Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
639832 | 6qkp RC | 34358 | cing | 1-original | 3 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 H MET 65 1HT MET 65 7.269 14.335 -25.311
2 HA MET 65 HA MET 65 8.293 12.196 -25.439
3 HB2 MET 65 2HB MET 65 10.349 11.823 -26.674
4 HB3 MET 65 1HB MET 65 9.104 12.358 -27.786
5 HG2 MET 65 2HG MET 65 10.062 14.596 -27.810
6 HG3 MET 65 1HG MET 65 11.280 14.094 -26.641
7 HE1 MET 65 1HE MET 65 13.366 14.554 -29.922
8 HE2 MET 65 2HE MET 65 13.158 15.040 -28.235
9 HE3 MET 65 3HE MET 65 11.964 15.508 -29.440
10 H SER 66 H SER 66 9.023 15.368 -24.604
11 HA SER 66 HA SER 66 11.212 14.467 -22.913
12 HB2 SER 66 2HB SER 66 11.709 16.280 -24.464
13 HB3 SER 66 1HB SER 66 10.385 17.228 -23.799
14 HG SER 66 HG SER 66 12.540 17.714 -22.950
15 H GLY 67 H GLY 67 10.257 13.718 -21.097
16 HA2 GLY 67 2HA GLY 67 9.458 14.048 -18.970
17 HA3 GLY 67 1HA GLY 67 8.885 15.642 -19.438
18 H SER 68 H SER 68 7.703 13.125 -18.155
19 HA SER 68 HA SER 68 5.379 12.904 -19.918
20 HB2 SER 68 2HB SER 68 6.205 11.115 -17.621
21 HB3 SER 68 1HB SER 68 4.882 10.821 -18.751
22 HG SER 68 HG SER 68 7.249 9.940 -19.045
23 H GLY 69 H GLY 69 6.409 14.690 -17.426
24 HA2 GLY 69 2HA GLY 69 4.960 16.341 -16.490
25 HA3 GLY 69 1HA GLY 69 3.664 15.159 -16.530
26 H ARG 70 H ARG 70 3.102 14.402 -14.716
27 HA ARG 70 HA ARG 70 2.963 13.757 -12.588
28 HB2 ARG 70 2HB ARG 70 5.869 13.176 -12.793
29 HB3 ARG 70 1HB ARG 70 4.799 12.677 -11.501
30 HG2 ARG 70 2HG ARG 70 3.436 11.476 -13.265
31 HG3 ARG 70 1HG ARG 70 4.804 11.757 -14.355
32 HD2 ARG 70 2HD ARG 70 6.269 10.770 -12.642
33 HD3 ARG 70 1HD ARG 70 4.800 10.387 -11.738
34 HE ARG 70 HE ARG 70 4.688 9.346 -14.373
35 HH11 ARG 70 1HH1 ARG 70 5.789 8.669 -11.099
36 HH12 ARG 70 2HH1 ARG 70 6.198 7.033 -11.441
37 HH21 ARG 70 1HH2 ARG 70 5.288 7.107 -14.822
38 HH22 ARG 70 2HH2 ARG 70 5.968 6.159 -13.564
39 H GLY 71 H GLY 71 2.468 15.842 -11.908
40 HA2 GLY 71 2HA GLY 71 4.667 17.306 -10.754
41 HA3 GLY 71 1HA GLY 71 2.982 17.853 -10.813
42 H ARG 72 H ARG 72 2.180 15.175 -9.842
43 HA ARG 72 HA ARG 72 2.450 15.783 -7.004
44 HB2 ARG 72 2HB ARG 72 0.458 14.238 -8.629
45 HB3 ARG 72 1HB ARG 72 0.499 14.139 -6.872
46 HG2 ARG 72 2HG ARG 72 -0.160 16.336 -6.605
47 HG3 ARG 72 1HG ARG 72 0.393 16.799 -8.211
48 HD2 ARG 72 2HD ARG 72 -2.091 16.724 -7.952
49 HD3 ARG 72 1HD ARG 72 -1.454 15.735 -9.246
50 HE ARG 72 HE ARG 72 -1.798 13.800 -7.802
51 HH11 ARG 72 1HH1 ARG 72 -3.486 16.740 -6.770
52 HH12 ARG 72 2HH1 ARG 72 -4.837 15.898 -6.163
53 HH21 ARG 72 1HH2 ARG 72 -3.582 12.707 -7.073
54 HH22 ARG 72 2HH2 ARG 72 -4.921 13.490 -6.332
55 H GLY 73 H GLY 73 3.122 14.354 -5.483
56 HA2 GLY 73 2HA GLY 73 4.430 11.905 -6.443
57 HA3 GLY 73 1HA GLY 73 4.880 12.803 -4.991
58 H ALA 74 H ALA 74 4.629 10.950 -3.657
59 HA ALA 74 HA ALA 74 3.490 9.555 -2.179
60 HB1 ALA 74 1HB ALA 74 2.369 11.714 -1.566
61 HB2 ALA 74 2HB ALA 74 1.328 10.312 -1.373
62 HB3 ALA 74 3HB ALA 74 1.128 11.373 -2.771
63 H ILE 75 H ILE 75 0.664 8.902 -2.395
64 HA ILE 75 HA ILE 75 1.087 6.993 -4.548
65 HB ILE 75 HB ILE 75 -0.754 6.840 -2.187
66 HG12 ILE 75 2HG1 ILE 75 1.869 5.411 -2.626
67 HG13 ILE 75 1HG1 ILE 75 1.710 6.892 -1.702
68 HG21 ILE 75 1HG2 ILE 75 -0.908 4.411 -2.815
69 HG22 ILE 75 2HG2 ILE 75 0.133 4.726 -4.206
70 HG23 ILE 75 3HG2 ILE 75 -1.475 5.446 -4.127
71 HD11 ILE 75 1HD1 ILE 75 0.427 4.251 -1.035
72 HD12 ILE 75 2HD1 ILE 75 0.307 5.772 -0.120
73 HD13 ILE 75 3HD1 ILE 75 1.865 4.981 -0.295
74 H ASP 76 H ASP 76 0.528 8.482 -5.896
75 HA ASP 76 HA ASP 76 -2.260 9.404 -6.118
76 HB2 ASP 76 2HB ASP 76 -0.554 11.119 -6.471
77 HB3 ASP 76 1HB ASP 76 0.212 10.140 -7.712
78 H ARG 77 H ARG 77 -0.045 7.153 -7.342
79 HA ARG 77 HA ARG 77 -1.905 6.393 -9.495
80 HB2 ARG 77 2HB ARG 77 1.069 5.814 -9.258
81 HB3 ARG 77 1HB ARG 77 0.042 5.426 -10.635
82 HG2 ARG 77 2HG ARG 77 0.636 8.211 -9.650
83 HG3 ARG 77 1HG ARG 77 1.414 7.430 -11.028
84 HD2 ARG 77 2HD ARG 77 -0.541 7.464 -12.298
85 HD3 ARG 77 1HD ARG 77 -1.580 7.681 -10.898
86 HE ARG 77 HE ARG 77 -0.791 9.926 -10.722
87 HH11 ARG 77 1HH1 ARG 77 -0.032 8.339 -13.808
88 HH12 ARG 77 2HH1 ARG 77 -0.010 9.801 -14.688
89 HH21 ARG 77 1HH2 ARG 77 -0.792 11.859 -11.949
90 HH22 ARG 77 2HH2 ARG 77 -0.461 11.825 -13.629
91 H GLU 78 H GLU 78 -1.065 3.786 -9.907
92 HA GLU 78 HA GLU 78 -2.271 2.547 -7.669
93 HB2 GLU 78 2HB GLU 78 -0.950 1.421 -10.118
94 HB3 GLU 78 1HB GLU 78 -1.596 0.391 -8.848
95 HG2 GLU 78 2HG GLU 78 -3.785 1.455 -9.159
96 HG3 GLU 78 1HG GLU 78 -3.125 2.374 -10.509
97 H GLN 79 H GLN 79 -1.479 1.275 -6.138
98 HA GLN 79 HA GLN 79 0.896 2.067 -4.914
99 HB2 GLN 79 2HB GLN 79 -0.645 -0.491 -4.470
100 HB3 GLN 79 1HB GLN 79 0.470 0.265 -3.341
101 HG2 GLN 79 2HG GLN 79 -1.012 2.152 -3.081
102 HG3 GLN 79 1HG GLN 79 -2.102 1.500 -4.302
103 HE21 GLN 79 1HE2 GLN 79 -2.658 2.170 -1.592
104 HE22 GLN 79 2HE2 GLN 79 -3.253 0.740 -0.830
105 H SER 80 H SER 80 0.090 -0.903 -6.656
106 HA SER 80 HA SER 80 2.506 -2.217 -6.363
107 HB2 SER 80 2HB SER 80 0.618 -2.362 -8.710
108 HB3 SER 80 1HB SER 80 1.748 -3.609 -8.178
109 HG SER 80 HG SER 80 0.301 -4.262 -6.868
110 H ALA 81 H ALA 81 1.424 -0.029 -8.930
111 HA ALA 81 HA ALA 81 3.723 -0.247 -10.539
112 HB1 ALA 81 1HB ALA 81 1.621 0.629 -11.397
113 HB2 ALA 81 2HB ALA 81 2.930 1.809 -11.593
114 HB3 ALA 81 3HB ALA 81 1.741 2.006 -10.300
115 H ALA 82 H ALA 82 2.771 1.990 -7.995
116 HA ALA 82 HA ALA 82 4.947 3.716 -8.139
117 HB1 ALA 82 1HB ALA 82 3.292 3.014 -5.715
118 HB2 ALA 82 2HB ALA 82 2.881 4.241 -6.916
119 HB3 ALA 82 3HB ALA 82 4.304 4.445 -5.894
120 H ILE 83 H ILE 83 4.445 0.825 -6.144
121 HA ILE 83 HA ILE 83 6.916 0.973 -4.799
122 HB ILE 83 HB ILE 83 5.220 -1.491 -5.333
123 HG12 ILE 83 2HG1 ILE 83 5.307 0.318 -2.906
124 HG13 ILE 83 1HG1 ILE 83 4.046 0.340 -4.130
125 HG21 ILE 83 1HG2 ILE 83 7.402 -1.016 -3.290
126 HG22 ILE 83 2HG2 ILE 83 7.495 -2.105 -4.676
127 HG23 ILE 83 3HG2 ILE 83 6.371 -2.444 -3.357
128 HD11 ILE 83 1HD1 ILE 83 3.424 -1.945 -3.522
129 HD12 ILE 83 2HD1 ILE 83 3.341 -0.858 -2.134
130 HD13 ILE 83 3HD1 ILE 83 4.706 -1.961 -2.311
131 H ARG 84 H ARG 84 5.966 -0.563 -7.836
132 HA ARG 84 HA ARG 84 8.380 -1.958 -8.240
133 HB2 ARG 84 2HB ARG 84 6.255 -1.046 -10.136
134 HB3 ARG 84 1HB ARG 84 7.681 -1.922 -10.673
135 HG2 ARG 84 2HG ARG 84 7.100 -3.795 -9.275
136 HG3 ARG 84 1HG ARG 84 5.726 -2.901 -8.621
137 HD2 ARG 84 2HD ARG 84 4.996 -4.457 -10.309
138 HD3 ARG 84 1HD ARG 84 4.757 -2.788 -10.833
139 HE ARG 84 HE ARG 84 7.231 -3.673 -11.777
140 HH11 ARG 84 1HH1 ARG 84 3.790 -4.266 -12.316
141 HH12 ARG 84 2HH1 ARG 84 3.963 -4.714 -13.945
142 HH21 ARG 84 1HH2 ARG 84 7.482 -4.268 -14.008
143 HH22 ARG 84 2HH2 ARG 84 6.114 -4.699 -14.946
144 H GLU 85 H GLU 85 7.276 1.230 -9.311
145 HA GLU 85 HA GLU 85 9.637 1.818 -10.696
146 HB2 GLU 85 2HB GLU 85 7.670 3.637 -9.370
147 HB3 GLU 85 1HB GLU 85 8.999 4.222 -10.369
148 HG2 GLU 85 2HG GLU 85 7.989 2.765 -12.204
149 HG3 GLU 85 1HG GLU 85 6.569 2.655 -11.162
150 H TRP 86 H TRP 86 8.773 2.227 -7.267
151 HA TRP 86 HA TRP 86 11.018 3.736 -6.525
152 HB2 TRP 86 2HB TRP 86 9.039 3.553 -5.121
153 HB3 TRP 86 1HB TRP 86 9.243 1.812 -5.007
154 HD1 TRP 86 HD TRP 86 10.541 5.086 -3.546
155 HE1 TRP 86 1HE TRP 86 11.942 4.563 -1.478
156 HE3 TRP 86 3HE TRP 86 10.687 0.043 -3.986
157 HZ2 TRP 86 2HZ TRP 86 13.000 2.277 -0.174
158 HZ3 TRP 86 3HZ TRP 86 11.926 -1.275 -2.270
159 HH2 TRP 86 HH TRP 86 13.050 -0.165 -0.419
160 H ALA 87 H ALA 87 10.299 0.298 -6.575
161 HA ALA 87 HA ALA 87 12.658 -0.750 -5.619
162 HB1 ALA 87 1HB ALA 87 12.034 -2.785 -6.864
163 HB2 ALA 87 2HB ALA 87 10.845 -1.847 -7.762
164 HB3 ALA 87 3HB ALA 87 10.652 -2.075 -6.027
165 H ARG 88 H ARG 88 11.757 0.051 -8.949
166 HA ARG 88 HA ARG 88 14.236 -0.723 -10.049
167 HB2 ARG 88 2HB ARG 88 12.220 1.219 -11.172
168 HB3 ARG 88 1HB ARG 88 13.624 0.628 -12.043
169 HG2 ARG 88 2HG ARG 88 11.181 -0.895 -11.184
170 HG3 ARG 88 1HG ARG 88 11.795 -0.635 -12.814
171 HD2 ARG 88 2HD ARG 88 12.912 -2.423 -10.663
172 HD3 ARG 88 1HD ARG 88 12.317 -2.877 -12.254
173 HE ARG 88 HE ARG 88 14.528 -1.120 -12.488
174 HH11 ARG 88 1HH1 ARG 88 13.683 -4.483 -12.001
175 HH12 ARG 88 2HH1 ARG 88 15.261 -5.086 -12.197
176 HH21 ARG 88 1HH2 ARG 88 16.692 -1.884 -12.771
177 HH22 ARG 88 2HH2 ARG 88 17.035 -3.548 -12.633
178 H ARG 89 H ARG 89 13.123 2.362 -8.821
179 HA ARG 89 HA ARG 89 15.363 3.851 -9.659
180 HB2 ARG 89 2HB ARG 89 13.417 4.314 -7.445
181 HB3 ARG 89 1HB ARG 89 14.648 5.474 -7.940
182 HG2 ARG 89 2HG ARG 89 13.743 5.554 -10.163
183 HG3 ARG 89 1HG ARG 89 12.551 4.321 -9.743
184 HD2 ARG 89 2HD ARG 89 11.725 5.804 -8.008
185 HD3 ARG 89 1HD ARG 89 12.865 7.028 -8.618
186 HE ARG 89 HE ARG 89 11.674 6.875 -10.765
187 HH11 ARG 89 1HH1 ARG 89 9.919 6.145 -7.794
188 HH12 ARG 89 2HH1 ARG 89 8.380 6.175 -8.502
189 HH21 ARG 89 1HH2 ARG 89 9.561 6.966 -11.762
190 HH22 ARG 89 2HH2 ARG 89 8.180 6.569 -10.856
191 H ASN 90 H ASN 90 14.776 1.796 -6.949
192 HA ASN 90 HA ASN 90 17.293 2.586 -5.712
193 HB2 ASN 90 2HB ASN 90 15.023 0.895 -4.802
194 HB3 ASN 90 1HB ASN 90 16.562 0.865 -3.923
195 HD21 ASN 90 1HD2 ASN 90 13.728 2.645 -4.713
196 HD22 ASN 90 2HD2 ASN 90 13.962 3.944 -3.614
197 H GLY 91 H GLY 91 16.204 0.237 -7.847
198 HA2 GLY 91 2HA GLY 91 17.754 -1.055 -9.087
199 HA3 GLY 91 1HA GLY 91 18.864 -0.978 -7.731
200 H HIS 92 H HIS 92 15.550 -1.812 -7.123
201 HA HIS 92 HA HIS 92 16.398 -4.489 -6.405
202 HB2 HIS 92 2HB HIS 92 13.797 -3.013 -5.927
203 HB3 HIS 92 1HB HIS 92 14.131 -4.652 -5.390
204 HD1 HIS 92 1HD HIS 92 15.957 -4.843 -3.379
205 HD2 HIS 92 2HD HIS 92 14.661 -1.021 -4.357
206 HE1 HIS 92 1HE HIS 92 16.625 -3.365 -1.461
207 H ASN 93 H ASN 93 15.782 -6.219 -7.521
208 HA ASN 93 HA ASN 93 14.572 -5.708 -10.090
209 HB2 ASN 93 2HB ASN 93 15.967 -8.149 -8.997
210 HB3 ASN 93 1HB ASN 93 15.185 -8.118 -10.571
211 HD21 ASN 93 1HD2 ASN 93 18.007 -8.489 -9.808
212 HD22 ASN 93 2HD2 ASN 93 18.873 -7.271 -10.656
213 H VAL 94 H VAL 94 12.511 -5.323 -9.494
214 HA VAL 94 HA VAL 94 10.978 -7.651 -8.612
215 HB VAL 94 HB VAL 94 10.117 -4.744 -8.826
216 HG11 VAL 94 1HG1 VAL 94 8.243 -6.244 -9.204
217 HG12 VAL 94 2HG1 VAL 94 8.092 -5.462 -7.627
218 HG13 VAL 94 3HG1 VAL 94 8.637 -7.134 -7.734
219 HG21 VAL 94 1HG2 VAL 94 11.690 -5.094 -7.004
220 HG22 VAL 94 2HG2 VAL 94 10.723 -6.439 -6.403
221 HG23 VAL 94 3HG2 VAL 94 10.069 -4.800 -6.369
222 H SER 95 H SER 95 10.678 -8.840 -10.397
223 HA SER 95 HA SER 95 8.926 -7.915 -12.432
224 HB2 SER 95 2HB SER 95 11.239 -6.894 -13.014
225 HB3 SER 95 1HB SER 95 11.749 -8.541 -13.352
226 HG SER 95 HG SER 95 9.721 -8.458 -14.807
227 H THR 96 H THR 96 11.587 -10.263 -11.753
228 HA THR 96 HA THR 96 10.537 -12.332 -13.297
229 HB THR 96 HB THR 96 12.276 -13.609 -11.843
230 HG1 THR 96 1HG THR 96 13.762 -12.112 -10.928
231 HG21 THR 96 1HG2 THR 96 14.078 -12.657 -13.223
232 HG22 THR 96 2HG2 THR 96 13.034 -11.298 -13.638
233 HG23 THR 96 3HG2 THR 96 12.623 -12.927 -14.180
234 H ARG 97 H ARG 97 10.094 -11.489 -9.930
235 HA ARG 97 HA ARG 97 9.070 -14.039 -9.178
236 HB2 ARG 97 2HB ARG 97 8.928 -11.362 -7.790
237 HB3 ARG 97 1HB ARG 97 8.209 -12.818 -7.126
238 HG2 ARG 97 2HG ARG 97 11.134 -12.428 -7.737
239 HG3 ARG 97 1HG ARG 97 10.394 -12.359 -6.133
240 HD2 ARG 97 2HD ARG 97 9.652 -14.701 -6.426
241 HD3 ARG 97 1HD ARG 97 10.478 -14.745 -7.978
242 HE ARG 97 HE ARG 97 12.133 -14.022 -5.744
243 HH11 ARG 97 1HH1 ARG 97 10.963 -16.641 -7.819
244 HH12 ARG 97 2HH1 ARG 97 12.141 -17.751 -7.301
245 HH21 ARG 97 1HH2 ARG 97 13.793 -15.568 -5.078
246 HH22 ARG 97 2HH2 ARG 97 13.741 -17.155 -5.729
247 H GLY 98 H GLY 98 7.706 -11.493 -10.921
248 HA2 GLY 98 2HA GLY 98 5.623 -11.282 -11.874
249 HA3 GLY 98 1HA GLY 98 5.223 -12.862 -11.221
250 H ARG 99 H ARG 99 6.315 -10.811 -8.846
251 HA ARG 99 HA ARG 99 3.792 -9.615 -8.122
252 HB2 ARG 99 2HB ARG 99 3.792 -12.038 -7.251
253 HB3 ARG 99 1HB ARG 99 5.191 -11.592 -6.289
254 HG2 ARG 99 2HG ARG 99 3.696 -9.740 -5.330
255 HG3 ARG 99 1HG ARG 99 2.354 -10.650 -6.027
256 HD2 ARG 99 2HD ARG 99 3.234 -12.654 -4.780
257 HD3 ARG 99 1HD ARG 99 4.342 -11.558 -3.963
258 HE ARG 99 HE ARG 99 1.489 -11.793 -3.616
259 HH11 ARG 99 1HH1 ARG 99 4.344 -9.766 -2.857
260 HH12 ARG 99 2HH1 ARG 99 3.651 -9.164 -1.427
261 HH21 ARG 99 1HH2 ARG 99 0.586 -10.827 -1.623
262 HH22 ARG 99 2HH2 ARG 99 1.534 -9.731 -0.748
263 H ILE 100 H ILE 100 4.292 -8.137 -6.296
264 HA ILE 100 HA ILE 100 7.079 -7.393 -6.301
265 HB ILE 100 HB ILE 100 4.787 -6.157 -4.751
266 HG12 ILE 100 2HG1 ILE 100 5.923 -5.360 -7.438
267 HG13 ILE 100 1HG1 ILE 100 4.357 -6.122 -7.180
268 HG21 ILE 100 1HG2 ILE 100 6.270 -4.199 -4.639
269 HG22 ILE 100 2HG2 ILE 100 7.518 -5.091 -5.511
270 HG23 ILE 100 3HG2 ILE 100 7.024 -5.615 -3.900
271 HD11 ILE 100 1HD1 ILE 100 4.129 -3.755 -7.527
272 HD12 ILE 100 2HD1 ILE 100 5.235 -3.448 -6.185
273 HD13 ILE 100 3HD1 ILE 100 3.656 -4.187 -5.875
274 HA PRO 101 HA PRO 101 7.684 -9.980 -2.698
275 HB2 PRO 101 2HB PRO 101 10.111 -8.336 -2.323
276 HB3 PRO 101 1HB PRO 101 9.977 -10.094 -2.543
277 HG2 PRO 101 2HG PRO 101 10.956 -8.542 -4.464
278 HG3 PRO 101 1HG PRO 101 9.972 -9.975 -4.817
279 HD2 PRO 101 2HD PRO 101 9.175 -7.099 -4.928
280 HD3 PRO 101 1HD PRO 101 8.710 -8.465 -5.961
281 H ALA 102 H ALA 102 6.967 -9.721 -0.739
282 HA ALA 102 HA ALA 102 5.871 -7.388 0.281
283 HB1 ALA 102 1HB ALA 102 5.308 -9.664 1.019
284 HB2 ALA 102 2HB ALA 102 5.675 -8.584 2.361
285 HB3 ALA 102 3HB ALA 102 6.870 -9.764 1.831
286 H ASP 103 H ASP 103 9.045 -8.668 0.554
287 HA ASP 103 HA ASP 103 10.074 -7.082 2.630
288 HB2 ASP 103 2HB ASP 103 11.471 -8.303 0.248
289 HB3 ASP 103 1HB ASP 103 12.288 -7.652 1.662
290 H VAL 104 H VAL 104 9.784 -6.548 -0.840
291 HA VAL 104 HA VAL 104 11.253 -4.083 -0.817
292 HB VAL 104 HB VAL 104 9.460 -5.350 -2.935
293 HG11 VAL 104 1HG1 VAL 104 11.236 -2.916 -3.209
294 HG12 VAL 104 2HG1 VAL 104 9.474 -2.882 -3.164
295 HG13 VAL 104 3HG1 VAL 104 10.309 -3.683 -4.498
296 HG21 VAL 104 1HG2 VAL 104 12.433 -5.003 -2.771
297 HG22 VAL 104 2HG2 VAL 104 11.557 -5.746 -4.109
298 HG23 VAL 104 3HG2 VAL 104 11.568 -6.522 -2.515
299 H ILE 105 H ILE 105 7.929 -5.115 -0.726
300 HA ILE 105 HA ILE 105 6.680 -2.591 -0.867
301 HB ILE 105 HB ILE 105 5.748 -5.101 0.567
302 HG12 ILE 105 2HG1 ILE 105 5.089 -4.080 -2.210
303 HG13 ILE 105 1HG1 ILE 105 6.208 -5.387 -1.852
304 HG21 ILE 105 1HG2 ILE 105 3.484 -4.161 0.365
305 HG22 ILE 105 2HG2 ILE 105 4.176 -2.662 -0.275
306 HG23 ILE 105 3HG2 ILE 105 4.535 -3.162 1.372
307 HD11 ILE 105 1HD1 ILE 105 4.376 -6.719 -0.966
308 HD12 ILE 105 2HD1 ILE 105 4.052 -6.210 -2.618
309 HD13 ILE 105 3HD1 ILE 105 3.251 -5.394 -1.270
310 H ASP 106 H ASP 106 7.925 -4.461 1.850
311 HA ASP 106 HA ASP 106 7.012 -2.761 3.918
312 HB2 ASP 106 2HB ASP 106 7.844 -5.158 4.165
313 HB3 ASP 106 1HB ASP 106 9.474 -4.516 4.014
314 H ALA 107 H ALA 107 10.117 -3.124 2.272
315 HA ALA 107 HA ALA 107 11.511 -1.035 3.472
316 HB1 ALA 107 1HB ALA 107 12.529 -2.767 2.062
317 HB2 ALA 107 2HB ALA 107 12.976 -1.147 1.522
318 HB3 ALA 107 3HB ALA 107 11.740 -2.068 0.652
319 H TYR 108 H TYR 108 9.456 -1.065 0.594
320 HA TYR 108 HA TYR 108 9.673 1.566 -0.218
321 HB2 TYR 108 2HB TYR 108 8.446 -0.055 -1.546
322 HB3 TYR 108 1HB TYR 108 7.252 -0.244 -0.266
323 HD1 TYR 108 1HD TYR 108 8.527 2.049 -2.848
324 HD2 TYR 108 2HD TYR 108 5.423 1.311 -0.052
325 HE1 TYR 108 1HE TYR 108 7.219 3.823 -3.860
326 HE2 TYR 108 2HE TYR 108 4.080 3.105 -1.056
327 HH TYR 108 HH TYR 108 4.388 5.085 -2.377
328 H HIS 109 H HIS 109 7.220 0.213 1.987
329 HA HIS 109 HA HIS 109 6.238 2.784 2.550
330 HB2 HIS 109 2HB HIS 109 5.665 0.147 3.877
331 HB3 HIS 109 1HB HIS 109 4.932 1.651 4.430
332 HD1 HIS 109 1HD HIS 109 3.492 2.958 2.530
333 HD2 HIS 109 2HD HIS 109 4.418 -1.005 1.755
334 HE1 HIS 109 1HE HIS 109 2.027 2.284 0.625
335 H ALA 110 H ALA 110 8.853 1.089 3.848
336 HA ALA 110 HA ALA 110 9.015 2.627 6.272
337 HB1 ALA 110 1HB ALA 110 11.183 1.584 6.556
338 HB2 ALA 110 2HB ALA 110 11.107 0.945 4.915
339 HB3 ALA 110 3HB ALA 110 9.976 0.373 6.135
340 H ALA 111 H ALA 111 10.156 2.985 2.944
341 HA ALA 111 HA ALA 111 12.096 5.026 3.756
342 HB1 ALA 111 1HB ALA 111 11.464 3.776 1.101
343 HB2 ALA 111 2HB ALA 111 12.793 3.292 2.157
344 HB3 ALA 111 3HB ALA 111 12.783 4.901 1.411
345 H THR 112 H THR 112 9.078 4.471 2.311
346 HA THR 112 HA THR 112 8.750 7.243 1.632
347 HB THR 112 HB THR 112 8.368 4.749 -0.016
348 HG1 THR 112 1HG THR 112 10.290 6.447 0.277
349 HG21 THR 112 1HG2 THR 112 6.505 6.142 -0.314
350 HG22 THR 112 2HG2 THR 112 7.543 6.183 -1.762
351 HG23 THR 112 3HG2 THR 112 7.532 7.563 -0.610
Start of MODEL 2
1 H MET 65 1HT MET 65 -5.166 9.879 -11.757
2 HA MET 65 HA MET 65 -4.227 11.473 -10.414
3 HB2 MET 65 2HB MET 65 -2.256 12.812 -11.177
4 HB3 MET 65 1HB MET 65 -1.871 11.154 -10.755
5 HG2 MET 65 2HG MET 65 -2.269 12.123 -13.578
6 HG3 MET 65 1HG MET 65 -0.699 12.056 -12.781
7 HE1 MET 65 1HE MET 65 0.220 10.581 -14.774
8 HE2 MET 65 2HE MET 65 -1.357 10.617 -15.569
9 HE3 MET 65 3HE MET 65 -0.528 9.083 -15.325
10 H SER 66 H SER 66 -5.580 13.050 -10.556
11 HA SER 66 HA SER 66 -5.987 14.359 -13.164
12 HB2 SER 66 2HB SER 66 -8.018 13.994 -10.944
13 HB3 SER 66 1HB SER 66 -8.308 14.780 -12.497
14 HG SER 66 HG SER 66 -7.671 12.077 -11.999
15 H GLY 67 H GLY 67 -4.765 14.657 -10.106
16 HA2 GLY 67 2HA GLY 67 -4.516 17.484 -10.326
17 HA3 GLY 67 1HA GLY 67 -5.494 16.948 -8.955
18 H SER 68 H SER 68 -3.709 17.941 -7.752
19 HA SER 68 HA SER 68 -1.528 16.005 -7.420
20 HB2 SER 68 2HB SER 68 -1.440 18.980 -6.865
