888 30.478
283 HD13 ILE 40 HD13 ILE 40 23.097 -0.249 29.493
284 H ARG 41 HN ARG 41 23.888 4.287 32.078
285 HA ARG 41 HA ARG 41 24.980 5.774 33.207
286 HB2 ARG 41 HB2 ARG 41 25.620 6.748 30.387
287 HB3 ARG 41 HB3 ARG 41 26.363 7.477 31.797
288 HG2 ARG 41 HG2 ARG 41 26.441 4.467 31.368
289 HG3 ARG 41 HG3 ARG 41 27.621 5.516 30.609
290 HD2 ARG 41 HD2 ARG 41 27.113 5.801 33.582
291 HD3 ARG 41 HD3 ARG 41 28.094 4.463 33.015
292 HE ARG 41 HE ARG 41 28.929 6.983 31.822
293 HH11 ARG 41 HH22 ARG 41 29.210 5.001 34.745
294 HH12 ARG 41 HH21 ARG 41 30.724 5.695 35.220
295 HH22 ARG 41 HH1 ARG 41 31.714 7.397 33.855
296 H GLY 42 HN GLY 42 24.248 8.107 30.545
297 HA2 GLY 42 HA1 GLY 42 22.073 9.337 31.985
298 HA3 GLY 42 HA2 GLY 42 23.562 10.260 32.040
299 H VAL 43 HN VAL 43 22.846 8.146 29.270
300 HA VAL 43 HA VAL 43 22.086 10.512 27.713
301 HB VAL 43 HB VAL 43 23.834 8.441 26.479
302 HG11 VAL 43 HG11 VAL 43 22.860 11.099 25.886
303 HG12 VAL 43 HG12 VAL 43 24.639 11.063 25.827
304 HG13 VAL 43 HG13 VAL 43 23.692 9.935 24.827
305 HG21 VAL 43 HG21 VAL 43 24.793 10.512 28.468
306 HG22 VAL 43 HG22 VAL 43 25.110 8.761 28.452
307 HG23 VAL 43 HG23 VAL 43 25.851 9.811 27.220
308 H LEU 44 HN LEU 44 20.200 10.196 26.650
309 HA LEU 44 HA LEU 44 19.277 7.430 26.428
310 HB2 LEU 44 HB2 LEU 44 17.613 8.473 27.532
311 HB3 LEU 44 HB3 LEU 44 17.997 10.052 26.876
312 HG LEU 44 HG LEU 44 16.910 9.448 24.749
313 HD11 LEU 44 HD11 LEU 44 16.870 6.777 25.989
314 HD12 LEU 44 HD12 LEU 44 15.351 7.257 25.196
315 HD13 LEU 44 HD13 LEU 44 16.874 7.256 24.275
316 HD21 LEU 44 HD21 LEU 44 15.107 8.973 27.137
317 HD22 LEU 44 HD22 LEU 44 15.650 10.566 26.558
318 HD23 LEU 44 HD23 LEU 44 14.621 9.546 25.523
319 H VAL 45 HN VAL 45 19.588 6.442 24.513
320 HA VAL 45 HA VAL 45 19.901 8.145 22.161
321 HB VAL 45 HB VAL 45 20.392 5.181 22.340
322 HG11 VAL 45 HG11 VAL 45 22.240 5.990 20.659
323 HG12 VAL 45 HG12 VAL 45 20.556 5.801 20.115
324 HG13 VAL 45 HG13 VAL 45 21.191 7.419 20.499
325 HG21 VAL 45 HG21 VAL 45 21.789 5.755 24.069
326 HG22 VAL 45 HG22 VAL 45 22.871 6.066 22.690
327 HG23 VAL 45 HG23 VAL 45 22.023 7.418 23.479
328 H ARG 46 HN ARG 46 17.978 8.626 21.208
329 HA ARG 46 HA ARG 46 16.058 6.447 21.077
330 HB2 ARG 46 HB2 ARG 46 15.544 9.431 20.647
331 HB3 ARG 46 HB3 ARG 46 14.326 8.179 20.785
332 HG2 ARG 46 HG2 ARG 46 14.832 7.795 23.115
333 HG3 ARG 46 HG3 ARG 46 16.327 8.704 23.020
334 HD2 ARG 46 HD2 ARG 46 14.094 10.382 22.163
335 HD3 ARG 46 HD3 ARG 46 13.749 9.690 23.735
336 HE ARG 46 HE ARG 46 16.458 10.825 23.440
337 HH11 ARG 46 HH22 ARG 46 13.124 11.385 24.501
338 HH12 ARG 46 HH21 ARG 46 13.543 12.716 25.527
339 HH22 ARG 46 HH1 ARG 46 15.835 13.402 25.684
340 H TYR 47 HN TYR 47 16.036 5.421 19.101
341 HA TYR 47 HA TYR 47 16.917 6.953 16.769
342 HB2 TYR 47 HB2 TYR 47 17.985 4.741 17.398
343 HB3 TYR 47 HB3 TYR 47 16.408 3.976 17.391
344 HD1 TYR 47 HD1 TYR 47 17.362 6.452 14.825
345 HD2 TYR 47 HD2 TYR 47 17.039 2.290 15.764
346 HE1 TYR 47 HE1 TYR 47 17.654 5.867 12.368
347 HE2 TYR 47 HE2 TYR 47 17.332 1.720 13.304
348 HH TYR 47 HH TYR 47 17.400 4.244 10.864
349 H ARG 48 HN ARG 48 15.586 7.382 15.035
350 HA ARG 48 HA ARG 48 13.089 5.982 14.890
351 HB2 ARG 48 HB2 ARG 48 11.990 8.398 14.535
352 HB3 ARG 48 HB3 ARG 48 12.136 7.710 16.140
353 HG2 ARG 48 HG2 ARG 48 13.639 9.293 16.806
354 HG3 ARG 48 HG3 ARG 48 14.586 9.137 15.340
355 HD2 ARG 48 HD2 ARG 48 13.526 10.900 14.309
356 HD3 ARG 48 HD3 ARG 48 11.948 10.438 14.914
357 HE ARG 48 HE ARG 48 13.454 11.358 17.140
358 HH11 ARG 48 HH22 ARG 48 12.108 12.671 14.138
359 HH12 ARG 48 HH21 ARG 48 11.925 14.272 14.774
360 HH22 ARG 48 HH1 ARG 48 12.582 14.718 17.035
361 H ARG 49 HN ARG 49 12.903 5.413 12.746
362 HA ARG 49 HA ARG 49 13.233 7.362 10.747
363 HB2 ARG 49 HB2 ARG 49 15.652 6.519 11.332
364 HB3 ARG 49 HB3 ARG 49 15.181 5.028 10.541
365 HG2 ARG 49 HG2 ARG 49 16.360 6.788 9.068
366 HG3 ARG 49 HG3 ARG 49 14.885 6.093 8.425
367 HD2 ARG 49 HD2 ARG 49 15.076 8.647 8.246
368 HD3 ARG 49 HD3 ARG 49 13.592 8.049 8.962
369 HE ARG 49 HE ARG 49 15.710 8.594 10.923
370 HH11 ARG 49 HH22 ARG 49 12.967 9.966 9.148
371 HH12 ARG 49 HH21 ARG 49 12.704 11.240 10.291
372 HH22 ARG 49 HH1 ARG 49 14.126 11.403 12.214
373 H CYS 50 HN CYS 50 12.750 6.379 8.518
374 HA CYS 50 HA CYS 50 11.700 3.696 8.596
375 HB2 CYS 50 HB2 CYS 50 9.909 6.078 8.079
376 HB3 CYS 50 HB3 CYS 50 9.494 4.424 7.673
377 H TRP 51 HN TRP 51 11.551 2.817 6.433
378 HA TRP 51 HA TRP 51 12.438 4.643 4.313
379 HB2 TRP 51 HB2 TRP 51 14.421 3.523 4.915
380 HB3 TRP 51 HB3 TRP 51 13.610 1.978 5.078
381 HD1 TRP 51 HD1 TRP 51 15.578 3.934 2.594
382 HE1 TRP 51 HE1 TRP 51 15.614 2.832 0.196
383 HE3 TRP 51 HE3 TRP 51 11.825 0.621 3.486
384 HZ2 TRP 51 HZ2 TRP 51 14.103 0.744 -1.030
385 HZ3 TRP 51 HZ3 TRP 51 11.167 -0.914 1.635
386 HH2 TRP 51 HH2 TRP 51 12.239 -0.889 -0.562
Start of MODEL 18
1 H1 ARG 1 HN ARG 1 10.414 -5.027 0.879
2 HA ARG 1 HA ARG 1 7.828 -6.164 1.466
3 HB2 ARG 1 HB2 ARG 1 10.468 -7.100 2.572
4 HB3 ARG 1 HB3 ARG 1 9.135 -6.997 3.705
5 HG2 ARG 1 HG2 ARG 1 8.851 -8.421 1.027
6 HG3 ARG 1 HG3 ARG 1 9.461 -9.247 2.448
7 HD2 ARG 1 HD2 ARG 1 7.091 -7.841 3.264
8 HD3 ARG 1 HD3 ARG 1 6.709 -8.640 1.752
9 HE ARG 1 HE ARG 1 7.120 -9.931 4.293
10 HH11 ARG 1 HH22 ARG 1 7.752 -10.397 0.838
11 HH12 ARG 1 HH21 ARG 1 7.774 -12.125 0.948
12 HH22 ARG 1 HH1 ARG 1 7.417 -13.170 3.075
13 H TRP 2 HN TRP 2 7.392 -5.655 4.022
14 HA TRP 2 HA TRP 2 8.561 -3.039 4.636
15 HB2 TRP 2 HB2 TRP 2 6.633 -2.172 3.864
16 HB3 TRP 2 HB3 TRP 2 5.742 -3.670 4.042
17 HD1 TRP 2 HD1 TRP 2 4.350 -3.981 6.316
18 HE1 TRP 2 HE1 TRP 2 3.720 -2.463 8.380
19 HE3 TRP 2 HE3 TRP 2 7.690 -0.288 5.287
20 HZ2 TRP 2 HZ2 TRP 2 4.668 0.055 9.330
21 HZ3 TRP 2 HZ3 TRP 2 7.774 1.665 6.833
22 HH2 TRP 2 HH2 TRP 2 6.334 1.872 8.797
23 H CYS 3 HN CYS 3 9.592 -3.332 6.566
24 HA CYS 3 HA CYS 3 8.196 -4.971 8.548
25 HB2 CYS 3 HB2 CYS 3 10.986 -5.219 7.551
26 HB3 CYS 3 HB3 CYS 3 10.744 -5.391 9.278
27 H VAL 4 HN VAL 4 9.057 -4.400 10.843
28 HA VAL 4 HA VAL 4 10.248 -1.773 11.030
29 HB VAL 4 HB VAL 4 8.481 -0.710 12.117
30 HG11 VAL 4 HG11 VAL 4 8.154 -0.814 9.696
31 HG12 VAL 4 HG12 VAL 4 7.244 -2.335 9.868
32 HG13 VAL 4 HG13 VAL 4 6.587 -0.823 10.541
33 HG21 VAL 4 HG21 VAL 4 7.533 -2.099 13.670
34 HG22 VAL 4 HG22 VAL 4 6.256 -2.148 12.431
35 HG23 VAL 4 HG23 VAL 4 7.435 -3.477 12.548
36 H TYR 5 HN TYR 5 11.751 -1.901 12.611
37 HA TYR 5 HA TYR 5 11.304 -3.935 14.689
38 HB2 TYR 5 HB2 TYR 5 13.638 -2.836 13.081
39 HB3 TYR 5 HB3 TYR 5 13.988 -3.337 14.723
40 HD1 TYR 5 HD2 TYR 5 12.351 -5.739 15.081
41 HD2 TYR 5 HD1 TYR 5 14.555 -4.432 11.655
42 HE1 TYR 5 HE2 TYR 5 12.569 -8.146 14.294
43 HE2 TYR 5 HE1 TYR 5 14.766 -6.844 10.880
44 HH TYR 5 HH TYR 5 14.427 -9.366 12.731
45 H ALA 6 HN ALA 6 11.673 -3.395 16.870
46 HA ALA 6 HA ALA 6 12.434 -0.631 17.413
47 HB1 ALA 6 HB1 ALA 6 10.364 -0.017 18.030
48 HB2 ALA 6 HB2 ALA 6 9.749 -1.593 17.475
49 HB3 ALA 6 HB3 ALA 6 10.274 -1.386 19.163
50 H TYR 7 HN TYR 7 13.511 -0.372 19.405
51 HA TYR 7 HA TYR 7 13.679 -2.705 21.136
52 HB2 TYR 7 HB2 TYR 7 15.495 -2.801 19.328
53 HB3 TYR 7 HB3 TYR 7 16.027 -1.204 19.816
54 HD1 TYR 7 HD2 TYR 7 16.696 -0.966 22.372
55 HD2 TYR 7 HD1 TYR 7 16.547 -4.671 20.238
56 HE1 TYR 7 HE2 TYR 7 18.269 -2.016 24.071
57 HE2 TYR 7 HE1 TYR 7 18.120 -5.709 21.945
58 HH TYR 7 HH TYR 7 19.907 -3.889 24.087
59 H VAL 8 HN VAL 8 13.000 -1.804 23.031
60 HA VAL 8 HA VAL 8 14.144 0.815 23.711
61 HB VAL 8 HB VAL 8 11.620 -0.492 24.742
62 HG11 VAL 8 HG11 VAL 8 11.616 2.339 25.038
63 HG12 VAL 8 HG12 VAL 8 11.640 1.093 26.309
64 HG13 VAL 8 HG13 VAL 8 13.169 1.738 25.665
65 HG21 VAL 8 HG21 VAL 8 10.488 1.322 23.362
66 HG22 VAL 8 HG22 VAL 8 12.051 1.540 22.538
67 HG23 VAL 8 HG23 VAL 8 11.209 -0.026 22.450
68 H ARG 9 HN ARG 9 15.401 0.997 25.531
69 HA ARG 9 HA ARG 9 15.293 -1.158 27.430
70 HB2 ARG 9 HB2 ARG 9 17.048 -1.982 25.968
71 HB3 ARG 9 HB3 ARG 9 17.789 -0.399 25.847
72 HG2 ARG 9 HG2 ARG 9 18.639 -0.481 28.072
73 HG3 ARG 9 HG3 ARG 9 17.518 -1.738 28.556
74 HD2 ARG 9 HD2 ARG 9 18.933 -3.391 27.877
75 HD3 ARG 9 HD3 ARG 9 19.172 -2.644 26.310
76 HE ARG 9 HE ARG 9 21.076 -1.488 27.143
77 HH11 ARG 9 HH22 ARG 9 19.442 -3.258 29.741
78 HH12 ARG 9 HH21 ARG 9 20.759 -3.090 30.853
79 HH22 ARG 9 HH1 ARG 9 22.732 -1.915 30.167
80 H ILE 10 HN ILE 10 15.268 -0.224 29.455
81 HA ILE 10 HA ILE 10 16.960 2.058 29.966
82 HB ILE 10 HB ILE 10 14.084 2.412 30.676
83 HG12 ILE 10 HG12 ILE 10 15.239 3.119 27.962
84 HG13 ILE 10 HG13 ILE 10 14.072 1.848 28.267
85 HG21 ILE 10 HG21 ILE 10 15.696 4.686 29.757
86 HG22 ILE 10 HG22 ILE 10 14.711 4.487 31.226
87 HG23 ILE 10 HG23 ILE 10 16.370 3.845 31.173
88 HD11 ILE 10 HD11 ILE 10 13.143 4.132 27.487
89 HD12 ILE 10 HD12 ILE 10 12.367 3.396 28.910
90 HD13 ILE 10 HD13 ILE 10 13.540 4.718 29.121
91 H ARG 11 HN ARG 11 17.282 2.414 32.259
92 HA ARG 11 HA ARG 11 17.606 1.745 34.286
93 HB2 ARG 11 HB2 ARG 11 14.793 0.757 33.805
94 HB3 ARG 11 HB3 ARG 11 15.592 0.232 35.274
95 HG2 ARG 11 HG2 ARG 11 14.979 2.211 36.202
96 HG3 ARG 11 HG3 ARG 11 16.171 2.980 35.172
97 HD2 ARG 11 HD2 ARG 11 14.496 3.368 33.416
98 HD3 ARG 11 HD3 ARG 11 13.301 2.425 34.283
99 HE ARG 11 HE ARG 11 14.182 4.473 36.045
100 HH11 ARG 11 HH22 ARG 11 12.421 4.198 32.983
101 HH12 ARG 11 HH21 ARG 11 11.511 5.651 33.233
102 HH22 ARG 11 HH1 ARG 11 11.857 6.923 35.234
103 H GLY 12 HN GLY 12 15.665 -1.181 33.404
104 HA2 GLY 12 HA1 GLY 12 18.026 -2.796 32.978
105 HA3 GLY 12 HA2 GLY 12 17.208 -3.104 34.497
106 H VAL 13 HN VAL 13 15.356 -1.945 31.699
107 HA VAL 13 HA VAL 13 14.267 -4.661 31.409
108 HB VAL 13 HB VAL 13 12.842 -2.007 31.138
109 HG11 VAL 13 HG11 VAL 13 11.976 -4.871 30.746
110 HG12 VAL 13 HG12 VAL 13 10.807 -3.609 31.202
111 HG13 VAL 13 HG13 VAL 13 11.727 -3.463 29.686
112 HG21 VAL 13 HG21 VAL 13 13.412 -3.662 33.456
113 HG22 VAL 13 HG22 VAL 13 12.653 -2.054 33.364
114 HG23 VAL 13 HG23 VAL 13 11.659 -3.520 33.182
115 H LEU 14 HN LEU 14 13.604 -5.281 29.243
116 HA LEU 14 HA LEU 14 14.567 -3.521 27.127
117 HB2 LEU 14 HB2 LEU 14 16.477 -4.866 27.558
118 HB3 LEU 14 HB3 LEU 14 15.521 -6.332 27.642
119 HG LEU 14 HG LEU 14 15.366 -6.551 25.366
120 HD11 LEU 14 HD11 LEU 14 15.890 -4.446 23.855
121 HD12 LEU 14 HD12 LEU 14 14.274 -4.715 24.553
122 HD13 LEU 14 HD13 LEU 14 15.395 -3.563 25.319
123 HD21 LEU 14 HD21 LEU 14 17.549 -5.982 24.331
124 HD22 LEU 14 HD22 LEU 14 17.939 -5.004 25.767
125 HD23 LEU 14 HD23 LEU 14 17.699 -6.760 25.925
126 H VAL 15 HN VAL 15 12.890 -3.228 25.771
127 HA VAL 15 HA VAL 15 11.095 -5.524 25.389
128 HB VAL 15 HB VAL 15 10.151 -2.705 25.087
129 HG11 VAL 15 HG11 VAL 15 8.989 -5.227 24.850
130 HG12 VAL 15 HG12 VAL 15 8.416 -4.632 26.427
131 HG13 VAL 15 HG13 VAL 15 8.135 -3.669 24.956
132 HG21 VAL 15 HG21 VAL 15 10.969 -3.981 27.642
133 HG22 VAL 15 HG22 VAL 15 10.836 -2.261 27.204
134 HG23 VAL 15 HG23 VAL 15 9.376 -3.186 27.633
135 H ARG 16 HN ARG 16 12.033 -6.326 23.506
136 HA ARG 16 HA ARG 16 12.618 -4.436 21.428
137 HB2 ARG 16 HB2 ARG 16 12.947 -7.469 21.628
138 HB3 ARG 16 HB3 ARG 16 13.387 -6.556 20.198
139 HG2 ARG 16 HG2 ARG 16 14.902 -5.124 21.676
140 HG3 ARG 16 HG3 ARG 16 14.560 -6.224 22.997
141 HD2 ARG 16 HD2 ARG 16 16.547 -6.525 20.981
142 HD3 ARG 16 HD3 ARG 16 16.134 -7.673 22.239
143 HE ARG 16 HE ARG 16 15.257 -7.757 19.425
144 HH11 ARG 16 HH22 ARG 16 14.751 -9.014 22.699
145 HH12 ARG 16 HH21 ARG 16 13.940 -10.446 22.158
146 HH22 ARG 16 HH1 ARG 16 13.620 -10.796 19.809
147 H TYR 17 HN TYR 17 10.788 -3.717 20.338
148 HA TYR 17 HA TYR 17 8.613 -5.582 19.875
149 HB2 TYR 17 HB2 TYR 17 8.776 -2.931 20.540
150 HB3 TYR 17 HB3 TYR 17 8.856 -2.743 18.800
151 HD1 TYR 17 HD2 TYR 17 6.939 -3.576 17.375
152 HD2 TYR 17 HD1 TYR 17 6.710 -3.390 21.643
153 HE1 TYR 17 HE2 TYR 17 4.404 -3.709 17.251
154 HE2 TYR 17 HE1 TYR 17 4.175 -3.523 21.505
155 HH TYR 17 HH TYR 17 2.512 -3.176 18.513
156 H ARG 18 HN ARG 18 7.710 -5.965 17.739
157 HA ARG 18 HA ARG 18 9.347 -5.176 15.529
158 HB2 ARG 18 HB2 ARG 18 9.262 -7.735 14.773
159 HB3 ARG 18 HB3 ARG 18 10.553 -7.163 15.811
160 HG2 ARG 18 HG2 ARG 18 9.379 -7.971 17.815
161 HG3 ARG 18 HG3 ARG 18 7.965 -8.393 16.868
162 HD2 ARG 18 HD2 ARG 18 8.863 -10.463 16.596
163 HD3 ARG 18 HD3 ARG 18 10.079 -9.737 15.565
164 HE ARG 18 HE ARG 18 11.637 -9.801 17.348
165 HH11 ARG 18 HH22 ARG 18 8.413 -10.713 18.501
166 HH12 ARG 18 HH21 ARG 18 8.990 -11.307 20.022
167 HH22 ARG 18 HH1 ARG 18 11.336 -11.222 20.503
168 H ARG 19 HN ARG 19 8.275 -5.946 13.384
169 HA ARG 19 HA ARG 19 5.766 -7.049 13.374
170 HB2 ARG 19 HB2 ARG 19 5.309 -4.754 14.554
171 HB3 ARG 19 HB3 ARG 19 5.573 -4.033 12.979
172 HG2 ARG 19 HG2 ARG 19 3.653 -6.358 13.201
173 HG3 ARG 19 HG3 ARG 19 3.127 -4.781 13.754
174 HD2 ARG 19 HD2 ARG 19 4.333 -4.217 11.280
175 HD3 ARG 19 HD3 ARG 19 3.539 -5.754 10.995
176 HE ARG 19 HE ARG 19 1.464 -4.684 11.161
177 HH11 ARG 19 HH22 ARG 19 3.934 -2.597 12.609
178 HH12 ARG 19 HH21 ARG 19 2.853 -1.261 12.829
179 HH22 ARG 19 HH1 ARG 19 0.567 -1.476 12.142
180 H CYS 20 HN CYS 20 4.897 -7.149 11.157
181 HA CYS 20 HA CYS 20 6.370 -5.715 9.134
182 HB2 CYS 20 HB2 CYS 20 6.408 -8.737 9.266
183 HB3 CYS 20 HB3 CYS 20 6.887 -7.794 7.869
184 H TRP 21 HN TRP 21 5.130 -5.587 7.161
185 HA TRP 21 HA TRP 21 2.671 -7.107 7.017
186 HB2 TRP 21 HB2 TRP 21 1.823 -5.357 8.330
187 HB3 TRP 21 HB3 TRP 21 2.740 -4.135 7.472
188 HD1 TRP 21 HD1 TRP 21 -0.665 -5.604 7.546
189 HE1 TRP 21 HE1 TRP 21 -2.170 -4.868 5.507
190 HE3 TRP 21 HE3 TRP 21 3.133 -3.692 4.757
191 HZ2 TRP 21 HZ2 TRP 21 -1.615 -3.597 3.012
192 HZ3 TRP 21 HZ3 TRP 21 2.566 -2.722 2.532
193 HH2 TRP 21 HH2 TRP 21 0.287 -2.656 1.650
194 H1 ARG 31 HN ARG 31 8.213 -0.941 3.543
195 HA ARG 31 HA ARG 31 10.293 1.006 3.228
196 HB2 ARG 31 HB2 ARG 31 7.657 1.562 4.562
197 HB3 ARG 31 HB3 ARG 31 9.081 2.141 5.403
198 HG2 ARG 31 HG2 ARG 31 8.065 3.806 3.767
199 HG3 ARG 31 HG3 ARG 31 9.772 3.492 3.524
200 HD2 ARG 31 HD2 ARG 31 8.748 3.413 1.338
201 HD3 ARG 31 HD3 ARG 31 9.122 1.755 1.764
202 HE ARG 31 HE ARG 31 6.525 2.134 2.713
203 HH11 ARG 31 HH22 ARG 31 8.104 2.443 -0.444
204 HH12 ARG 31 HH21 ARG 31 6.671 2.062 -1.337
205 HH22 ARG 31 HH1 ARG 31 4.641 1.587 -0.154
206 H TRP 32 HN TRP 32 11.084 1.521 5.749
207 HA TRP 32 HA TRP 32 10.842 -0.912 7.331
208 HB2 TRP 32 HB2 TRP 32 13.300 -0.024 5.915
209 HB3 TRP 32 HB3 TRP 32 13.488 -0.574 7.569
210 HD1 TRP 32 HD1 TRP 32 12.391 -1.910 4.109
211 HE1 TRP 32 HE1 TRP 32 12.491 -4.546 4.035
212 HE3 TRP 32 HE3 TRP 32 13.395 -2.535 9.055