21 HB3 SER 68 1HB SER 68 -0.091 17.852 -6.770
22 HG SER 68 HG SER 68 0.109 17.857 -8.863
23 H GLY 69 H GLY 69 -3.664 18.368 -5.837
24 HA2 GLY 69 2HA GLY 69 -4.646 18.302 -3.780
25 HA3 GLY 69 1HA GLY 69 -3.984 16.685 -3.543
26 H ARG 70 H ARG 70 -3.469 17.352 -1.371
27 HA ARG 70 HA ARG 70 -1.552 19.433 -0.955
28 HB2 ARG 70 2HB ARG 70 -3.243 17.989 0.710
29 HB3 ARG 70 1HB ARG 70 -1.635 17.446 1.165
30 HG2 ARG 70 2HG ARG 70 -2.296 19.293 2.550
31 HG3 ARG 70 1HG ARG 70 -0.976 19.789 1.490
32 HD2 ARG 70 2HD ARG 70 -2.735 20.758 -0.050
33 HD3 ARG 70 1HD ARG 70 -3.903 20.433 1.232
34 HE ARG 70 HE ARG 70 -1.738 21.838 2.278
35 HH11 ARG 70 1HH1 ARG 70 -4.599 22.335 0.259
36 HH12 ARG 70 2HH1 ARG 70 -4.618 24.023 0.404
37 HH21 ARG 70 1HH2 ARG 70 -1.780 24.173 2.538
38 HH22 ARG 70 2HH2 ARG 70 -2.974 25.107 1.769
39 H GLY 71 H GLY 71 -1.401 15.931 -1.148
40 HA2 GLY 71 2HA GLY 71 0.740 15.319 -2.387
41 HA3 GLY 71 1HA GLY 71 1.521 16.150 -1.047
42 H ARG 72 H ARG 72 0.012 13.335 -2.134
43 HA ARG 72 HA ARG 72 -0.145 11.246 -1.386
44 HB2 ARG 72 2HB ARG 72 1.753 12.081 0.838
45 HB3 ARG 72 1HB ARG 72 1.358 10.432 0.379
46 HG2 ARG 72 2HG ARG 72 2.363 10.846 -1.839
47 HG3 ARG 72 1HG ARG 72 2.857 12.443 -1.272
48 HD2 ARG 72 2HD ARG 72 4.729 11.001 -0.994
49 HD3 ARG 72 1HD ARG 72 4.050 11.292 0.604
50 HE ARG 72 HE ARG 72 3.140 8.898 -0.754
51 HH11 ARG 72 1HH1 ARG 72 5.258 10.257 1.753
52 HH12 ARG 72 2HH1 ARG 72 5.757 8.725 2.312
53 HH21 ARG 72 1HH2 ARG 72 3.844 6.836 0.059
54 HH22 ARG 72 2HH2 ARG 72 4.976 6.781 1.354
55 H GLY 73 H GLY 73 -0.061 10.463 1.521
56 HA2 GLY 73 2HA GLY 73 -1.495 10.756 3.382
57 HA3 GLY 73 1HA GLY 73 -2.630 11.643 2.348
58 H ALA 74 H ALA 74 -1.741 9.650 0.341
59 HA ALA 74 HA ALA 74 -2.479 7.039 0.858
60 HB1 ALA 74 1HB ALA 74 -4.505 7.015 -0.576
61 HB2 ALA 74 2HB ALA 74 -4.505 8.781 -0.606
62 HB3 ALA 74 3HB ALA 74 -4.813 7.924 0.908
63 H ILE 75 H ILE 75 -2.445 6.015 -1.318
64 HA ILE 75 HA ILE 75 -0.441 7.480 -2.797
65 HB ILE 75 HB ILE 75 -1.225 4.542 -2.892
66 HG12 ILE 75 2HG1 ILE 75 1.132 5.938 -1.610
67 HG13 ILE 75 1HG1 ILE 75 -0.299 5.410 -0.752
68 HG21 ILE 75 1HG2 ILE 75 1.168 5.991 -4.084
69 HG22 ILE 75 2HG2 ILE 75 -0.192 5.352 -5.007
70 HG23 ILE 75 3HG2 ILE 75 0.880 4.253 -4.144
71 HD11 ILE 75 1HD1 ILE 75 1.588 3.930 -0.462
72 HD12 ILE 75 2HD1 ILE 75 1.596 3.585 -2.207
73 HD13 ILE 75 3HD1 ILE 75 0.200 3.149 -1.196
74 H ASP 76 H ASP 76 -0.801 8.241 -4.724
75 HA ASP 76 HA ASP 76 -3.541 8.238 -5.682
76 HB2 ASP 76 2HB ASP 76 -2.441 10.383 -5.496
77 HB3 ASP 76 1HB ASP 76 -1.122 9.845 -6.523
78 H ARG 77 H ARG 77 -0.416 7.194 -6.694
79 HA ARG 77 HA ARG 77 -1.282 6.127 -9.258
80 HB2 ARG 77 2HB ARG 77 1.245 5.712 -7.627
81 HB3 ARG 77 1HB ARG 77 1.002 5.142 -9.268
82 HG2 ARG 77 2HG ARG 77 0.758 8.031 -8.621
83 HG3 ARG 77 1HG ARG 77 2.349 7.286 -8.827
84 HD2 ARG 77 2HD ARG 77 0.148 7.092 -10.872
85 HD3 ARG 77 1HD ARG 77 1.361 8.372 -10.892
86 HE ARG 77 HE ARG 77 2.707 5.948 -10.718
87 HH11 ARG 77 1HH1 ARG 77 0.643 7.559 -13.083
88 HH12 ARG 77 2HH1 ARG 77 1.432 6.898 -14.440
89 HH21 ARG 77 1HH2 ARG 77 3.793 5.017 -12.553
90 HH22 ARG 77 2HH2 ARG 77 3.221 5.364 -14.121
91 H GLU 78 H GLU 78 -0.881 3.708 -9.583
92 HA GLU 78 HA GLU 78 -2.072 2.081 -7.580
93 HB2 GLU 78 2HB GLU 78 -1.134 1.683 -10.244
94 HB3 GLU 78 1HB GLU 78 -0.258 0.553 -9.228
95 HG2 GLU 78 2HG GLU 78 -3.255 0.764 -9.155
96 HG3 GLU 78 1HG GLU 78 -2.411 -0.270 -10.299
97 H GLN 79 H GLN 79 -1.183 1.174 -5.862
98 HA GLN 79 HA GLN 79 1.291 2.040 -4.895
99 HB2 GLN 79 2HB GLN 79 -0.194 -0.457 -4.090
100 HB3 GLN 79 1HB GLN 79 1.062 0.346 -3.169
101 HG2 GLN 79 2HG GLN 79 -0.414 2.341 -3.016
102 HG3 GLN 79 1HG GLN 79 -1.684 1.398 -3.781
103 HE21 GLN 79 1HE2 GLN 79 -1.617 2.565 -1.107
104 HE22 GLN 79 2HE2 GLN 79 -1.833 1.240 -0.027
105 H SER 80 H SER 80 0.285 -0.870 -6.569
106 HA SER 80 HA SER 80 2.649 -2.345 -6.314
107 HB2 SER 80 2HB SER 80 0.743 -2.408 -8.654
108 HB3 SER 80 1HB SER 80 1.701 -3.745 -8.004
109 HG SER 80 HG SER 80 -0.629 -2.549 -7.055
110 H ALA 81 H ALA 81 1.563 -0.088 -8.813
111 HA ALA 81 HA ALA 81 3.822 -0.375 -10.486
112 HB1 ALA 81 1HB ALA 81 3.007 1.647 -11.603
113 HB2 ALA 81 2HB ALA 81 1.886 1.932 -10.271
114 HB3 ALA 81 3HB ALA 81 1.685 0.516 -11.305
115 H ALA 82 H ALA 82 2.931 1.911 -7.966
116 HA ALA 82 HA ALA 82 5.169 3.591 -8.247
117 HB1 ALA 82 1HB ALA 82 3.102 4.265 -7.095
118 HB2 ALA 82 2HB ALA 82 4.538 4.539 -6.116
119 HB3 ALA 82 3HB ALA 82 3.492 3.157 -5.777
120 H ILE 83 H ILE 83 4.614 0.710 -6.243
121 HA ILE 83 HA ILE 83 7.057 0.914 -4.844
122 HB ILE 83 HB ILE 83 5.415 -1.597 -5.407
123 HG12 ILE 83 2HG1 ILE 83 5.509 0.154 -2.941
124 HG13 ILE 83 1HG1 ILE 83 4.234 0.200 -4.150
125 HG21 ILE 83 1HG2 ILE 83 7.592 -1.090 -3.374
126 HG22 ILE 83 2HG2 ILE 83 7.737 -2.126 -4.792
127 HG23 ILE 83 3HG2 ILE 83 6.625 -2.562 -3.483
128 HD11 ILE 83 1HD1 ILE 83 4.938 -2.139 -2.404
129 HD12 ILE 83 2HD1 ILE 83 3.647 -2.111 -3.608
130 HD13 ILE 83 3HD1 ILE 83 3.559 -1.060 -2.192
131 H ARG 84 H ARG 84 6.116 -0.750 -7.825
132 HA ARG 84 HA ARG 84 8.589 -1.952 -8.305
133 HB2 ARG 84 2HB ARG 84 6.369 -1.140 -10.144
134 HB3 ARG 84 1HB ARG 84 7.838 -1.901 -10.745
135 HG2 ARG 84 2HG ARG 84 7.453 -3.836 -9.406
136 HG3 ARG 84 1HG ARG 84 6.063 -3.076 -8.631
137 HD2 ARG 84 2HD ARG 84 5.387 -4.672 -10.332
138 HD3 ARG 84 1HD ARG 84 4.903 -3.029 -10.749
139 HE ARG 84 HE ARG 84 7.230 -3.263 -12.044
140 HH11 ARG 84 1HH1 ARG 84 4.510 -5.544 -11.879
141 HH12 ARG 84 2HH1 ARG 84 4.624 -6.017 -13.500
142 HH21 ARG 84 1HH2 ARG 84 7.409 -3.959 -14.295
143 HH22 ARG 84 2HH2 ARG 84 6.296 -5.101 -14.897
144 H GLU 85 H GLU 85 7.322 1.194 -9.312
145 HA GLU 85 HA GLU 85 9.534 2.075 -10.773
146 HB2 GLU 85 2HB GLU 85 7.510 3.597 -9.136
147 HB3 GLU 85 1HB GLU 85 8.714 4.387 -10.142
148 HG2 GLU 85 2HG GLU 85 7.781 3.337 -12.122
149 HG3 GLU 85 1HG GLU 85 6.626 2.452 -11.130
150 H TRP 86 H TRP 86 8.803 2.448 -7.302
151 HA TRP 86 HA TRP 86 11.060 3.916 -6.606
152 HB2 TRP 86 2HB TRP 86 9.123 3.784 -5.170
153 HB3 TRP 86 1HB TRP 86 9.270 2.037 -5.059
154 HD1 TRP 86 HD TRP 86 10.753 5.272 -3.664
155 HE1 TRP 86 1HE TRP 86 12.159 4.683 -1.578
156 HE3 TRP 86 3HE TRP 86 10.591 0.200 -3.993
157 HZ2 TRP 86 2HZ TRP 86 13.054 2.377 -0.247
158 HZ3 TRP 86 3HZ TRP 86 11.751 -1.139 -2.254
159 HH2 TRP 86 HH TRP 86 12.946 -0.067 -0.439
160 H ALA 87 H ALA 87 10.388 0.463 -6.639
161 HA ALA 87 HA ALA 87 12.743 -0.527 -5.581
162 HB1 ALA 87 1HB ALA 87 10.765 -1.894 -5.972
163 HB2 ALA 87 2HB ALA 87 12.166 -2.610 -6.775
164 HB3 ALA 87 3HB ALA 87 10.974 -1.729 -7.706
165 H ARG 88 H ARG 88 11.908 0.198 -8.939
166 HA ARG 88 HA ARG 88 14.463 -0.648 -9.840
167 HB2 ARG 88 2HB ARG 88 12.364 0.876 -11.363
168 HB3 ARG 88 1HB ARG 88 13.831 0.199 -12.059
169 HG2 ARG 88 2HG ARG 88 12.930 -2.023 -11.018
170 HG3 ARG 88 1HG ARG 88 11.392 -1.174 -11.062
171 HD2 ARG 88 2HD ARG 88 13.235 -1.619 -13.377
172 HD3 ARG 88 1HD ARG 88 11.748 -2.506 -13.069
173 HE ARG 88 HE ARG 88 10.987 0.119 -13.194
174 HH11 ARG 88 1HH1 ARG 88 12.782 -1.980 -15.395
175 HH12 ARG 88 2HH1 ARG 88 12.110 -1.303 -16.811
176 HH21 ARG 88 1HH2 ARG 88 10.128 1.056 -15.084
177 HH22 ARG 88 2HH2 ARG 88 10.565 0.492 -16.646
178 H ARG 89 H ARG 89 13.253 2.364 -8.709
179 HA ARG 89 HA ARG 89 15.459 3.875 -9.802
180 HB2 ARG 89 2HB ARG 89 13.692 4.611 -7.451
181 HB3 ARG 89 1HB ARG 89 14.776 5.687 -8.312
182 HG2 ARG 89 2HG ARG 89 12.253 4.429 -9.351
183 HG3 ARG 89 1HG ARG 89 12.523 6.128 -8.971
184 HD2 ARG 89 2HD ARG 89 14.221 6.219 -10.753
185 HD3 ARG 89 1HD ARG 89 13.871 4.534 -11.137
186 HE ARG 89 HE ARG 89 11.506 6.062 -11.156
187 HH11 ARG 89 1HH1 ARG 89 14.375 5.445 -13.149
188 HH12 ARG 89 2HH1 ARG 89 13.604 5.856 -14.611
189 HH21 ARG 89 1HH2 ARG 89 10.470 6.612 -13.118
190 HH22 ARG 89 2HH2 ARG 89 11.298 6.525 -14.595
191 H ASN 90 H ASN 90 14.825 2.031 -6.960
192 HA ASN 90 HA ASN 90 17.217 3.049 -5.653
193 HB2 ASN 90 2HB ASN 90 14.896 1.461 -4.674
194 HB3 ASN 90 1HB ASN 90 16.368 1.586 -3.704
195 HD21 ASN 90 1HD2 ASN 90 13.674 3.298 -5.065
196 HD22 ASN 90 2HD2 ASN 90 13.835 4.725 -4.112
197 H GLY 91 H GLY 91 16.337 0.280 -7.429
198 HA2 GLY 91 2HA GLY 91 18.193 -0.996 -8.322
199 HA3 GLY 91 1HA GLY 91 19.020 -0.768 -6.796
200 H HIS 92 H HIS 92 15.680 -1.616 -6.670
201 HA HIS 92 HA HIS 92 16.430 -4.202 -5.599
202 HB2 HIS 92 2HB HIS 92 13.804 -2.705 -5.628
203 HB3 HIS 92 1HB HIS 92 14.023 -4.300 -4.924
204 HD1 HIS 92 1HD HIS 92 14.902 -4.340 -2.491
205 HD2 HIS 92 2HD HIS 92 15.104 -0.610 -4.298
206 HE1 HIS 92 1HE HIS 92 15.497 -2.726 -0.668
207 H ASN 93 H ASN 93 16.044 -6.021 -6.644
208 HA ASN 93 HA ASN 93 15.058 -5.850 -9.368
209 HB2 ASN 93 2HB ASN 93 16.382 -8.090 -7.821
210 HB3 ASN 93 1HB ASN 93 15.712 -8.322 -9.429
211 HD21 ASN 93 1HD2 ASN 93 18.265 -6.799 -7.570
212 HD22 ASN 93 2HD2 ASN 93 19.259 -6.417 -8.911
213 H VAL 94 H VAL 94 12.943 -5.822 -9.555
214 HA VAL 94 HA VAL 94 11.341 -7.561 -7.861
215 HB VAL 94 HB VAL 94 10.554 -5.186 -9.586
216 HG11 VAL 94 1HG1 VAL 94 8.716 -6.784 -9.572
217 HG12 VAL 94 2HG1 VAL 94 8.348 -5.409 -8.510
218 HG13 VAL 94 3HG1 VAL 94 8.869 -6.941 -7.819
219 HG21 VAL 94 1HG2 VAL 94 11.733 -4.610 -7.556
220 HG22 VAL 94 2HG2 VAL 94 10.599 -5.574 -6.609
221 HG23 VAL 94 3HG2 VAL 94 10.040 -4.131 -7.453
222 H SER 95 H SER 95 10.395 -9.279 -8.653
223 HA SER 95 HA SER 95 10.927 -10.011 -11.377
224 HB2 SER 95 2HB SER 95 11.411 -11.601 -9.607
225 HB3 SER 95 1HB SER 95 9.738 -11.547 -9.064
226 HG SER 95 HG SER 95 9.935 -13.314 -10.302
227 H THR 96 H THR 96 9.523 -9.601 -12.932
228 HA THR 96 HA THR 96 6.826 -8.926 -12.504
229 HB THR 96 HB THR 96 7.697 -9.720 -15.183
230 HG1 THR 96 1HG THR 96 9.374 -8.299 -15.327
231 HG21 THR 96 1HG2 THR 96 6.759 -7.106 -13.971
232 HG22 THR 96 2HG2 THR 96 5.727 -8.312 -14.740
233 HG23 THR 96 3HG2 THR 96 6.921 -7.436 -15.693
234 H ARG 97 H ARG 97 8.568 -11.866 -12.929
235 HA ARG 97 HA ARG 97 6.254 -13.323 -13.922
236 HB2 ARG 97 2HB ARG 97 9.056 -14.236 -13.285
237 HB3 ARG 97 1HB ARG 97 7.789 -15.300 -13.875
238 HG2 ARG 97 2HG ARG 97 7.638 -14.037 -15.933
239 HG3 ARG 97 1HG ARG 97 8.839 -12.889 -15.346
240 HD2 ARG 97 2HD ARG 97 9.301 -15.833 -15.823
241 HD3 ARG 97 1HD ARG 97 9.803 -14.529 -16.900
242 HE ARG 97 HE ARG 97 10.762 -14.494 -14.144
243 HH11 ARG 97 1HH1 ARG 97 11.537 -15.154 -17.536
244 HH12 ARG 97 2HH1 ARG 97 13.210 -14.957 -17.322
245 HH21 ARG 97 1HH2 ARG 97 12.994 -14.298 -13.852
246 HH22 ARG 97 2HH2 ARG 97 14.078 -14.480 -15.176
247 H GLY 98 H GLY 98 7.359 -12.358 -10.971
248 HA2 GLY 98 2HA GLY 98 5.994 -14.612 -9.643
249 HA3 GLY 98 1HA GLY 98 7.337 -13.742 -8.917
250 H ARG 99 H ARG 99 6.924 -12.049 -7.692
251 HA ARG 99 HA ARG 99 4.524 -10.475 -7.973
252 HB2 ARG 99 2HB ARG 99 3.873 -12.344 -6.395
253 HB3 ARG 99 1HB ARG 99 5.229 -11.903 -5.368
254 HG2 ARG 99 2HG ARG 99 4.152 -9.608 -5.170
255 HG3 ARG 99 1HG ARG 99 2.729 -10.317 -5.924
256 HD2 ARG 99 2HD ARG 99 2.564 -11.932 -4.101
257 HD3 ARG 99 1HD ARG 99 4.018 -11.263 -3.356
258 HE ARG 99 HE ARG 99 1.515 -9.760 -3.741
259 HH11 ARG 99 1HH1 ARG 99 4.360 -10.493 -1.725
260 HH12 ARG 99 2HH1 ARG 99 3.889 -9.420 -0.475
261 HH21 ARG 99 1HH2 ARG 99 0.915 -8.321 -1.993
262 HH22 ARG 99 2HH2 ARG 99 1.922 -8.168 -0.630
263 H ILE 100 H ILE 100 4.865 -8.483 -6.714
264 HA ILE 100 HA ILE 100 7.532 -7.619 -6.499
265 HB ILE 100 HB ILE 100 5.112 -6.500 -5.043
266 HG12 ILE 100 2HG1 ILE 100 6.164 -5.774 -7.785
267 HG13 ILE 100 1HG1 ILE 100 4.683 -6.675 -7.469
268 HG21 ILE 100 1HG2 ILE 100 6.374 -4.381 -5.081
269 HG22 ILE 100 2HG2 ILE 100 7.717 -5.201 -5.875
270 HG23 ILE 100 3HG2 ILE 100 7.260 -5.651 -4.233
271 HD11 ILE 100 1HD1 ILE 100 3.765 -4.732 -6.316
272 HD12 ILE 100 2HD1 ILE 100 4.229 -4.348 -7.980
273 HD13 ILE 100 3HD1 ILE 100 5.268 -3.861 -6.637
274 HA PRO 101 HA PRO 101 8.360 -9.938 -2.765
275 HB2 PRO 101 2HB PRO 101 10.553 -7.999 -2.378
276 HB3 PRO 101 1HB PRO 101 10.646 -9.763 -2.536
277 HG2 PRO 101 2HG PRO 101 11.476 -8.165 -4.490
278 HG3 PRO 101 1HG PRO 101 10.685 -9.723 -4.806
279 HD2 PRO 101 2HD PRO 101 9.554 -6.974 -5.060
280 HD3 PRO 101 1HD PRO 101 9.274 -8.426 -6.040
281 H ALA 102 H ALA 102 7.572 -9.727 -0.830
282 HA ALA 102 HA ALA 102 6.216 -7.470 0.104
283 HB1 ALA 102 1HB ALA 102 5.722 -9.754 0.814
284 HB2 ALA 102 2HB ALA 102 6.018 -8.709 2.202
285 HB3 ALA 102 3HB ALA 102 7.268 -9.827 1.653
286 H ASP 103 H ASP 103 9.421 -8.577 0.532
287 HA ASP 103 HA ASP 103 10.348 -6.947 2.622
288 HB2 ASP 103 2HB ASP 103 11.576 -8.888 1.739
289 HB3 ASP 103 1HB ASP 103 11.840 -8.034 0.224
290 H VAL 104 H VAL 104 10.085 -6.409 -0.854
291 HA VAL 104 HA VAL 104 11.442 -3.875 -0.842
292 HB VAL 104 HB VAL 104 9.771 -5.301 -2.963
293 HG11 VAL 104 1HG1 VAL 104 11.364 -2.759 -3.305
294 HG12 VAL 104 2HG1 VAL 104 9.605 -2.824 -3.224
295 HG13 VAL 104 3HG1 VAL 104 10.461 -3.610 -4.556
296 HG21 VAL 104 1HG2 VAL 104 12.694 -4.678 -2.806
297 HG22 VAL 104 2HG2 VAL 104 11.889 -5.559 -4.102
298 HG23 VAL 104 3HG2 VAL 104 11.978 -6.263 -2.477
299 H ILE 105 H ILE 105 8.150 -5.043 -0.922
300 HA ILE 105 HA ILE 105 6.773 -2.609 -1.099
301 HB ILE 105 HB ILE 105 5.981 -5.173 0.323
302 HG12 ILE 105 2HG1 ILE 105 5.275 -4.186 -2.458
303 HG13 ILE 105 1HG1 ILE 105 6.502 -5.390 -2.096
304 HG21 ILE 105 1HG2 ILE 105 4.633 -3.329 1.138
305 HG22 ILE 105 2HG2 ILE 105 3.650 -4.385 0.119
306 HG23 ILE 105 3HG2 ILE 105 4.241 -2.841 -0.504
307 HD11 ILE 105 1HD1 ILE 105 3.549 -5.673 -1.549
308 HD12 ILE 105 2HD1 ILE 105 4.796 -6.900 -1.274
309 HD13 ILE 105 3HD1 ILE 105 4.431 -6.370 -2.905
310 H ASP 106 H ASP 106 7.965 -4.409 1.649
311 HA ASP 106 HA ASP 106 6.940 -2.808 3.734
312 HB2 ASP 106 2HB ASP 106 7.761 -5.133 3.951
313 HB3 ASP 106 1HB ASP 106 9.384 -4.548 3.626
314 H ALA 107 H ALA 107 10.058 -2.949 2.089
315 HA ALA 107 HA ALA 107 11.339 -0.883 3.476
316 HB1 ALA 107 1HB ALA 107 11.780 -1.862 0.664
317 HB2 ALA 107 2HB ALA 107 12.493 -2.556 2.115
318 HB3 ALA 107 3HB ALA 107 12.934 -0.918 1.615
319 H TYR 108 H TYR 108 9.332 -0.918 0.599
320 HA TYR 108 HA TYR 108 9.566 1.731 -0.220
321 HB2 TYR 108 2HB TYR 108 8.467 0.092 -1.624
322 HB3 TYR 108 1HB TYR 108 7.241 -0.196 -0.402
323 HD1 TYR 108 1HD TYR 108 5.316 1.252 -0.213
324 HD2 TYR 108 2HD TYR 108 8.430 2.168 -2.955
325 HE1 TYR 108 1HE TYR 108 3.869 2.922 -1.281
326 HE2 TYR 108 2HE TYR 108 7.001 3.834 -4.036
327 HH TYR 108 HH TYR 108 4.672 4.386 -4.268
328 H HIS 109 H HIS 109 7.092 0.267 1.870
329 HA HIS 109 HA HIS 109 5.878 2.731 2.420
330 HB2 HIS 109 2HB HIS 109 5.614 0.094 3.849
331 HB3 HIS 109 1HB HIS 109 4.696 1.524 4.314
332 HD1 HIS 109 1HD HIS 109 2.899 2.399 2.540
333 HD2 HIS 109 2HD HIS 109 4.714 -1.218 1.631
334 HE1 HIS 109 1HE HIS 109 1.577 1.413 0.655
335 H ALA 110 H ALA 110 8.531 1.127 3.880
336 HA ALA 110 HA ALA 110 8.620 2.780 6.208
337 HB1 ALA 110 1HB ALA 110 10.803 1.118 4.934
338 HB2 ALA 110 2HB ALA 110 9.656 0.541 6.127
339 HB3 ALA 110 3HB ALA 110 10.827 1.792 6.565
340 H ALA 111 H ALA 111 10.253 2.806 3.050
341 HA ALA 111 HA ALA 111 11.908 5.043 3.713
342 HB1 ALA 111 1HB ALA 111 12.756 4.893 1.470
343 HB2 ALA 111 2HB ALA 111 11.434 3.817 1.014
344 HB3 ALA 111 3HB ALA 111 12.646 3.282 2.178
345 H THR 112 H THR 112 8.877 4.730 1.875
346 HA THR 112 HA THR 112 9.158 7.570 1.536
347 HB THR 112 HB THR 112 9.048 6.446 -0.647
348 HG1 THR 112 1HG THR 112 7.877 8.548 -0.116
349 HG21 THR 112 1HG2 THR 112 6.270 5.538 0.160
350 HG22 THR 112 2HG2 THR 112 7.667 4.498 -0.075
351 HG23 THR 112 3HG2 THR 112 6.976 5.363 -1.444
Start of MODEL 3
1 H MET 65 1HT MET 65 5.974 14.599 -7.361
2 HA MET 65 HA MET 65 7.376 12.921 -8.512
3 HB2 MET 65 2HB MET 65 7.084 15.164 -9.547
4 HB3 MET 65 1HB MET 65 8.480 15.734 -8.642
5 HG2 MET 65 2HG MET 65 9.853 14.008 -9.798
6 HG3 MET 65 1HG MET 65 8.455 13.643 -10.801
7 HE1 MET 65 1HE MET 65 10.066 14.028 -12.889
8 HE2 MET 65 2HE MET 65 11.390 14.483 -11.820
9 HE3 MET 65 3HE MET 65 10.953 15.527 -13.170
10 H SER 66 H SER 66 9.707 15.190 -7.139
11 HA SER 66 HA SER 66 11.323 12.841 -6.513
12 HB2 SER 66 2HB SER 66 12.088 15.375 -7.876
13 HB3 SER 66 1HB SER 66 13.238 14.068 -7.484
14 HG SER 66 HG SER 66 12.536 13.039 -9.218
15 H GLY 67 H GLY 67 11.266 13.005 -4.324
16 HA2 GLY 67 2HA GLY 67 12.036 13.797 -2.298
17 HA3 GLY 67 1HA GLY 67 12.517 15.297 -3.081
18 H SER 68 H SER 68 10.520 16.437 -4.044
19 HA SER 68 HA SER 68 8.729 16.970 -1.832
20 HB2 SER 68 2HB SER 68 9.021 18.374 -4.485
21 HB3 SER 68 1HB SER 68 8.254 19.004 -3.021
22 HG SER 68 HG SER 68 10.475 18.499 -2.103
23 H GLY 69 H GLY 69 6.461 16.919 -2.108
24 HA2 GLY 69 2HA GLY 69 4.432 16.435 -3.109
25 HA3 GLY 69 1HA GLY 69 5.288 16.086 -4.603
26 H ARG 70 H ARG 70 5.105 14.782 -1.315
27 HA ARG 70 HA ARG 70 5.568 12.113 -2.320
28 HB2 ARG 70 2HB ARG 70 5.195 13.197 0.430
29 HB3 ARG 70 1HB ARG 70 5.344 11.478 0.079
30 HG2 ARG 70 2HG ARG 70 7.517 12.001 -1.053
31 HG3 ARG 70 1HG ARG 70 7.376 13.638 -0.390
32 HD2 ARG 70 2HD ARG 70 7.230 12.725 1.837
33 HD3 ARG 70 1HD ARG 70 7.288 11.104 1.107
34 HE ARG 70 HE ARG 70 9.542 12.148 0.205
35 HH11 ARG 70 1HH1 ARG 70 8.292 12.068 3.525
36 HH12 ARG 70 2HH1 ARG 70 9.820 12.027 4.263
37 HH21 ARG 70 1HH2 ARG 70 11.655 12.067 1.237
38 HH22 ARG 70 2HH2 ARG 70 11.779 12.002 2.927
39 H GLY 71 H GLY 71 2.917 14.058 -1.271
40 HA2 GLY 71 2HA GLY 71 1.133 11.953 -2.144
41 HA3 GLY 71 1HA GLY 71 1.003 12.421 -0.452
42 H ARG 72 H ARG 72 1.031 13.836 -3.699
43 HA ARG 72 HA ARG 72 -0.508 16.105 -2.796
44 HB2 ARG 72 2HB ARG 72 0.083 15.165 -5.620
45 HB3 ARG 72 1HB ARG 72 -0.733 16.663 -5.219