213 HZ2 TRP 32 HZ2 TRP 32 12.968 -6.552 6.009
214 HZ3 TRP 32 HZ3 TRP 32 13.663 -4.865 9.900
215 HH2 TRP 32 HH2 TRP 32 13.465 -6.833 8.465
216 H CYS 33 HN CYS 33 9.961 0.040 9.141
217 HA CYS 33 HA CYS 33 10.887 2.669 9.899
218 HB2 CYS 33 HB2 CYS 33 8.583 0.927 10.590
219 HB3 CYS 33 HB3 CYS 33 9.150 2.010 11.845
220 H VAL 34 HN VAL 34 11.695 3.062 12.142
221 HA VAL 34 HA VAL 34 12.582 0.730 13.601
222 HB VAL 34 HB VAL 34 14.928 1.516 13.634
223 HG11 VAL 34 HG11 VAL 34 13.893 -0.238 12.001
224 HG12 VAL 34 HG12 VAL 34 14.199 0.999 10.758
225 HG13 VAL 34 HG13 VAL 34 15.549 0.351 11.720
226 HG21 VAL 34 HG21 VAL 34 14.437 3.873 12.955
227 HG22 VAL 34 HG22 VAL 34 15.750 3.113 12.024
228 HG23 VAL 34 HG23 VAL 34 14.133 3.288 11.301
229 H TYR 35 HN TYR 35 12.275 1.126 15.735
230 HA TYR 35 HA TYR 35 12.601 3.864 16.681
231 HB2 TYR 35 HB2 TYR 35 10.130 2.947 15.959
232 HB3 TYR 35 HB3 TYR 35 10.219 2.159 17.522
233 HD1 TYR 35 HD2 TYR 35 10.667 3.646 19.589
234 HD2 TYR 35 HD1 TYR 35 9.466 5.201 15.788
235 HE1 TYR 35 HE2 TYR 35 9.881 5.790 20.706
236 HE2 TYR 35 HE1 TYR 35 8.684 7.340 16.918
237 HH TYR 35 HH TYR 35 9.366 8.565 19.115
238 H ALA 36 HN ALA 36 14.196 3.577 18.176
239 HA ALA 36 HA ALA 36 13.746 1.436 20.136
240 HB1 ALA 36 HB1 ALA 36 15.525 0.635 18.765
241 HB2 ALA 36 HB2 ALA 36 16.294 2.238 18.693
242 HB3 ALA 36 HB3 ALA 36 16.306 1.313 20.214
243 H TYR 37 HN TYR 37 14.842 1.909 22.265
244 HA TYR 37 HA TYR 37 15.480 4.704 22.698
245 HB2 TYR 37 HB2 TYR 37 12.887 4.105 22.884
246 HB3 TYR 37 HB3 TYR 37 13.342 3.221 24.327
247 HD1 TYR 37 HD2 TYR 37 14.621 4.557 26.169
248 HD2 TYR 37 HD1 TYR 37 12.392 6.393 23.013
249 HE1 TYR 37 HE2 TYR 37 14.452 6.700 27.527
250 HE2 TYR 37 HE1 TYR 37 12.230 8.530 24.381
251 HH TYR 37 HH TYR 37 12.342 8.906 27.152
252 H VAL 38 HN VAL 38 17.582 3.563 23.045
253 HA VAL 38 HA VAL 38 17.624 2.076 25.568
254 HB VAL 38 HB VAL 38 19.628 2.302 23.314
255 HG11 VAL 38 HG11 VAL 38 19.739 0.696 25.889
256 HG12 VAL 38 HG12 VAL 38 20.852 0.498 24.514
257 HG13 VAL 38 HG13 VAL 38 20.812 2.034 25.412
258 HG21 VAL 38 HG21 VAL 38 19.026 -0.300 23.379
259 HG22 VAL 38 HG22 VAL 38 17.490 0.338 24.015
260 HG23 VAL 38 HG23 VAL 38 18.084 0.870 22.423
261 H ARG 39 HN ARG 39 18.924 2.754 27.307
262 HA ARG 39 HA ARG 39 20.261 5.294 26.900
263 HB2 ARG 39 HB2 ARG 39 17.895 5.491 27.998
264 HB3 ARG 39 HB3 ARG 39 18.613 4.730 29.404
265 HG2 ARG 39 HG2 ARG 39 20.269 6.537 29.610
266 HG3 ARG 39 HG3 ARG 39 19.737 7.253 28.102
267 HD2 ARG 39 HD2 ARG 39 18.332 8.530 29.365
268 HD3 ARG 39 HD3 ARG 39 17.353 7.088 29.547
269 HE ARG 39 HE ARG 39 19.451 6.992 31.488
270 HH11 ARG 39 HH22 ARG 39 16.506 8.835 30.792
271 HH12 ARG 39 HH21 ARG 39 16.212 9.229 32.453
272 HH22 ARG 39 HH1 ARG 39 17.728 8.440 34.133
273 H ILE 40 HN ILE 40 22.231 5.473 28.046
274 HA ILE 40 HA ILE 40 22.767 3.538 30.140
275 HB ILE 40 HB ILE 40 24.107 3.570 27.466
276 HG12 ILE 40 HG12 ILE 40 22.543 1.724 29.064
277 HG13 ILE 40 HG13 ILE 40 22.967 1.657 27.365
278 HG21 ILE 40 HG21 ILE 40 26.052 2.412 28.404
279 HG22 ILE 40 HG22 ILE 40 25.910 4.072 29.031
280 HG23 ILE 40 HG23 ILE 40 25.430 2.692 30.048
281 HD11 ILE 40 HD11 ILE 40 23.877 -0.289 28.637
282 HD12 ILE 40 HD12 ILE 40 25.173 0.690 27.909
283 HD13 ILE 40 HD13 ILE 40 24.821 0.832 29.648
284 H ARG 41 HN ARG 41 24.851 4.085 31.292
285 HA ARG 41 HA ARG 41 25.825 5.601 32.523
286 HB2 ARG 41 HB2 ARG 41 26.541 6.483 29.695
287 HB3 ARG 41 HB3 ARG 41 27.245 7.281 31.088
288 HG2 ARG 41 HG2 ARG 41 27.375 4.266 30.608
289 HG3 ARG 41 HG3 ARG 41 28.647 5.382 30.155
290 HD2 ARG 41 HD2 ARG 41 28.005 5.964 32.887
291 HD3 ARG 41 HD3 ARG 41 28.097 4.218 32.763
292 HE ARG 41 HE ARG 41 30.312 5.529 31.392
293 HH11 ARG 41 HH22 ARG 41 29.170 4.436 34.563
294 HH12 ARG 41 HH21 ARG 41 30.764 4.291 35.226
295 HH22 ARG 41 HH1 ARG 41 32.657 4.828 33.857
296 H GLY 42 HN GLY 42 25.381 8.028 29.918
297 HA2 GLY 42 HA1 GLY 42 23.174 9.311 31.328
298 HA3 GLY 42 HA2 GLY 42 24.693 10.184 31.296
299 H VAL 43 HN VAL 43 23.580 7.990 28.682
300 HA VAL 43 HA VAL 43 22.967 10.338 27.046
301 HB VAL 43 HB VAL 43 24.466 8.083 25.810
302 HG11 VAL 43 HG11 VAL 43 24.304 9.523 24.110
303 HG12 VAL 43 HG12 VAL 43 23.705 10.814 25.180
304 HG13 VAL 43 HG13 VAL 43 25.456 10.570 24.974
305 HG21 VAL 43 HG21 VAL 43 25.944 8.322 27.604
306 HG22 VAL 43 HG22 VAL 43 26.614 9.424 26.377
307 HG23 VAL 43 HG23 VAL 43 25.662 10.074 27.734
308 H LEU 44 HN LEU 44 20.946 10.129 26.248
309 HA LEU 44 HA LEU 44 19.852 7.420 26.111
310 HB2 LEU 44 HB2 LEU 44 18.368 8.548 27.377
311 HB3 LEU 44 HB3 LEU 44 18.771 10.107 26.687
312 HG LEU 44 HG LEU 44 17.460 9.537 24.659
313 HD11 LEU 44 HD11 LEU 44 15.781 7.509 25.279
314 HD12 LEU 44 HD12 LEU 44 17.252 7.324 24.295
315 HD13 LEU 44 HD13 LEU 44 17.284 6.920 26.028
316 HD21 LEU 44 HD21 LEU 44 15.403 9.090 26.683
317 HD22 LEU 44 HD22 LEU 44 16.552 10.372 27.134
318 HD23 LEU 44 HD23 LEU 44 15.666 10.473 25.594
319 H VAL 45 HN VAL 45 19.898 6.429 24.174
320 HA VAL 45 HA VAL 45 20.020 8.143 21.805
321 HB VAL 45 HB VAL 45 20.530 5.180 21.927
322 HG11 VAL 45 HG11 VAL 45 22.181 5.978 20.055
323 HG12 VAL 45 HG12 VAL 45 20.445 5.810 19.697
324 HG13 VAL 45 HG13 VAL 45 21.138 7.419 20.013
325 HG21 VAL 45 HG21 VAL 45 22.241 7.408 22.932
326 HG22 VAL 45 HG22 VAL 45 22.129 5.714 23.467
327 HG23 VAL 45 HG23 VAL 45 23.036 6.123 21.991
328 H ARG 46 HN ARG 46 18.015 8.618 21.040
329 HA ARG 46 HA ARG 46 16.134 6.395 21.015
330 HB2 ARG 46 HB2 ARG 46 15.433 9.370 20.933
331 HB3 ARG 46 HB3 ARG 46 14.318 8.036 21.155
332 HG2 ARG 46 HG2 ARG 46 15.402 7.461 23.320
333 HG3 ARG 46 HG3 ARG 46 16.571 8.746 23.094
334 HD2 ARG 46 HD2 ARG 46 13.582 9.328 23.088
335 HD3 ARG 46 HD3 ARG 46 14.481 9.236 24.589
336 HE ARG 46 HE ARG 46 15.958 10.950 22.899
337 HH11 ARG 46 HH22 ARG 46 12.749 10.919 24.399
338 HH12 ARG 46 HH21 ARG 46 12.633 12.645 24.480
339 HH22 ARG 46 HH1 ARG 46 14.443 13.983 23.654
340 H TYR 47 HN TYR 47 15.948 5.563 18.957
341 HA TYR 47 HA TYR 47 16.439 7.373 16.711
342 HB2 TYR 47 HB2 TYR 47 17.592 5.054 17.183
343 HB3 TYR 47 HB3 TYR 47 16.035 4.325 16.842
344 HD1 TYR 47 HD1 TYR 47 14.965 5.388 14.508
345 HD2 TYR 47 HD2 TYR 47 19.114 4.930 15.448
346 HE1 TYR 47 HE1 TYR 47 15.531 5.357 12.030
347 HE2 TYR 47 HE2 TYR 47 19.665 4.900 12.966
348 HH TYR 47 HH TYR 47 17.277 4.517 10.595
349 H ARG 48 HN ARG 48 14.878 7.879 15.205
350 HA ARG 48 HA ARG 48 12.469 6.328 15.205
351 HB2 ARG 48 HB2 ARG 48 11.187 8.675 15.257
352 HB3 ARG 48 HB3 ARG 48 11.587 7.847 16.749
353 HG2 ARG 48 HG2 ARG 48 13.044 9.479 17.391
354 HG3 ARG 48 HG3 ARG 48 13.824 9.515 15.822
355 HD2 ARG 48 HD2 ARG 48 12.540 11.656 16.613
356 HD3 ARG 48 HD3 ARG 48 12.322 11.128 14.957
357 HE ARG 48 HE ARG 48 10.363 9.873 16.674
358 HH11 ARG 48 HH22 ARG 48 11.115 12.956 15.097
359 HH12 ARG 48 HH21 ARG 48 9.462 13.471 15.039
360 HH22 ARG 48 HH1 ARG 48 7.755 12.042 15.927
361 H ARG 49 HN ARG 49 12.465 5.834 13.020
362 HA ARG 49 HA ARG 49 11.887 7.772 11.171
363 HB2 ARG 49 HB2 ARG 49 14.433 8.229 11.636
364 HB3 ARG 49 HB3 ARG 49 14.725 6.755 10.735
365 HG2 ARG 49 HG2 ARG 49 14.756 8.986 9.408
366 HG3 ARG 49 HG3 ARG 49 13.852 7.652 8.717
367 HD2 ARG 49 HD2 ARG 49 12.638 9.906 8.718
368 HD3 ARG 49 HD3 ARG 49 11.738 8.576 9.418
369 HE ARG 49 HE ARG 49 13.345 10.106 11.354
370 HH11 ARG 49 HH22 ARG 49 10.182 9.761 9.795
371 HH12 ARG 49 HH21 ARG 49 9.336 10.615 11.042
372 HH22 ARG 49 HH1 ARG 49 10.559 11.471 12.916
373 H CYS 50 HN CYS 50 12.108 6.788 8.807
374 HA CYS 50 HA CYS 50 12.241 3.890 8.894
375 HB2 CYS 50 HB2 CYS 50 9.882 5.156 7.540
376 HB3 CYS 50 HB3 CYS 50 10.123 3.488 8.019
377 H TRP 51 HN TRP 51 12.514 2.988 6.674
378 HA TRP 51 HA TRP 51 13.554 5.040 4.843
379 HB2 TRP 51 HB2 TRP 51 15.366 3.729 5.499
380 HB3 TRP 51 HB3 TRP 51 14.440 2.241 5.471
381 HD1 TRP 51 HD1 TRP 51 16.460 4.518 3.166
382 HE1 TRP 51 HE1 TRP 51 16.811 3.438 0.784
383 HE3 TRP 51 HE3 TRP 51 13.220 0.661 3.859
384 HZ2 TRP 51 HZ2 TRP 51 15.718 1.143 -0.514
385 HZ3 TRP 51 HZ3 TRP 51 12.920 -0.954 1.985
386 HH2 TRP 51 HH2 TRP 51 14.105 -0.760 -0.144
Start of MODEL 19
1 H1 ARG 1 HN ARG 1 10.123 -6.637 0.430
2 HA ARG 1 HA ARG 1 7.734 -6.952 2.017
3 HB2 ARG 1 HB2 ARG 1 9.557 -8.772 1.769
4 HB3 ARG 1 HB3 ARG 1 10.587 -7.755 2.757
5 HG2 ARG 1 HG2 ARG 1 9.621 -9.114 4.397
6 HG3 ARG 1 HG3 ARG 1 8.531 -7.742 4.430
7 HD2 ARG 1 HD2 ARG 1 6.836 -9.208 4.033
8 HD3 ARG 1 HD3 ARG 1 7.456 -9.367 2.402
9 HE ARG 1 HE ARG 1 8.471 -11.431 2.983
10 HH11 ARG 1 HH22 ARG 1 7.123 -9.862 5.859
11 HH12 ARG 1 HH21 ARG 1 7.274 -11.273 6.852
12 HH22 ARG 1 HH1 ARG 1 8.187 -13.279 5.910
13 H TRP 2 HN TRP 2 7.390 -5.825 3.995
14 HA TRP 2 HA TRP 2 9.471 -3.911 4.762
15 HB2 TRP 2 HB2 TRP 2 6.631 -3.025 4.875
16 HB3 TRP 2 HB3 TRP 2 8.102 -2.084 4.726
17 HD1 TRP 2 HD1 TRP 2 5.372 -3.610 2.611
18 HE1 TRP 2 HE1 TRP 2 5.719 -3.152 0.035
19 HE3 TRP 2 HE3 TRP 2 10.126 -1.857 3.029
20 HZ2 TRP 2 HZ2 TRP 2 7.894 -2.130 -1.503
21 HZ3 TRP 2 HZ3 TRP 2 11.291 -1.149 0.941
22 HH2 TRP 2 HH2 TRP 2 10.251 -1.264 -1.268
23 H CYS 3 HN CYS 3 9.544 -3.533 7.038
24 HA CYS 3 HA CYS 3 7.526 -4.811 8.658
25 HB2 CYS 3 HB2 CYS 3 10.400 -5.724 8.619
26 HB3 CYS 3 HB3 CYS 3 9.366 -5.953 10.015
27 H VAL 4 HN VAL 4 8.630 -4.515 11.154
28 HA VAL 4 HA VAL 4 9.926 -1.912 11.243
29 HB VAL 4 HB VAL 4 8.271 -0.798 12.316
30 HG11 VAL 4 HG11 VAL 4 7.367 -1.269 10.132
31 HG12 VAL 4 HG12 VAL 4 6.749 -2.848 10.674
32 HG13 VAL 4 HG13 VAL 4 6.041 -1.347 11.316
33 HG21 VAL 4 HG21 VAL 4 7.918 -2.026 14.264
34 HG22 VAL 4 HG22 VAL 4 6.324 -2.081 13.474
35 HG23 VAL 4 HG23 VAL 4 7.413 -3.485 13.378
36 H TYR 5 HN TYR 5 11.450 -1.845 12.842
37 HA TYR 5 HA TYR 5 11.296 -3.978 14.864
38 HB2 TYR 5 HB2 TYR 5 13.446 -2.894 13.007
39 HB3 TYR 5 HB3 TYR 5 13.971 -3.395 14.601
40 HD1 TYR 5 HD1 TYR 5 12.265 -4.597 11.516
41 HD2 TYR 5 HD2 TYR 5 14.298 -5.688 15.119
42 HE1 TYR 5 HE1 TYR 5 12.383 -7.011 10.727
43 HE2 TYR 5 HE2 TYR 5 14.409 -8.098 14.318
44 HH TYR 5 HH TYR 5 14.410 -9.247 12.070
45 H ALA 6 HN ALA 6 11.301 -3.280 16.946
46 HA ALA 6 HA ALA 6 12.401 -0.601 17.438
47 HB1 ALA 6 HB1 ALA 6 10.363 0.107 18.057
48 HB2 ALA 6 HB2 ALA 6 9.676 -1.485 17.655
49 HB3 ALA 6 HB3 ALA 6 10.299 -1.173 19.293
50 H TYR 7 HN TYR 7 13.409 -0.324 19.510
51 HA TYR 7 HA TYR 7 13.606 -2.680 21.195
52 HB2 TYR 7 HB2 TYR 7 15.406 -2.786 19.378
53 HB3 TYR 7 HB3 TYR 7 15.948 -1.188 19.853
54 HD1 TYR 7 HD1 TYR 7 16.555 -0.977 22.464
55 HD2 TYR 7 HD2 TYR 7 16.557 -4.618 20.218
56 HE1 TYR 7 HE1 TYR 7 18.145 -2.024 24.149
57 HE2 TYR 7 HE2 TYR 7 18.147 -5.653 21.910
58 HH TYR 7 HH TYR 7 19.839 -4.835 23.522
59 H VAL 8 HN VAL 8 13.043 -1.846 23.147
60 HA VAL 8 HA VAL 8 14.202 0.768 23.832
61 HB VAL 8 HB VAL 8 11.672 -0.461 24.930
62 HG11 VAL 8 HG11 VAL 8 11.722 2.393 25.021
63 HG12 VAL 8 HG12 VAL 8 11.716 1.236 26.373
64 HG13 VAL 8 HG13 VAL 8 13.260 1.791 25.684
65 HG21 VAL 8 HG21 VAL 8 12.152 0.995 22.401
66 HG22 VAL 8 HG22 VAL 8 10.817 -0.084 22.873
67 HG23 VAL 8 HG23 VAL 8 10.811 1.619 23.391
68 H ARG 9 HN ARG 9 15.467 0.894 25.650
69 HA ARG 9 HA ARG 9 15.303 -1.279 27.524
70 HB2 ARG 9 HB2 ARG 9 17.050 -2.229 26.244
71 HB3 ARG 9 HB3 ARG 9 17.709 -0.669 25.791
72 HG2 ARG 9 HG2 ARG 9 18.610 -0.315 28.036
73 HG3 ARG 9 HG3 ARG 9 17.774 -1.726 28.653
74 HD2 ARG 9 HD2 ARG 9 19.518 -3.052 28.060
75 HD3 ARG 9 HD3 ARG 9 19.343 -2.573 26.384
76 HE ARG 9 HE ARG 9 20.654 -0.411 27.378
77 HH11 ARG 9 HH22 ARG 9 21.272 -3.870 27.832
78 HH12 ARG 9 HH21 ARG 9 22.978 -3.663 28.053
79 HH22 ARG 9 HH1 ARG 9 23.915 -1.459 27.954
80 H ILE 10 HN ILE 10 15.263 -0.347 29.547
81 HA ILE 10 HA ILE 10 17.033 1.868 30.098
82 HB ILE 10 HB ILE 10 14.156 2.306 30.767
83 HG12 ILE 10 HG12 ILE 10 15.401 3.012 28.092
84 HG13 ILE 10 HG13 ILE 10 14.167 1.795 28.352
85 HG21 ILE 10 HG21 ILE 10 15.623 4.632 29.966
86 HG22 ILE 10 HG22 ILE 10 14.953 4.215 31.562
87 HG23 ILE 10 HG23 ILE 10 16.599 3.697 31.124
88 HD11 ILE 10 HD11 ILE 10 12.689 3.484 27.949
89 HD12 ILE 10 HD12 ILE 10 13.048 3.998 29.615
90 HD13 ILE 10 HD13 ILE 10 13.912 4.741 28.248
91 H ARG 11 HN ARG 11 17.312 2.214 32.408
92 HA ARG 11 HA ARG 11 17.577 1.527 34.438
93 HB2 ARG 11 HB2 ARG 11 14.763 0.609 33.875
94 HB3 ARG 11 HB3 ARG 11 15.515 -0.009 35.332
95 HG2 ARG 11 HG2 ARG 11 14.949 1.939 36.349
96 HG3 ARG 11 HG3 ARG 11 16.166 2.729 35.367
97 HD2 ARG 11 HD2 ARG 11 14.585 3.444 33.741
98 HD3 ARG 11 HD3 ARG 11 13.408 2.231 34.206
99 HE ARG 11 HE ARG 11 13.742 3.803 36.498
100 HH11 ARG 11 HH22 ARG 11 12.756 4.405 33.148
101 HH12 ARG 11 HH21 ARG 11 11.746 5.751 33.556
102 HH22 ARG 11 HH1 ARG 11 11.557 6.424 35.849
103 H GLY 12 HN GLY 12 15.637 -1.376 33.482
104 HA2 GLY 12 HA1 GLY 12 17.987 -3.004 33.079
105 HA3 GLY 12 HA2 GLY 12 17.156 -3.315 34.590
106 H VAL 13 HN VAL 13 15.346 -2.133 31.771
107 HA VAL 13 HA VAL 13 14.269 -4.847 31.428
108 HB VAL 13 HB VAL 13 12.769 -2.231 31.214
109 HG11 VAL 13 HG11 VAL 13 10.775 -3.801 31.302
110 HG12 VAL 13 HG12 VAL 13 11.739 -3.850 29.807
111 HG13 VAL 13 HG13 VAL 13 11.922 -5.134 31.026
112 HG21 VAL 13 HG21 VAL 13 13.492 -3.790 33.546
113 HG22 VAL 13 HG22 VAL 13 12.635 -2.234 33.442
114 HG23 VAL 13 HG23 VAL 13 11.725 -3.760 33.332
115 H LEU 14 HN LEU 14 13.529 -5.362 29.240
116 HA LEU 14 HA LEU 14 14.488 -3.524 27.190
117 HB2 LEU 14 HB2 LEU 14 16.374 -4.952 27.582
118 HB3 LEU 14 HB3 LEU 14 15.375 -6.390 27.512
119 HG LEU 14 HG LEU 14 15.226 -6.368 25.215
120 HD11 LEU 14 HD11 LEU 14 15.635 -3.384 25.382
121 HD12 LEU 14 HD12 LEU 14 15.774 -4.273 23.846
122 HD13 LEU 14 HD13 LEU 14 14.241 -4.294 24.750
123 HD21 LEU 14 HD21 LEU 14 17.542 -6.754 25.851
124 HD22 LEU 14 HD22 LEU 14 17.455 -5.911 24.286
125 HD23 LEU 14 HD23 LEU 14 17.881 -5.009 25.761
126 H VAL 15 HN VAL 15 12.714 -3.102 25.996
127 HA VAL 15 HA VAL 15 10.869 -5.347 25.551
128 HB VAL 15 HB VAL 15 10.071 -2.481 25.249
129 HG11 VAL 15 HG11 VAL 15 8.774 -4.934 25.001
130 HG12 VAL 15 HG12 VAL 15 8.239 -4.321 26.584
131 HG13 VAL 15 HG13 VAL 15 8.005 -3.333 25.122
132 HG21 VAL 15 HG21 VAL 15 10.727 -2.055 27.368
133 HG22 VAL 15 HG22 VAL 15 9.279 -2.991 27.809
134 HG23 VAL 15 HG23 VAL 15 10.875 -3.779 27.783
135 H ARG 16 HN ARG 16 11.768 -6.203 23.668
136 HA ARG 16 HA ARG 16 12.393 -4.348 21.566
137 HB2 ARG 16 HB2 ARG 16 12.769 -7.334 21.984
138 HB3 ARG 16 HB3 ARG 16 12.934 -6.660 20.374
139 HG2 ARG 16 HG2 ARG 16 14.541 -4.911 21.529
140 HG3 ARG 16 HG3 ARG 16 14.601 -6.071 22.842
141 HD2 ARG 16 HD2 ARG 16 16.460 -6.572 21.369
142 HD3 ARG 16 HD3 ARG 16 15.284 -7.853 21.158