46 HG2 ARG 72 2HG ARG 72 2.110 15.949 -4.539
47 HG3 ARG 72 1HG ARG 72 1.580 17.061 -5.800
48 HD2 ARG 72 2HD ARG 72 0.517 18.457 -4.024
49 HD3 ARG 72 1HD ARG 72 1.222 17.369 -2.827
50 HE ARG 72 HE ARG 72 3.091 18.475 -4.689
51 HH11 ARG 72 1HH1 ARG 72 1.539 18.959 -1.541
52 HH12 ARG 72 2HH1 ARG 72 2.739 20.037 -0.982
53 HH21 ARG 72 1HH2 ARG 72 4.728 19.941 -3.883
54 HH22 ARG 72 2HH2 ARG 72 4.550 20.580 -2.311
55 H GLY 73 H GLY 73 -2.199 15.066 -1.800
56 HA2 GLY 73 2HA GLY 73 -4.484 14.576 -1.825
57 HA3 GLY 73 1HA GLY 73 -4.398 14.373 -3.577
58 H ALA 74 H ALA 74 -2.921 12.506 -4.213
59 HA ALA 74 HA ALA 74 -3.103 10.174 -2.472
60 HB1 ALA 74 1HB ALA 74 -4.202 8.864 -4.221
61 HB2 ALA 74 2HB ALA 74 -4.346 10.306 -5.225
62 HB3 ALA 74 3HB ALA 74 -5.235 10.197 -3.708
63 H ILE 75 H ILE 75 -2.245 8.263 -4.052
64 HA ILE 75 HA ILE 75 0.365 9.151 -4.752
65 HB ILE 75 HB ILE 75 -0.878 6.392 -5.009
66 HG12 ILE 75 2HG1 ILE 75 0.699 5.989 -3.030
67 HG13 ILE 75 1HG1 ILE 75 0.594 7.713 -2.762
68 HG21 ILE 75 1HG2 ILE 75 1.071 6.625 -6.412
69 HG22 ILE 75 2HG2 ILE 75 1.461 5.597 -5.028
70 HG23 ILE 75 3HG2 ILE 75 1.995 7.280 -5.063
71 HD11 ILE 75 1HD1 ILE 75 -1.840 7.527 -2.479
72 HD12 ILE 75 2HD1 ILE 75 -0.978 6.504 -1.329
73 HD13 ILE 75 3HD1 ILE 75 -1.730 5.789 -2.752
74 H ASP 76 H ASP 76 1.161 9.227 -6.775
75 HA ASP 76 HA ASP 76 -0.634 9.898 -8.890
76 HB2 ASP 76 2HB ASP 76 1.572 10.950 -8.679
77 HB3 ASP 76 1HB ASP 76 2.340 9.397 -8.976
78 H ARG 77 H ARG 77 1.084 7.064 -8.051
79 HA ARG 77 HA ARG 77 0.275 5.697 -10.539
80 HB2 ARG 77 2HB ARG 77 2.471 4.983 -8.594
81 HB3 ARG 77 1HB ARG 77 2.128 4.170 -10.112
82 HG2 ARG 77 2HG ARG 77 2.957 7.043 -9.880
83 HG3 ARG 77 1HG ARG 77 4.076 5.699 -10.145
84 HD2 ARG 77 2HD ARG 77 3.207 5.255 -12.252
85 HD3 ARG 77 1HD ARG 77 1.727 6.161 -11.940
86 HE ARG 77 HE ARG 77 2.921 8.154 -12.107
87 HH11 ARG 77 1HH1 ARG 77 5.061 5.414 -12.866
88 HH12 ARG 77 2HH1 ARG 77 5.905 6.241 -14.076
89 HH21 ARG 77 1HH2 ARG 77 4.197 9.296 -13.715
90 HH22 ARG 77 2HH2 ARG 77 5.450 8.480 -14.548
91 H GLU 78 H GLU 78 -0.064 3.349 -10.157
92 HA GLU 78 HA GLU 78 -1.797 2.729 -7.954
93 HB2 GLU 78 2HB GLU 78 -0.321 0.954 -9.914
94 HB3 GLU 78 1HB GLU 78 -1.580 0.410 -8.832
95 HG2 GLU 78 2HG GLU 78 -3.217 1.716 -9.991
96 HG3 GLU 78 1HG GLU 78 -1.969 2.438 -11.012
97 H GLN 79 H GLN 79 -1.145 1.453 -6.102
98 HA GLN 79 HA GLN 79 1.407 1.991 -5.202
99 HB2 GLN 79 2HB GLN 79 -0.622 0.052 -4.172
100 HB3 GLN 79 1HB GLN 79 0.967 0.198 -3.432
101 HG2 GLN 79 2HG GLN 79 -1.030 2.437 -3.747
102 HG3 GLN 79 1HG GLN 79 -0.718 1.525 -2.273
103 HE21 GLN 79 1HE2 GLN 79 -0.075 3.332 -1.098
104 HE22 GLN 79 2HE2 GLN 79 1.402 4.164 -1.417
105 H SER 80 H SER 80 0.266 -1.078 -6.558
106 HA SER 80 HA SER 80 2.656 -2.465 -6.256
107 HB2 SER 80 2HB SER 80 0.650 -2.691 -8.496
108 HB3 SER 80 1HB SER 80 1.788 -3.942 -7.982
109 HG SER 80 HG SER 80 -0.240 -4.300 -7.075
110 H ALA 81 H ALA 81 1.647 -0.272 -8.834
111 HA ALA 81 HA ALA 81 3.913 -0.714 -10.499
112 HB1 ALA 81 1HB ALA 81 1.818 0.200 -11.389
113 HB2 ALA 81 2HB ALA 81 3.171 1.290 -11.693
114 HB3 ALA 81 3HB ALA 81 2.029 1.647 -10.399
115 H ALA 82 H ALA 82 3.033 1.690 -8.092
116 HA ALA 82 HA ALA 82 5.266 3.352 -8.288
117 HB1 ALA 82 1HB ALA 82 4.646 4.193 -6.107
118 HB2 ALA 82 2HB ALA 82 3.638 2.778 -5.819
119 HB3 ALA 82 3HB ALA 82 3.185 3.937 -7.064
120 H ILE 83 H ILE 83 4.658 0.536 -6.207
121 HA ILE 83 HA ILE 83 7.121 0.675 -4.856
122 HB ILE 83 HB ILE 83 5.387 -1.789 -5.306
123 HG12 ILE 83 2HG1 ILE 83 5.503 0.117 -2.953
124 HG13 ILE 83 1HG1 ILE 83 4.242 0.115 -4.178
125 HG21 ILE 83 1HG2 ILE 83 6.538 -2.688 -3.322
126 HG22 ILE 83 2HG2 ILE 83 7.545 -1.239 -3.262
127 HG23 ILE 83 3HG2 ILE 83 7.684 -2.350 -4.624
128 HD11 ILE 83 1HD1 ILE 83 3.587 -2.134 -3.491
129 HD12 ILE 83 2HD1 ILE 83 3.519 -0.989 -2.147
130 HD13 ILE 83 3HD1 ILE 83 4.866 -2.121 -2.277
131 H ARG 84 H ARG 84 6.139 -1.052 -7.793
132 HA ARG 84 HA ARG 84 8.557 -2.428 -8.226
133 HB2 ARG 84 2HB ARG 84 6.367 -1.503 -10.035
134 HB3 ARG 84 1HB ARG 84 7.832 -2.198 -10.706
135 HG2 ARG 84 2HG ARG 84 7.428 -4.278 -9.607
136 HG3 ARG 84 1HG ARG 84 6.075 -3.590 -8.700
137 HD2 ARG 84 2HD ARG 84 4.778 -3.342 -10.573
138 HD3 ARG 84 1HD ARG 84 6.128 -3.578 -11.697
139 HE ARG 84 HE ARG 84 5.579 -5.868 -10.063
140 HH11 ARG 84 1HH1 ARG 84 4.568 -4.151 -13.022
141 HH12 ARG 84 2HH1 ARG 84 3.959 -5.539 -13.768
142 HH21 ARG 84 1HH2 ARG 84 4.712 -7.757 -11.121
143 HH22 ARG 84 2HH2 ARG 84 3.997 -7.625 -12.666
144 H GLU 85 H GLU 85 7.464 0.736 -9.378
145 HA GLU 85 HA GLU 85 9.828 1.326 -10.756
146 HB2 GLU 85 2HB GLU 85 7.708 3.088 -9.610
147 HB3 GLU 85 1HB GLU 85 9.036 3.720 -10.589
148 HG2 GLU 85 2HG GLU 85 8.260 2.150 -12.401
149 HG3 GLU 85 1HG GLU 85 6.838 1.837 -11.408
150 H TRP 86 H TRP 86 8.819 2.012 -7.427
151 HA TRP 86 HA TRP 86 10.972 3.617 -6.677
152 HB2 TRP 86 2HB TRP 86 8.917 3.434 -5.362
153 HB3 TRP 86 1HB TRP 86 9.196 1.723 -5.112
154 HD1 TRP 86 HD TRP 86 10.125 5.143 -3.716
155 HE1 TRP 86 1HE TRP 86 11.465 4.839 -1.585
156 HE3 TRP 86 3HE TRP 86 10.769 0.146 -3.985
157 HZ2 TRP 86 2HZ TRP 86 12.686 2.683 -0.147
158 HZ3 TRP 86 3HZ TRP 86 12.049 -1.017 -2.177
159 HH2 TRP 86 HH TRP 86 12.971 0.249 -0.306
160 H ALA 87 H ALA 87 10.442 0.131 -6.603
161 HA ALA 87 HA ALA 87 12.793 -0.717 -5.413
162 HB1 ALA 87 1HB ALA 87 12.359 -2.864 -6.546
163 HB2 ALA 87 2HB ALA 87 11.204 -2.061 -7.598
164 HB3 ALA 87 3HB ALA 87 10.881 -2.176 -5.874
165 H ARG 88 H ARG 88 12.058 -0.313 -8.837
166 HA ARG 88 HA ARG 88 14.614 -0.929 -9.831
167 HB2 ARG 88 2HB ARG 88 12.437 0.803 -11.000
168 HB3 ARG 88 1HB ARG 88 13.909 0.376 -11.859
169 HG2 ARG 88 2HG ARG 88 11.883 -1.607 -10.827
170 HG3 ARG 88 1HG ARG 88 11.966 -1.015 -12.488
171 HD2 ARG 88 2HD ARG 88 14.110 -2.581 -11.033
172 HD3 ARG 88 1HD ARG 88 13.054 -3.179 -12.312
173 HE ARG 88 HE ARG 88 14.389 -0.931 -13.275
174 HH11 ARG 88 1HH1 ARG 88 15.099 -4.302 -12.436
175 HH12 ARG 88 2HH1 ARG 88 16.493 -4.396 -13.394
176 HH21 ARG 88 1HH2 ARG 88 16.323 -1.077 -14.617
177 HH22 ARG 88 2HH2 ARG 88 17.196 -2.539 -14.651
178 H ARG 89 H ARG 89 13.239 2.145 -8.821
179 HA ARG 89 HA ARG 89 15.402 3.768 -9.656
180 HB2 ARG 89 2HB ARG 89 13.223 4.257 -7.674
181 HB3 ARG 89 1HB ARG 89 14.387 5.467 -8.189
182 HG2 ARG 89 2HG ARG 89 13.664 5.145 -10.516
183 HG3 ARG 89 1HG ARG 89 12.438 4.011 -9.943
184 HD2 ARG 89 2HD ARG 89 11.527 5.733 -8.530
185 HD3 ARG 89 1HD ARG 89 12.772 6.838 -9.155
186 HE ARG 89 HE ARG 89 11.091 5.626 -11.165
187 HH11 ARG 89 1HH1 ARG 89 11.403 8.339 -8.992
188 HH12 ARG 89 2HH1 ARG 89 10.611 9.473 -9.991
189 HH21 ARG 89 1HH2 ARG 89 9.879 7.081 -12.541
190 HH22 ARG 89 2HH2 ARG 89 9.652 8.695 -12.090
191 H ASN 90 H ASN 90 14.792 1.957 -6.775
192 HA ASN 90 HA ASN 90 17.044 3.173 -5.404
193 HB2 ASN 90 2HB ASN 90 14.977 1.172 -4.617
194 HB3 ASN 90 1HB ASN 90 16.451 1.306 -3.648
195 HD21 ASN 90 1HD2 ASN 90 13.559 2.875 -4.709
196 HD22 ASN 90 2HD2 ASN 90 13.526 4.124 -3.537
197 H GLY 91 H GLY 91 16.343 0.304 -7.191
198 HA2 GLY 91 2HA GLY 91 18.278 -0.684 -8.328
199 HA3 GLY 91 1HA GLY 91 19.171 -0.478 -6.834
200 H HIS 92 H HIS 92 15.881 -1.620 -6.716
201 HA HIS 92 HA HIS 92 16.830 -4.250 -5.892
202 HB2 HIS 92 2HB HIS 92 14.114 -2.923 -5.634
203 HB3 HIS 92 1HB HIS 92 14.524 -4.522 -5.036
204 HD1 HIS 92 1HD HIS 92 15.610 -4.591 -2.661
205 HD2 HIS 92 2HD HIS 92 15.219 -0.781 -4.259
206 HE1 HIS 92 1HE HIS 92 16.107 -2.996 -0.789
207 H ASN 93 H ASN 93 16.593 -5.865 -7.327
208 HA ASN 93 HA ASN 93 15.140 -5.234 -9.733
209 HB2 ASN 93 2HB ASN 93 17.133 -7.389 -9.113
210 HB3 ASN 93 1HB ASN 93 16.132 -7.461 -10.555
211 HD21 ASN 93 1HD2 ASN 93 17.903 -7.301 -11.867
212 HD22 ASN 93 2HD2 ASN 93 18.800 -5.849 -12.099
213 H VAL 94 H VAL 94 13.126 -5.374 -9.315
214 HA VAL 94 HA VAL 94 11.941 -7.829 -8.281
215 HB VAL 94 HB VAL 94 10.733 -5.118 -8.965
216 HG11 VAL 94 1HG1 VAL 94 8.691 -5.901 -7.886
217 HG12 VAL 94 2HG1 VAL 94 9.408 -7.497 -7.665
218 HG13 VAL 94 3HG1 VAL 94 9.081 -6.894 -9.293
219 HG21 VAL 94 1HG2 VAL 94 10.465 -4.869 -6.549
220 HG22 VAL 94 2HG2 VAL 94 12.162 -5.084 -6.994
221 HG23 VAL 94 3HG2 VAL 94 11.255 -6.427 -6.303
222 H SER 95 H SER 95 10.966 -9.248 -9.625
223 HA SER 95 HA SER 95 11.118 -8.693 -12.474
224 HB2 SER 95 2HB SER 95 12.121 -10.792 -11.580
225 HB3 SER 95 1HB SER 95 10.534 -11.283 -11.002
226 HG SER 95 HG SER 95 11.631 -11.377 -13.479
227 H THR 96 H THR 96 9.259 -9.312 -13.812
228 HA THR 96 HA THR 96 6.768 -8.578 -12.554
229 HB THR 96 HB THR 96 5.978 -8.723 -15.006
230 HG1 THR 96 1HG THR 96 8.196 -8.214 -16.192
231 HG21 THR 96 1HG2 THR 96 6.916 -6.514 -15.505
232 HG22 THR 96 2HG2 THR 96 8.121 -6.740 -14.235
233 HG23 THR 96 3HG2 THR 96 6.410 -6.619 -13.820
234 H ARG 97 H ARG 97 8.416 -11.301 -12.753
235 HA ARG 97 HA ARG 97 6.073 -12.941 -13.247
236 HB2 ARG 97 2HB ARG 97 9.007 -13.634 -13.315
237 HB3 ARG 97 1HB ARG 97 7.733 -14.852 -13.339
238 HG2 ARG 97 2HG ARG 97 8.018 -12.649 -15.365
239 HG3 ARG 97 1HG ARG 97 8.625 -14.293 -15.579
240 HD2 ARG 97 2HD ARG 97 6.402 -15.195 -15.434
241 HD3 ARG 97 1HD ARG 97 5.729 -13.625 -15.026
242 HE ARG 97 HE ARG 97 6.423 -12.895 -17.242
243 HH11 ARG 97 1HH1 ARG 97 6.050 -16.396 -16.717
244 HH12 ARG 97 2HH1 ARG 97 5.545 -16.706 -18.304
245 HH21 ARG 97 1HH2 ARG 97 5.705 -13.365 -19.423
246 HH22 ARG 97 2HH2 ARG 97 5.374 -14.972 -19.858
247 H GLY 98 H GLY 98 5.008 -12.993 -11.438
248 HA2 GLY 98 2HA GLY 98 4.907 -14.551 -9.537
249 HA3 GLY 98 1HA GLY 98 6.432 -13.835 -9.021
250 H ARG 99 H ARG 99 6.334 -12.219 -7.694
251 HA ARG 99 HA ARG 99 4.005 -10.474 -7.621
252 HB2 ARG 99 2HB ARG 99 3.846 -10.668 -5.197
253 HB3 ARG 99 1HB ARG 99 3.539 -12.223 -5.960
254 HG2 ARG 99 2HG ARG 99 5.683 -13.036 -5.363
255 HG3 ARG 99 1HG ARG 99 6.210 -11.432 -4.853
256 HD2 ARG 99 2HD ARG 99 4.018 -13.041 -3.565
257 HD3 ARG 99 1HD ARG 99 5.684 -12.904 -3.005
258 HE ARG 99 HE ARG 99 4.847 -10.325 -3.181
259 HH11 ARG 99 1HH1 ARG 99 3.765 -13.181 -1.408
260 HH12 ARG 99 2HH1 ARG 99 3.015 -12.316 -0.150
261 HH21 ARG 99 1HH2 ARG 99 3.821 -9.108 -1.429
262 HH22 ARG 99 2HH2 ARG 99 3.071 -9.964 -0.161
263 H ILE 100 H ILE 100 4.521 -8.680 -6.008
264 HA ILE 100 HA ILE 100 7.266 -7.854 -6.316
265 HB ILE 100 HB ILE 100 4.986 -6.499 -4.814
266 HG12 ILE 100 2HG1 ILE 100 5.918 -6.022 -7.644
267 HG13 ILE 100 1HG1 ILE 100 4.438 -6.871 -7.208
268 HG21 ILE 100 1HG2 ILE 100 6.317 -4.458 -5.130
269 HG22 ILE 100 2HG2 ILE 100 7.569 -5.387 -5.926
270 HG23 ILE 100 3HG2 ILE 100 7.225 -5.662 -4.206
271 HD11 ILE 100 1HD1 ILE 100 5.101 -4.019 -6.603
272 HD12 ILE 100 2HD1 ILE 100 3.599 -4.843 -6.165
273 HD13 ILE 100 3HD1 ILE 100 4.008 -4.584 -7.867
274 HA PRO 101 HA PRO 101 8.251 -9.960 -2.493
275 HB2 PRO 101 2HB PRO 101 10.479 -8.035 -2.287
276 HB3 PRO 101 1HB PRO 101 10.546 -9.807 -2.386
277 HG2 PRO 101 2HG PRO 101 11.297 -8.285 -4.426
278 HG3 PRO 101 1HG PRO 101 10.482 -9.847 -4.655
279 HD2 PRO 101 2HD PRO 101 9.367 -7.100 -4.956
280 HD3 PRO 101 1HD PRO 101 9.030 -8.587 -5.866
281 H ALA 102 H ALA 102 7.460 -9.667 -0.576
282 HA ALA 102 HA ALA 102 6.230 -7.308 0.270
283 HB1 ALA 102 1HB ALA 102 5.846 -8.444 2.367
284 HB2 ALA 102 2HB ALA 102 7.075 -9.640 1.958
285 HB3 ALA 102 3HB ALA 102 5.583 -9.553 1.018
286 H ASP 103 H ASP 103 9.468 -8.472 0.782
287 HA ASP 103 HA ASP 103 10.216 -6.729 2.878
288 HB2 ASP 103 2HB ASP 103 11.918 -7.840 0.637
289 HB3 ASP 103 1HB ASP 103 12.539 -7.007 2.053
290 H VAL 104 H VAL 104 10.100 -6.374 -0.623
291 HA VAL 104 HA VAL 104 11.399 -3.826 -0.648
292 HB VAL 104 HB VAL 104 9.794 -5.311 -2.771
293 HG11 VAL 104 1HG1 VAL 104 9.632 -2.867 -3.132
294 HG12 VAL 104 2HG1 VAL 104 10.581 -3.671 -4.379
295 HG13 VAL 104 3HG1 VAL 104 11.396 -2.769 -3.101
296 HG21 VAL 104 1HG2 VAL 104 11.946 -5.635 -3.833
297 HG22 VAL 104 2HG2 VAL 104 11.981 -6.281 -2.183
298 HG23 VAL 104 3HG2 VAL 104 12.725 -4.715 -2.553
299 H ILE 105 H ILE 105 8.123 -5.037 -0.717
300 HA ILE 105 HA ILE 105 6.774 -2.591 -0.949
301 HB ILE 105 HB ILE 105 5.922 -5.102 0.518
302 HG12 ILE 105 2HG1 ILE 105 5.293 -4.171 -2.300
303 HG13 ILE 105 1HG1 ILE 105 6.488 -5.390 -1.884
304 HG21 ILE 105 1HG2 ILE 105 4.602 -3.193 1.248
305 HG22 ILE 105 2HG2 ILE 105 3.608 -4.262 0.256
306 HG23 ILE 105 3HG2 ILE 105 4.246 -2.753 -0.414
307 HD11 ILE 105 1HD1 ILE 105 3.531 -5.588 -1.406
308 HD12 ILE 105 2HD1 ILE 105 4.732 -6.830 -1.030
309 HD13 ILE 105 3HD1 ILE 105 4.434 -6.369 -2.703
310 H ASP 106 H ASP 106 7.987 -4.314 1.882
311 HA ASP 106 HA ASP 106 6.946 -2.517 3.812
312 HB2 ASP 106 2HB ASP 106 7.586 -4.738 4.505
313 HB3 ASP 106 1HB ASP 106 9.244 -4.475 3.965
314 H ALA 107 H ALA 107 10.101 -2.870 2.285
315 HA ALA 107 HA ALA 107 11.396 -0.712 3.482
316 HB1 ALA 107 1HB ALA 107 12.937 -0.840 1.585
317 HB2 ALA 107 2HB ALA 107 11.755 -1.822 0.705
318 HB3 ALA 107 3HB ALA 107 12.510 -2.458 2.159
319 H TYR 108 H TYR 108 9.432 -0.897 0.565
320 HA TYR 108 HA TYR 108 9.582 1.693 -0.353
321 HB2 TYR 108 2HB TYR 108 8.430 0.002 -1.640
322 HB3 TYR 108 1HB TYR 108 7.244 -0.226 -0.365
323 HD1 TYR 108 1HD TYR 108 8.315 1.925 -3.102
324 HD2 TYR 108 2HD TYR 108 5.422 1.370 -0.063
325 HE1 TYR 108 1HE TYR 108 6.927 3.591 -4.155
326 HE2 TYR 108 2HE TYR 108 3.986 3.051 -1.093
327 HH TYR 108 HH TYR 108 4.356 4.158 -4.154
328 H HIS 109 H HIS 109 7.108 0.344 1.825
329 HA HIS 109 HA HIS 109 6.044 2.897 2.276
330 HB2 HIS 109 2HB HIS 109 5.506 0.305 3.711
331 HB3 HIS 109 1HB HIS 109 4.684 1.807 4.124
332 HD1 HIS 109 1HD HIS 109 3.331 2.931 1.906
333 HD2 HIS 109 2HD HIS 109 4.296 -1.116 1.782
334 HE1 HIS 109 1HE HIS 109 1.861 1.927 0.156
335 H ALA 110 H ALA 110 8.673 1.304 3.693
336 HA ALA 110 HA ALA 110 8.657 2.849 6.115
337 HB1 ALA 110 1HB ALA 110 9.690 0.620 6.041
338 HB2 ALA 110 2HB ALA 110 10.842 1.863 6.532
339 HB3 ALA 110 3HB ALA 110 10.880 1.223 4.890
340 H ALA 111 H ALA 111 9.928 3.207 2.854
341 HA ALA 111 HA ALA 111 11.796 5.304 3.661
342 HB1 ALA 111 1HB ALA 111 11.092 4.141 0.987
343 HB2 ALA 111 2HB ALA 111 12.466 3.628 1.971
344 HB3 ALA 111 3HB ALA 111 12.409 5.269 1.288
345 H THR 112 H THR 112 8.981 4.635 1.832
346 HA THR 112 HA THR 112 8.459 7.410 1.363
347 HB THR 112 HB THR 112 7.884 4.837 -0.150
348 HG1 THR 112 1HG THR 112 9.671 6.841 -0.317
349 HG21 THR 112 1HG2 THR 112 6.740 6.169 -1.748
350 HG22 THR 112 2HG2 THR 112 6.920 7.604 -0.677
351 HG23 THR 112 3HG2 THR 112 5.957 6.187 -0.153
Start of MODEL 4
1 H MET 65 1HT MET 65 -1.256 -2.613 6.322
2 HA MET 65 HA MET 65 -0.677 -3.989 4.495
3 HB2 MET 65 2HB MET 65 -1.821 -6.043 5.323
4 HB3 MET 65 1HB MET 65 -3.374 -5.289 5.014
5 HG2 MET 65 2HG MET 65 -2.849 -5.218 2.614
6 HG3 MET 65 1HG MET 65 -1.311 -6.007 2.944
7 HE1 MET 65 1HE MET 65 -1.823 -7.900 1.183
8 HE2 MET 65 2HE MET 65 -3.336 -7.082 0.806
9 HE3 MET 65 3HE MET 65 -3.333 -8.813 1.142
10 H SER 66 H SER 66 -1.153 -2.989 2.520
11 HA SER 66 HA SER 66 -2.903 -0.774 2.604
12 HB2 SER 66 2HB SER 66 -1.432 -2.027 0.281
13 HB3 SER 66 1HB SER 66 -2.295 -0.493 0.203
14 HG SER 66 HG SER 66 0.133 -1.104 1.333
15 H GLY 67 H GLY 67 -4.969 -0.865 2.502
16 HA2 GLY 67 2HA GLY 67 -6.632 -1.383 0.514
17 HA3 GLY 67 1HA GLY 67 -6.348 -3.020 1.093
18 H SER 68 H SER 68 -6.642 -0.020 2.966
19 HA SER 68 HA SER 68 -8.826 -1.276 4.455
20 HB2 SER 68 2HB SER 68 -7.088 1.059 5.279
21 HB3 SER 68 1HB SER 68 -8.139 0.085 6.308
22 HG SER 68 HG SER 68 -6.740 -1.737 5.709
23 H GLY 69 H GLY 69 -10.566 0.218 5.141
24 HA2 GLY 69 2HA GLY 69 -11.404 1.854 2.911
25 HA3 GLY 69 1HA GLY 69 -12.363 1.444 4.321
26 H ARG 70 H ARG 70 -9.348 3.197 3.753
27 HA ARG 70 HA ARG 70 -10.480 5.609 5.052
28 HB2 ARG 70 2HB ARG 70 -7.687 4.499 5.527
29 HB3 ARG 70 1HB ARG 70 -8.303 6.012 6.161
30 HG2 ARG 70 2HG ARG 70 -9.359 3.282 6.854
31 HG3 ARG 70 1HG ARG 70 -8.238 4.222 7.836
32 HD2 ARG 70 2HD ARG 70 -9.899 5.952 8.141
33 HD3 ARG 70 1HD ARG 70 -11.020 5.118 7.059
34 HE ARG 70 HE ARG 70 -10.372 3.317 8.998
35 HH11 ARG 70 1HH1 ARG 70 -11.870 6.525 9.001
36 HH12 ARG 70 2HH1 ARG 70 -12.826 6.236 10.381
37 HH21 ARG 70 1HH2 ARG 70 -11.725 2.895 10.866
38 HH22 ARG 70 2HH2 ARG 70 -12.752 4.117 11.457
39 H GLY 71 H GLY 71 -9.867 4.578 2.281
40 HA2 GLY 71 2HA GLY 71 -7.567 6.058 1.398
41 HA3 GLY 71 1HA GLY 71 -8.657 5.106 0.398
42 H ARG 72 H ARG 72 -7.661 8.166 1.210
43 HA ARG 72 HA ARG 72 -9.906 9.274 -0.280
44 HB2 ARG 72 2HB ARG 72 -8.405 10.555 2.015
45 HB3 ARG 72 1HB ARG 72 -9.426 11.471 0.918
46 HG2 ARG 72 2HG ARG 72 -10.351 9.182 2.649
47 HG3 ARG 72 1HG ARG 72 -10.576 10.896 3.004
48 HD2 ARG 72 2HD ARG 72 -11.907 11.183 1.008
49 HD3 ARG 72 1HD ARG 72 -11.628 9.510 0.536
50 HE ARG 72 HE ARG 72 -12.761 9.462 3.044
51 HH11 ARG 72 1HH1 ARG 72 -13.679 10.597 -0.178
52 HH12 ARG 72 2HH1 ARG 72 -15.326 10.227 0.002
53 HH21 ARG 72 1HH2 ARG 72 -15.020 8.953 3.297
54 HH22 ARG 72 2HH2 ARG 72 -16.106 9.280 2.026
55 H GLY 73 H GLY 73 -8.938 8.918 -2.103
56 HA2 GLY 73 2HA GLY 73 -7.674 10.526 -3.630
57 HA3 GLY 73 1HA GLY 73 -6.309 10.070 -2.600
58 H ALA 74 H ALA 74 -8.211 9.229 -5.207
59 HA ALA 74 HA ALA 74 -8.058 6.411 -5.169
60 HB1 ALA 74 1HB ALA 74 -9.626 7.705 -6.573
61 HB2 ALA 74 2HB ALA 74 -8.698 6.507 -7.470
62 HB3 ALA 74 3HB ALA 74 -8.262 8.215 -7.571
63 H ILE 75 H ILE 75 -6.852 5.036 -6.266
64 HA ILE 75 HA ILE 75 -4.065 5.695 -6.360
65 HB ILE 75 HB ILE 75 -5.525 3.147 -6.988
66 HG12 ILE 75 2HG1 ILE 75 -4.249 4.005 -4.404
67 HG13 ILE 75 1HG1 ILE 75 -5.971 4.087 -4.733
68 HG21 ILE 75 1HG2 ILE 75 -2.636 3.648 -6.213
69 HG22 ILE 75 2HG2 ILE 75 -3.201 3.180 -7.818