143 HE ARG 16 HE ARG 16 14.797 -5.711 19.272
144 HH11 ARG 16 HH22 ARG 16 16.939 -8.470 19.872
145 HH12 ARG 16 HH21 ARG 16 17.318 -8.698 18.197
146 HH22 ARG 16 HH1 ARG 16 16.341 -7.242 16.563
147 H TYR 17 HN TYR 17 10.604 -3.607 20.435
148 HA TYR 17 HA TYR 17 8.374 -5.427 20.019
149 HB2 TYR 17 HB2 TYR 17 8.579 -2.784 20.689
150 HB3 TYR 17 HB3 TYR 17 8.664 -2.588 18.949
151 HD1 TYR 17 HD1 TYR 17 6.530 -3.855 21.716
152 HD2 TYR 17 HD2 TYR 17 6.708 -2.738 17.590
153 HE1 TYR 17 HE1 TYR 17 3.993 -3.941 21.576
154 HE2 TYR 17 HE2 TYR 17 4.170 -2.827 17.464
155 HH TYR 17 HH TYR 17 2.282 -4.128 20.072
156 H ARG 18 HN ARG 18 7.401 -5.679 17.858
157 HA ARG 18 HA ARG 18 9.127 -5.006 15.670
158 HB2 ARG 18 HB2 ARG 18 8.681 -7.815 16.663
159 HB3 ARG 18 HB3 ARG 18 8.674 -7.584 14.926
160 HG2 ARG 18 HG2 ARG 18 10.917 -6.828 14.877
161 HG3 ARG 18 HG3 ARG 18 10.904 -6.353 16.564
162 HD2 ARG 18 HD2 ARG 18 12.066 -8.332 16.820
163 HD3 ARG 18 HD3 ARG 18 10.452 -9.009 16.900
164 HE ARG 18 HE ARG 18 11.320 -8.823 14.148
165 HH11 ARG 18 HH22 ARG 18 11.782 -10.750 17.085
166 HH12 ARG 18 HH21 ARG 18 12.229 -12.184 16.223
167 HH22 ARG 18 HH1 ARG 18 12.298 -12.140 13.827
168 H ARG 19 HN ARG 19 7.973 -6.032 13.520
169 HA ARG 19 HA ARG 19 5.298 -6.619 13.619
170 HB2 ARG 19 HB2 ARG 19 5.433 -4.044 14.361
171 HB3 ARG 19 HB3 ARG 19 5.586 -3.768 12.637
172 HG2 ARG 19 HG2 ARG 19 3.396 -5.624 13.548
173 HG3 ARG 19 HG3 ARG 19 3.182 -3.913 13.865
174 HD2 ARG 19 HD2 ARG 19 4.129 -4.091 11.175
175 HD3 ARG 19 HD3 ARG 19 2.921 -5.350 11.340
176 HE ARG 19 HE ARG 19 1.337 -3.650 11.269
177 HH11 ARG 19 HH22 ARG 19 4.232 -2.369 12.860
178 HH12 ARG 19 HH21 ARG 19 3.541 -0.804 13.132
179 HH22 ARG 19 HH1 ARG 19 1.301 -0.366 12.400
180 H CYS 20 HN CYS 20 4.340 -6.693 11.374
181 HA CYS 20 HA CYS 20 6.196 -6.077 9.244
182 HB2 CYS 20 HB2 CYS 20 5.399 -8.869 10.003
183 HB3 CYS 20 HB3 CYS 20 5.683 -8.467 8.321
184 H TRP 21 HN TRP 21 5.058 -6.133 7.112
185 HA TRP 21 HA TRP 21 2.257 -5.481 7.475
186 HB2 TRP 21 HB2 TRP 21 4.154 -4.268 6.050
187 HB3 TRP 21 HB3 TRP 21 3.602 -5.387 4.820
188 HD1 TRP 21 HD1 TRP 21 1.951 -4.078 3.281
189 HE1 TRP 21 HE1 TRP 21 -0.066 -2.394 3.517
190 HE3 TRP 21 HE3 TRP 21 2.218 -3.648 8.341
191 HZ2 TRP 21 HZ2 TRP 21 -1.297 -1.100 5.743
192 HZ3 TRP 21 HZ3 TRP 21 0.572 -2.153 9.468
193 HH2 TRP 21 HH2 TRP 21 -1.142 -0.904 8.253
194 H1 ARG 31 HN ARG 31 5.880 -0.591 6.142
195 HA ARG 31 HA ARG 31 7.982 0.151 4.274
196 HB2 ARG 31 HB2 ARG 31 6.530 1.636 6.473
197 HB3 ARG 31 HB3 ARG 31 8.183 2.102 6.123
198 HG2 ARG 31 HG2 ARG 31 7.043 3.492 4.638
199 HG3 ARG 31 HG3 ARG 31 7.351 2.117 3.597
200 HD2 ARG 31 HD2 ARG 31 5.059 2.429 3.231
201 HD3 ARG 31 HD3 ARG 31 5.019 1.236 4.515
202 HE ARG 31 HE ARG 31 5.082 3.752 5.795
203 HH11 ARG 31 HH22 ARG 31 2.909 2.016 3.599
204 HH12 ARG 31 HH21 ARG 31 1.485 2.813 4.179
205 HH22 ARG 31 HH1 ARG 31 1.681 4.448 5.920
206 H TRP 32 HN TRP 32 9.909 1.218 5.943
207 HA TRP 32 HA TRP 32 10.556 -1.047 7.705
208 HB2 TRP 32 HB2 TRP 32 12.151 0.480 5.720
209 HB3 TRP 32 HB3 TRP 32 12.959 0.036 7.210
210 HD1 TRP 32 HD1 TRP 32 12.254 -1.365 3.871
211 HE1 TRP 32 HE1 TRP 32 12.709 -3.958 3.690
212 HE3 TRP 32 HE3 TRP 32 12.554 -2.195 8.879
213 HZ2 TRP 32 HZ2 TRP 32 13.134 -6.019 5.618
214 HZ3 TRP 32 HZ3 TRP 32 12.991 -4.526 9.646
215 HH2 TRP 32 HH2 TRP 32 13.278 -6.403 8.106
216 H CYS 33 HN CYS 33 9.456 -0.050 9.516
217 HA CYS 33 HA CYS 33 10.327 2.600 10.261
218 HB2 CYS 33 HB2 CYS 33 8.159 0.745 11.079
219 HB3 CYS 33 HB3 CYS 33 8.775 1.818 12.320
220 H VAL 34 HN VAL 34 11.382 3.013 12.359
221 HA VAL 34 HA VAL 34 12.410 0.716 13.777
222 HB VAL 34 HB VAL 34 14.691 1.163 13.449
223 HG11 VAL 34 HG11 VAL 34 13.606 -0.069 11.602
224 HG12 VAL 34 HG12 VAL 34 13.370 1.465 10.730
225 HG13 VAL 34 HG13 VAL 34 15.016 0.866 11.048
226 HG21 VAL 34 HG21 VAL 34 13.756 3.773 12.279
227 HG22 VAL 34 HG22 VAL 34 14.987 3.464 13.527
228 HG23 VAL 34 HG23 VAL 34 15.341 3.105 11.819
229 H TYR 35 HN TYR 35 12.155 1.175 15.897
230 HA TYR 35 HA TYR 35 12.704 3.896 16.783
231 HB2 TYR 35 HB2 TYR 35 10.145 3.150 16.179
232 HB3 TYR 35 HB3 TYR 35 10.245 2.375 17.747
233 HD1 TYR 35 HD2 TYR 35 10.569 3.747 19.806
234 HD2 TYR 35 HD1 TYR 35 9.951 5.543 15.973
235 HE1 TYR 35 HE2 TYR 35 9.986 5.954 20.926
236 HE2 TYR 35 HE1 TYR 35 9.371 7.744 17.106
237 HH TYR 35 HH TYR 35 9.675 8.106 20.604
238 H ALA 36 HN ALA 36 14.197 3.663 18.367
239 HA ALA 36 HA ALA 36 13.732 1.525 20.316
240 HB1 ALA 36 HB1 ALA 36 15.426 0.585 18.943
241 HB2 ALA 36 HB2 ALA 36 16.265 2.145 18.769
242 HB3 ALA 36 HB3 ALA 36 16.297 1.287 20.328
243 H TYR 37 HN TYR 37 14.782 1.978 22.430
244 HA TYR 37 HA TYR 37 15.632 4.735 22.797
245 HB2 TYR 37 HB2 TYR 37 13.028 4.338 23.038
246 HB3 TYR 37 HB3 TYR 37 13.424 3.372 24.445
247 HD1 TYR 37 HD1 TYR 37 14.628 4.486 26.398
248 HD2 TYR 37 HD2 TYR 37 12.899 6.705 23.174
249 HE1 TYR 37 HE1 TYR 37 14.634 6.587 27.830
250 HE2 TYR 37 HE2 TYR 37 12.911 8.798 24.616
251 HH TYR 37 HH TYR 37 12.910 9.376 26.945
252 H VAL 38 HN VAL 38 17.689 3.574 23.162
253 HA VAL 38 HA VAL 38 17.700 2.070 25.677
254 HB VAL 38 HB VAL 38 19.700 2.239 23.415
255 HG11 VAL 38 HG11 VAL 38 19.763 0.548 25.939
256 HG12 VAL 38 HG12 VAL 38 20.912 0.445 24.583
257 HG13 VAL 38 HG13 VAL 38 20.830 1.924 25.569
258 HG21 VAL 38 HG21 VAL 38 17.488 0.357 24.099
259 HG22 VAL 38 HG22 VAL 38 18.123 0.858 22.513
260 HG23 VAL 38 HG23 VAL 38 19.002 -0.347 23.483
261 H ARG 39 HN ARG 39 18.889 2.775 27.446
262 HA ARG 39 HA ARG 39 20.282 5.295 27.027
263 HB2 ARG 39 HB2 ARG 39 17.939 5.268 28.318
264 HB3 ARG 39 HB3 ARG 39 18.904 4.683 29.658
265 HG2 ARG 39 HG2 ARG 39 20.413 6.674 29.433
266 HG3 ARG 39 HG3 ARG 39 19.434 7.260 28.103
267 HD2 ARG 39 HD2 ARG 39 18.346 8.419 29.771
268 HD3 ARG 39 HD3 ARG 39 17.464 6.916 29.959
269 HE ARG 39 HE ARG 39 19.850 6.740 31.522
270 HH11 ARG 39 HH22 ARG 39 16.781 8.511 31.493
271 HH12 ARG 39 HH21 ARG 39 16.753 8.736 33.210
272 HH22 ARG 39 HH1 ARG 39 18.545 7.861 34.539
273 H ILE 40 HN ILE 40 22.301 5.483 28.093
274 HA ILE 40 HA ILE 40 22.991 3.394 30.004
275 HB ILE 40 HB ILE 40 24.786 4.029 27.671
276 HG12 ILE 40 HG12 ILE 40 22.519 2.095 27.862
277 HG13 ILE 40 HG13 ILE 40 23.094 3.021 26.490
278 HG21 ILE 40 HG21 ILE 40 25.948 1.996 28.357
279 HG22 ILE 40 HG22 ILE 40 25.878 3.174 29.690
280 HG23 ILE 40 HG23 ILE 40 24.788 1.766 29.687
281 HD11 ILE 40 HD11 ILE 40 25.104 1.571 26.323
282 HD12 ILE 40 HD12 ILE 40 24.550 0.643 27.737
283 HD13 ILE 40 HD13 ILE 40 23.610 0.607 26.226
284 H ARG 41 HN ARG 41 24.379 4.099 31.621
285 HA ARG 41 HA ARG 41 25.385 5.508 32.913
286 HB2 ARG 41 HB2 ARG 41 26.299 6.658 30.239
287 HB3 ARG 41 HB3 ARG 41 26.865 7.323 31.758
288 HG2 ARG 41 HG2 ARG 41 27.217 4.450 30.788
289 HG3 ARG 41 HG3 ARG 41 28.477 5.657 30.954
290 HD2 ARG 41 HD2 ARG 41 26.946 4.222 33.151
291 HD3 ARG 41 HD3 ARG 41 28.681 4.315 32.919
292 HE ARG 41 HE ARG 41 28.026 6.954 33.288
293 HH11 ARG 41 HH22 ARG 41 27.224 4.037 35.132
294 HH12 ARG 41 HH21 ARG 41 27.110 4.874 36.644
295 HH22 ARG 41 HH1 ARG 41 27.497 7.238 36.709
296 H GLY 42 HN GLY 42 24.824 7.950 30.297
297 HA2 GLY 42 HA1 GLY 42 22.546 9.088 31.680
298 HA3 GLY 42 HA2 GLY 42 24.008 10.051 31.754
299 H VAL 43 HN VAL 43 23.472 7.931 28.965