70 HG23 ILE 75 3HG2 ILE 75 -3.354 2.057 -6.467
71 HD11 ILE 75 1HD1 ILE 75 -4.306 1.576 -4.637
72 HD12 ILE 75 2HD1 ILE 75 -6.046 1.681 -4.971
73 HD13 ILE 75 3HD1 ILE 75 -5.424 2.160 -3.391
74 H ASP 76 H ASP 76 -3.813 6.910 -7.958
75 HA ASP 76 HA ASP 76 -5.064 6.847 -10.514
76 HB2 ASP 76 2HB ASP 76 -4.044 8.895 -9.544
77 HB3 ASP 76 1HB ASP 76 -2.451 8.201 -9.827
78 H ARG 77 H ARG 77 -1.779 6.051 -9.576
79 HA ARG 77 HA ARG 77 -1.749 4.066 -11.715
80 HB2 ARG 77 2HB ARG 77 0.387 5.904 -10.742
81 HB3 ARG 77 1HB ARG 77 0.889 4.245 -11.035
82 HG2 ARG 77 2HG ARG 77 1.318 5.614 -12.994
83 HG3 ARG 77 1HG ARG 77 0.082 4.416 -13.350
84 HD2 ARG 77 2HD ARG 77 -1.629 6.201 -12.925
85 HD3 ARG 77 1HD ARG 77 -0.296 7.350 -12.806
86 HE ARG 77 HE ARG 77 -0.095 5.864 -15.168
87 HH11 ARG 77 1HH1 ARG 77 -2.016 8.522 -13.773
88 HH12 ARG 77 2HH1 ARG 77 -2.426 9.196 -15.284
89 HH21 ARG 77 1HH2 ARG 77 -0.724 6.809 -17.269
90 HH22 ARG 77 2HH2 ARG 77 -1.678 8.210 -17.308
91 H GLU 78 H GLU 78 -1.191 2.040 -11.127
92 HA GLU 78 HA GLU 78 -2.180 1.102 -8.715
93 HB2 GLU 78 2HB GLU 78 -0.163 -0.204 -10.524
94 HB3 GLU 78 1HB GLU 78 -1.130 -1.021 -9.308
95 HG2 GLU 78 2HG GLU 78 -3.142 -0.531 -10.507
96 HG3 GLU 78 1HG GLU 78 -2.257 0.433 -11.687
97 H GLN 79 H GLN 79 -1.317 0.555 -6.762
98 HA GLN 79 HA GLN 79 1.077 1.763 -5.892
99 HB2 GLN 79 2HB GLN 79 -0.527 -0.476 -4.627
100 HB3 GLN 79 1HB GLN 79 0.848 0.291 -3.852
101 HG2 GLN 79 2HG GLN 79 -0.365 2.441 -3.903
102 HG3 GLN 79 1HG GLN 79 -1.754 1.613 -4.604
103 HE21 GLN 79 1HE2 GLN 79 0.157 2.098 -1.705
104 HE22 GLN 79 2HE2 GLN 79 -0.943 1.300 -0.646
105 H SER 80 H SER 80 0.291 -1.389 -7.123
106 HA SER 80 HA SER 80 2.651 -2.774 -6.648
107 HB2 SER 80 2HB SER 80 0.941 -2.937 -9.133
108 HB3 SER 80 1HB SER 80 1.880 -4.232 -8.384
109 HG SER 80 HG SER 80 -0.535 -4.025 -7.984
110 H ALA 81 H ALA 81 1.793 -0.644 -9.370
111 HA ALA 81 HA ALA 81 4.272 -1.013 -10.666
112 HB1 ALA 81 1HB ALA 81 2.248 1.214 -10.998
113 HB2 ALA 81 2HB ALA 81 2.272 -0.297 -11.904
114 HB3 ALA 81 3HB ALA 81 3.580 0.867 -12.098
115 H ALA 82 H ALA 82 2.955 1.350 -8.454
116 HA ALA 82 HA ALA 82 5.035 3.209 -8.459
117 HB1 ALA 82 1HB ALA 82 4.158 3.951 -6.309
118 HB2 ALA 82 2HB ALA 82 3.234 2.457 -6.157
119 HB3 ALA 82 3HB ALA 82 2.838 3.614 -7.430
120 H ILE 83 H ILE 83 4.570 0.324 -6.414
121 HA ILE 83 HA ILE 83 6.939 0.697 -4.914
122 HB ILE 83 HB ILE 83 5.439 -1.889 -5.470
123 HG12 ILE 83 2HG1 ILE 83 5.273 -0.014 -3.099
124 HG13 ILE 83 1HG1 ILE 83 4.071 -0.145 -4.375
125 HG21 ILE 83 1HG2 ILE 83 7.718 -2.326 -4.693
126 HG22 ILE 83 2HG2 ILE 83 6.551 -2.740 -3.436
127 HG23 ILE 83 3HG2 ILE 83 7.470 -1.245 -3.320
128 HD11 ILE 83 1HD1 ILE 83 4.837 -2.318 -2.436
129 HD12 ILE 83 2HD1 ILE 83 3.616 -2.450 -3.700
130 HD13 ILE 83 3HD1 ILE 83 3.383 -1.324 -2.362
131 H ARG 84 H ARG 84 6.214 -1.172 -7.843
132 HA ARG 84 HA ARG 84 8.750 -2.341 -8.108
133 HB2 ARG 84 2HB ARG 84 6.636 -1.737 -10.168
134 HB3 ARG 84 1HB ARG 84 8.087 -2.668 -10.508
135 HG2 ARG 84 2HG ARG 84 7.416 -4.317 -8.821
136 HG3 ARG 84 1HG ARG 84 5.992 -3.352 -8.452
137 HD2 ARG 84 2HD ARG 84 5.239 -3.705 -10.795
138 HD3 ARG 84 1HD ARG 84 6.612 -4.822 -11.007
139 HE ARG 84 HE ARG 84 4.590 -5.219 -8.925
140 HH11 ARG 84 1HH1 ARG 84 6.227 -6.539 -11.782
141 HH12 ARG 84 2HH1 ARG 84 5.617 -8.109 -11.580
142 HH21 ARG 84 1HH2 ARG 84 3.722 -7.381 -8.689
143 HH22 ARG 84 2HH2 ARG 84 4.175 -8.606 -9.766
144 H GLU 85 H GLU 85 7.446 0.673 -9.391
145 HA GLU 85 HA GLU 85 9.789 1.373 -10.758
146 HB2 GLU 85 2HB GLU 85 7.487 2.969 -9.778
147 HB3 GLU 85 1HB GLU 85 8.895 3.766 -10.467
148 HG2 GLU 85 2HG GLU 85 8.549 2.211 -12.457
149 HG3 GLU 85 1HG GLU 85 6.956 1.897 -11.760
150 H TRP 86 H TRP 86 8.802 1.996 -7.414
151 HA TRP 86 HA TRP 86 10.904 3.743 -6.779
152 HB2 TRP 86 2HB TRP 86 8.926 3.537 -5.377
153 HB3 TRP 86 1HB TRP 86 9.236 1.829 -5.119
154 HD1 TRP 86 HD TRP 86 10.186 5.287 -3.808
155 HE1 TRP 86 1HE TRP 86 11.623 5.014 -1.719
156 HE3 TRP 86 3HE TRP 86 10.883 0.256 -4.007
157 HZ2 TRP 86 2HZ TRP 86 12.902 2.914 -0.306
158 HZ3 TRP 86 3HZ TRP 86 12.233 -0.833 -2.233
159 HH2 TRP 86 HH TRP 86 13.214 0.486 -0.427
160 H ALA 87 H ALA 87 10.451 0.288 -6.607
161 HA ALA 87 HA ALA 87 12.838 -0.567 -5.509
162 HB1 ALA 87 1HB ALA 87 10.932 -2.007 -5.880
163 HB2 ALA 87 2HB ALA 87 12.344 -2.688 -6.705
164 HB3 ALA 87 3HB ALA 87 11.115 -1.834 -7.616
165 H ARG 88 H ARG 88 11.985 0.027 -8.863
166 HA ARG 88 HA ARG 88 14.553 -0.685 -9.858
167 HB2 ARG 88 2HB ARG 88 12.296 0.825 -11.163
168 HB3 ARG 88 1HB ARG 88 13.782 0.403 -11.999
169 HG2 ARG 88 2HG ARG 88 11.787 -1.524 -10.810
170 HG3 ARG 88 1HG ARG 88 12.041 -1.195 -12.526
171 HD2 ARG 88 2HD ARG 88 14.354 -2.024 -12.317
172 HD3 ARG 88 1HD ARG 88 14.055 -2.396 -10.623
173 HE ARG 88 HE ARG 88 12.121 -3.693 -12.066
174 HH11 ARG 88 1HH1 ARG 88 15.622 -3.743 -11.762
175 HH12 ARG 88 2HH1 ARG 88 15.811 -5.369 -12.201
176 HH21 ARG 88 1HH2 ARG 88 12.320 -5.914 -12.668
177 HH22 ARG 88 2HH2 ARG 88 13.870 -6.648 -12.749
178 H ARG 89 H ARG 89 13.215 2.327 -8.749
179 HA ARG 89 HA ARG 89 15.374 3.900 -9.743
180 HB2 ARG 89 2HB ARG 89 13.585 4.472 -7.357
181 HB3 ARG 89 1HB ARG 89 14.708 5.611 -8.064
182 HG2 ARG 89 2HG ARG 89 12.167 4.533 -9.251
183 HG3 ARG 89 1HG ARG 89 12.545 6.200 -8.816
184 HD2 ARG 89 2HD ARG 89 14.369 6.115 -10.546
185 HD3 ARG 89 1HD ARG 89 13.706 4.570 -11.062
186 HE ARG 89 HE ARG 89 12.828 7.105 -11.831
187 HH11 ARG 89 1HH1 ARG 89 11.192 4.098 -10.783
188 HH12 ARG 89 2HH1 ARG 89 9.856 4.411 -11.829
189 HH21 ARG 89 1HH2 ARG 89 10.974 7.351 -13.218
190 HH22 ARG 89 2HH2 ARG 89 9.729 6.185 -13.176
191 H ASN 90 H ASN 90 14.797 2.100 -6.824
192 HA ASN 90 HA ASN 90 17.254 3.049 -5.620
193 HB2 ASN 90 2HB ASN 90 14.986 1.384 -4.620
194 HB3 ASN 90 1HB ASN 90 16.470 1.564 -3.673
195 HD21 ASN 90 1HD2 ASN 90 13.639 3.160 -4.928
196 HD22 ASN 90 2HD2 ASN 90 13.787 4.582 -3.961
197 H GLY 91 H GLY 91 16.364 0.417 -7.534
198 HA2 GLY 91 2HA GLY 91 17.998 -0.957 -8.528
199 HA3 GLY 91 1HA GLY 91 19.070 -0.619 -7.183
200 H HIS 92 H HIS 92 15.734 -1.776 -6.882
201 HA HIS 92 HA HIS 92 16.756 -4.135 -5.507
202 HB2 HIS 92 2HB HIS 92 13.989 -2.974 -5.759
203 HB3 HIS 92 1HB HIS 92 14.331 -4.489 -4.941
204 HD1 HIS 92 1HD HIS 92 14.775 -4.243 -2.421
205 HD2 HIS 92 2HD HIS 92 15.264 -0.716 -4.558
206 HE1 HIS 92 1HE HIS 92 15.116 -2.443 -0.717
207 H ASN 93 H ASN 93 16.223 -6.197 -6.151
208 HA ASN 93 HA ASN 93 15.562 -6.479 -8.958
209 HB2 ASN 93 2HB ASN 93 16.488 -8.489 -6.889
210 HB3 ASN 93 1HB ASN 93 16.058 -8.925 -8.536
211 HD21 ASN 93 1HD2 ASN 93 18.578 -9.118 -7.027
212 HD22 ASN 93 2HD2 ASN 93 19.759 -8.317 -7.985
213 H VAL 94 H VAL 94 13.413 -6.061 -9.080
214 HA VAL 94 HA VAL 94 11.653 -7.840 -7.563
215 HB VAL 94 HB VAL 94 10.980 -5.247 -8.998
216 HG11 VAL 94 1HG1 VAL 94 9.207 -7.108 -7.408
217 HG12 VAL 94 2HG1 VAL 94 9.081 -6.777 -9.138
218 HG13 VAL 94 3HG1 VAL 94 8.747 -5.502 -7.960
219 HG21 VAL 94 1HG2 VAL 94 11.030 -5.958 -6.075
220 HG22 VAL 94 2HG2 VAL 94 10.539 -4.403 -6.755
221 HG23 VAL 94 3HG2 VAL 94 12.206 -4.954 -6.919
222 H SER 95 H SER 95 10.777 -9.453 -8.542
223 HA SER 95 HA SER 95 11.148 -10.072 -11.238
224 HB2 SER 95 2HB SER 95 10.828 -11.718 -9.387
225 HB3 SER 95 1HB SER 95 9.149 -11.203 -9.261
226 HG SER 95 HG SER 95 8.674 -12.364 -10.918
227 H THR 96 H THR 96 9.926 -9.603 -13.007
228 HA THR 96 HA THR 96 7.723 -7.817 -12.704
229 HB THR 96 HB THR 96 7.653 -8.151 -15.267
230 HG1 THR 96 1HG THR 96 8.906 -9.642 -16.001
231 HG21 THR 96 1HG2 THR 96 10.171 -7.101 -13.958
232 HG22 THR 96 2HG2 THR 96 8.682 -6.190 -14.218
233 HG23 THR 96 3HG2 THR 96 9.643 -6.723 -15.599
234 H ARG 97 H ARG 97 8.338 -11.137 -13.429
235 HA ARG 97 HA ARG 97 5.536 -11.773 -13.812
236 HB2 ARG 97 2HB ARG 97 8.002 -13.523 -13.715
237 HB3 ARG 97 1HB ARG 97 6.379 -14.130 -13.972
238 HG2 ARG 97 2HG ARG 97 7.865 -12.235 -15.781
239 HG3 ARG 97 1HG ARG 97 7.608 -13.959 -16.060
240 HD2 ARG 97 2HD ARG 97 5.157 -13.525 -15.995
241 HD3 ARG 97 1HD ARG 97 5.513 -11.803 -15.909
242 HE ARG 97 HE ARG 97 6.844 -12.953 -18.082
243 HH11 ARG 97 1HH1 ARG 97 3.658 -11.815 -17.095
244 HH12 ARG 97 2HH1 ARG 97 3.022 -11.744 -18.673
245 HH21 ARG 97 1HH2 ARG 97 5.987 -12.842 -20.259
246 HH22 ARG 97 2HH2 ARG 97 4.367 -12.356 -20.494
247 H GLY 98 H GLY 98 4.352 -11.797 -12.017
248 HA2 GLY 98 2HA GLY 98 3.796 -13.219 -10.134
249 HA3 GLY 98 1HA GLY 98 5.498 -13.174 -9.697
250 H ARG 99 H ARG 99 4.852 -12.470 -7.661
251 HA ARG 99 HA ARG 99 3.638 -9.837 -7.415
252 HB2 ARG 99 2HB ARG 99 4.379 -11.948 -5.406
253 HB3 ARG 99 1HB ARG 99 3.800 -10.356 -4.947
254 HG2 ARG 99 2HG ARG 99 1.700 -10.744 -6.012
255 HG3 ARG 99 1HG ARG 99 2.279 -12.260 -6.704
256 HD2 ARG 99 2HD ARG 99 0.841 -12.603 -4.751
257 HD3 ARG 99 1HD ARG 99 2.471 -13.235 -4.507
258 HE ARG 99 HE ARG 99 2.665 -10.843 -3.354
259 HH11 ARG 99 1HH1 ARG 99 0.034 -13.190 -3.082
260 HH12 ARG 99 2HH1 ARG 99 -0.285 -12.885 -1.447
261 HH21 ARG 99 1HH2 ARG 99 2.270 -10.393 -1.154
262 HH22 ARG 99 2HH2 ARG 99 1.061 -11.190 -0.261
263 H ILE 100 H ILE 100 4.572 -8.511 -5.609
264 HA ILE 100 HA ILE 100 7.367 -7.930 -6.224
265 HB ILE 100 HB ILE 100 5.400 -6.435 -4.450
266 HG12 ILE 100 2HG1 ILE 100 6.163 -5.818 -7.296
267 HG13 ILE 100 1HG1 ILE 100 4.663 -6.596 -6.813
268 HG21 ILE 100 1HG2 ILE 100 7.722 -5.913 -3.967
269 HG22 ILE 100 2HG2 ILE 100 6.905 -4.544 -4.735
270 HG23 ILE 100 3HG2 ILE 100 8.007 -5.549 -5.679
271 HD11 ILE 100 1HD1 ILE 100 5.565 -3.852 -6.012
272 HD12 ILE 100 2HD1 ILE 100 4.031 -4.604 -5.555
273 HD13 ILE 100 3HD1 ILE 100 4.362 -4.211 -7.246
274 HA PRO 101 HA PRO 101 8.624 -10.124 -2.515
275 HB2 PRO 101 2HB PRO 101 10.806 -8.119 -2.424
276 HB3 PRO 101 1HB PRO 101 10.921 -9.889 -2.470
277 HG2 PRO 101 2HG PRO 101 11.520 -8.384 -4.575
278 HG3 PRO 101 1HG PRO 101 10.804 -10.002 -4.733
279 HD2 PRO 101 2HD PRO 101 9.560 -7.345 -5.151
280 HD3 PRO 101 1HD PRO 101 9.192 -8.914 -5.900
281 H ALA 102 H ALA 102 7.878 -9.840 -0.552
282 HA ALA 102 HA ALA 102 6.602 -7.574 0.392
283 HB1 ALA 102 1HB ALA 102 7.764 -9.804 2.044
284 HB2 ALA 102 2HB ALA 102 6.198 -9.849 1.231
285 HB3 ALA 102 3HB ALA 102 6.485 -8.697 2.533
286 H ASP 103 H ASP 103 9.962 -8.440 0.679
287 HA ASP 103 HA ASP 103 10.593 -6.577 2.724
288 HB2 ASP 103 2HB ASP 103 12.107 -8.444 2.108
289 HB3 ASP 103 1HB ASP 103 12.428 -7.630 0.581
290 H VAL 104 H VAL 104 10.430 -6.353 -0.794
291 HA VAL 104 HA VAL 104 11.598 -3.743 -0.914
292 HB VAL 104 HB VAL 104 9.870 -5.247 -2.925
293 HG11 VAL 104 1HG1 VAL 104 10.585 -3.600 -4.571
294 HG12 VAL 104 2HG1 VAL 104 11.466 -2.711 -3.330
295 HG13 VAL 104 3HG1 VAL 104 9.703 -2.806 -3.264
296 HG21 VAL 104 1HG2 VAL 104 12.815 -4.692 -2.870
297 HG22 VAL 104 2HG2 VAL 104 11.959 -5.565 -4.134
298 HG23 VAL 104 3HG2 VAL 104 12.070 -6.251 -2.502
299 H ILE 105 H ILE 105 8.410 -5.110 -0.749
300 HA ILE 105 HA ILE 105 6.925 -2.720 -0.924
301 HB ILE 105 HB ILE 105 6.239 -5.271 0.573
302 HG12 ILE 105 2HG1 ILE 105 5.518 -4.410 -2.238
303 HG13 ILE 105 1HG1 ILE 105 6.763 -5.575 -1.829
304 HG21 ILE 105 1HG2 ILE 105 4.421 -3.051 -0.401
305 HG22 ILE 105 2HG2 ILE 105 4.842 -3.385 1.273
306 HG23 ILE 105 3HG2 ILE 105 3.908 -4.569 0.350
307 HD11 ILE 105 1HD1 ILE 105 3.806 -5.875 -1.337
308 HD12 ILE 105 2HD1 ILE 105 5.054 -7.043 -0.878
309 HD13 ILE 105 3HD1 ILE 105 4.779 -6.678 -2.576
310 H ASP 106 H ASP 106 8.373 -4.417 1.781
311 HA ASP 106 HA ASP 106 7.378 -2.797 3.869
312 HB2 ASP 106 2HB ASP 106 8.376 -5.030 4.262
313 HB3 ASP 106 1HB ASP 106 9.943 -4.403 3.768
314 H ALA 107 H ALA 107 10.407 -2.821 2.089
315 HA ALA 107 HA ALA 107 11.608 -0.609 3.268
316 HB1 ALA 107 1HB ALA 107 11.911 -1.587 0.441
317 HB2 ALA 107 2HB ALA 107 12.702 -2.291 1.835
318 HB3 ALA 107 3HB ALA 107 13.091 -0.632 1.356
319 H TYR 108 H TYR 108 9.464 -0.870 0.480
320 HA TYR 108 HA TYR 108 9.485 1.782 -0.372
321 HB2 TYR 108 2HB TYR 108 8.477 -0.014 -1.685
322 HB3 TYR 108 1HB TYR 108 7.240 -0.249 -0.463
323 HD1 TYR 108 1HD TYR 108 5.225 1.012 -0.541
324 HD2 TYR 108 2HD TYR 108 8.507 2.170 -2.972
325 HE1 TYR 108 1HE TYR 108 3.777 2.583 -1.741
326 HE2 TYR 108 2HE TYR 108 7.095 3.719 -4.178
327 HH TYR 108 HH TYR 108 3.998 4.594 -3.054
328 H HIS 109 H HIS 109 7.225 0.162 1.848
329 HA HIS 109 HA HIS 109 5.958 2.619 2.457
330 HB2 HIS 109 2HB HIS 109 5.662 -0.125 3.627
331 HB3 HIS 109 1HB HIS 109 4.841 1.265 4.337
332 HD1 HIS 109 1HD HIS 109 2.821 2.183 3.101
333 HD2 HIS 109 2HD HIS 109 4.822 -0.799 1.036
334 HE1 HIS 109 1HE HIS 109 1.324 1.560 1.171
335 H ALA 110 H ALA 110 8.755 1.193 3.635
336 HA ALA 110 HA ALA 110 8.805 2.650 6.103
337 HB1 ALA 110 1HB ALA 110 11.172 2.025 6.160
338 HB2 ALA 110 2HB ALA 110 11.057 1.429 4.504
339 HB3 ALA 110 3HB ALA 110 10.159 0.626 5.794
340 H ALA 111 H ALA 111 10.288 2.979 2.924
341 HA ALA 111 HA ALA 111 11.567 5.427 3.426
342 HB1 ALA 111 1HB ALA 111 12.267 3.897 1.671
343 HB2 ALA 111 2HB ALA 111 11.939 5.509 1.031
344 HB3 ALA 111 3HB ALA 111 10.768 4.209 0.795
345 H THR 112 H THR 112 8.493 4.694 1.733
346 HA THR 112 HA THR 112 7.994 7.526 1.931
347 HB THR 112 HB THR 112 8.181 6.716 -0.440
348 HG1 THR 112 1HG THR 112 6.430 8.325 0.520
349 HG21 THR 112 1HG2 THR 112 6.370 5.407 -1.454
350 HG22 THR 112 2HG2 THR 112 5.655 5.162 0.139
351 HG23 THR 112 3HG2 THR 112 7.239 4.482 -0.232
Start of MODEL 5
1 H MET 65 1HT MET 65 5.700 8.400 -14.595
2 HA MET 65 HA MET 65 3.554 9.101 -14.031
3 HB2 MET 65 2HB MET 65 3.466 8.080 -11.785
4 HB3 MET 65 1HB MET 65 4.619 9.263 -11.191
5 HG2 MET 65 2HG MET 65 3.006 11.049 -11.587
6 HG3 MET 65 1HG MET 65 1.862 9.881 -12.241
7 HE1 MET 65 1HE MET 65 0.654 8.009 -10.792
8 HE2 MET 65 2HE MET 65 0.935 7.761 -9.074
9 HE3 MET 65 3HE MET 65 2.207 7.386 -10.236
10 H SER 66 H SER 66 4.317 10.569 -15.465
11 HA SER 66 HA SER 66 5.343 13.060 -14.335
12 HB2 SER 66 2HB SER 66 6.335 11.743 -16.878
13 HB3 SER 66 1HB SER 66 6.900 13.260 -16.186
14 HG SER 66 HG SER 66 7.612 12.089 -14.379
15 H GLY 67 H GLY 67 4.859 14.874 -15.798
16 HA2 GLY 67 2HA GLY 67 3.779 15.901 -17.572
17 HA3 GLY 67 1HA GLY 67 3.023 14.367 -17.982
18 H SER 68 H SER 68 0.935 14.481 -17.808
19 HA SER 68 HA SER 68 -0.464 16.469 -16.391
20 HB2 SER 68 2HB SER 68 -1.471 13.800 -17.389
21 HB3 SER 68 1HB SER 68 -2.419 15.263 -17.104
22 HG SER 68 HG SER 68 -0.828 16.213 -18.654
23 H GLY 69 H GLY 69 0.251 13.088 -15.739
24 HA2 GLY 69 2HA GLY 69 -1.134 13.107 -13.239
25 HA3 GLY 69 1HA GLY 69 -0.192 11.787 -13.914
26 H ARG 70 H ARG 70 -0.243 14.410 -11.831
27 HA ARG 70 HA ARG 70 2.507 13.829 -11.001
28 HB2 ARG 70 2HB ARG 70 1.187 16.376 -11.492
29 HB3 ARG 70 1HB ARG 70 1.684 16.215 -9.816
30 HG2 ARG 70 2HG ARG 70 3.419 17.338 -11.058
31 HG3 ARG 70 1HG ARG 70 3.994 15.750 -10.560
32 HD2 ARG 70 2HD ARG 70 3.567 14.895 -12.807
33 HD3 ARG 70 1HD ARG 70 2.931 16.467 -13.292
34 HE ARG 70 HE ARG 70 5.708 16.143 -12.362
35 HH11 ARG 70 1HH1 ARG 70 3.450 17.249 -14.879
36 HH12 ARG 70 2HH1 ARG 70 4.642 18.072 -15.767
37 HH21 ARG 70 1HH2 ARG 70 7.319 17.198 -13.633
38 HH22 ARG 70 2HH2 ARG 70 6.909 17.985 -15.073
39 H GLY 71 H GLY 71 2.702 13.268 -8.898
40 HA2 GLY 71 2HA GLY 71 0.307 12.578 -7.530
41 HA3 GLY 71 1HA GLY 71 1.958 12.349 -6.944
42 H ARG 72 H ARG 72 -0.839 14.003 -6.513
43 HA ARG 72 HA ARG 72 0.176 16.523 -5.609
44 HB2 ARG 72 2HB ARG 72 -2.451 15.127 -5.065
45 HB3 ARG 72 1HB ARG 72 -2.080 16.786 -4.631
46 HG2 ARG 72 2HG ARG 72 -1.938 17.428 -6.921
47 HG3 ARG 72 1HG ARG 72 -2.076 15.754 -7.457
48 HD2 ARG 72 2HD ARG 72 -4.185 17.323 -5.965
49 HD3 ARG 72 1HD ARG 72 -4.194 16.962 -7.688
50 HE ARG 72 HE ARG 72 -4.309 14.600 -7.074
51 HH11 ARG 72 1HH1 ARG 72 -5.348 16.975 -4.630
52 HH12 ARG 72 2HH1 ARG 72 -6.501 15.944 -3.923
53 HH21 ARG 72 1HH2 ARG 72 -5.909 13.206 -6.056
54 HH22 ARG 72 2HH2 ARG 72 -6.830 13.787 -4.728
55 H GLY 73 H GLY 73 -0.731 13.468 -4.222
56 HA2 GLY 73 2HA GLY 73 0.895 14.058 -1.890
57 HA3 GLY 73 1HA GLY 73 -0.797 13.689 -1.594
58 H ALA 74 H ALA 74 -1.595 11.646 -2.381
59 HA ALA 74 HA ALA 74 0.527 9.588 -2.331
60 HB1 ALA 74 1HB ALA 74 -0.979 9.537 -0.391
61 HB2 ALA 74 2HB ALA 74 -1.119 8.083 -1.382
62 HB3 ALA 74 3HB ALA 74 -2.349 9.343 -1.484
63 H ILE 75 H ILE 75 -0.040 7.607 -3.385
64 HA ILE 75 HA ILE 75 -0.693 8.165 -6.121
65 HB ILE 75 HB ILE 75 0.203 5.657 -4.681
66 HG12 ILE 75 2HG1 ILE 75 1.787 7.575 -6.385
67 HG13 ILE 75 1HG1 ILE 75 1.692 7.655 -4.631
68 HG21 ILE 75 1HG2 ILE 75 -0.928 5.126 -6.823
69 HG22 ILE 75 2HG2 ILE 75 0.803 4.798 -6.907
70 HG23 ILE 75 3HG2 ILE 75 0.146 6.253 -7.655
71 HD11 ILE 75 1HD1 ILE 75 2.779 5.368 -6.239
72 HD12 ILE 75 2HD1 ILE 75 2.668 5.472 -4.473
73 HD13 ILE 75 3HD1 ILE 75 3.716 6.587 -5.354
74 H ASP 76 H ASP 76 -2.522 7.568 -7.144
75 HA ASP 76 HA ASP 76 -4.767 6.890 -5.438
76 HB2 ASP 76 2HB ASP 76 -4.901 8.758 -7.097
77 HB3 ASP 76 1HB ASP 76 -4.739 7.581 -8.387
78 H ARG 77 H ARG 77 -3.560 5.711 -8.564
79 HA ARG 77 HA ARG 77 -4.728 3.115 -7.857
80 HB2 ARG 77 2HB ARG 77 -4.435 4.296 -10.624
81 HB3 ARG 77 1HB ARG 77 -5.031 2.680 -10.263
82 HG2 ARG 77 2HG ARG 77 -6.900 3.634 -9.037
83 HG3 ARG 77 1HG ARG 77 -6.294 5.254 -9.373
84 HD2 ARG 77 2HD ARG 77 -6.565 4.780 -11.795
85 HD3 ARG 77 1HD ARG 77 -7.286 3.227 -11.369
86 HE ARG 77 HE ARG 77 -8.442 5.601 -10.191
87 HH11 ARG 77 1HH1 ARG 77 -8.698 3.199 -12.767
88 HH12 ARG 77 2HH1 ARG 77 -10.364 3.427 -13.033
89 HH21 ARG 77 1HH2 ARG 77 -10.689 5.955 -10.545
90 HH22 ARG 77 2HH2 ARG 77 -11.558 5.053 -11.699
91 H GLU 78 H GLU 78 -3.664 1.292 -8.346
92 HA GLU 78 HA GLU 78 -2.024 -0.144 -8.568
93 HB2 GLU 78 2HB GLU 78 -1.093 1.724 -10.734
94 HB3 GLU 78 1HB GLU 78 -0.460 0.102 -10.475
95 HG2 GLU 78 2HG GLU 78 -2.755 -0.785 -10.792
96 HG3 GLU 78 1HG GLU 78 -3.278 0.844 -11.206
97 H GLN 79 H GLN 79 -1.602 1.148 -6.394
98 HA GLN 79 HA GLN 79 0.928 2.306 -6.100
99 HB2 GLN 79 2HB GLN 79 -0.793 0.843 -4.105
100 HB3 GLN 79 1HB GLN 79 0.774 1.502 -3.675
101 HG2 GLN 79 2HG GLN 79 -0.008 3.724 -4.401
102 HG3 GLN 79 1HG GLN 79 -1.611 3.039 -4.667
103 HE21 GLN 79 1HE2 GLN 79 -2.441 4.488 -3.131
104 HE22 GLN 79 2HE2 GLN 79 -2.260 4.224 -1.442
105 H SER 80 H SER 80 -0.079 -1.054 -6.201
106 HA SER 80 HA SER 80 2.268 -2.268 -5.356
107 HB2 SER 80 2HB SER 80 0.449 -3.218 -7.564
108 HB3 SER 80 1HB SER 80 1.445 -4.216 -6.499
109 HG SER 80 HG SER 80 -0.957 -3.736 -6.149
110 H ALA 81 H ALA 81 1.283 -1.178 -8.609
111 HA ALA 81 HA ALA 81 3.589 -2.014 -9.970
112 HB1 ALA 81 1HB ALA 81 1.739 0.279 -10.636
113 HB2 ALA 81 2HB ALA 81 1.510 -1.400 -11.128
114 HB3 ALA 81 3HB ALA 81 2.885 -0.479 -11.744
115 H ALA 82 H ALA 82 2.707 1.006 -8.408
116 HA ALA 82 HA ALA 82 5.036 2.455 -8.987
117 HB1 ALA 82 1HB ALA 82 4.421 3.907 -7.129
118 HB2 ALA 82 2HB ALA 82 3.295 2.687 -6.534
119 HB3 ALA 82 3HB ALA 82 2.997 3.478 -8.080
120 H ILE 83 H ILE 83 4.352 0.178 -6.368
121 HA ILE 83 HA ILE 83 6.748 0.537 -4.906
122 HB ILE 83 HB ILE 83 5.099 -1.998 -5.192
123 HG12 ILE 83 2HG1 ILE 83 5.015 0.123 -3.032
124 HG13 ILE 83 1HG1 ILE 83 3.806 -0.102 -4.288
125 HG21 ILE 83 1HG2 ILE 83 7.173 -1.254 -3.124
126 HG22 ILE 83 2HG2 ILE 83 7.318 -2.520 -4.341
127 HG23 ILE 83 3HG2 ILE 83 6.135 -2.675 -3.036
128 HD11 ILE 83 1HD1 ILE 83 3.263 -2.305 -3.360
129 HD12 ILE 83 2HD1 ILE 83 3.060 -1.024 -2.170
130 HD13 ILE 83 3HD1 ILE 83 4.481 -2.067 -2.106
131 H ARG 84 H ARG 84 5.899 -1.618 -7.548
132 HA ARG 84 HA ARG 84 8.294 -3.063 -7.684
133 HB2 ARG 84 2HB ARG 84 6.343 -2.397 -9.872
134 HB3 ARG 84 1HB ARG 84 7.562 -3.672 -9.956
135 HG2 ARG 84 2HG ARG 84 6.548 -4.887 -8.237
136 HG3 ARG 84 1HG ARG 84 5.496 -3.541 -7.798
137 HD2 ARG 84 2HD ARG 84 4.068 -4.893 -8.932
138 HD3 ARG 84 1HD ARG 84 4.635 -3.824 -10.210
139 HE ARG 84 HE ARG 84 6.015 -6.344 -9.853
140 HH11 ARG 84 1HH1 ARG 84 4.027 -4.316 -11.903
141 HH12 ARG 84 2HH1 ARG 84 3.580 -5.549 -12.988
142 HH21 ARG 84 1HH2 ARG 84 5.445 -8.065 -11.319
143 HH22 ARG 84 2HH2 ARG 84 4.446 -7.747 -12.677
144 H GLU 85 H GLU 85 7.171 -0.195 -9.389
145 HA GLU 85 HA GLU 85 9.417 0.351 -10.937
146 HB2 GLU 85 2HB GLU 85 7.390 2.216 -9.705
147 HB3 GLU 85 1HB GLU 85 8.613 2.744 -10.848
148 HG2 GLU 85 2HG GLU 85 6.453 0.717 -11.395
149 HG3 GLU 85 1HG GLU 85 6.452 2.396 -11.930
150 H TRP 86 H TRP 86 8.581 1.474 -7.655
151 HA TRP 86 HA TRP 86 10.773 3.098 -7.175
152 HB2 TRP 86 2HB TRP 86 8.804 3.165 -5.766
153 HB3 TRP 86 1HB TRP 86 8.990 1.470 -5.343
154 HD1 TRP 86 HD TRP 86 10.193 4.942 -4.379
155 HE1 TRP 86 1HE TRP 86 11.646 4.778 -2.280
156 HE3 TRP 86 3HE TRP 86 10.523 -0.110 -4.077
157 HZ2 TRP 86 2HZ TRP 86 12.775 2.738 -0.676
158 HZ3 TRP 86 3HZ TRP 86 11.811 -1.116 -2.213
159 HH2 TRP 86 HH TRP 86 12.905 0.291 -0.555
160 H ALA 87 H ALA 87 10.211 -0.322 -6.626
161 HA ALA 87 HA ALA 87 12.523 -1.040 -5.303
162 HB1 ALA 87 1HB ALA 87 12.067 -3.293 -6.104
163 HB2 ALA 87 2HB ALA 87 10.965 -2.639 -7.314
164 HB3 ALA 87 3HB ALA 87 10.583 -2.479 -5.602
165 H ARG 88 H ARG 88 11.848 -1.169 -8.755
166 HA ARG 88 HA ARG 88 14.410 -1.977 -9.555
167 HB2 ARG 88 2HB ARG 88 12.153 -0.630 -10.990
168 HB3 ARG 88 1HB ARG 88 13.688 -0.899 -11.802
169 HG2 ARG 88 2HG ARG 88 12.063 -3.089 -10.518
170 HG3 ARG 88 1HG ARG 88 11.958 -2.653 -12.226
171 HD2 ARG 88 2HD ARG 88 14.358 -3.110 -12.484
172 HD3 ARG 88 1HD ARG 88 14.455 -3.558 -10.790
173 HE ARG 88 HE ARG 88 13.012 -5.422 -11.278
174 HH11 ARG 88 1HH1 ARG 88 14.256 -3.820 -14.183
175 HH12 ARG 88 2HH1 ARG 88 14.490 -5.254 -15.056
176 HH21 ARG 88 1HH2 ARG 88 13.396 -7.426 -12.464
177 HH22 ARG 88 2HH2 ARG 88 13.968 -7.368 -14.055
178 H ARG 89 H ARG 89 13.075 1.203 -9.054
179 HA ARG 89 HA ARG 89 15.273 2.600 -10.158
180 HB2 ARG 89 2HB ARG 89 13.121 3.538 -8.295
181 HB3 ARG 89 1HB ARG 89 14.244 4.587 -9.170
182 HG2 ARG 89 2HG ARG 89 13.497 3.672 -11.281
183 HG3 ARG 89 1HG ARG 89 12.402 2.594 -10.433
184 HD2 ARG 89 2HD ARG 89 11.422 4.691 -9.456
185 HD3 ARG 89 1HD ARG 89 12.350 5.508 -10.744
186 HE ARG 89 HE ARG 89 10.779 3.280 -11.631
187 HH11 ARG 89 1HH1 ARG 89 10.673 6.805 -11.176
188 HH12 ARG 89 2HH1 ARG 89 9.430 7.042 -12.297
189 HH21 ARG 89 1HH2 ARG 89 9.013 3.602 -13.130
190 HH22 ARG 89 2HH2 ARG 89 8.479 5.173 -13.475
191 H ASN 90 H ASN 90 14.591 1.321 -7.016
192 HA ASN 90 HA ASN 90 16.897 2.659 -5.822
193 HB2 ASN 90 2HB ASN 90 14.635 1.072 -4.737
194 HB3 ASN 90 1HB ASN 90 16.097 1.247 -3.757
195 HD21 ASN 90 1HD2 ASN 90 13.407 2.851 -5.214
196 HD22 ASN 90 2HD2 ASN 90 13.554 4.324 -4.319
197 H GLY 91 H GLY 91 16.200 -0.286 -7.309
198 HA2 GLY 91 2HA GLY 91 18.014 -1.663 -8.022
199 HA3 GLY 91 1HA GLY 91 18.902 -1.189 -6.587
200 H HIS 92 H HIS 92 15.579 -2.082 -6.250
201 HA HIS 92 HA HIS 92 16.399 -4.487 -4.865
202 HB2 HIS 92 2HB HIS 92 13.732 -3.075 -5.074
203 HB3 HIS 92 1HB HIS 92 13.974 -4.587 -4.207
204 HD1 HIS 92 1HD HIS 92 14.849 -4.350 -1.767
205 HD2 HIS 92 2HD HIS 92 14.900 -0.828 -3.950
206 HE1 HIS 92 1HE HIS 92 15.373 -2.536 -0.119
207 H ASN 93 H ASN 93 16.065 -6.447 -5.726
208 HA ASN 93 HA ASN 93 15.265 -6.414 -8.464
209 HB2 ASN 93 2HB ASN 93 16.599 -8.503 -6.800
210 HB3 ASN 93 1HB ASN 93 15.877 -8.925 -8.350
211 HD21 ASN 93 1HD2 ASN 93 18.672 -8.941 -7.549
212 HD22 ASN 93 2HD2 ASN 93 19.501 -7.908 -8.653
213 H VAL 94 H VAL 94 13.252 -5.976 -8.406
214 HA VAL 94 HA VAL 94 11.460 -8.226 -7.810
215 HB VAL 94 HB VAL 94 10.772 -5.270 -8.093
216 HG11 VAL 94 1HG1 VAL 94 8.517 -5.909 -7.368
217 HG12 VAL 94 2HG1 VAL 94 9.005 -7.602 -7.334
218 HG13 VAL 94 3HG1 VAL 94 8.964 -6.728 -8.865
219 HG21 VAL 94 1HG2 VAL 94 10.203 -5.368 -5.715
220 HG22 VAL 94 2HG2 VAL 94 11.919 -5.674 -6.013
221 HG23 VAL 94 3HG2 VAL 94 10.827 -7.016 -5.647
222 H SER 95 H SER 95 10.502 -9.044 -9.589
223 HA SER 95 HA SER 95 11.453 -8.042 -12.106
224 HB2 SER 95 2HB SER 95 11.513 -10.438 -11.656
225 HB3 SER 95 1HB SER 95 9.767 -10.445 -11.417
226 HG SER 95 HG SER 95 11.043 -10.813 -13.631
227 H THR 96 H THR 96 10.164 -7.337 -13.770
228 HA THR 96 HA THR 96 7.715 -6.086 -13.117
229 HB THR 96 HB THR 96 7.754 -5.775 -15.684
230 HG1 THR 96 1HG THR 96 9.440 -6.482 -16.707
231 HG21 THR 96 1HG2 THR 96 9.496 -4.049 -15.496
232 HG22 THR 96 2HG2 THR 96 10.026 -4.765 -13.969
233 HG23 THR 96 3HG2 THR 96 8.423 -4.042 -14.096
234 H ARG 97 H ARG 97 8.663 -9.202 -13.967
235 HA ARG 97 HA ARG 97 5.970 -9.906 -14.829
236 HB2 ARG 97 2HB ARG 97 8.590 -11.381 -15.172
237 HB3 ARG 97 1HB ARG 97 7.023 -12.023 -15.633
238 HG2 ARG 97 2HG ARG 97 8.318 -9.560 -16.787
239 HG3 ARG 97 1HG ARG 97 8.251 -11.150 -17.551
240 HD2 ARG 97 2HD ARG 97 5.791 -11.025 -17.520
241 HD3 ARG 97 1HD ARG 97 5.898 -9.400 -16.836
242 HE ARG 97 HE ARG 97 7.423 -9.490 -19.144
243 HH11 ARG 97 1HH1 ARG 97 3.995 -9.580 -18.190
244 HH12 ARG 97 2HH1 ARG 97 3.439 -9.026 -19.699
245 HH21 ARG 97 1HH2 ARG 97 6.596 -8.680 -21.215
246 HH22 ARG 97 2HH2 ARG 97 4.912 -8.525 -21.415
247 H GLY 98 H GLY 98 7.496 -9.537 -12.078
248 HA2 GLY 98 2HA GLY 98 6.564 -12.077 -10.956
249 HA3 GLY 98 1HA GLY 98 8.036 -11.292 -10.404
250 H ARG 99 H ARG 99 6.254 -11.869 -8.578
251 HA ARG 99 HA ARG 99 4.496 -9.611 -8.091
252 HB2 ARG 99 2HB ARG 99 3.753 -11.970 -7.706
253 HB3 ARG 99 1HB ARG 99 4.984 -12.126 -6.469
254 HG2 ARG 99 2HG ARG 99 3.857 -10.532 -5.066
255 HG3 ARG 99 1HG ARG 99 2.708 -10.163 -6.353
256 HD2 ARG 99 2HD ARG 99 3.024 -12.850 -5.019
257 HD3 ARG 99 1HD ARG 99 1.752 -11.679 -4.668
258 HE ARG 99 HE ARG 99 1.732 -12.174 -7.406
259 HH11 ARG 99 1HH1 ARG 99 1.105 -14.020 -4.467
260 HH12 ARG 99 2HH1 ARG 99 -0.160 -14.947 -5.143
261 HH21 ARG 99 1HH2 ARG 99 0.081 -13.453 -8.352
262 HH22 ARG 99 2HH2 ARG 99 -0.753 -14.627 -7.433
263 H ILE 100 H ILE 100 4.610 -8.587 -5.856
264 HA ILE 100 HA ILE 100 7.334 -7.688 -5.478
265 HB ILE 100 HB ILE 100 4.935 -6.814 -3.888
266 HG12 ILE 100 2HG1 ILE 100 5.908 -5.675 -6.495
267 HG13 ILE 100 1HG1 ILE 100 4.447 -6.644 -6.321
268 HG21 ILE 100 1HG2 ILE 100 7.523 -5.446 -4.669
269 HG22 ILE 100 2HG2 ILE 100 7.143 -6.119 -3.082
270 HG23 ILE 100 3HG2 ILE 100 6.236 -4.735 -3.693
271 HD11 ILE 100 1HD1 ILE 100 3.927 -4.286 -6.393
272 HD12 ILE 100 2HD1 ILE 100 5.032 -4.018 -5.044
273 HD13 ILE 100 3HD1 ILE 100 3.554 -4.949 -4.789
274 HA PRO 101 HA PRO 101 7.793 -10.219 -1.790
275 HB2 PRO 101 2HB PRO 101 10.323 -8.831 -1.374
276 HB3 PRO 101 1HB PRO 101 10.064 -10.535 -1.805
277 HG2 PRO 101 2HG PRO 101 11.158 -8.738 -3.500
278 HG3 PRO 101 1HG PRO 101 10.251 -10.173 -4.009
279 HD2 PRO 101 2HD PRO 101 9.347 -7.327 -3.926
280 HD3 PRO 101 1HD PRO 101 8.987 -8.619 -5.090
281 H ALA 102 H ALA 102 7.402 -9.777 0.311
282 HA ALA 102 HA ALA 102 6.291 -7.340 1.102
283 HB1 ALA 102 1HB ALA 102 5.764 -9.509 2.135
284 HB2 ALA 102 2HB ALA 102 6.183 -8.271 3.317
285 HB3 ALA 102 3HB ALA 102 7.361 -9.515 2.888
286 H ASP 103 H ASP 103 9.584 -8.489 1.366
287 HA ASP 103 HA ASP 103 10.558 -6.555 3.159
288 HB2 ASP 103 2HB ASP 103 11.969 -8.430 2.519
289 HB3 ASP 103 1HB ASP 103 11.994 -7.874 0.846
290 H VAL 104 H VAL 104 10.019 -6.451 -0.303
291 HA VAL 104 HA VAL 104 11.269 -3.896 -0.580
292 HB VAL 104 HB VAL 104 9.575 -5.523 -2.506
293 HG11 VAL 104 1HG1 VAL 104 11.125 -2.980 -3.047
294 HG12 VAL 104 2HG1 VAL 104 9.369 -3.086 -2.942
295 HG13 VAL 104 3HG1 VAL 104 10.224 -3.933 -4.228
296 HG21 VAL 104 1HG2 VAL 104 11.691 -5.876 -3.647
297 HG22 VAL 104 2HG2 VAL 104 11.803 -6.423 -1.965
298 HG23 VAL 104 3HG2 VAL 104 12.502 -4.871 -2.450
299 H ILE 105 H ILE 105 8.044 -5.155 -0.210
300 HA ILE 105 HA ILE 105 6.636 -2.718 -0.530
301 HB ILE 105 HB ILE 105 5.947 -5.067 1.272
302 HG12 ILE 105 2HG1 ILE 105 5.068 -4.451 -1.559
303 HG13 ILE 105 1HG1 ILE 105 6.260 -5.660 -1.106
304 HG21 ILE 105 1HG2 ILE 105 3.645 -4.265 1.117
305 HG22 ILE 105 2HG2 ILE 105 4.196 -2.850 0.201
306 HG23 ILE 105 3HG2 ILE 105 4.694 -3.065 1.880
307 HD11 ILE 105 1HD1 ILE 105 4.134 -6.667 -1.619
308 HD12 ILE 105 2HD1 ILE 105 3.335 -5.689 -0.386
309 HD13 ILE 105 3HD1 ILE 105 4.521 -6.911 0.082
310 H ASP 106 H ASP 106 8.199 -4.212 2.223
311 HA ASP 106 HA ASP 106 7.450 -2.377 4.223
312 HB2 ASP 106 2HB ASP 106 8.265 -4.505 4.918
313 HB3 ASP 106 1HB ASP 106 9.724 -4.332 3.952
314 H ALA 107 H ALA 107 10.399 -2.718 2.351
315 HA ALA 107 HA ALA 107 11.718 -0.437 3.237
316 HB1 ALA 107 1HB ALA 107 12.740 -2.266 1.977
317 HB2 ALA 107 2HB ALA 107 13.089 -0.706 1.235
318 HB3 ALA 107 3HB ALA 107 11.847 -1.774 0.546
319 H TYR 108 H TYR 108 9.530 -0.921 0.493
320 HA TYR 108 HA TYR 108 9.559 1.587 -0.632
321 HB2 TYR 108 2HB TYR 108 8.375 -0.210 -1.718
322 HB3 TYR 108 1HB TYR 108 7.256 -0.343 -0.368
323 HD1 TYR 108 1HD TYR 108 5.349 1.104 -0.204
324 HD2 TYR 108 2HD TYR 108 8.252 1.762 -3.237
325 HE1 TYR 108 1HE TYR 108 3.842 2.702 -1.291
326 HE2 TYR 108 2HE TYR 108 6.760 3.348 -4.333
327 HH TYR 108 HH TYR 108 4.415 3.892 -4.423
328 H HIS 109 H HIS 109 7.358 0.403 1.902
329 HA HIS 109 HA HIS 109 6.280 2.995 2.145
330 HB2 HIS 109 2HB HIS 109 5.862 0.512 3.762
331 HB3 HIS 109 1HB HIS 109 5.192 2.059 4.289
332 HD1 HIS 109 1HD HIS 109 3.468 3.205 2.619
333 HD2 HIS 109 2HD HIS 109 4.486 -0.719 1.727
334 HE1 HIS 109 1HE HIS 109 1.776 2.422 0.960
335 H ALA 110 H ALA 110 8.994 1.511 3.560
336 HA ALA 110 HA ALA 110 9.216 3.336 5.751
337 HB1 ALA 110 1HB ALA 110 10.236 1.105 5.838
338 HB2 ALA 110 2HB ALA 110 11.451 2.370 6.045
339 HB3 ALA 110 3HB ALA 110 11.292 1.541 4.499
340 H ALA 111 H ALA 111 10.017 3.460 2.343
341 HA ALA 111 HA ALA 111 11.872 5.688 2.799
342 HB1 ALA 111 1HB ALA 111 12.620 3.862 1.357
343 HB2 ALA 111 2HB ALA 111 12.387 5.350 0.418
344 HB3 ALA 111 3HB ALA 111 11.176 4.076 0.369
345 H THR 112 H THR 112 8.968 4.682 1.225
346 HA THR 112 HA THR 112 8.446 7.344 0.283
347 HB THR 112 HB THR 112 7.893 4.580 -0.841
348 HG1 THR 112 1HG THR 112 9.637 4.904 -1.749
349 HG21 THR 112 1HG2 THR 112 6.048 5.973 -1.198
350 HG22 THR 112 2HG2 THR 112 6.960 5.719 -2.715
351 HG23 THR 112 3HG2 THR 112 7.084 7.278 -1.819
Start of MODEL 6
1 H MET 65 1HT MET 65 1.574 14.273 -16.315
2 HA MET 65 HA MET 65 4.246 13.107 -15.776
3 HB2 MET 65 2HB MET 65 5.160 15.282 -16.235
4 HB3 MET 65 1HB MET 65 4.153 14.846 -17.603
5 HG2 MET 65 2HG MET 65 3.377 16.723 -15.375
6 HG3 MET 65 1HG MET 65 3.918 17.198 -16.981
7 HE1 MET 65 1HE MET 65 0.091 18.128 -16.954
8 HE2 MET 65 2HE MET 65 1.740 18.739 -17.131
9 HE3 MET 65 3HE MET 65 1.171 18.182 -15.560
10 H SER 66 H SER 66 1.392 14.254 -14.338
11 HA SER 66 HA SER 66 2.920 15.240 -12.095
12 HB2 SER 66 2HB SER 66 1.677 17.007 -13.327
13 HB3 SER 66 1HB SER 66 0.187 16.121 -13.032
14 HG SER 66 HG SER 66 1.746 16.685 -10.820
15 H GLY 67 H GLY 67 2.932 13.502 -10.829
16 HA2 GLY 67 2HA GLY 67 0.355 12.249 -10.196
17 HA3 GLY 67 1HA GLY 67 1.891 11.385 -10.204
18 H SER 68 H SER 68 0.049 13.852 -8.596
19 HA SER 68 HA SER 68 1.394 13.131 -6.114
20 HB2 SER 68 2HB SER 68 1.245 16.006 -7.064
21 HB3 SER 68 1HB SER 68 1.862 15.469 -5.498
22 HG SER 68 HG SER 68 3.074 14.040 -7.304
23 H GLY 69 H GLY 69 -1.372 13.498 -7.710
24 HA2 GLY 69 2HA GLY 69 -3.492 13.257 -6.820
25 HA3 GLY 69 1HA GLY 69 -2.890 13.839 -5.272
26 H ARG 70 H ARG 70 -4.326 14.700 -8.269
27 HA ARG 70 HA ARG 70 -4.403 17.510 -7.378
28 HB2 ARG 70 2HB ARG 70 -4.764 16.473 -10.186
29 HB3 ARG 70 1HB ARG 70 -4.931 18.144 -9.681
30 HG2 ARG 70 2HG ARG 70 -2.517 17.889 -8.824
31 HG3 ARG 70 1HG ARG 70 -2.470 16.472 -9.875
32 HD2 ARG 70 2HD ARG 70 -3.190 17.870 -11.749
33 HD3 ARG 70 1HD ARG 70 -3.195 19.247 -10.631
34 HE ARG 70 HE ARG 70 -0.726 17.729 -11.135
35 HH11 ARG 70 1HH1 ARG 70 -2.397 20.851 -11.198
36 HH12 ARG 70 2HH1 ARG 70 -0.984 21.749 -11.541
37 HH21 ARG 70 1HH2 ARG 70 1.124 18.903 -11.543
38 HH22 ARG 70 2HH2 ARG 70 1.121 20.612 -11.719
39 H GLY 71 H GLY 71 -6.358 15.219 -9.286
40 HA2 GLY 71 2HA GLY 71 -8.796 16.588 -8.799
41 HA3 GLY 71 1HA GLY 71 -8.626 14.959 -9.444
42 H ARG 72 H ARG 72 -7.156 13.917 -7.299
43 HA ARG 72 HA ARG 72 -8.846 14.120 -4.916
44 HB2 ARG 72 2HB ARG 72 -8.057 11.507 -6.222
45 HB3 ARG 72 1HB ARG 72 -8.910 11.686 -4.711
46 HG2 ARG 72 2HG ARG 72 -10.854 12.535 -5.920
47 HG3 ARG 72 1HG ARG 72 -9.975 12.352 -7.447
48 HD2 ARG 72 2HD ARG 72 -9.630 9.956 -6.884
49 HD3 ARG 72 1HD ARG 72 -10.663 10.194 -5.481
50 HE ARG 72 HE ARG 72 -12.053 11.039 -7.719
51 HH11 ARG 72 1HH1 ARG 72 -10.845 8.057 -6.237
52 HH12 ARG 72 2HH1 ARG 72 -11.937 7.042 -7.058
53 HH21 ARG 72 1HH2 ARG 72 -13.539 9.626 -8.866
54 HH22 ARG 72 2HH2 ARG 72 -13.494 7.937 -8.562
55 H GLY 73 H GLY 73 -7.662 12.488 -3.301
56 HA2 GLY 73 2HA GLY 73 -4.797 13.025 -3.461
57 HA3 GLY 73 1HA GLY 73 -5.663 12.414 -2.050
58 H ALA 74 H ALA 74 -5.620 11.372 -5.378
59 HA ALA 74 HA ALA 74 -5.064 8.604 -4.520
60 HB1 ALA 74 1HB ALA 74 -7.245 8.947 -5.609
61 HB2 ALA 74 2HB ALA 74 -6.177 7.946 -6.590
62 HB3 ALA 74 3HB ALA 74 -6.424 9.639 -7.007
63 H ILE 75 H ILE 75 -3.897 7.335 -6.143
64 HA ILE 75 HA ILE 75 -1.533 8.840 -6.868
65 HB ILE 75 HB ILE 75 -1.996 5.836 -6.832
66 HG12 ILE 75 2HG1 ILE 75 -0.646 7.547 -4.748
67 HG13 ILE 75 1HG1 ILE 75 -2.328 7.051 -4.653
68 HG21 ILE 75 1HG2 ILE 75 -0.069 6.560 -8.214
69 HG22 ILE 75 2HG2 ILE 75 0.462 5.700 -6.767
70 HG23 ILE 75 3HG2 ILE 75 0.573 7.457 -6.835
71 HD11 ILE 75 1HD1 ILE 75 -0.898 5.656 -3.284
72 HD12 ILE 75 2HD1 ILE 75 0.056 5.209 -4.708
73 HD13 ILE 75 3HD1 ILE 75 -1.647 4.734 -4.582
74 H ASP 76 H ASP 76 -0.848 8.995 -8.942
75 HA ASP 76 HA ASP 76 -2.748 8.895 -11.012
76 HB2 ASP 76 2HB ASP 76 -0.791 10.414 -11.059
77 HB3 ASP 76 1HB ASP 76 0.266 9.028 -11.310
78 H ARG 77 H ARG 77 -0.054 6.770 -10.294
79 HA ARG 77 HA ARG 77 -1.170 4.791 -12.157
80 HB2 ARG 77 2HB ARG 77 1.572 5.093 -10.942
81 HB3 ARG 77 1HB ARG 77 1.037 3.526 -11.516
82 HG2 ARG 77 2HG ARG 77 2.369 4.532 -13.210
83 HG3 ARG 77 1HG ARG 77 0.701 4.537 -13.765
84 HD2 ARG 77 2HD ARG 77 1.770 6.625 -14.318
85 HD3 ARG 77 1HD ARG 77 0.529 6.898 -13.097
86 HE ARG 77 HE ARG 77 2.194 7.285 -11.495
87 HH11 ARG 77 1HH1 ARG 77 3.657 6.609 -14.682
88 HH12 ARG 77 2HH1 ARG 77 5.094 7.421 -14.317
89 HH21 ARG 77 1HH2 ARG 77 4.162 8.403 -11.051
90 HH22 ARG 77 2HH2 ARG 77 5.404 8.475 -12.225
91 H GLU 78 H GLU 78 -0.656 2.457 -11.187
92 HA GLU 78 HA GLU 78 -2.260 2.128 -8.886
93 HB2 GLU 78 2HB GLU 78 -1.192 0.458 -10.860
94 HB3 GLU 78 1HB GLU 78 -0.507 -0.117 -9.349
95 HG2 GLU 78 2HG GLU 78 -3.440 0.289 -9.854
96 HG3 GLU 78 1HG GLU 78 -2.594 -1.259 -9.957
97 H GLN 79 H GLN 79 -1.703 1.346 -6.861
98 HA GLN 79 HA GLN 79 0.462 2.476 -5.477
99 HB2 GLN 79 2HB GLN 79 -1.033 -0.077 -4.856
100 HB3 GLN 79 1HB GLN 79 -0.060 0.842 -3.719
101 HG2 GLN 79 2HG GLN 79 -1.619 2.645 -3.761
102 HG3 GLN 79 1HG GLN 79 -2.521 1.884 -5.073
103 HE21 GLN 79 1HE2 GLN 79 -4.389 1.823 -3.898
104 HE22 GLN 79 2HE2 GLN 79 -4.652 0.736 -2.580
105 H SER 80 H SER 80 -0.129 -0.740 -6.726
106 HA SER 80 HA SER 80 2.261 -2.028 -6.158
107 HB2 SER 80 2HB SER 80 0.518 -2.451 -8.583
108 HB3 SER 80 1HB SER 80 1.487 -3.648 -7.717
109 HG SER 80 HG SER 80 -1.008 -2.575 -7.103
110 H ALA 81 H ALA 81 1.313 -0.045 -8.916
111 HA ALA 81 HA ALA 81 3.598 -0.558 -10.491
112 HB1 ALA 81 1HB ALA 81 1.763 1.818 -10.550
113 HB2 ALA 81 2HB ALA 81 1.477 0.290 -11.381
114 HB3 ALA 81 3HB ALA 81 2.854 1.298 -11.838
115 H ALA 82 H ALA 82 2.715 2.018 -8.248