300 HA VAL 43 HA VAL 43 22.722 10.296 27.392
301 HB VAL 43 HB VAL 43 24.357 8.120 26.185
302 HG11 VAL 43 HG11 VAL 43 24.230 9.598 24.514
303 HG12 VAL 43 HG12 VAL 43 23.552 10.849 25.584
304 HG13 VAL 43 HG13 VAL 43 25.316 10.647 25.456
305 HG21 VAL 43 HG21 VAL 43 26.407 9.593 26.915
306 HG22 VAL 43 HG22 VAL 43 25.345 10.043 28.272
307 HG23 VAL 43 HG23 VAL 43 25.772 8.336 28.004
308 H LEU 44 HN LEU 44 20.842 10.062 26.290
309 HA LEU 44 HA LEU 44 19.752 7.352 26.149
310 HB2 LEU 44 HB2 LEU 44 18.144 8.539 27.191
311 HB3 LEU 44 HB3 LEU 44 18.632 10.065 26.479
312 HG LEU 44 HG LEU 44 17.542 9.430 24.356
313 HD11 LEU 44 HD11 LEU 44 17.008 7.334 23.878
314 HD12 LEU 44 HD12 LEU 44 17.585 6.825 25.483
315 HD13 LEU 44 HD13 LEU 44 15.880 7.284 25.254
316 HD21 LEU 44 HD21 LEU 44 15.157 9.445 25.266
317 HD22 LEU 44 HD22 LEU 44 15.895 9.442 26.886
318 HD23 LEU 44 HD23 LEU 44 16.227 10.780 25.759
319 H VAL 45 HN VAL 45 19.916 6.273 24.265
320 HA VAL 45 HA VAL 45 20.265 7.897 21.845
321 HB VAL 45 HB VAL 45 20.956 4.986 22.119
322 HG11 VAL 45 HG11 VAL 45 21.294 5.423 19.923
323 HG12 VAL 45 HG12 VAL 45 21.442 7.178 20.183
324 HG13 VAL 45 HG13 VAL 45 22.829 6.110 20.504
325 HG21 VAL 45 HG21 VAL 45 22.204 5.786 23.921
326 HG22 VAL 45 HG22 VAL 45 23.348 5.897 22.562
327 HG23 VAL 45 HG23 VAL 45 22.512 7.357 23.143
328 H ARG 46 HN ARG 46 18.091 8.273 21.316
329 HA ARG 46 HA ARG 46 16.528 5.847 20.953
330 HB2 ARG 46 HB2 ARG 46 14.661 7.807 20.702
331 HB3 ARG 46 HB3 ARG 46 15.103 7.126 22.255
332 HG2 ARG 46 HG2 ARG 46 16.784 8.949 22.581
333 HG3 ARG 46 HG3 ARG 46 16.354 9.628 21.024
334 HD2 ARG 46 HD2 ARG 46 14.269 9.200 23.206
335 HD3 ARG 46 HD3 ARG 46 15.229 10.664 23.128
336 HE ARG 46 HE ARG 46 14.172 10.258 20.532
337 HH11 ARG 46 HH22 ARG 46 12.936 10.912 23.787
338 HH12 ARG 46 HH21 ARG 46 11.521 11.735 23.219
339 HH22 ARG 46 HH1 ARG 46 11.172 11.976 20.860
340 H TYR 47 HN TYR 47 16.203 5.192 18.847
341 HA TYR 47 HA TYR 47 16.813 7.132 16.742
342 HB2 TYR 47 HB2 TYR 47 17.950 4.832 16.967
343 HB3 TYR 47 HB3 TYR 47 16.377 4.080 16.792
344 HD1 TYR 47 HD2 TYR 47 17.245 7.064 14.821
345 HD2 TYR 47 HD1 TYR 47 17.086 2.789 14.846
346 HE1 TYR 47 HE2 TYR 47 17.538 7.031 12.295
347 HE2 TYR 47 HE1 TYR 47 17.379 2.771 12.320
348 HH TYR 47 HH TYR 47 17.948 5.779 10.550
349 H ARG 48 HN ARG 48 15.372 7.558 15.026
350 HA ARG 48 HA ARG 48 12.837 6.222 15.096
351 HB2 ARG 48 HB2 ARG 48 11.645 8.523 15.012
352 HB3 ARG 48 HB3 ARG 48 12.243 8.006 16.577
353 HG2 ARG 48 HG2 ARG 48 14.460 9.307 15.743
354 HG3 ARG 48 HG3 ARG 48 13.292 10.167 14.760
355 HD2 ARG 48 HD2 ARG 48 11.989 10.181 17.185
356 HD3 ARG 48 HD3 ARG 48 13.656 10.188 17.728
357 HE ARG 48 HE ARG 48 13.706 12.129 15.797
358 HH11 ARG 48 HH22 ARG 48 11.509 11.582 18.522
359 HH12 ARG 48 HH21 ARG 48 11.141 13.263 18.723
360 HH22 ARG 48 HH1 ARG 48 12.158 14.870 17.265
361 H ARG 49 HN ARG 49 12.371 5.744 12.970
362 HA ARG 49 HA ARG 49 12.381 7.648 10.986
363 HB2 ARG 49 HB2 ARG 49 14.904 7.392 11.234
364 HB3 ARG 49 HB3 ARG 49 14.741 5.712 10.762
365 HG2 ARG 49 HG2 ARG 49 13.642 7.941 9.008
366 HG3 ARG 49 HG3 ARG 49 15.327 7.469 8.913
367 HD2 ARG 49 HD2 ARG 49 13.735 5.057 8.873
368 HD3 ARG 49 HD3 ARG 49 13.044 6.174 7.714
369 HE ARG 49 HE ARG 49 15.675 6.393 7.085
370 HH11 ARG 49 HH22 ARG 49 13.710 3.509 7.700
371 HH12 ARG 49 HH21 ARG 49 14.653 2.493 6.661
372 HH22 ARG 49 HH1 ARG 49 16.534 3.423 5.503
373 H CYS 50 HN CYS 50 11.547 6.742 8.951
374 HA CYS 50 HA CYS 50 11.098 3.870 8.980
375 HB2 CYS 50 HB2 CYS 50 8.855 5.870 8.628
376 HB3 CYS 50 HB3 CYS 50 8.727 4.132 8.447
377 H TRP 51 HN TRP 51 11.188 3.013 6.875
378 HA TRP 51 HA TRP 51 11.951 4.907 4.815
379 HB2 TRP 51 HB2 TRP 51 13.009 2.554 5.490
380 HB3 TRP 51 HB3 TRP 51 11.827 1.971 4.334
381 HD1 TRP 51 HD1 TRP 51 13.110 1.593 2.093
382 HE1 TRP 51 HE1 TRP 51 14.855 2.858 0.571
383 HE3 TRP 51 HE3 TRP 51 13.798 5.522 5.245
384 HZ2 TRP 51 HZ2 TRP 51 16.295 5.306 0.851
385 HZ3 TRP 51 HZ3 TRP 51 15.391 7.307 4.545
386 HH2 TRP 51 HH2 TRP 51 16.618 7.244 2.432
Start of MODEL 20
1 H1 ARG 1 HN ARG 1 8.768 -5.536 0.476
2 HA ARG 1 HA ARG 1 6.343 -5.692 2.081
3 HB2 ARG 1 HB2 ARG 1 8.863 -7.381 2.083
4 HB3 ARG 1 HB3 ARG 1 7.957 -7.209 3.573
5 HG2 ARG 1 HG2 ARG 1 7.346 -9.215 2.053
6 HG3 ARG 1 HG3 ARG 1 6.018 -8.254 2.671
7 HD2 ARG 1 HD2 ARG 1 5.725 -7.107 0.568
8 HD3 ARG 1 HD3 ARG 1 7.276 -7.654 -0.038
9 HE ARG 1 HE ARG 1 5.419 -9.833 0.634
10 HH11 ARG 1 HH22 ARG 1 6.543 -7.638 -1.910
11 HH12 ARG 1 HH21 ARG 1 5.985 -8.648 -3.201
12 HH22 ARG 1 HH1 ARG 1 4.893 -10.718 -2.683
13 H TRP 2 HN TRP 2 6.305 -4.447 3.979
14 HA TRP 2 HA TRP 2 8.755 -2.915 4.514
15 HB2 TRP 2 HB2 TRP 2 6.093 -2.024 5.506
16 HB3 TRP 2 HB3 TRP 2 7.499 -1.084 5.047
17 HD1 TRP 2 HD1 TRP 2 4.214 -1.213 3.870
18 HE1 TRP 2 HE1 TRP 2 3.860 -0.911 1.273
19 HE3 TRP 2 HE3 TRP 2 9.011 -2.278 2.562
20 HZ2 TRP 2 HZ2 TRP 2 5.587 -1.146 -0.987
21 HZ3 TRP 2 HZ3 TRP 2 9.594 -2.219 0.139
22 HH2 TRP 2 HH2 TRP 2 7.973 -1.678 -1.609
23 H CYS 3 HN CYS 3 9.749 -3.272 6.467
24 HA CYS 3 HA CYS 3 8.273 -4.943 8.358
25 HB2 CYS 3 HB2 CYS 3 11.135 -4.747 7.577
26 HB3 CYS 3 HB3 CYS 3 10.797 -5.077 9.265
27 H VAL 4 HN VAL 4 8.713 -4.419 10.729
28 HA VAL 4 HA VAL 4 9.575 -1.686 11.198
29 HB VAL 4 HB VAL 4 7.412 -1.520 12.674
30 HG11 VAL 4 HG11 VAL 4 7.186 0.191 11.261
31 HG12 VAL 4 HG12 VAL 4 8.133 -0.659 10.016
32 HG13 VAL 4 HG13 VAL 4 6.373 -0.903 10.117
33 HG21 VAL 4 HG21 VAL 4 5.929 -2.826 10.509
34 HG22 VAL 4 HG22 VAL 4 6.897 -3.963 11.477
35 HG23 VAL 4 HG23 VAL 4 5.700 -2.913 12.272
36 H TYR 5 HN TYR 5 11.115 -1.935 12.728
37 HA TYR 5 HA TYR 5 10.620 -3.987 14.778
38 HB2 TYR 5 HB2 TYR 5 12.992 -2.913 13.209
39 HB3 TYR 5 HB3 TYR 5 13.312 -3.418 14.856
40 HD1 TYR 5 HD1 TYR 5 11.632 -5.800 15.184
41 HD2 TYR 5 HD2 TYR 5 13.924 -4.522 11.806
42 HE1 TYR 5 HE1 TYR 5 11.835 -8.210 14.401
43 HE2 TYR 5 HE2 TYR 5 14.120 -6.936 11.034
44 HH TYR 5 HH TYR 5 13.929 -9.070 11.741
45 H ALA 6 HN ALA 6 11.419 -3.497 16.970
46 HA ALA 6 HA ALA 6 12.013 -0.718 17.512
47 HB1 ALA 6 HB1 ALA 6 9.340 -1.745 17.685
48 HB2 ALA 6 HB2 ALA 6 9.934 -1.462 19.339
49 HB3 ALA 6 HB3 ALA 6 9.942 -0.136 18.152
50 H TYR 7 HN TYR 7 13.077 -0.448 19.531
51 HA TYR 7 HA TYR 7 13.328 -2.777 21.238
52 HB2 TYR 7 HB2 TYR 7 15.122 -3.148 19.603
53 HB3 TYR 7 HB3 TYR 7 15.501 -1.438 19.534
54 HD1 TYR 7 HD2 TYR 7 14.922 -2.827 22.845
55 HD2 TYR 7 HD1 TYR 7 17.896 -2.101 19.856
56 HE1 TYR 7 HE2 TYR 7 16.753 -3.160 24.576
57 HE2 TYR 7 HE1 TYR 7 19.718 -2.437 21.598
58 HH TYR 7 HH TYR 7 19.864 -3.756 23.816
59 H VAL 8 HN VAL 8 12.855 -1.914 23.200
60 HA VAL 8 HA VAL 8 14.035 0.713 23.790
61 HB VAL 8 HB VAL 8 11.511 -0.522 24.907
62 HG11 VAL 8 HG11 VAL 8 11.612 2.308 25.223
63 HG12 VAL 8 HG12 VAL 8 11.620 1.050 26.482
64 HG13 VAL 8 HG13 VAL 8 13.157 1.643 25.806
65 HG21 VAL 8 HG21 VAL 8 10.688 0.019 22.867
66 HG22 VAL 8 HG22 VAL 8 10.665 1.665 23.544
67 HG23 VAL 8 HG23 VAL 8 12.017 1.147 22.508
68 H ARG 9 HN ARG 9 15.149 0.966 25.747
69 HA ARG 9 HA ARG 9 15.094 -1.143 27.640
70 HB2 ARG 9 HB2 ARG 9 16.733 -2.295 26.422
71 HB3 ARG 9 HB3 ARG 9 17.394 -0.833 25.717
72 HG2 ARG 9 HG2 ARG 9 18.457 -0.222 27.857
73 HG3 ARG 9 HG3 ARG 9 17.693 -1.576 28.665
74 HD2 ARG 9 HD2 ARG 9 19.399 -2.939 28.049
75 HD3 ARG 9 HD3 ARG 9 19.073 -2.619 26.357
76 HE ARG 9 HE ARG 9 20.434 -0.349 27.151
77 HH11 ARG 9 HH22 ARG 9 21.145 -3.811 27.411
78 HH12 ARG 9 HH21 ARG 9 22.862 -3.589 27.360
79 HH22 ARG 9 HH1 ARG 9 23.753 -1.373 27.166
80 H ILE 10 HN ILE 10 15.059 0.011 29.543
81 HA ILE 10 HA ILE 10 17.020 2.127 29.882
82 HB ILE 10 HB ILE 10 14.205 2.737 30.668
83 HG12 ILE 10 HG12 ILE 10 15.332 3.137 27.881
84 HG13 ILE 10 HG13 ILE 10 13.998 2.090 28.323
85 HG21 ILE 10 HG21 ILE 10 16.743 4.051 30.726
86 HG22 ILE 10 HG22 ILE 10 15.651 4.962 29.655
87 HG23 ILE 10 HG23 ILE 10 15.169 4.618 31.333
88 HD11 ILE 10 HD11 ILE 10 14.103 5.118 28.329
89 HD12 ILE 10 HD12 ILE 10 12.906 4.042 27.570
90 HD13 ILE 10 HD13 ILE 10 12.915 4.257 29.337
91 H ARG 11 HN ARG 11 16.894 2.910 32.297
92 HA ARG 11 HA ARG 11 17.440 2.224 34.301
93 HB2 ARG 11 HB2 ARG 11 14.546 1.458 33.916
94 HB3 ARG 11 HB3 ARG 11 15.316 0.962 35.410
95 HG2 ARG 11 HG2 ARG 11 14.886 3.045 36.206
96 HG3 ARG 11 HG3 ARG 11 16.140 3.629 35.129
97 HD2 ARG 11 HD2 ARG 11 14.593 4.304 33.467
98 HD3 ARG 11 HD3 ARG 11 13.349 3.206 34.030
99 HE ARG 11 HE ARG 11 13.843 5.004 36.158
100 HH11 ARG 11 HH22 ARG 11 12.629 5.169 32.833
101 HH12 ARG 11 HH21 ARG 11 11.637 6.557 33.132
102 HH22 ARG 11 HH1 ARG 11 11.597 7.520 35.327
103 H GLY 12 HN GLY 12 15.225 -0.567 34.078
104 HA2 GLY 12 HA1 GLY 12 17.484 -2.409 33.703
105 HA3 GLY 12 HA2 GLY 12 16.522 -2.532 35.163
106 H VAL 13 HN VAL 13 14.726 -1.348 32.438
107 HA VAL 13 HA VAL 13 13.488 -3.991 32.178
108 HB VAL 13 HB VAL 13 12.437 -1.233 31.514
109 HG11 VAL 13 HG11 VAL 13 11.103 -3.959 31.470
110 HG12 VAL 13 HG12 VAL 13 10.239 -2.409 31.341
111 HG13 VAL 13 HG13 VAL 13 11.406 -2.884 30.084
112 HG21 VAL 13 HG21 VAL 13 10.951 -2.525 33.583
113 HG22 VAL 13 HG22 VAL 13 12.675 -2.577 34.024
114 HG23 VAL 13 HG23 VAL 13 11.895 -1.018 33.664
115 H LEU 14 HN LEU 14 12.940 -4.788 30.042
116 HA LEU 14 HA LEU 14 14.271 -3.404 27.848
117 HB2 LEU 14 HB2 LEU 14 15.963 -4.893 28.610
118 HB3 LEU 14 HB3 LEU 14 14.834 -6.227 28.740
119 HG LEU 14 HG LEU 14 14.876 -6.689 26.502
120 HD11 LEU 14 HD11 LEU 14 15.701 -4.841 24.821
121 HD12 LEU 14 HD12 LEU 14 14.027 -4.848 25.427
122 HD13 LEU 14 HD13 LEU 14 15.225 -3.738 26.135
123 HD21 LEU 14 HD21 LEU 14 17.202 -6.351 25.611
124 HD22 LEU 14 HD22 LEU 14 17.539 -5.364 27.053
125 HD23 LEU 14 HD23 LEU 14 17.107 -7.082 27.231
126 H VAL 15 HN VAL 15 12.724 -3.066 26.355
127 HA VAL 15 HA VAL 15 10.771 -5.228 25.976
128 HB VAL 15 HB VAL 15 10.054 -2.359 25.529
129 HG11 VAL 15 HG11 VAL 15 7.988 -3.176 25.258
130 HG12 VAL 15 HG12 VAL 15 8.732 -4.793 25.241
131 HG13 VAL 15 HG13 VAL 15 8.085 -4.128 26.759
132 HG21 VAL 15 HG21 VAL 15 10.542 -1.883 27.681
133 HG22 VAL 15 HG22 VAL 15 9.051 -2.789 28.031
134 HG23 VAL 15 HG23 VAL 15 10.632 -3.598 28.150
135 H ARG 16 HN ARG 16 11.817 -6.157 24.200
136 HA ARG 16 HA ARG 16 12.502 -4.348 22.057
137 HB2 ARG 16 HB2 ARG 16 13.028 -7.335 22.458
138 HB3 ARG 16 HB3 ARG 16 13.538 -6.445 21.037
139 HG2 ARG 16 HG2 ARG 16 14.651 -4.806 22.820
140 HG3 ARG 16 HG3 ARG 16 14.527 -6.191 23.886
141 HD2 ARG 16 HD2 ARG 16 16.732 -6.031 22.625
142 HD3 ARG 16 HD3 ARG 16 15.900 -7.560 22.431
143 HE ARG 16 HE ARG 16 15.263 -5.540 20.379
144 HH11 ARG 16 HH22 ARG 16 17.307 -8.297 21.259
145 HH12 ARG 16 HH21 ARG 16 17.731 -8.664 19.621
146 HH22 ARG 16 HH1 ARG 16 16.846 -7.316 17.848
147 H TYR 17 HN TYR 17 10.751 -3.868 20.744
148 HA TYR 17 HA TYR 17 8.717 -5.896 20.328
149 HB2 TYR 17 HB2 TYR 17 8.686 -3.190 20.724
150 HB3 TYR 17 HB3 TYR 17 8.899 -3.167 18.985
151 HD1 TYR 17 HD1 TYR 17 6.758 -5.043 21.446
152 HD2 TYR 17 HD2 TYR 17 6.956 -2.865 17.769
153 HE1 TYR 17 HE1 TYR 17 4.252 -5.335 21.130
154 HE2 TYR 17 HE2 TYR 17 4.450 -3.165 17.466
155 HH TYR 17 HH TYR 17 2.654 -5.354 19.356
156 H ARG 18 HN ARG 18 7.915 -6.365 18.108
157 HA ARG 18 HA ARG 18 9.799 -5.824 16.020
158 HB2 ARG 18 HB2 ARG 18 9.622 -8.433 15.451
159 HB3 ARG 18 HB3 ARG 18 10.855 -7.841 16.547
160 HG2 ARG 18 HG2 ARG 18 9.373 -8.356 18.496
161 HG3 ARG 18 HG3 ARG 18 8.134 -8.939 17.403
162 HD2 ARG 18 HD2 ARG 18 9.122 -10.984 17.728
163 HD3 ARG 18 HD3 ARG 18 10.280 -10.427 16.535
164 HE ARG 18 HE ARG 18 11.033 -9.499 19.168
165 HH11 ARG 18 HH22 ARG 18 11.031 -12.403 17.138
166 HH12 ARG 18 HH21 ARG 18 12.376 -13.126 17.955
167 HH22 ARG 18 HH1 ARG 18 13.406 -11.961 19.779
168 H ARG 19 HN ARG 19 8.870 -6.307 13.852
169 HA ARG 19 HA ARG 19 6.322 -7.419 13.635
170 HB2 ARG 19 HB2 ARG 19 5.636 -5.241 14.653
171 HB3 ARG 19 HB3 ARG 19 6.481 -4.372 13.388
172 HG2 ARG 19 HG2 ARG 19 4.763 -4.638 11.917
173 HG3 ARG 19 HG3 ARG 19 4.644 -6.355 12.246
174 HD2 ARG 19 HD2 ARG 19 3.290 -5.923 14.266
175 HD3 ARG 19 HD3 ARG 19 3.506 -4.194 14.084
176 HE ARG 19 HE ARG 19 2.356 -5.419 11.697
177 HH11 ARG 19 HH22 ARG 19 1.578 -4.125 14.903
178 HH12 ARG 19 HH21 ARG 19 -0.067 -3.769 14.497
179 HH22 ARG 19 HH1 ARG 19 -0.865 -4.262 12.291
180 H CYS 20 HN CYS 20 5.734 -7.688 11.373
181 HA CYS 20 HA CYS 20 7.387 -6.366 9.416
182 HB2 CYS 20 HB2 CYS 20 7.715 -9.230 10.142
183 HB3 CYS 20 HB3 CYS 20 7.688 -8.848 8.432
184 H TRP 21 HN TRP 21 6.296 -6.278 7.384
185 HA TRP 21 HA TRP 21 3.605 -7.461 7.434
186 HB2 TRP 21 HB2 TRP 21 4.641 -4.897 6.230
187 HB3 TRP 21 HB3 TRP 21 3.109 -5.609 5.762
188 HD1 TRP 21 HD1 TRP 21 1.661 -6.291 8.373
189 HE1 TRP 21 HE1 TRP 21 1.008 -4.566 10.260
190 HE3 TRP 21 HE3 TRP 21 5.115 -2.784 7.095
191 HZ2 TRP 21 HZ2 TRP 21 1.988 -1.987 10.991
192 HZ3 TRP 21 HZ3 TRP 21 5.200 -0.692 8.447
193 HH2 TRP 21 HH2 TRP 21 3.710 -0.265 10.337
194 H1 ARG 31 HN ARG 31 7.574 0.327 3.711
195 HA ARG 31 HA ARG 31 10.338 0.896 3.194
196 HB2 ARG 31 HB2 ARG 31 8.104 2.166 4.754
197 HB3 ARG 31 HB3 ARG 31 9.725 2.458 5.353
198 HG2 ARG 31 HG2 ARG 31 9.659 4.189 3.833
199 HG3 ARG 31 HG3 ARG 31 10.184 2.939 2.723
200 HD2 ARG 31 HD2 ARG 31 8.352 3.633 1.508
201 HD3 ARG 31 HD3 ARG 31 7.493 2.533 2.568
202 HE ARG 31 HE ARG 31 7.602 4.973 3.962
203 HH11 ARG 31 HH22 ARG 31 6.269 3.844 0.879
204 HH12 ARG 31 HH21 ARG 31 4.988 5.009 0.864
205 HH22 ARG 31 HH1 ARG 31 4.797 6.568 2.674
206 H TRP 32 HN TRP 32 11.398 1.519 5.682
207 HA TRP 32 HA TRP 32 11.013 -0.892 7.304
208 HB2 TRP 32 HB2 TRP 32 13.490 0.018 5.935
209 HB3 TRP 32 HB3 TRP 32 13.657 -0.564 7.580
210 HD1 TRP 32 HD1 TRP 32 12.835 -1.826 4.052
211 HE1 TRP 32 HE1 TRP 32 12.844 -4.462 3.940
212 HE3 TRP 32 HE3 TRP 32 13.218 -2.561 9.069
213 HZ2 TRP 32 HZ2 TRP 32 13.007 -6.513 5.918
214 HZ3 TRP 32 HZ3 TRP 32 13.296 -4.912 9.896
215 HH2 TRP 32 HH2 TRP 32 13.197 -6.850 8.410
216 H CYS 33 HN CYS 33 9.917 0.236 8.944
217 HA CYS 33 HA CYS 33 11.063 2.722 9.867
218 HB2 CYS 33 HB2 CYS 33 8.489 1.283 10.233
219 HB3 CYS 33 HB3 CYS 33 9.028 2.285 11.567
220 H VAL 34 HN VAL 34 11.610 2.991 12.211
221 HA VAL 34 HA VAL 34 12.020 0.549 13.702
222 HB VAL 34 HB VAL 34 14.454 1.336 14.088
223 HG11 VAL 34 HG11 VAL 34 13.852 -0.797 13.058
224 HG12 VAL 34 HG12 VAL 34 13.624 0.006 11.486
225 HG13 VAL 34 HG13 VAL 34 15.244 -0.069 12.219
226 HG21 VAL 34 HG21 VAL 34 15.432 2.287 11.926
227 HG22 VAL 34 HG22 VAL 34 13.764 2.739 11.496
228 HG23 VAL 34 HG23 VAL 34 14.521 3.415 12.959
229 H TYR 35 HN TYR 35 11.898 0.915 15.910
230 HA TYR 35 HA TYR 35 12.099 3.677 16.823