116 HA ALA 82 HA ALA 82 5.009 3.604 -8.575
117 HB1 ALA 82 1HB ALA 82 3.236 3.335 -6.152
118 HB2 ALA 82 2HB ALA 82 2.961 4.431 -7.506
119 HB3 ALA 82 3HB ALA 82 4.364 4.652 -6.456
120 H ILE 83 H ILE 83 4.295 0.918 -6.391
121 HA ILE 83 HA ILE 83 6.726 1.046 -4.944
122 HB ILE 83 HB ILE 83 4.964 -1.391 -5.444
123 HG12 ILE 83 2HG1 ILE 83 5.042 0.501 -3.077
124 HG13 ILE 83 1HG1 ILE 83 3.801 0.488 -4.320
125 HG21 ILE 83 1HG2 ILE 83 7.112 -0.929 -3.358
126 HG22 ILE 83 2HG2 ILE 83 7.212 -2.044 -4.720
127 HG23 ILE 83 3HG2 ILE 83 6.046 -2.331 -3.428
128 HD11 ILE 83 1HD1 ILE 83 3.041 -0.619 -2.298
129 HD12 ILE 83 2HD1 ILE 83 4.397 -1.745 -2.389
130 HD13 ILE 83 3HD1 ILE 83 3.147 -1.768 -3.633
131 H ARG 84 H ARG 84 5.763 -0.662 -7.878
132 HA ARG 84 HA ARG 84 8.178 -2.037 -8.257
133 HB2 ARG 84 2HB ARG 84 5.995 -1.226 -10.143
134 HB3 ARG 84 1HB ARG 84 7.412 -2.092 -10.711
135 HG2 ARG 84 2HG ARG 84 6.920 -3.917 -9.167
136 HG3 ARG 84 1HG ARG 84 5.519 -3.033 -8.569
137 HD2 ARG 84 2HD ARG 84 4.845 -4.733 -10.137
138 HD3 ARG 84 1HD ARG 84 4.519 -3.123 -10.777
139 HE ARG 84 HE ARG 84 6.995 -3.801 -11.723
140 HH11 ARG 84 1HH1 ARG 84 3.807 -5.352 -11.955
141 HH12 ARG 84 2HH1 ARG 84 4.012 -5.867 -13.557
142 HH21 ARG 84 1HH2 ARG 84 7.289 -4.601 -13.962
143 HH22 ARG 84 2HH2 ARG 84 6.016 -5.430 -14.721
144 H GLU 85 H GLU 85 7.115 1.148 -9.322
145 HA GLU 85 HA GLU 85 9.415 1.821 -10.776
146 HB2 GLU 85 2HB GLU 85 7.540 3.548 -9.196
147 HB3 GLU 85 1HB GLU 85 8.810 4.187 -10.232
148 HG2 GLU 85 2HG GLU 85 7.756 3.035 -12.134
149 HG3 GLU 85 1HG GLU 85 6.454 2.528 -11.058
150 H TRP 86 H TRP 86 8.633 2.189 -7.329
151 HA TRP 86 HA TRP 86 10.898 3.611 -6.553
152 HB2 TRP 86 2HB TRP 86 8.866 3.432 -5.213
153 HB3 TRP 86 1HB TRP 86 9.075 1.694 -5.083
154 HD1 TRP 86 HD TRP 86 10.146 4.971 -3.513
155 HE1 TRP 86 1HE TRP 86 11.542 4.505 -1.461
156 HE3 TRP 86 3HE TRP 86 10.689 -0.008 -4.125
157 HZ2 TRP 86 2HZ TRP 86 12.764 2.249 -0.199
158 HZ3 TRP 86 3HZ TRP 86 11.997 -1.298 -2.423
159 HH2 TRP 86 HH TRP 86 13.000 -0.172 -0.518
160 H ALA 87 H ALA 87 10.116 0.183 -6.660
161 HA ALA 87 HA ALA 87 12.434 -0.943 -5.667
162 HB1 ALA 87 1HB ALA 87 11.772 -2.938 -7.021
163 HB2 ALA 87 2HB ALA 87 10.598 -1.930 -7.856
164 HB3 ALA 87 3HB ALA 87 10.427 -2.231 -6.131
165 H ARG 88 H ARG 88 11.611 -0.153 -8.988
166 HA ARG 88 HA ARG 88 14.048 -0.917 -10.147
167 HB2 ARG 88 2HB ARG 88 11.902 0.933 -11.069
168 HB3 ARG 88 1HB ARG 88 13.347 0.625 -12.029
169 HG2 ARG 88 2HG ARG 88 12.839 -1.799 -11.921
170 HG3 ARG 88 1HG ARG 88 11.333 -1.400 -11.091
171 HD2 ARG 88 2HD ARG 88 12.123 -0.250 -13.689
172 HD3 ARG 88 1HD ARG 88 11.249 -1.784 -13.588
173 HE ARG 88 HE ARG 88 9.493 -0.500 -12.393
174 HH11 ARG 88 1HH1 ARG 88 11.644 1.297 -14.595
175 HH12 ARG 88 2HH1 ARG 88 10.463 2.437 -15.019
176 HH21 ARG 88 1HH2 ARG 88 7.832 1.092 -13.103
177 HH22 ARG 88 2HH2 ARG 88 8.275 2.317 -14.181
178 H ARG 89 H ARG 89 13.010 2.162 -8.828
179 HA ARG 89 HA ARG 89 15.272 3.682 -9.626
180 HB2 ARG 89 2HB ARG 89 13.453 4.076 -7.246
181 HB3 ARG 89 1HB ARG 89 14.604 5.250 -7.847
182 HG2 ARG 89 2HG ARG 89 12.205 4.219 -9.345
183 HG3 ARG 89 1HG ARG 89 12.314 5.761 -8.506
184 HD2 ARG 89 2HD ARG 89 14.162 6.406 -10.003
185 HD3 ARG 89 1HD ARG 89 13.954 4.887 -10.876
186 HE ARG 89 HE ARG 89 11.561 5.733 -11.183
187 HH11 ARG 89 1HH1 ARG 89 14.389 7.875 -11.121
188 HH12 ARG 89 2HH1 ARG 89 13.680 9.050 -12.109
189 HH21 ARG 89 1HH2 ARG 89 10.619 7.334 -12.518
190 HH22 ARG 89 2HH2 ARG 89 11.487 8.754 -12.914
191 H ASN 90 H ASN 90 14.588 1.711 -6.831
192 HA ASN 90 HA ASN 90 17.059 2.501 -5.511
193 HB2 ASN 90 2HB ASN 90 14.662 0.940 -4.688
194 HB3 ASN 90 1HB ASN 90 16.126 0.895 -3.695
195 HD21 ASN 90 1HD2 ASN 90 13.492 2.809 -4.882
196 HD22 ASN 90 2HD2 ASN 90 13.661 4.133 -3.800
197 H GLY 91 H GLY 91 16.099 0.071 -7.606
198 HA2 GLY 91 2HA GLY 91 17.715 -1.309 -8.643
199 HA3 GLY 91 1HA GLY 91 18.718 -1.177 -7.210
200 H HIS 92 H HIS 92 15.314 -1.980 -7.068
201 HA HIS 92 HA HIS 92 16.038 -4.633 -6.124
202 HB2 HIS 92 2HB HIS 92 13.429 -3.105 -6.014
203 HB3 HIS 92 1HB HIS 92 13.670 -4.720 -5.370
204 HD1 HIS 92 1HD HIS 92 14.601 -4.818 -2.926
205 HD2 HIS 92 2HD HIS 92 14.691 -1.041 -4.637
206 HE1 HIS 92 1HE HIS 92 15.116 -3.233 -1.068
207 H ASN 93 H ASN 93 15.801 -6.234 -7.513
208 HA ASN 93 HA ASN 93 14.642 -5.681 -10.077
209 HB2 ASN 93 2HB ASN 93 16.074 -8.121 -9.029
210 HB3 ASN 93 1HB ASN 93 15.401 -8.017 -10.655
211 HD21 ASN 93 1HD2 ASN 93 17.909 -6.946 -8.515
212 HD22 ASN 93 2HD2 ASN 93 18.876 -6.171 -9.701
213 H VAL 94 H VAL 94 12.558 -5.364 -9.371
214 HA VAL 94 HA VAL 94 11.112 -7.802 -8.696
215 HB VAL 94 HB VAL 94 10.125 -4.928 -8.617
216 HG11 VAL 94 1HG1 VAL 94 8.298 -6.490 -9.036
217 HG12 VAL 94 2HG1 VAL 94 8.180 -5.837 -7.403
218 HG13 VAL 94 3HG1 VAL 94 8.796 -7.469 -7.660
219 HG21 VAL 94 1HG2 VAL 94 11.801 -5.361 -6.900
220 HG22 VAL 94 2HG2 VAL 94 10.906 -6.782 -6.368
221 HG23 VAL 94 3HG2 VAL 94 10.203 -5.178 -6.171
222 H SER 95 H SER 95 10.930 -8.801 -10.545
223 HA SER 95 HA SER 95 8.929 -8.310 -12.348
224 HB2 SER 95 2HB SER 95 10.385 -6.388 -13.127
225 HB3 SER 95 1HB SER 95 11.606 -7.570 -13.591
226 HG SER 95 HG SER 95 9.025 -7.965 -14.509
227 H THR 96 H THR 96 11.880 -9.866 -11.379
228 HA THR 96 HA THR 96 12.105 -11.823 -13.330
229 HB THR 96 HB THR 96 13.209 -13.005 -11.248
230 HG1 THR 96 1HG THR 96 12.620 -11.802 -9.540
231 HG21 THR 96 1HG2 THR 96 14.246 -10.419 -12.427
232 HG22 THR 96 2HG2 THR 96 14.424 -12.027 -13.137
233 HG23 THR 96 3HG2 THR 96 15.228 -11.640 -11.611
234 H ARG 97 H ARG 97 10.152 -11.541 -10.475
235 HA ARG 97 HA ARG 97 8.659 -13.867 -11.323
236 HB2 ARG 97 2HB ARG 97 9.353 -13.163 -8.432
237 HB3 ARG 97 1HB ARG 97 8.327 -14.513 -8.924
238 HG2 ARG 97 2HG ARG 97 10.217 -15.536 -10.103
239 HG3 ARG 97 1HG ARG 97 11.238 -14.186 -9.637
240 HD2 ARG 97 2HD ARG 97 11.712 -16.050 -8.213
241 HD3 ARG 97 1HD ARG 97 10.887 -14.822 -7.266
242 HE ARG 97 HE ARG 97 8.876 -16.147 -7.456
243 HH11 ARG 97 1HH1 ARG 97 11.897 -17.844 -8.242
244 HH12 ARG 97 2HH1 ARG 97 11.297 -19.380 -7.839
245 HH21 ARG 97 1HH2 ARG 97 8.080 -18.242 -6.907
246 HH22 ARG 97 2HH2 ARG 97 9.076 -19.624 -7.078
247 H GLY 98 H GLY 98 6.466 -13.433 -11.353
248 HA2 GLY 98 2HA GLY 98 5.862 -10.687 -11.717
249 HA3 GLY 98 1HA GLY 98 4.785 -12.025 -11.965
250 H ARG 99 H ARG 99 6.274 -10.906 -8.955
251 HA ARG 99 HA ARG 99 3.888 -9.518 -8.145
252 HB2 ARG 99 2HB ARG 99 4.833 -11.886 -6.518
253 HB3 ARG 99 1HB ARG 99 3.806 -10.632 -5.869
254 HG2 ARG 99 2HG ARG 99 2.209 -11.302 -7.802
255 HG3 ARG 99 1HG ARG 99 3.173 -12.783 -7.837
256 HD2 ARG 99 2HD ARG 99 1.292 -13.139 -6.381
257 HD3 ARG 99 1HD ARG 99 2.751 -13.032 -5.390
258 HE ARG 99 HE ARG 99 1.504 -10.502 -5.715
259 HH11 ARG 99 1HH1 ARG 99 1.388 -13.435 -3.707
260 HH12 ARG 99 2HH1 ARG 99 0.491 -12.673 -2.465
261 HH21 ARG 99 1HH2 ARG 99 0.220 -9.521 -4.006
262 HH22 ARG 99 2HH2 ARG 99 -0.174 -10.453 -2.645
263 H ILE 100 H ILE 100 4.221 -8.352 -6.142
264 HA ILE 100 HA ILE 100 6.962 -7.440 -6.025
265 HB ILE 100 HB ILE 100 4.531 -6.291 -4.627
266 HG12 ILE 100 2HG1 ILE 100 5.781 -5.488 -7.263
267 HG13 ILE 100 1HG1 ILE 100 4.240 -6.319 -7.081
268 HG21 ILE 100 1HG2 ILE 100 6.708 -5.632 -3.679
269 HG22 ILE 100 2HG2 ILE 100 5.924 -4.265 -4.475
270 HG23 ILE 100 3HG2 ILE 100 7.248 -5.113 -5.275
271 HD11 ILE 100 1HD1 ILE 100 4.910 -3.588 -6.066
272 HD12 ILE 100 2HD1 ILE 100 3.350 -4.404 -5.883
273 HD13 ILE 100 3HD1 ILE 100 3.939 -3.960 -7.493
274 HA PRO 101 HA PRO 101 7.515 -9.971 -2.372
275 HB2 PRO 101 2HB PRO 101 9.935 -8.353 -1.981
276 HB3 PRO 101 1HB PRO 101 9.809 -10.097 -2.267
277 HG2 PRO 101 2HG PRO 101 10.772 -8.412 -4.113
278 HG3 PRO 101 1HG PRO 101 9.895 -9.896 -4.524
279 HD2 PRO 101 2HD PRO 101 8.959 -7.078 -4.637
280 HD3 PRO 101 1HD PRO 101 8.562 -8.475 -5.654
281 H ALA 102 H ALA 102 6.795 -9.634 -0.384
282 HA ALA 102 HA ALA 102 5.861 -7.212 0.606
283 HB1 ALA 102 1HB ALA 102 5.576 -8.377 2.719
284 HB2 ALA 102 2HB ALA 102 6.695 -9.636 2.196
285 HB3 ALA 102 3HB ALA 102 5.143 -9.445 1.384
286 H ASP 103 H ASP 103 9.004 -8.644 0.820
287 HA ASP 103 HA ASP 103 10.172 -7.005 2.788
288 HB2 ASP 103 2HB ASP 103 11.319 -8.979 2.020
289 HB3 ASP 103 1HB ASP 103 11.360 -8.367 0.372
290 H VAL 104 H VAL 104 9.724 -6.534 -0.678
291 HA VAL 104 HA VAL 104 11.185 -4.063 -0.752
292 HB VAL 104 HB VAL 104 9.357 -5.387 -2.806
293 HG11 VAL 104 1HG1 VAL 104 11.091 -2.940 -3.170
294 HG12 VAL 104 2HG1 VAL 104 9.330 -2.933 -3.104
295 HG13 VAL 104 3HG1 VAL 104 10.163 -3.751 -4.429
296 HG21 VAL 104 1HG2 VAL 104 11.490 -6.525 -2.391
297 HG22 VAL 104 2HG2 VAL 104 12.336 -5.007 -2.741
298 HG23 VAL 104 3HG2 VAL 104 11.422 -5.812 -4.007
299 H ILE 105 H ILE 105 7.862 -5.083 -0.508
300 HA ILE 105 HA ILE 105 6.634 -2.547 -0.740
301 HB ILE 105 HB ILE 105 5.689 -4.963 0.829
302 HG12 ILE 105 2HG1 ILE 105 4.990 -4.069 -1.978
303 HG13 ILE 105 1HG1 ILE 105 6.103 -5.373 -1.581
304 HG21 ILE 105 1HG2 ILE 105 3.441 -3.982 0.642
305 HG22 ILE 105 2HG2 ILE 105 4.134 -2.553 -0.141
306 HG23 ILE 105 3HG2 ILE 105 4.533 -2.912 1.529
307 HD11 ILE 105 1HD1 ILE 105 3.937 -6.215 -2.251
308 HD12 ILE 105 2HD1 ILE 105 3.159 -5.312 -0.945
309 HD13 ILE 105 3HD1 ILE 105 4.275 -6.629 -0.574
310 H ASP 106 H ASP 106 7.885 -4.330 2.037
311 HA ASP 106 HA ASP 106 7.037 -2.391 3.929
312 HB2 ASP 106 2HB ASP 106 7.448 -4.721 4.586
313 HB3 ASP 106 1HB ASP 106 9.159 -4.523 4.221
314 H ALA 107 H ALA 107 10.057 -3.037 2.245
315 HA ALA 107 HA ALA 107 11.611 -1.030 3.410
316 HB1 ALA 107 1HB ALA 107 12.500 -2.795 1.944
317 HB2 ALA 107 2HB ALA 107 12.995 -1.192 1.396
318 HB3 ALA 107 3HB ALA 107 11.687 -2.053 0.568
319 H TYR 108 H TYR 108 9.448 -0.983 0.635
320 HA TYR 108 HA TYR 108 9.659 1.617 -0.252
321 HB2 TYR 108 2HB TYR 108 8.315 -0.082 -1.409
322 HB3 TYR 108 1HB TYR 108 7.200 -0.137 -0.055
323 HD1 TYR 108 1HD TYR 108 5.499 1.601 0.224
324 HD2 TYR 108 2HD TYR 108 8.291 1.780 -2.965
325 HE1 TYR 108 1HE TYR 108 4.123 3.310 -0.877
326 HE2 TYR 108 2HE TYR 108 6.947 3.479 -4.070
327 HH TYR 108 HH TYR 108 4.476 5.146 -2.521
328 H HIS 109 H HIS 109 7.344 0.338 2.132
329 HA HIS 109 HA HIS 109 6.435 2.912 2.733
330 HB2 HIS 109 2HB HIS 109 5.929 0.277 4.058
331 HB3 HIS 109 1HB HIS 109 5.335 1.770 4.784
332 HD1 HIS 109 1HD HIS 109 3.660 3.199 3.248
333 HD2 HIS 109 2HD HIS 109 4.446 -0.669 1.959
334 HE1 HIS 109 1HE HIS 109 1.913 2.683 1.518
335 H ALA 110 H ALA 110 9.086 1.149 3.951
336 HA ALA 110 HA ALA 110 9.384 2.777 6.301
337 HB1 ALA 110 1HB ALA 110 11.487 1.584 6.631
338 HB2 ALA 110 2HB ALA 110 11.344 0.874 5.021
339 HB3 ALA 110 3HB ALA 110 10.174 0.459 6.272
340 H ALA 111 H ALA 111 10.295 3.078 2.951
341 HA ALA 111 HA ALA 111 12.389 5.048 3.608
342 HB1 ALA 111 1HB ALA 111 12.873 4.966 1.217
343 HB2 ALA 111 2HB ALA 111 11.481 3.917 0.979
344 HB3 ALA 111 3HB ALA 111 12.876 3.325 1.890
345 H THR 112 H THR 112 9.376 4.555 2.050
346 HA THR 112 HA THR 112 9.142 7.324 1.386
347 HB THR 112 HB THR 112 8.172 4.745 0.172
348 HG1 THR 112 1HG THR 112 10.197 6.512 -0.269
349 HG21 THR 112 1HG2 THR 112 7.165 6.090 -1.540
350 HG22 THR 112 2HG2 THR 112 7.558 7.565 -0.595
351 HG23 THR 112 3HG2 THR 112 6.433 6.333 0.056
Start of MODEL 7
1 H MET 65 1HT MET 65 10.719 19.947 -18.242
2 HA MET 65 HA MET 65 9.581 21.466 -16.842
3 HB2 MET 65 2HB MET 65 7.292 21.011 -16.078
4 HB3 MET 65 1HB MET 65 7.336 21.263 -17.813
5 HG2 MET 65 2HG MET 65 7.195 18.851 -18.176
6 HG3 MET 65 1HG MET 65 7.190 18.589 -16.436
7 HE1 MET 65 1HE MET 65 5.073 17.387 -18.466
8 HE2 MET 65 2HE MET 65 3.565 17.633 -17.586
9 HE3 MET 65 3HE MET 65 5.006 17.089 -16.729
10 H SER 66 H SER 66 9.691 17.932 -16.998
11 HA SER 66 HA SER 66 10.188 16.335 -15.595
12 HB2 SER 66 2HB SER 66 11.494 18.566 -14.014
13 HB3 SER 66 1HB SER 66 11.752 16.845 -13.705
14 HG SER 66 HG SER 66 12.114 17.240 -16.283
15 H GLY 67 H GLY 67 10.043 15.746 -13.008
16 HA2 GLY 67 2HA GLY 67 8.616 16.374 -11.076
17 HA3 GLY 67 1HA GLY 67 7.350 16.701 -12.256
18 H SER 68 H SER 68 9.661 14.056 -11.947
19 HA SER 68 HA SER 68 7.565 12.142 -12.433
20 HB2 SER 68 2HB SER 68 10.520 11.788 -11.973
21 HB3 SER 68 1HB SER 68 9.398 10.560 -12.564
22 HG SER 68 HG SER 68 8.895 12.184 -14.225
23 H GLY 69 H GLY 69 8.897 13.614 -9.719
24 HA2 GLY 69 2HA GLY 69 8.692 11.317 -7.975
25 HA3 GLY 69 1HA GLY 69 9.162 12.957 -7.516
26 H ARG 70 H ARG 70 6.451 11.053 -8.587
27 HA ARG 70 HA ARG 70 4.579 13.025 -7.654
28 HB2 ARG 70 2HB ARG 70 4.147 10.310 -8.882
29 HB3 ARG 70 1HB ARG 70 2.856 11.413 -8.424
30 HG2 ARG 70 2HG ARG 70 5.007 12.034 -10.448
31 HG3 ARG 70 1HG ARG 70 3.375 11.493 -10.838
32 HD2 ARG 70 2HD ARG 70 2.447 13.468 -9.776
33 HD3 ARG 70 1HD ARG 70 4.065 14.007 -9.320
34 HE ARG 70 HE ARG 70 4.182 13.660 -11.994
35 HH11 ARG 70 1HH1 ARG 70 2.095 15.588 -9.852
36 HH12 ARG 70 2HH1 ARG 70 1.944 16.889 -10.938
37 HH21 ARG 70 1HH2 ARG 70 3.893 15.417 -13.514
38 HH22 ARG 70 2HH2 ARG 70 2.949 16.777 -13.071
39 H GLY 71 H GLY 71 4.348 13.228 -5.603
40 HA2 GLY 71 2HA GLY 71 3.719 10.827 -4.054
41 HA3 GLY 71 1HA GLY 71 4.505 12.257 -3.362
42 H ARG 72 H ARG 72 1.603 10.781 -3.792
43 HA ARG 72 HA ARG 72 0.203 13.373 -3.857
44 HB2 ARG 72 2HB ARG 72 -0.927 10.724 -4.756
45 HB3 ARG 72 1HB ARG 72 -1.708 12.289 -4.869
46 HG2 ARG 72 2HG ARG 72 0.125 13.001 -6.423
47 HG3 ARG 72 1HG ARG 72 0.708 11.342 -6.396
48 HD2 ARG 72 2HD ARG 72 -1.523 10.591 -7.189
49 HD3 ARG 72 1HD ARG 72 -2.005 12.280 -7.323
50 HE ARG 72 HE ARG 72 -0.085 10.838 -8.966
51 HH11 ARG 72 1HH1 ARG 72 -1.717 13.935 -8.319
52 HH12 ARG 72 2HH1 ARG 72 -1.571 14.512 -9.912
53 HH21 ARG 72 1HH2 ARG 72 0.111 11.667 -11.187
54 HH22 ARG 72 2HH2 ARG 72 -0.510 13.204 -11.569
55 H GLY 73 H GLY 73 -0.075 10.057 -2.645
56 HA2 GLY 73 2HA GLY 73 -0.656 9.601 -0.367
57 HA3 GLY 73 1HA GLY 73 -1.570 11.115 -0.342
58 H ALA 74 H ALA 74 -2.954 11.044 -2.601
59 HA ALA 74 HA ALA 74 -4.892 8.903 -2.253
60 HB1 ALA 74 1HB ALA 74 -6.157 10.090 -3.987
61 HB2 ALA 74 2HB ALA 74 -4.806 11.202 -4.223
62 HB3 ALA 74 3HB ALA 74 -5.689 11.194 -2.694
63 H ILE 75 H ILE 75 -5.701 7.908 -4.336
64 HA ILE 75 HA ILE 75 -3.315 6.784 -5.573
65 HB ILE 75 HB ILE 75 -6.060 5.638 -5.191
66 HG12 ILE 75 2HG1 ILE 75 -3.432 4.965 -3.859
67 HG13 ILE 75 1HG1 ILE 75 -4.723 5.911 -3.138
68 HG21 ILE 75 1HG2 ILE 75 -5.039 4.743 -7.226
69 HG22 ILE 75 2HG2 ILE 75 -5.080 3.500 -5.973
70 HG23 ILE 75 3HG2 ILE 75 -3.573 4.342 -6.332
71 HD11 ILE 75 1HD1 ILE 75 -4.852 3.035 -3.951
72 HD12 ILE 75 2HD1 ILE 75 -6.177 3.985 -3.233
73 HD13 ILE 75 3HD1 ILE 75 -4.703 3.677 -2.309
74 H ASP 76 H ASP 76 -2.954 7.404 -7.438
75 HA ASP 76 HA ASP 76 -5.113 7.938 -9.392
76 HB2 ASP 76 2HB ASP 76 -3.748 9.951 -9.040
77 HB3 ASP 76 1HB ASP 76 -2.274 9.028 -9.337
78 H ARG 77 H ARG 77 -1.890 6.703 -8.899
79 HA ARG 77 HA ARG 77 -2.209 4.858 -11.155
80 HB2 ARG 77 2HB ARG 77 0.272 5.677 -9.614
81 HB3 ARG 77 1HB ARG 77 0.238 4.569 -10.972
82 HG2 ARG 77 2HG ARG 77 -0.491 7.486 -11.075
83 HG3 ARG 77 1HG ARG 77 1.046 6.783 -11.591
84 HD2 ARG 77 2HD ARG 77 -1.668 6.164 -12.772
85 HD3 ARG 77 1HD ARG 77 -0.461 7.230 -13.487
86 HE ARG 77 HE ARG 77 0.495 4.577 -12.944
87 HH11 ARG 77 1HH1 ARG 77 -1.201 6.557 -15.333
88 HH12 ARG 77 2HH1 ARG 77 -0.777 5.579 -16.649
89 HH21 ARG 77 1HH2 ARG 77 1.086 3.232 -14.774
90 HH22 ARG 77 2HH2 ARG 77 0.570 3.670 -16.331
91 H GLU 78 H GLU 78 -1.144 2.701 -10.604
92 HA GLU 78 HA GLU 78 -2.435 1.707 -8.274
93 HB2 GLU 78 2HB GLU 78 -1.439 0.596 -10.631
94 HB3 GLU 78 1HB GLU 78 -0.494 -0.128 -9.336
95 HG2 GLU 78 2HG GLU 78 -3.494 -0.085 -9.513
96 HG3 GLU 78 1HG GLU 78 -2.438 -1.463 -9.852
97 H GLN 79 H GLN 79 -1.612 1.019 -6.364
98 HA GLN 79 HA GLN 79 0.686 2.317 -5.428
99 HB2 GLN 79 2HB GLN 79 -0.648 -0.084 -4.167
100 HB3 GLN 79 1HB GLN 79 0.473 1.004 -3.383
101 HG2 GLN 79 2HG GLN 79 -1.214 2.842 -3.796
102 HG3 GLN 79 1HG GLN 79 -2.346 1.563 -4.245
103 HE21 GLN 79 1HE2 GLN 79 -3.705 1.906 -2.489
104 HE22 GLN 79 2HE2 GLN 79 -3.231 1.512 -0.869
105 H SER 80 H SER 80 0.010 -0.947 -6.605
106 HA SER 80 HA SER 80 2.448 -2.163 -5.950
107 HB2 SER 80 2HB SER 80 0.714 -2.742 -8.349
108 HB3 SER 80 1HB SER 80 1.793 -3.866 -7.516
109 HG SER 80 HG SER 80 -0.682 -2.851 -6.836
110 H ALA 81 H ALA 81 1.392 -0.257 -8.708
111 HA ALA 81 HA ALA 81 3.660 -0.680 -10.331
112 HB1 ALA 81 1HB ALA 81 1.549 0.177 -11.237
113 HB2 ALA 81 2HB ALA 81 2.890 1.270 -11.593
114 HB3 ALA 81 3HB ALA 81 1.754 1.658 -10.301
115 H ALA 82 H ALA 82 2.748 1.858 -8.043
116 HA ALA 82 HA ALA 82 5.008 3.462 -8.306
117 HB1 ALA 82 1HB ALA 82 2.969 4.162 -7.131
118 HB2 ALA 82 2HB ALA 82 4.402 4.385 -6.128
119 HB3 ALA 82 3HB ALA 82 3.327 3.018 -5.838
120 H ILE 83 H ILE 83 4.425 0.700 -6.153
121 HA ILE 83 HA ILE 83 6.891 0.803 -4.796
122 HB ILE 83 HB ILE 83 5.243 -1.686 -5.400
123 HG12 ILE 83 2HG1 ILE 83 5.193 0.119 -2.967
124 HG13 ILE 83 1HG1 ILE 83 3.972 0.101 -4.232
125 HG21 ILE 83 1HG2 ILE 83 7.517 -2.229 -4.668
126 HG22 ILE 83 2HG2 ILE 83 6.352 -2.634 -3.407
127 HG23 ILE 83 3HG2 ILE 83 7.331 -1.173 -3.266
128 HD11 ILE 83 1HD1 ILE 83 3.406 -2.202 -3.650
129 HD12 ILE 83 2HD1 ILE 83 3.240 -1.119 -2.263
130 HD13 ILE 83 3HD1 ILE 83 4.642 -2.181 -2.391
131 H ARG 84 H ARG 84 5.942 -0.835 -7.771
132 HA ARG 84 HA ARG 84 8.330 -2.219 -8.308
133 HB2 ARG 84 2HB ARG 84 6.200 -1.126 -10.120
134 HB3 ARG 84 1HB ARG 84 7.584 -2.034 -10.710
135 HG2 ARG 84 2HG ARG 84 6.913 -3.980 -9.570
136 HG3 ARG 84 1HG ARG 84 5.704 -3.094 -8.639
137 HD2 ARG 84 2HD ARG 84 4.745 -4.425 -10.470