231 HB2 TYR 35 HB2 TYR 35 9.678 2.862 16.129
232 HB3 TYR 35 HB3 TYR 35 9.788 1.763 17.490
233 HD1 TYR 35 HD1 TYR 35 11.000 5.293 17.307
234 HD2 TYR 35 HD2 TYR 35 8.139 2.574 18.959
235 HE1 TYR 35 HE1 TYR 35 10.149 7.120 18.858
236 HE2 TYR 35 HE2 TYR 35 7.298 4.410 20.504
237 HH TYR 35 HH TYR 35 8.101 7.656 20.050
238 H ALA 36 HN ALA 36 13.796 3.407 18.228
239 HA ALA 36 HA ALA 36 13.400 1.360 20.296
240 HB1 ALA 36 HB1 ALA 36 15.865 2.007 18.657
241 HB2 ALA 36 HB2 ALA 36 15.985 1.240 20.259
242 HB3 ALA 36 HB3 ALA 36 15.102 0.425 18.946
243 H TYR 37 HN TYR 37 14.559 1.911 22.358
244 HA TYR 37 HA TYR 37 15.306 4.698 22.629
245 HB2 TYR 37 HB2 TYR 37 12.696 4.175 22.922
246 HB3 TYR 37 HB3 TYR 37 13.181 3.394 24.414
247 HD1 TYR 37 HD1 TYR 37 14.522 4.824 26.121
248 HD2 TYR 37 HD2 TYR 37 12.292 6.490 22.872
249 HE1 TYR 37 HE1 TYR 37 14.450 7.069 27.311
250 HE2 TYR 37 HE2 TYR 37 12.228 8.729 24.073
251 HH TYR 37 HH TYR 37 12.437 9.645 26.180
252 H VAL 38 HN VAL 38 17.352 3.367 22.924
253 HA VAL 38 HA VAL 38 17.431 1.980 25.484
254 HB VAL 38 HB VAL 38 19.486 2.276 23.284
255 HG11 VAL 38 HG11 VAL 38 19.476 0.785 25.904
256 HG12 VAL 38 HG12 VAL 38 20.424 0.186 24.521
257 HG13 VAL 38 HG13 VAL 38 20.747 1.805 25.188
258 HG21 VAL 38 HG21 VAL 38 18.807 0.241 22.406
259 HG22 VAL 38 HG22 VAL 38 18.014 -0.270 23.916
260 HG23 VAL 38 HG23 VAL 38 17.252 0.965 22.884
261 H ARG 39 HN ARG 39 18.880 2.593 27.179
262 HA ARG 39 HA ARG 39 20.202 5.124 26.820
263 HB2 ARG 39 HB2 ARG 39 17.775 5.408 27.798
264 HB3 ARG 39 HB3 ARG 39 18.435 4.716 29.266
265 HG2 ARG 39 HG2 ARG 39 20.145 6.504 29.384
266 HG3 ARG 39 HG3 ARG 39 19.594 7.167 27.858
267 HD2 ARG 39 HD2 ARG 39 17.975 8.364 28.910
268 HD3 ARG 39 HD3 ARG 39 17.304 6.908 29.616
269 HE ARG 39 HE ARG 39 18.557 7.283 31.600
270 HH11 ARG 39 HH22 ARG 39 19.430 9.640 29.102
271 HH12 ARG 39 HH21 ARG 39 20.283 10.674 30.200
272 HH22 ARG 39 HH1 ARG 39 20.418 10.070 32.516
273 H ILE 40 HN ILE 40 22.131 5.230 28.029
274 HA ILE 40 HA ILE 40 22.473 3.451 30.274
275 HB ILE 40 HB ILE 40 23.759 3.000 27.623
276 HG12 ILE 40 HG12 ILE 40 22.135 1.534 29.530
277 HG13 ILE 40 HG13 ILE 40 22.476 1.189 27.846
278 HG21 ILE 40 HG21 ILE 40 25.118 2.435 30.273
279 HG22 ILE 40 HG22 ILE 40 25.645 1.832 28.683
280 HG23 ILE 40 HG23 ILE 40 25.661 3.579 29.022
281 HD11 ILE 40 HD11 ILE 40 24.619 0.131 28.443
282 HD12 ILE 40 HD12 ILE 40 24.381 0.571 30.152
283 HD13 ILE 40 HD13 ILE 40 23.299 -0.612 29.378
284 H ARG 41 HN ARG 41 24.482 3.958 31.480
285 HA ARG 41 HA ARG 41 25.735 5.418 32.470
286 HB2 ARG 41 HB2 ARG 41 26.324 6.162 29.570
287 HB3 ARG 41 HB3 ARG 41 27.185 6.912 30.899
288 HG2 ARG 41 HG2 ARG 41 27.012 3.886 30.559
289 HG3 ARG 41 HG3 ARG 41 28.296 4.840 29.846
290 HD2 ARG 41 HD2 ARG 41 28.060 5.639 32.608
291 HD3 ARG 41 HD3 ARG 41 28.073 3.887 32.567
292 HE ARG 41 HE ARG 41 30.117 4.780 30.804
293 HH11 ARG 41 HH22 ARG 41 29.400 4.840 34.274
294 HH12 ARG 41 HH21 ARG 41 31.067 4.874 34.743
295 HH22 ARG 41 HH1 ARG 41 32.764 4.864 33.051
296 H GLY 42 HN GLY 42 25.071 7.635 29.693
297 HA2 GLY 42 HA1 GLY 42 23.079 9.132 31.151
298 HA3 GLY 42 HA2 GLY 42 24.636 9.930 31.054
299 H VAL 43 HN VAL 43 23.602 7.695 28.490
300 HA VAL 43 HA VAL 43 22.934 10.002 26.807
301 HB VAL 43 HB VAL 43 24.436 7.709 25.642
302 HG11 VAL 43 HG11 VAL 43 24.335 9.078 23.884
303 HG12 VAL 43 HG12 VAL 43 23.616 10.367 24.880
304 HG13 VAL 43 HG13 VAL 43 25.386 10.221 24.755
305 HG21 VAL 43 HG21 VAL 43 26.602 8.839 26.173
306 HG22 VAL 43 HG22 VAL 43 25.725 9.897 27.305
307 HG23 VAL 43 HG23 VAL 43 25.788 8.142 27.594
308 H LEU 44 HN LEU 44 21.030 9.757 25.735
309 HA LEU 44 HA LEU 44 19.815 7.100 25.878
310 HB2 LEU 44 HB2 LEU 44 18.291 8.448 26.845
311 HB3 LEU 44 HB3 LEU 44 18.830 9.880 25.992
312 HG LEU 44 HG LEU 44 17.660 9.093 23.951
313 HD11 LEU 44 HD11 LEU 44 17.440 6.651 25.490
314 HD12 LEU 44 HD12 LEU 44 15.844 7.206 24.934
315 HD13 LEU 44 HD13 LEU 44 17.153 6.940 23.758
316 HD21 LEU 44 HD21 LEU 44 15.878 9.275 26.396
317 HD22 LEU 44 HD22 LEU 44 16.586 10.653 25.520
318 HD23 LEU 44 HD23 LEU 44 15.405 9.595 24.711
319 H VAL 45 HN VAL 45 20.079 5.852 24.111
320 HA VAL 45 HA VAL 45 20.414 7.215 21.546
321 HB VAL 45 HB VAL 45 20.801 4.280 22.024
322 HG11 VAL 45 HG11 VAL 45 21.112 5.975 19.823
323 HG12 VAL 45 HG12 VAL 45 22.769 5.686 20.404
324 HG13 VAL 45 HG13 VAL 45 21.720 4.310 19.986
325 HG21 VAL 45 HG21 VAL 45 23.264 4.933 22.489
326 HG22 VAL 45 HG22 VAL 45 22.600 6.518 22.951
327 HG23 VAL 45 HG23 VAL 45 22.087 5.052 23.820
328 H ARG 46 HN ARG 46 18.175 7.792 21.257
329 HA ARG 46 HA ARG 46 16.473 5.462 20.891
330 HB2 ARG 46 HB2 ARG 46 15.222 6.763 22.356
331 HB3 ARG 46 HB3 ARG 46 15.985 8.257 21.851
332 HG2 ARG 46 HG2 ARG 46 14.666 8.251 19.745
333 HG3 ARG 46 HG3 ARG 46 13.944 6.715 20.181
334 HD2 ARG 46 HD2 ARG 46 12.337 7.792 21.368
335 HD3 ARG 46 HD3 ARG 46 13.559 8.484 22.417
336 HE ARG 46 HE ARG 46 13.697 10.066 20.139
337 HH11 ARG 46 HH22 ARG 46 11.077 9.146 22.340
338 HH12 ARG 46 HH21 ARG 46 10.185 10.609 22.087
339 HH22 ARG 46 HH1 ARG 46 11.051 12.270 20.593
340 H TYR 47 HN TYR 47 15.043 5.447 18.960
341 HA TYR 47 HA TYR 47 15.809 7.351 16.877
342 HB2 TYR 47 HB2 TYR 47 17.079 5.011 16.958
343 HB3 TYR 47 HB3 TYR 47 15.539 4.317 16.492
344 HD1 TYR 47 HD2 TYR 47 17.023 7.533 15.307
345 HD2 TYR 47 HD1 TYR 47 15.981 3.501 14.327
346 HE1 TYR 47 HE2 TYR 47 17.556 7.982 12.862
347 HE2 TYR 47 HE1 TYR 47 16.516 3.964 11.885
348 HH TYR 47 HH TYR 47 17.714 7.156 10.876
349 H ARG 48 HN ARG 48 14.167 7.803 15.375
350 HA ARG 48 HA ARG 48 11.796 6.196 15.513
351 HB2 ARG 48 HB2 ARG 48 10.489 8.534 15.679
352 HB3 ARG 48 HB3 ARG 48 10.975 7.670 17.125
353 HG2 ARG 48 HG2 ARG 48 12.487 9.277 17.720
354 HG3 ARG 48 HG3 ARG 48 13.131 9.401 16.094
355 HD2 ARG 48 HD2 ARG 48 11.732 11.149 15.523
356 HD3 ARG 48 HD3 ARG 48 10.375 10.501 16.422
357 HE ARG 48 HE ARG 48 12.230 11.265 18.379
358 HH11 ARG 48 HH22 ARG 48 10.493 12.901 15.760
359 HH12 ARG 48 HH21 ARG 48 10.471 14.434 16.565
360 HH22 ARG 48 HH1 ARG 48 11.480 14.638 18.729
361 H ARG 49 HN ARG 49 12.361 5.709 13.286
362 HA ARG 49 HA ARG 49 11.270 7.522 11.470
363 HB2 ARG 49 HB2 ARG 49 13.760 8.354 11.982
364 HB3 ARG 49 HB3 ARG 49 14.210 7.052 10.900
365 HG2 ARG 49 HG2 ARG 49 13.343 9.651 10.171
366 HG3 ARG 49 HG3 ARG 49 13.652 8.303 9.095
367 HD2 ARG 49 HD2 ARG 49 11.403 8.906 8.608
368 HD3 ARG 49 HD3 ARG 49 11.238 7.508 9.652
369 HE ARG 49 HE ARG 49 11.283 9.745 11.369
370 HH11 ARG 49 HH22 ARG 49 9.227 8.546 8.745
371 HH12 ARG 49 HH21 ARG 49 7.791 9.292 9.361
372 HH22 ARG 49 HH1 ARG 49 7.910 10.572 11.384
373 H CYS 50 HN CYS 50 12.847 6.546 9.140
374 HA CYS 50 HA CYS 50 12.716 3.674 9.343
375 HB2 CYS 50 HB2 CYS 50 11.130 4.823 7.095
376 HB3 CYS 50 HB3 CYS 50 11.021 3.251 7.862
377 H TRP 51 HN TRP 51 12.890 3.124 6.565
378 HA TRP 51 HA TRP 51 14.878 4.924 5.469
379 HB2 TRP 51 HB2 TRP 51 16.356 3.621 6.745
380 HB3 TRP 51 HB3 TRP 51 15.506 2.130 6.390
381 HD1 TRP 51 HD1 TRP 51 18.393 4.175 5.169
382 HE1 TRP 51 HE1 TRP 51 19.468 3.217 2.957
383 HE3 TRP 51 HE3 TRP 51 14.626 0.924 4.124
384 HZ2 TRP 51 HZ2 TRP 51 18.640 1.251 1.061
385 HZ3 TRP 51 HZ3 TRP 51 14.837 -0.478 2.073
386 HH2 TRP 51 HH2 TRP 51 16.758 -0.353 0.566