138 HD3 ARG 84 1HD ARG 84 4.408 -2.697 -10.586
139 HE ARG 84 HE ARG 84 6.684 -3.193 -12.087
140 HH11 ARG 84 1HH1 ARG 84 3.260 -4.085 -12.184
141 HH12 ARG 84 2HH1 ARG 84 3.177 -4.229 -13.872
142 HH21 ARG 84 1HH2 ARG 84 6.597 -3.413 -14.425
143 HH22 ARG 84 2HH2 ARG 84 5.152 -3.874 -15.184
144 H GLU 85 H GLU 85 7.206 0.967 -9.296
145 HA GLU 85 HA GLU 85 9.410 1.725 -10.821
146 HB2 GLU 85 2HB GLU 85 7.539 3.437 -9.193
147 HB3 GLU 85 1HB GLU 85 8.623 4.042 -10.445
148 HG2 GLU 85 2HG GLU 85 6.317 2.142 -10.838
149 HG3 GLU 85 1HG GLU 85 6.323 3.856 -11.236
150 H TRP 86 H TRP 86 8.672 2.256 -7.357
151 HA TRP 86 HA TRP 86 10.918 3.775 -6.728
152 HB2 TRP 86 2HB TRP 86 8.958 3.666 -5.298
153 HB3 TRP 86 1HB TRP 86 9.169 1.939 -5.077
154 HD1 TRP 86 HD TRP 86 10.361 5.293 -3.742
155 HE1 TRP 86 1HE TRP 86 11.815 4.897 -1.661
156 HE3 TRP 86 3HE TRP 86 10.729 0.272 -4.030
157 HZ2 TRP 86 2HZ TRP 86 12.968 2.703 -0.299
158 HZ3 TRP 86 3HZ TRP 86 12.031 -0.952 -2.278
159 HH2 TRP 86 HH TRP 86 13.115 0.260 -0.465
160 H ALA 87 H ALA 87 10.292 0.312 -6.637
161 HA ALA 87 HA ALA 87 12.679 -0.579 -5.517
162 HB1 ALA 87 1HB ALA 87 10.683 -1.997 -5.878
163 HB2 ALA 87 2HB ALA 87 12.129 -2.747 -6.551
164 HB3 ALA 87 3HB ALA 87 10.982 -1.977 -7.607
165 H ARG 88 H ARG 88 11.822 -0.057 -8.861
166 HA ARG 88 HA ARG 88 14.389 -0.863 -9.752
167 HB2 ARG 88 2HB ARG 88 12.060 0.312 -11.182
168 HB3 ARG 88 1HB ARG 88 13.589 -0.051 -11.986
169 HG2 ARG 88 2HG ARG 88 13.430 -2.366 -11.161
170 HG3 ARG 88 1HG ARG 88 11.842 -1.985 -10.498
171 HD2 ARG 88 2HD ARG 88 11.011 -1.496 -12.676
172 HD3 ARG 88 1HD ARG 88 12.651 -1.697 -13.327
173 HE ARG 88 HE ARG 88 12.324 -4.046 -12.233
174 HH11 ARG 88 1HH1 ARG 88 9.930 -2.300 -14.154
175 HH12 ARG 88 2HH1 ARG 88 9.288 -3.689 -14.881
176 HH21 ARG 88 1HH2 ARG 88 11.440 -5.990 -13.254
177 HH22 ARG 88 2HH2 ARG 88 10.152 -5.838 -14.348
178 H ARG 89 H ARG 89 13.032 2.193 -8.865
179 HA ARG 89 HA ARG 89 15.106 3.780 -10.036
180 HB2 ARG 89 2HB ARG 89 13.464 4.420 -7.569
181 HB3 ARG 89 1HB ARG 89 14.456 5.560 -8.451
182 HG2 ARG 89 2HG ARG 89 11.928 4.231 -9.401
183 HG3 ARG 89 1HG ARG 89 12.134 5.918 -8.949
184 HD2 ARG 89 2HD ARG 89 13.686 6.210 -10.832
185 HD3 ARG 89 1HD ARG 89 13.419 4.522 -11.284
186 HE ARG 89 HE ARG 89 11.256 6.494 -11.155
187 HH11 ARG 89 1HH1 ARG 89 13.043 4.077 -13.014
188 HH12 ARG 89 2HH1 ARG 89 11.880 3.914 -14.237
189 HH21 ARG 89 1HH2 ARG 89 9.625 6.268 -12.891
190 HH22 ARG 89 2HH2 ARG 89 9.900 5.150 -14.145
191 H ASN 90 H ASN 90 14.683 2.078 -7.015
192 HA ASN 90 HA ASN 90 17.123 3.203 -5.940
193 HB2 ASN 90 2HB ASN 90 14.938 1.545 -4.785
194 HB3 ASN 90 1HB ASN 90 16.449 1.787 -3.897
195 HD21 ASN 90 1HD2 ASN 90 13.559 3.251 -5.127
196 HD22 ASN 90 2HD2 ASN 90 13.684 4.738 -4.273
197 H GLY 91 H GLY 91 16.186 0.260 -7.460
198 HA2 GLY 91 2HA GLY 91 18.015 -1.005 -8.447
199 HA3 GLY 91 1HA GLY 91 18.959 -0.641 -7.015
200 H HIS 92 H HIS 92 15.645 -1.617 -6.662
201 HA HIS 92 HA HIS 92 16.524 -4.107 -5.447
202 HB2 HIS 92 2HB HIS 92 13.819 -2.737 -5.501
203 HB3 HIS 92 1HB HIS 92 14.166 -4.242 -4.666
204 HD1 HIS 92 1HD HIS 92 15.061 -3.990 -2.245
205 HD2 HIS 92 2HD HIS 92 15.017 -0.461 -4.417
206 HE1 HIS 92 1HE HIS 92 15.559 -2.156 -0.593
207 H ASN 93 H ASN 93 15.770 -6.077 -6.247
208 HA ASN 93 HA ASN 93 14.900 -5.939 -9.014
209 HB2 ASN 93 2HB ASN 93 16.003 -8.244 -7.391
210 HB3 ASN 93 1HB ASN 93 15.395 -8.417 -9.029
211 HD21 ASN 93 1HD2 ASN 93 17.954 -7.214 -7.041
212 HD22 ASN 93 2HD2 ASN 93 19.059 -6.861 -8.309
213 H VAL 94 H VAL 94 12.867 -5.966 -9.359
214 HA VAL 94 HA VAL 94 11.020 -7.198 -7.501
215 HB VAL 94 HB VAL 94 10.395 -5.884 -10.182
216 HG11 VAL 94 1HG1 VAL 94 8.693 -6.255 -7.737
217 HG12 VAL 94 2HG1 VAL 94 8.593 -7.247 -9.192
218 HG13 VAL 94 3HG1 VAL 94 8.191 -5.521 -9.258
219 HG21 VAL 94 1HG2 VAL 94 10.511 -4.573 -7.480
220 HG22 VAL 94 2HG2 VAL 94 9.925 -3.837 -8.972
221 HG23 VAL 94 3HG2 VAL 94 11.619 -4.303 -8.825
222 H SER 95 H SER 95 9.740 -9.029 -8.092
223 HA SER 95 HA SER 95 11.152 -10.941 -9.559
224 HB2 SER 95 2HB SER 95 9.800 -11.548 -7.646
225 HB3 SER 95 1HB SER 95 8.346 -10.962 -8.447
226 HG SER 95 HG SER 95 9.079 -13.308 -8.409
227 H THR 96 H THR 96 11.109 -11.474 -11.635
228 HA THR 96 HA THR 96 9.605 -10.031 -13.540
229 HB THR 96 HB THR 96 10.932 -12.498 -14.421
230 HG1 THR 96 1HG THR 96 12.847 -12.161 -13.514
231 HG21 THR 96 1HG2 THR 96 11.461 -9.561 -14.961
232 HG22 THR 96 2HG2 THR 96 10.371 -10.586 -15.890
233 HG23 THR 96 3HG2 THR 96 12.099 -10.915 -15.891
234 H ARG 97 H ARG 97 8.923 -12.628 -11.566
235 HA ARG 97 HA ARG 97 7.200 -14.156 -13.289
236 HB2 ARG 97 2HB ARG 97 7.460 -14.053 -10.277
237 HB3 ARG 97 1HB ARG 97 6.480 -15.210 -11.162
238 HG2 ARG 97 2HG ARG 97 8.420 -16.196 -12.153
239 HG3 ARG 97 1HG ARG 97 9.459 -14.944 -11.471
240 HD2 ARG 97 2HD ARG 97 9.554 -17.070 -10.199
241 HD3 ARG 97 1HD ARG 97 8.995 -15.712 -9.236
242 HE ARG 97 HE ARG 97 6.749 -16.532 -9.502
243 HH11 ARG 97 1HH1 ARG 97 9.301 -18.884 -10.260
244 HH12 ARG 97 2HH1 ARG 97 8.338 -20.236 -9.847
245 HH21 ARG 97 1HH2 ARG 97 5.471 -18.380 -8.949
246 HH22 ARG 97 2HH2 ARG 97 6.122 -19.955 -9.112
247 H GLY 98 H GLY 98 7.015 -11.221 -11.611
248 HA2 GLY 98 2HA GLY 98 5.223 -9.712 -11.913
249 HA3 GLY 98 1HA GLY 98 4.151 -11.084 -12.162
250 H ARG 99 H ARG 99 6.451 -10.693 -9.555
251 HA ARG 99 HA ARG 99 4.234 -10.291 -7.709
252 HB2 ARG 99 2HB ARG 99 4.864 -12.661 -7.532
253 HB3 ARG 99 1HB ARG 99 6.556 -12.211 -7.323
254 HG2 ARG 99 2HG ARG 99 5.945 -11.032 -5.239
255 HG3 ARG 99 1HG ARG 99 4.293 -11.592 -5.430
256 HD2 ARG 99 2HD ARG 99 5.037 -13.904 -5.233
257 HD3 ARG 99 1HD ARG 99 6.716 -13.370 -5.114
258 HE ARG 99 HE ARG 99 4.930 -12.212 -3.179
259 HH11 ARG 99 1HH1 ARG 99 7.061 -14.967 -3.762
260 HH12 ARG 99 2HH1 ARG 99 7.460 -15.160 -2.104
261 HH21 ARG 99 1HH2 ARG 99 5.438 -12.509 -0.954
262 HH22 ARG 99 2HH2 ARG 99 6.481 -13.766 -0.480
263 H ILE 100 H ILE 100 4.654 -8.706 -6.284
264 HA ILE 100 HA ILE 100 7.289 -7.512 -6.403
265 HB ILE 100 HB ILE 100 4.836 -6.549 -4.898
266 HG12 ILE 100 2HG1 ILE 100 5.940 -5.695 -7.578
267 HG13 ILE 100 1HG1 ILE 100 4.472 -6.635 -7.334
268 HG21 ILE 100 1HG2 ILE 100 7.423 -5.151 -5.638
269 HG22 ILE 100 2HG2 ILE 100 6.980 -5.693 -4.020
270 HG23 ILE 100 3HG2 ILE 100 6.054 -4.411 -4.807
271 HD11 ILE 100 1HD1 ILE 100 4.979 -3.840 -6.397
272 HD12 ILE 100 2HD1 ILE 100 3.494 -4.760 -6.127
273 HD13 ILE 100 3HD1 ILE 100 3.979 -4.316 -7.771
274 HA PRO 101 HA PRO 101 8.259 -9.904 -2.751
275 HB2 PRO 101 2HB PRO 101 10.545 -8.062 -2.459
276 HB3 PRO 101 1HB PRO 101 10.565 -9.820 -2.711
277 HG2 PRO 101 2HG PRO 101 11.333 -8.133 -4.633
278 HG3 PRO 101 1HG PRO 101 10.503 -9.661 -4.980
279 HD2 PRO 101 2HD PRO 101 9.396 -6.889 -5.018
280 HD3 PRO 101 1HD PRO 101 9.060 -8.278 -6.075
281 H ALA 102 H ALA 102 7.546 -9.650 -0.765
282 HA ALA 102 HA ALA 102 6.352 -7.283 0.159
283 HB1 ALA 102 1HB ALA 102 6.049 -8.477 2.264
284 HB2 ALA 102 2HB ALA 102 7.205 -9.707 1.752
285 HB3 ALA 102 3HB ALA 102 5.673 -9.530 0.902
286 H ASP 103 H ASP 103 9.521 -8.589 0.515
287 HA ASP 103 HA ASP 103 10.570 -6.989 2.564
288 HB2 ASP 103 2HB ASP 103 11.967 -7.965 0.048
289 HB3 ASP 103 1HB ASP 103 12.774 -7.333 1.471
290 H VAL 104 H VAL 104 10.146 -6.386 -0.878
291 HA VAL 104 HA VAL 104 11.462 -3.841 -0.825
292 HB VAL 104 HB VAL 104 9.790 -5.233 -2.956
293 HG11 VAL 104 1HG1 VAL 104 10.472 -3.500 -4.505
294 HG12 VAL 104 2HG1 VAL 104 11.334 -2.648 -3.227
295 HG13 VAL 104 3HG1 VAL 104 9.572 -2.769 -3.173
296 HG21 VAL 104 1HG2 VAL 104 12.727 -4.607 -2.799
297 HG22 VAL 104 2HG2 VAL 104 11.920 -5.450 -4.118
298 HG23 VAL 104 3HG2 VAL 104 12.004 -6.192 -2.512
299 H ILE 105 H ILE 105 8.188 -5.058 -0.767
300 HA ILE 105 HA ILE 105 6.808 -2.612 -0.907
301 HB ILE 105 HB ILE 105 6.001 -5.119 0.604
302 HG12 ILE 105 2HG1 ILE 105 5.290 -4.233 -2.211
303 HG13 ILE 105 1HG1 ILE 105 6.480 -5.464 -1.812
304 HG21 ILE 105 1HG2 ILE 105 3.689 -4.273 0.382
305 HG22 ILE 105 2HG2 ILE 105 4.319 -2.782 -0.337
306 HG23 ILE 105 3HG2 ILE 105 4.705 -3.175 1.324
307 HD11 ILE 105 1HD1 ILE 105 4.393 -6.434 -2.554
308 HD12 ILE 105 2HD1 ILE 105 3.519 -5.629 -1.246
309 HD13 ILE 105 3HD1 ILE 105 4.721 -6.872 -0.884
310 H ASP 106 H ASP 106 8.143 -4.380 1.863
311 HA ASP 106 HA ASP 106 7.160 -2.605 3.835
312 HB2 ASP 106 2HB ASP 106 7.925 -4.867 4.428
313 HB3 ASP 106 1HB ASP 106 9.571 -4.435 3.968
314 H ALA 107 H ALA 107 10.279 -2.931 2.214
315 HA ALA 107 HA ALA 107 11.607 -0.806 3.390
316 HB1 ALA 107 1HB ALA 107 12.674 -2.489 1.979
317 HB2 ALA 107 2HB ALA 107 13.049 -0.861 1.410
318 HB3 ALA 107 3HB ALA 107 11.837 -1.841 0.573
319 H TYR 108 H TYR 108 9.546 -0.879 0.513
320 HA TYR 108 HA TYR 108 9.679 1.747 -0.321
321 HB2 TYR 108 2HB TYR 108 8.531 0.045 -1.626
322 HB3 TYR 108 1HB TYR 108 7.357 -0.174 -0.338
323 HD1 TYR 108 1HD TYR 108 5.382 1.167 -0.258
324 HD2 TYR 108 2HD TYR 108 8.515 2.208 -2.926
325 HE1 TYR 108 1HE TYR 108 3.900 2.793 -1.353
326 HE2 TYR 108 2HE TYR 108 7.058 3.830 -4.028
327 HH TYR 108 HH TYR 108 3.992 4.753 -2.731
328 H HIS 109 H HIS 109 7.211 0.341 1.841
329 HA HIS 109 HA HIS 109 6.153 2.869 2.385
330 HB2 HIS 109 2HB HIS 109 5.653 0.216 3.676
331 HB3 HIS 109 1HB HIS 109 4.925 1.693 4.305
332 HD1 HIS 109 1HD HIS 109 3.359 3.037 2.564
333 HD2 HIS 109 2HD HIS 109 4.406 -0.845 1.504
334 HE1 HIS 109 1HE HIS 109 1.864 2.423 0.663
335 H ALA 110 H ALA 110 8.775 1.248 3.761
336 HA ALA 110 HA ALA 110 8.795 2.799 6.180
337 HB1 ALA 110 1HB ALA 110 10.954 1.737 6.588
338 HB2 ALA 110 2HB ALA 110 10.924 1.057 4.960
339 HB3 ALA 110 3HB ALA 110 9.726 0.550 6.146
340 H ALA 111 H ALA 111 10.057 3.150 2.918
341 HA ALA 111 HA ALA 111 11.981 5.201 3.778
342 HB1 ALA 111 1HB ALA 111 11.419 4.024 1.084
343 HB2 ALA 111 2HB ALA 111 12.689 3.448 2.171
344 HB3 ALA 111 3HB ALA 111 12.768 5.082 1.484
345 H THR 112 H THR 112 9.019 4.651 2.211
346 HA THR 112 HA THR 112 8.747 7.417 1.495
347 HB THR 112 HB THR 112 8.351 4.889 -0.095
348 HG1 THR 112 1HG THR 112 10.314 6.355 0.063
349 HG21 THR 112 1HG2 THR 112 6.398 6.193 -0.326
350 HG22 THR 112 2HG2 THR 112 7.363 6.199 -1.821
351 HG23 THR 112 3HG2 THR 112 7.353 7.636 -0.742
Start of MODEL 8
1 H MET 65 1HT MET 65 6.939 12.226 -19.653
2 HA MET 65 HA MET 65 4.990 10.819 -17.959
3 HB2 MET 65 2HB MET 65 6.991 9.456 -18.383
4 HB3 MET 65 1HB MET 65 8.018 10.803 -17.910
5 HG2 MET 65 2HG MET 65 7.086 10.697 -15.641
6 HG3 MET 65 1HG MET 65 6.083 9.335 -16.134
7 HE1 MET 65 1HE MET 65 8.047 9.311 -13.605
8 HE2 MET 65 2HE MET 65 8.756 7.703 -13.766
9 HE3 MET 65 3HE MET 65 7.033 7.941 -14.064
10 H SER 66 H SER 66 4.274 12.083 -16.353
11 HA SER 66 HA SER 66 5.571 14.605 -15.877
12 HB2 SER 66 2HB SER 66 3.061 14.371 -15.967
13 HB3 SER 66 1HB SER 66 3.139 13.415 -14.493
14 HG SER 66 HG SER 66 4.420 15.689 -13.942
15 H GLY 67 H GLY 67 7.529 13.855 -15.078
16 HA2 GLY 67 2HA GLY 67 7.593 12.263 -12.626
17 HA3 GLY 67 1HA GLY 67 8.988 12.772 -13.573
18 H SER 68 H SER 68 7.353 15.426 -13.520
19 HA SER 68 HA SER 68 8.144 16.339 -10.874
20 HB2 SER 68 2HB SER 68 8.439 17.851 -13.486
21 HB3 SER 68 1HB SER 68 8.950 18.394 -11.884
22 HG SER 68 HG SER 68 10.106 16.187 -12.054
23 H GLY 69 H GLY 69 6.784 18.181 -10.191
24 HA2 GLY 69 2HA GLY 69 4.963 19.668 -11.123
25 HA3 GLY 69 1HA GLY 69 4.199 18.146 -11.565
26 H ARG 70 H ARG 70 5.477 19.960 -8.844
27 HA ARG 70 HA ARG 70 4.256 18.475 -6.793
28 HB2 ARG 70 2HB ARG 70 4.929 21.426 -6.822
29 HB3 ARG 70 1HB ARG 70 4.507 20.506 -5.387
30 HG2 ARG 70 2HG ARG 70 6.918 20.027 -7.134
31 HG3 ARG 70 1HG ARG 70 6.923 20.854 -5.579
32 HD2 ARG 70 2HD ARG 70 6.091 17.975 -6.011
33 HD3 ARG 70 1HD ARG 70 7.666 18.490 -5.438
34 HE ARG 70 HE ARG 70 5.528 19.508 -3.827
35 HH11 ARG 70 1HH1 ARG 70 7.507 16.614 -4.385
36 HH12 ARG 70 2HH1 ARG 70 7.438 16.093 -2.774
37 HH21 ARG 70 1HH2 ARG 70 5.430 18.761 -1.633
38 HH22 ARG 70 2HH2 ARG 70 6.241 17.318 -1.192
39 H GLY 71 H GLY 71 2.277 18.021 -6.701
40 HA2 GLY 71 2HA GLY 71 0.068 19.318 -6.172
41 HA3 GLY 71 1HA GLY 71 0.254 19.739 -7.882
42 H ARG 72 H ARG 72 1.595 17.379 -8.600
43 HA ARG 72 HA ARG 72 -0.609 15.509 -8.612
44 HB2 ARG 72 2HB ARG 72 1.918 15.715 -10.234
45 HB3 ARG 72 1HB ARG 72 0.954 14.245 -10.239
46 HG2 ARG 72 2HG ARG 72 -0.970 15.543 -11.046
47 HG3 ARG 72 1HG ARG 72 0.043 16.987 -11.079
48 HD2 ARG 72 2HD ARG 72 1.443 16.063 -12.767
49 HD3 ARG 72 1HD ARG 72 0.695 14.473 -12.606
50 HE ARG 72 HE ARG 72 -1.399 15.873 -13.281
51 HH11 ARG 72 1HH1 ARG 72 1.854 16.103 -14.699
52 HH12 ARG 72 2HH1 ARG 72 1.271 16.513 -16.239
53 HH21 ARG 72 1HH2 ARG 72 -2.166 16.367 -15.449
54 HH22 ARG 72 2HH2 ARG 72 -1.034 16.663 -16.673
55 H GLY 73 H GLY 73 -0.630 14.476 -6.758
56 HA2 GLY 73 2HA GLY 73 1.667 12.796 -6.115
57 HA3 GLY 73 1HA GLY 73 1.060 13.874 -4.861
58 H ALA 74 H ALA 74 -0.915 12.366 -7.257
59 HA ALA 74 HA ALA 74 -2.268 10.797 -5.160
60 HB1 ALA 74 1HB ALA 74 -3.290 11.655 -7.870
61 HB2 ALA 74 2HB ALA 74 -3.678 12.456 -6.349
62 HB3 ALA 74 3HB ALA 74 -4.196 10.796 -6.628
63 H ILE 75 H ILE 75 -3.458 8.921 -6.467
64 HA ILE 75 HA ILE 75 -1.171 7.315 -7.183
65 HB ILE 75 HB ILE 75 -4.012 6.432 -6.782
66 HG12 ILE 75 2HG1 ILE 75 -1.843 6.624 -4.712
67 HG13 ILE 75 1HG1 ILE 75 -3.122 7.811 -4.908
68 HG21 ILE 75 1HG2 ILE 75 -1.346 5.031 -6.396
69 HG22 ILE 75 2HG2 ILE 75 -2.396 4.815 -7.790
70 HG23 ILE 75 3HG2 ILE 75 -2.935 4.291 -6.192
71 HD11 ILE 75 1HD1 ILE 75 -3.490 4.916 -4.181
72 HD12 ILE 75 2HD1 ILE 75 -4.773 6.121 -4.404
73 HD13 ILE 75 3HD1 ILE 75 -3.599 6.313 -3.100
74 H ASP 76 H ASP 76 -0.932 8.264 -9.037
75 HA ASP 76 HA ASP 76 -2.772 8.399 -11.234
76 HB2 ASP 76 2HB ASP 76 -0.864 9.892 -11.165
77 HB3 ASP 76 1HB ASP 76 0.247 8.529 -11.243
78 H ARG 77 H ARG 77 -0.617 5.988 -10.134
79 HA ARG 77 HA ARG 77 -1.380 4.237 -12.360
80 HB2 ARG 77 2HB ARG 77 1.302 4.381 -10.940
81 HB3 ARG 77 1HB ARG 77 0.881 3.197 -12.172
82 HG2 ARG 77 2HG ARG 77 0.649 4.913 -13.819
83 HG3 ARG 77 1HG ARG 77 0.905 6.171 -12.613
84 HD2 ARG 77 2HD ARG 77 3.188 5.290 -12.265
85 HD3 ARG 77 1HD ARG 77 2.897 4.118 -13.558
86 HE ARG 77 HE ARG 77 2.273 6.667 -14.486
87 HH11 ARG 77 1HH1 ARG 77 5.208 4.882 -13.496
88 HH12 ARG 77 2HH1 ARG 77 6.200 5.651 -14.603
89 HH21 ARG 77 1HH2 ARG 77 3.682 7.784 -15.956
90 HH22 ARG 77 2HH2 ARG 77 5.337 7.362 -16.041
91 H GLU 78 H GLU 78 -0.366 1.881 -11.304
92 HA GLU 78 HA GLU 78 -2.091 1.355 -9.062
93 HB2 GLU 78 2HB GLU 78 0.128 -0.277 -10.291
94 HB3 GLU 78 1HB GLU 78 -1.025 -0.864 -9.105
95 HG2 GLU 78 2HG GLU 78 -2.794 -0.753 -10.631
96 HG3 GLU 78 1HG GLU 78 -1.854 0.204 -11.773
97 H GLN 79 H GLN 79 -1.374 0.863 -6.929
98 HA GLN 79 HA GLN 79 0.890 2.309 -6.034
99 HB2 GLN 79 2HB GLN 79 -0.932 0.344 -4.681
100 HB3 GLN 79 1HB GLN 79 0.444 1.066 -3.861
101 HG2 GLN 79 2HG GLN 79 -1.778 2.646 -5.129
102 HG3 GLN 79 1HG GLN 79 -1.729 2.173 -3.436
103 HE21 GLN 79 1HE2 GLN 79 -1.680 4.254 -2.678
104 HE22 GLN 79 2HE2 GLN 79 -0.308 5.297 -2.864
105 H SER 80 H SER 80 0.168 -1.036 -6.692
106 HA SER 80 HA SER 80 2.543 -2.212 -5.846
107 HB2 SER 80 2HB SER 80 0.841 -2.985 -8.212
108 HB3 SER 80 1HB SER 80 1.840 -4.058 -7.222
109 HG SER 80 HG SER 80 0.492 -3.521 -5.447
110 H ALA 81 H ALA 81 1.639 -0.631 -8.873
111 HA ALA 81 HA ALA 81 4.031 -1.203 -10.280
112 HB1 ALA 81 1HB ALA 81 2.066 1.058 -10.698
113 HB2 ALA 81 2HB ALA 81 1.984 -0.530 -11.461
114 HB3 ALA 81 3HB ALA 81 3.317 0.562 -11.836
115 H ALA 82 H ALA 82 2.940 1.446 -8.251
116 HA ALA 82 HA ALA 82 5.172 3.100 -8.558
117 HB1 ALA 82 1HB ALA 82 3.370 2.825 -6.153
118 HB2 ALA 82 2HB ALA 82 3.059 3.850 -7.553
119 HB3 ALA 82 3HB ALA 82 4.432 4.188 -6.502
120 H ILE 83 H ILE 83 4.517 0.477 -6.258
121 HA ILE 83 HA ILE 83 6.893 0.621 -4.759
122 HB ILE 83 HB ILE 83 5.369 -1.911 -5.505
123 HG12 ILE 83 2HG1 ILE 83 5.066 -0.131 -3.069
124 HG13 ILE 83 1HG1 ILE 83 3.932 -0.223 -4.407
125 HG21 ILE 83 1HG2 ILE 83 6.359 -2.860 -3.459
126 HG22 ILE 83 2HG2 ILE 83 7.276 -1.371 -3.221
127 HG23 ILE 83 3HG2 ILE 83 7.594 -2.391 -4.627
128 HD11 ILE 83 1HD1 ILE 83 3.478 -2.564 -3.854
129 HD12 ILE 83 2HD1 ILE 83 3.135 -1.488 -2.499
130 HD13 ILE 83 3HD1 ILE 83 4.606 -2.454 -2.503
131 H ARG 84 H ARG 84 6.131 -1.037 -7.738
132 HA ARG 84 HA ARG 84 8.554 -2.405 -8.127
133 HB2 ARG 84 2HB ARG 84 6.362 -1.516 -9.944
134 HB3 ARG 84 1HB ARG 84 7.791 -2.310 -10.580
135 HG2 ARG 84 2HG ARG 84 7.329 -4.298 -9.397
136 HG3 ARG 84 1HG ARG 84 6.102 -3.499 -8.406
137 HD2 ARG 84 2HD ARG 84 5.194 -4.941 -10.226
138 HD3 ARG 84 1HD ARG 84 4.648 -3.266 -10.259
139 HE ARG 84 HE ARG 84 6.954 -3.772 -11.893
140 HH11 ARG 84 1HH1 ARG 84 3.407 -3.842 -11.836
141 HH12 ARG 84 2HH1 ARG 84 3.212 -3.609 -13.492
142 HH21 ARG 84 1HH2 ARG 84 6.709 -3.429 -14.196
143 HH22 ARG 84 2HH2 ARG 84 5.160 -3.396 -14.895
144 H GLU 85 H GLU 85 7.423 0.727 -9.305
145 HA GLU 85 HA GLU 85 9.765 1.256 -10.773
146 HB2 GLU 85 2HB GLU 85 7.603 3.066 -9.775
147 HB3 GLU 85 1HB GLU 85 8.855 3.592 -10.916
148 HG2 GLU 85 2HG GLU 85 8.013 1.641 -12.370
149 HG3 GLU 85 1HG GLU 85 6.624 1.614 -11.294
150 H TRP 86 H TRP 86 8.764 2.042 -7.473
151 HA TRP 86 HA TRP 86 10.896 3.745 -6.818
152 HB2 TRP 86 2HB TRP 86 8.916 3.609 -5.429
153 HB3 TRP 86 1HB TRP 86 9.148 1.886 -5.190
154 HD1 TRP 86 HD TRP 86 10.322 5.276 -3.907
155 HE1 TRP 86 1HE TRP 86 11.697 4.918 -1.766
156 HE3 TRP 86 3HE TRP 86 10.645 0.185 -4.011
157 HZ2 TRP 86 2HZ TRP 86 12.782 2.746 -0.313
158 HZ3 TRP 86 3HZ TRP 86 11.867 -0.960 -2.196
159 HH2 TRP 86 HH TRP 86 12.909 0.301 -0.395
160 H ALA 87 H ALA 87 10.372 0.290 -6.626
161 HA ALA 87 HA ALA 87 12.695 -0.564 -5.418
162 HB1 ALA 87 1HB ALA 87 12.213 -2.718 -6.493
163 HB2 ALA 87 2HB ALA 87 11.073 -1.906 -7.558
164 HB3 ALA 87 3HB ALA 87 10.760 -1.970 -5.827
165 H ARG 88 H ARG 88 11.986 -0.161 -8.856
166 HA ARG 88 HA ARG 88 14.624 -0.884 -9.605
167 HB2 ARG 88 2HB ARG 88 12.389 0.333 -11.207
168 HB3 ARG 88 1HB ARG 88 13.973 0.009 -11.900
169 HG2 ARG 88 2HG ARG 88 12.135 -2.046 -10.667
170 HG3 ARG 88 1HG ARG 88 12.412 -1.802 -12.396
171 HD2 ARG 88 2HD ARG 88 14.791 -2.337 -12.075
172 HD3 ARG 88 1HD ARG 88 14.504 -2.606 -10.360
173 HE ARG 88 HE ARG 88 12.814 -4.217 -11.890
174 HH11 ARG 88 1HH1 ARG 88 16.183 -3.904 -10.883
175 HH12 ARG 88 2HH1 ARG 88 16.568 -5.551 -11.060
176 HH21 ARG 88 1HH2 ARG 88 13.313 -6.526 -12.097
177 HH22 ARG 88 2HH2 ARG 88 14.883 -7.090 -11.793
178 H ARG 89 H ARG 89 13.215 2.167 -8.808
179 HA ARG 89 HA ARG 89 15.410 3.712 -9.739
180 HB2 ARG 89 2HB ARG 89 13.318 4.223 -7.673
181 HB3 ARG 89 1HB ARG 89 14.600 5.375 -8.017
182 HG2 ARG 89 2HG ARG 89 13.870 5.324 -10.410
183 HG3 ARG 89 1HG ARG 89 12.473 4.382 -9.879
184 HD2 ARG 89 2HD ARG 89 11.815 6.127 -8.385
185 HD3 ARG 89 1HD ARG 89 13.295 7.009 -8.798
186 HE ARG 89 HE ARG 89 12.048 6.644 -11.180
187 HH11 ARG 89 1HH1 ARG 89 11.056 8.209 -8.151
188 HH12 ARG 89 2HH1 ARG 89 10.079 9.361 -8.932
189 HH21 ARG 89 1HH2 ARG 89 10.732 8.266 -12.200
190 HH22 ARG 89 2HH2 ARG 89 9.905 9.423 -11.225
191 H ASN 90 H ASN 90 14.760 1.970 -6.805
192 HA ASN 90 HA ASN 90 17.180 2.964 -5.557
193 HB2 ASN 90 2HB ASN 90 14.945 1.232 -4.617
194 HB3 ASN 90 1HB ASN 90 16.446 1.304 -3.683
195 HD21 ASN 90 1HD2 ASN 90 13.633 3.021 -4.765
196 HD22 ASN 90 2HD2 ASN 90 13.787 4.363 -3.706
197 H GLY 91 H GLY 91 16.309 0.301 -7.449
198 HA2 GLY 91 2HA GLY 91 18.075 -0.904 -8.531
199 HA3 GLY 91 1HA GLY 91 19.046 -0.702 -7.083
200 H HIS 92 H HIS 92 15.831 -1.607 -6.437
201 HA HIS 92 HA HIS 92 16.685 -4.132 -5.408
202 HB2 HIS 92 2HB HIS 92 13.965 -2.879 -5.684
203 HB3 HIS 92 1HB HIS 92 14.220 -4.462 -4.967
204 HD1 HIS 92 1HD HIS 92 15.032 -4.482 -2.503
205 HD2 HIS 92 2HD HIS 92 14.830 -0.706 -4.208
206 HE1 HIS 92 1HE HIS 92 15.219 -2.853 -0.604
207 H ASN 93 H ASN 93 16.036 -6.139 -6.102
208 HA ASN 93 HA ASN 93 15.669 -6.282 -8.979
209 HB2 ASN 93 2HB ASN 93 16.272 -8.521 -7.027
210 HB3 ASN 93 1HB ASN 93 16.339 -8.612 -8.780
211 HD21 ASN 93 1HD2 ASN 93 17.930 -7.576 -5.913
212 HD22 ASN 93 2HD2 ASN 93 19.445 -7.186 -6.635
213 H VAL 94 H VAL 94 13.517 -5.762 -9.068
214 HA VAL 94 HA VAL 94 11.724 -7.734 -7.874
215 HB VAL 94 HB VAL 94 11.090 -4.917 -8.819
216 HG11 VAL 94 1HG1 VAL 94 9.251 -6.989 -7.589
217 HG12 VAL 94 2HG1 VAL 94 9.199 -6.437 -9.262
218 HG13 VAL 94 3HG1 VAL 94 8.825 -5.318 -7.952
219 HG21 VAL 94 1HG2 VAL 94 12.270 -5.010 -6.695
220 HG22 VAL 94 2HG2 VAL 94 11.080 -6.161 -6.080
221 HG23 VAL 94 3HG2 VAL 94 10.595 -4.509 -6.469
222 H SER 95 H SER 95 11.268 -9.262 -9.196
223 HA SER 95 HA SER 95 11.336 -8.934 -11.998
224 HB2 SER 95 2HB SER 95 11.914 -11.076 -10.969
225 HB3 SER 95 1HB SER 95 10.308 -11.191 -10.257
226 HG SER 95 HG SER 95 11.142 -11.821 -12.767
227 H THR 96 H THR 96 9.632 -8.624 -13.368
228 HA THR 96 HA THR 96 7.185 -7.661 -12.297
229 HB THR 96 HB THR 96 6.685 -7.637 -14.853
230 HG1 THR 96 1HG THR 96 8.635 -7.634 -16.045
231 HG21 THR 96 1HG2 THR 96 7.239 -5.642 -13.546
232 HG22 THR 96 2HG2 THR 96 8.024 -5.596 -15.128
233 HG23 THR 96 3HG2 THR 96 8.953 -6.024 -13.689
234 H ARG 97 H ARG 97 8.456 -10.654 -12.999
235 HA ARG 97 HA ARG 97 5.926 -11.876 -13.734
236 HB2 ARG 97 2HB ARG 97 8.669 -13.128 -13.489
237 HB3 ARG 97 1HB ARG 97 7.249 -13.843 -14.239
238 HG2 ARG 97 2HG ARG 97 7.304 -12.057 -15.952
239 HG3 ARG 97 1HG ARG 97 8.785 -11.460 -15.218
240 HD2 ARG 97 2HD ARG 97 9.863 -13.625 -15.648
241 HD3 ARG 97 1HD ARG 97 8.385 -14.188 -16.427
242 HE ARG 97 HE ARG 97 9.616 -11.766 -17.431
243 HH11 ARG 97 1HH1 ARG 97 8.990 -15.223 -17.922
244 HH12 ARG 97 2HH1 ARG 97 9.422 -15.213 -19.560
245 HH21 ARG 97 1HH2 ARG 97 10.241 -11.759 -19.697
246 HH22 ARG 97 2HH2 ARG 97 10.116 -13.207 -20.593
247 H GLY 98 H GLY 98 4.748 -12.685 -12.142
248 HA2 GLY 98 2HA GLY 98 4.485 -14.076 -10.222
249 HA3 GLY 98 1HA GLY 98 6.101 -13.581 -9.720
250 H ARG 99 H ARG 99 5.746 -12.650 -7.806
251 HA ARG 99 HA ARG 99 3.933 -10.347 -7.794
252 HB2 ARG 99 2HB ARG 99 4.310 -12.378 -5.582
253 HB3 ARG 99 1HB ARG 99 3.634 -10.792 -5.287
254 HG2 ARG 99 2HG ARG 99 1.802 -12.273 -5.475
255 HG3 ARG 99 1HG ARG 99 1.846 -11.359 -6.976
256 HD2 ARG 99 2HD ARG 99 3.076 -13.285 -7.999
257 HD3 ARG 99 1HD ARG 99 2.761 -14.178 -6.512
258 HE ARG 99 HE ARG 99 0.541 -13.031 -8.028
259 HH11 ARG 99 1HH1 ARG 99 2.187 -15.918 -6.826
260 HH12 ARG 99 2HH1 ARG 99 0.923 -16.974 -7.229
261 HH21 ARG 99 1HH2 ARG 99 -1.171 -14.433 -8.547
262 HH22 ARG 99 2HH2 ARG 99 -1.082 -16.098 -8.183
263 H ILE 100 H ILE 100 4.470 -8.814 -5.969
264 HA ILE 100 HA ILE 100 7.247 -8.094 -6.236
265 HB ILE 100 HB ILE 100 5.009 -6.734 -4.696
266 HG12 ILE 100 2HG1 ILE 100 6.055 -6.124 -7.467
267 HG13 ILE 100 1HG1 ILE 100 4.547 -6.962 -7.118
268 HG21 ILE 100 1HG2 ILE 100 7.213 -6.020 -3.935
269 HG22 ILE 100 2HG2 ILE 100 6.422 -4.718 -4.821
270 HG23 ILE 100 3HG2 ILE 100 7.692 -5.663 -5.595
271 HD11 ILE 100 1HD1 ILE 100 3.709 -4.964 -5.994
272 HD12 ILE 100 2HD1 ILE 100 4.166 -4.634 -7.664
273 HD13 ILE 100 3HD1 ILE 100 5.223 -4.136 -6.344
274 HA PRO 101 HA PRO 101 8.434 -10.150 -2.434
275 HB2 PRO 101 2HB PRO 101 10.618 -8.171 -2.299
276 HB3 PRO 101 1HB PRO 101 10.721 -9.938 -2.429
277 HG2 PRO 101 2HG PRO 101 11.367 -8.371 -4.471
278 HG3 PRO 101 1HG PRO 101 10.577 -9.946 -4.687
279 HD2 PRO 101 2HD PRO 101 9.396 -7.225 -4.885
280 HD3 PRO 101 1HD PRO 101 9.079 -8.687 -5.841
281 H ALA 102 H ALA 102 7.893 -9.845 -0.397
282 HA ALA 102 HA ALA 102 6.534 -7.566 0.522
283 HB1 ALA 102 1HB ALA 102 6.545 -8.670 2.698
284 HB2 ALA 102 2HB ALA 102 7.768 -9.806 2.125
285 HB3 ALA 102 3HB ALA 102 6.155 -9.815 1.414
286 H ASP 103 H ASP 103 9.863 -8.559 0.754
287 HA ASP 103 HA ASP 103 10.743 -6.712 2.677
288 HB2 ASP 103 2HB ASP 103 12.215 -7.986 0.367
289 HB3 ASP 103 1HB ASP 103 13.002 -6.907 1.504
290 H VAL 104 H VAL 104 10.193 -6.393 -0.764
291 HA VAL 104 HA VAL 104 11.402 -3.788 -0.882
292 HB VAL 104 HB VAL 104 9.692 -5.293 -2.899
293 HG11 VAL 104 1HG1 VAL 104 9.513 -2.845 -3.209
294 HG12 VAL 104 2HG1 VAL 104 10.379 -3.628 -4.527
295 HG13 VAL 104 3HG1 VAL 104 11.276 -2.746 -3.290
296 HG21 VAL 104 1HG2 VAL 104 11.787 -5.608 -4.087
297 HG22 VAL 104 2HG2 VAL 104 11.888 -6.288 -2.456
298 HG23 VAL 104 3HG2 VAL 104 12.640 -4.728 -2.822
299 H ILE 105 H ILE 105 8.203 -5.174 -0.700
300 HA ILE 105 HA ILE 105 6.686 -2.820 -0.932
301 HB ILE 105 HB ILE 105 6.067 -5.320 0.671
302 HG12 ILE 105 2HG1 ILE 105 5.271 -4.557 -2.153
303 HG13 ILE 105 1HG1 ILE 105 6.526 -5.713 -1.732
304 HG21 ILE 105 1HG2 ILE 105 4.201 -3.151 -0.308
305 HG22 ILE 105 2HG2 ILE 105 4.665 -3.448 1.362
306 HG23 ILE 105 3HG2 ILE 105 3.719 -4.659 0.486
307 HD11 ILE 105 1HD1 ILE 105 4.492 -6.812 -2.408
308 HD12 ILE 105 2HD1 ILE 105 3.585 -5.993 -1.134
309 HD13 ILE 105 3HD1 ILE 105 4.845 -7.161 -0.718
310 H ASP 106 H ASP 106 8.054 -4.420 1.914
311 HA ASP 106 HA ASP 106 7.021 -2.586 3.809
312 HB2 ASP 106 2HB ASP 106 7.743 -4.817 4.485
313 HB3 ASP 106 1HB ASP 106 9.393 -4.452 3.997
314 H ALA 107 H ALA 107 10.125 -2.904 2.185
315 HA ALA 107 HA ALA 107 11.412 -0.726 3.338
316 HB1 ALA 107 1HB ALA 107 11.717 -1.790 0.537
317 HB2 ALA 107 2HB ALA 107 12.504 -2.445 1.965
318 HB3 ALA 107 3HB ALA 107 12.906 -0.811 1.412
319 H TYR 108 H TYR 108 9.336 -0.930 0.485
320 HA TYR 108 HA TYR 108 9.453 1.702 -0.399
321 HB2 TYR 108 2HB TYR 108 8.423 -0.050 -1.712
322 HB3 TYR 108 1HB TYR 108 7.213 -0.306 -0.465
323 HD1 TYR 108 1HD TYR 108 5.183 0.944 -0.479
324 HD2 TYR 108 2HD TYR 108 8.372 2.086 -3.045
325 HE1 TYR 108 1HE TYR 108 3.674 2.487 -1.654
326 HE2 TYR 108 2HE TYR 108 6.888 3.629 -4.220
327 HH TYR 108 HH TYR 108 3.731 4.411 -3.051
328 H HIS 109 H HIS 109 7.052 0.205 1.769
329 HA HIS 109 HA HIS 109 5.764 2.652 2.233
330 HB2 HIS 109 2HB HIS 109 5.503 -0.006 3.600
331 HB3 HIS 109 1HB HIS 109 4.603 1.403 4.163
332 HD1 HIS 109 1HD HIS 109 2.775 2.368 2.479
333 HD2 HIS 109 2HD HIS 109 4.526 -1.221 1.333
334 HE1 HIS 109 1HE HIS 109 1.353 1.467 0.619
335 H ALA 110 H ALA 110 8.525 1.288 3.686
336 HA ALA 110 HA ALA 110 8.388 3.012 6.003
337 HB1 ALA 110 1HB ALA 110 10.578 2.119 6.556
338 HB2 ALA 110 2HB ALA 110 10.659 1.320 4.983
339 HB3 ALA 110 3HB ALA 110 9.458 0.814 6.166
340 H ALA 111 H ALA 111 10.133 2.907 2.931
341 HA ALA 111 HA ALA 111 11.816 5.124 3.589
342 HB1 ALA 111 1HB ALA 111 11.360 3.799 0.945
343 HB2 ALA 111 2HB ALA 111 12.563 3.312 2.138
344 HB3 ALA 111 3HB ALA 111 12.686 4.888 1.349
345 H THR 112 H THR 112 8.975 4.758 1.461
346 HA THR 112 HA THR 112 9.263 7.575 0.917
347 HB THR 112 HB THR 112 8.926 6.030 -1.030
348 HG1 THR 112 1HG THR 112 8.033 8.366 -0.767
349 HG21 THR 112 1HG2 THR 112 6.657 5.180 -1.527
350 HG22 THR 112 2HG2 THR 112 6.115 5.729 0.061
351 HG23 THR 112 3HG2 THR 112 7.321 4.453 -0.065
Start of MODEL 9
1 H MET 65 1HT MET 65 16.354 24.750 -9.625
2 HA MET 65 HA MET 65 14.318 23.487 -9.969
3 HB2 MET 65 2HB MET 65 16.126 23.625 -12.404
4 HB3 MET 65 1HB MET 65 14.384 23.439 -12.456
5 HG2 MET 65 2HG MET 65 14.897 25.705 -12.952
6 HG3 MET 65 1HG MET 65 14.184 25.660 -11.345
7 HE1 MET 65 1HE MET 65 16.743 28.634 -11.124
8 HE2 MET 65 2HE MET 65 15.054 28.151 -10.953
9 HE3 MET 65 3HE MET 65 15.810 28.168 -12.545
10 H SER 66 H SER 66 13.468 21.482 -9.973
11 HA SER 66 HA SER 66 14.915 19.319 -11.182
12 HB2 SER 66 2HB SER 66 14.322 19.336 -8.213
13 HB3 SER 66 1HB SER 66 14.828 17.909 -9.121
14 HG SER 66 HG SER 66 16.508 19.775 -9.768
15 H GLY 67 H GLY 67 13.436 18.530 -12.450
16 HA2 GLY 67 2HA GLY 67 10.695 18.311 -11.465
17 HA3 GLY 67 1HA GLY 67 11.185 18.303 -13.161
18 H SER 68 H SER 68 10.122 16.392 -10.778
19 HA SER 68 HA SER 68 11.058 14.053 -12.163
20 HB2 SER 68 2HB SER 68 11.605 12.967 -9.942
21 HB3 SER 68 1HB SER 68 12.737 14.215 -10.460
22 HG SER 68 HG SER 68 12.345 14.778 -8.433
23 H GLY 69 H GLY 69 9.550 14.588 -9.071
24 HA2 GLY 69 2HA GLY 69 6.900 14.216 -10.019
25 HA3 GLY 69 1HA GLY 69 7.568 12.741 -9.313
26 H ARG 70 H ARG 70 5.903 15.514 -8.679
27 HA ARG 70 HA ARG 70 6.622 15.458 -5.830
28 HB2 ARG 70 2HB ARG 70 4.863 17.429 -7.319
29 HB3 ARG 70 1HB ARG 70 5.417 17.582 -5.667
30 HG2 ARG 70 2HG ARG 70 7.186 17.689 -8.116
31 HG3 ARG 70 1HG ARG 70 6.592 19.088 -7.240
32 HD2 ARG 70 2HD ARG 70 8.861 18.710 -6.566
33 HD3 ARG 70 1HD ARG 70 7.832 18.231 -5.225
34 HE ARG 70 HE ARG 70 8.219 15.878 -6.390
35 HH11 ARG 70 1HH1 ARG 70 10.657 18.402 -5.789
36 HH12 ARG 70 2HH1 ARG 70 11.901 17.268 -5.546
37 HH21 ARG 70 1HH2 ARG 70 9.963 14.375 -6.050
38 HH22 ARG 70 2HH2 ARG 70 11.512 14.996 -5.686
39 H GLY 71 H GLY 71 4.982 15.003 -4.317
40 HA2 GLY 71 2HA GLY 71 2.388 14.196 -5.390
41 HA3 GLY 71 1HA GLY 71 3.393 12.956 -4.655
42 H ARG 72 H ARG 72 3.950 13.109 -2.461
43 HA ARG 72 HA ARG 72 3.530 13.305 -0.335
44 HB2 ARG 72 2HB ARG 72 2.452 15.995 -1.120
45 HB3 ARG 72 1HB ARG 72 2.317 15.420 0.535
46 HG2 ARG 72 2HG ARG 72 4.891 15.733 -0.998
47 HG3 ARG 72 1HG ARG 72 4.275 16.859 0.218
48 HD2 ARG 72 2HD ARG 72 4.298 15.037 1.876
49 HD3 ARG 72 1HD ARG 72 4.979 13.958 0.674
50 HE ARG 72 HE ARG 72 6.500 16.320 1.081
51 HH11 ARG 72 1HH1 ARG 72 5.911 12.969 2.085
52 HH12 ARG 72 2HH1 ARG 72 7.347 12.776 2.956
53 HH21 ARG 72 1HH2 ARG 72 8.544 16.097 2.277
54 HH22 ARG 72 2HH2 ARG 72 8.919 14.626 3.048
55 H GLY 73 H GLY 73 2.419 11.999 0.666
56 HA2 GLY 73 2HA GLY 73 0.597 11.144 1.759
57 HA3 GLY 73 1HA GLY 73 -0.414 12.336 0.967
58 H ALA 74 H ALA 74 -0.114 11.766 -1.636
59 HA ALA 74 HA ALA 74 -1.339 9.086 -1.794
60 HB1 ALA 74 1HB ALA 74 -2.476 9.869 -3.785
61 HB2 ALA 74 2HB ALA 74 -1.627 11.410 -3.699
62 HB3 ALA 74 3HB ALA 74 -2.785 10.969 -2.443
63 H ILE 75 H ILE 75 -1.147 8.080 -3.941
64 HA ILE 75 HA ILE 75 1.683 7.904 -4.558
65 HB ILE 75 HB ILE 75 -0.592 5.998 -5.177
66 HG12 ILE 75 2HG1 ILE 75 1.519 5.801 -3.027
67 HG13 ILE 75 1HG1 ILE 75 -0.128 6.353 -2.755
68 HG21 ILE 75 1HG2 ILE 75 2.403 5.605 -5.318
69 HG22 ILE 75 2HG2 ILE 75 1.320 5.771 -6.700
70 HG23 ILE 75 3HG2 ILE 75 1.182 4.372 -5.638
71 HD11 ILE 75 1HD1 ILE 75 0.680 3.623 -3.731
72 HD12 ILE 75 2HD1 ILE 75 -0.969 4.195 -3.417
73 HD13 ILE 75 3HD1 ILE 75 0.179 4.055 -2.090
74 H ASP 76 H ASP 76 2.368 8.107 -6.620
75 HA ASP 76 HA ASP 76 1.016 9.923 -8.278
76 HB2 ASP 76 2HB ASP 76 3.478 9.708 -8.138
77 HB3 ASP 76 1HB ASP 76 3.368 8.168 -8.980
78 H ARG 77 H ARG 77 1.573 6.469 -8.606
79 HA ARG 77 HA ARG 77 -0.499 6.356 -10.696
80 HB2 ARG 77 2HB ARG 77 2.167 4.895 -10.762
81 HB3 ARG 77 1HB ARG 77 0.872 4.686 -11.931
82 HG2 ARG 77 2HG ARG 77 2.423 7.218 -11.467
83 HG3 ARG 77 1HG ARG 77 2.644 6.089 -12.805
84 HD2 ARG 77 2HD ARG 77 0.439 6.563 -13.637
85 HD3 ARG 77 1HD ARG 77 0.063 7.548 -12.220
86 HE ARG 77 HE ARG 77 2.233 8.727 -13.216
87 HH11 ARG 77 1HH1 ARG 77 -0.890 7.864 -14.663
88 HH12 ARG 77 2HH1 ARG 77 -0.859 9.102 -15.827
89 HH21 ARG 77 1HH2 ARG 77 2.257 10.455 -14.802
90 HH22 ARG 77 2HH2 ARG 77 0.972 10.609 -15.908
91 H GLU 78 H GLU 78 -0.183 3.531 -11.042
92 HA GLU 78 HA GLU 78 -1.860 2.433 -9.154
93 HB2 GLU 78 2HB GLU 78 0.254 0.989 -10.744
94 HB3 GLU 78 1HB GLU 78 -1.220 0.308 -10.086
95 HG2 GLU 78 2HG GLU 78 -2.548 1.628 -11.600
96 HG3 GLU 78 1HG GLU 78 -1.096 2.403 -12.226
97 H GLN 79 H GLN 79 -1.489 1.142 -7.357
98 HA GLN 79 HA GLN 79 0.537 1.796 -5.574
99 HB2 GLN 79 2HB GLN 79 -1.099 -0.742 -5.644
100 HB3 GLN 79 1HB GLN 79 -0.220 -0.127 -4.254
101 HG2 GLN 79 2HG GLN 79 -1.671 1.808 -4.159
102 HG3 GLN 79 1HG GLN 79 -2.514 1.267 -5.612
103 HE21 GLN 79 1HE2 GLN 79 -2.008 0.701 -2.235
104 HE22 GLN 79 2HE2 GLN 79 -3.320 -0.383 -2.007
105 H SER 80 H SER 80 0.153 -1.319 -7.289
106 HA SER 80 HA SER 80 2.564 -2.431 -6.482
107 HB2 SER 80 2HB SER 80 0.982 -3.004 -8.983
108 HB3 SER 80 1HB SER 80 2.086 -4.107 -8.151
109 HG SER 80 HG SER 80 0.701 -4.264 -6.478
110 H ALA 81 H ALA 81 1.743 -0.442 -9.270
111 HA ALA 81 HA ALA 81 4.159 -0.862 -10.691
112 HB1 ALA 81 1HB ALA 81 3.498 1.034 -12.043
113 HB2 ALA 81 2HB ALA 81 2.289 1.489 -10.850
114 HB3 ALA 81 3HB ALA 81 2.109 -0.017 -11.757
115 H ALA 82 H ALA 82 3.076 1.558 -8.380
116 HA ALA 82 HA ALA 82 5.356 3.199 -8.570
117 HB1 ALA 82 1HB ALA 82 3.212 3.962 -7.661
118 HB2 ALA 82 2HB ALA 82 4.550 4.244 -6.551
119 HB3 ALA 82 3HB ALA 82 3.440 2.899 -6.272
120 H ILE 83 H ILE 83 4.529 0.477 -6.472
121 HA ILE 83 HA ILE 83 6.834 0.645 -4.835
122 HB ILE 83 HB ILE 83 5.280 -1.868 -5.572
123 HG12 ILE 83 2HG1 ILE 83 4.943 -0.016 -3.195
124 HG13 ILE 83 1HG1 ILE 83 3.861 -0.095 -4.577
125 HG21 ILE 83 1HG2 ILE 83 6.178 -2.781 -3.467
126 HG22 ILE 83 2HG2 ILE 83 7.113 -1.308 -3.226
127 HG23 ILE 83 3HG2 ILE 83 7.471 -2.367 -4.593
128 HD11 ILE 83 1HD1 ILE 83 2.948 -1.287 -2.668
129 HD12 ILE 83 2HD1 ILE 83 4.381 -2.314 -2.608
130 HD13 ILE 83 3HD1 ILE 83 3.292 -2.401 -3.991
131 H ARG 84 H ARG 84 6.160 -1.029 -7.837
132 HA ARG 84 HA ARG 84 8.568 -2.449 -8.140
133 HB2 ARG 84 2HB ARG 84 6.442 -1.498 -9.977
134 HB3 ARG 84 1HB ARG 84 7.917 -2.159 -10.641
135 HG2 ARG 84 2HG ARG 84 7.525 -4.266 -9.626
136 HG3 ARG 84 1HG ARG 84 6.195 -3.616 -8.661
137 HD2 ARG 84 2HD ARG 84 5.529 -4.928 -10.701
138 HD3 ARG 84 1HD ARG 84 4.836 -3.313 -10.553
139 HE ARG 84 HE ARG 84 7.281 -3.547 -12.101
140 HH11 ARG 84 1HH1 ARG 84 3.743 -3.397 -12.223
141 HH12 ARG 84 2HH1 ARG 84 3.671 -2.733 -13.784
142 HH21 ARG 84 1HH2 ARG 84 7.174 -2.625 -14.273
143 HH22 ARG 84 2HH2 ARG 84 5.661 -2.238 -14.950
144 H GLU 85 H GLU 85 7.542 0.683 -9.386
145 HA GLU 85 HA GLU 85 10.024 1.112 -10.631
146 HB2 GLU 85 2HB GLU 85 7.719 2.915 -10.093
147 HB3 GLU 85 1HB GLU 85 9.130 3.426 -11.039
148 HG2 GLU 85 2HG GLU 85 7.140 1.239 -11.665
149 HG3 GLU 85 1HG GLU 85 7.400 2.736 -12.560
150 H TRP 86 H TRP 86 8.804 1.907 -7.431
151 HA TRP 86 HA TRP 86 10.866 3.693 -6.743
152 HB2 TRP 86 2HB TRP 86 8.899 3.482 -5.326
153 HB3 TRP 86 1HB TRP 86 9.197 1.763 -5.101
154 HD1 TRP 86 HD TRP 86 10.355 5.193 -3.855
155 HE1 TRP 86 1HE TRP 86 11.791 4.854 -1.750
156 HE3 TRP 86 3HE TRP 86 10.665 0.124 -3.939
157 HZ2 TRP 86 2HZ TRP 86 12.913 2.688 -0.307
158 HZ3 TRP 86 3HZ TRP 86 11.948 -1.030 -2.155
159 HH2 TRP 86 HH TRP 86 13.038 0.239 -0.387
160 H ALA 87 H ALA 87 10.488 0.208 -6.665
161 HA ALA 87 HA ALA 87 12.921 -0.519 -5.539
162 HB1 ALA 87 1HB ALA 87 11.083 -2.104 -5.870
163 HB2 ALA 87 2HB ALA 87 12.525 -2.715 -6.681
164 HB3 ALA 87 3HB ALA 87 11.246 -1.961 -7.607
165 H ARG 88 H ARG 88 12.010 0.076 -8.889
166 HA ARG 88 HA ARG 88 14.490 -0.493 -10.078
167 HB2 ARG 88 2HB ARG 88 12.424 1.523 -10.956
168 HB3 ARG 88 1HB ARG 88 13.710 0.896 -11.971
169 HG2 ARG 88 2HG ARG 88 11.590 -0.855 -10.764
170 HG3 ARG 88 1HG ARG 88 11.372 -0.027 -12.296
171 HD2 ARG 88 2HD ARG 88 12.047 -2.262 -12.742
172 HD3 ARG 88 1HD ARG 88 13.390 -1.207 -13.151
173 HE ARG 88 HE ARG 88 14.039 -2.029 -10.667
174 HH11 ARG 88 1HH1 ARG 88 12.957 -3.779 -13.521
175 HH12 ARG 88 2HH1 ARG 88 13.808 -5.211 -13.151
176 HH21 ARG 88 1HH2 ARG 88 15.265 -3.989 -10.162
177 HH22 ARG 88 2HH2 ARG 88 15.217 -5.290 -11.267
178 H ARG 89 H ARG 89 13.143 2.555 -8.874
179 HA ARG 89 HA ARG 89 15.239 4.327 -9.492
180 HB2 ARG 89 2HB ARG 89 13.295 4.357 -7.174
181 HB3 ARG 89 1HB ARG 89 14.367 5.683 -7.561
182 HG2 ARG 89 2HG ARG 89 12.333 4.645 -9.519
183 HG3 ARG 89 1HG ARG 89 11.935 5.852 -8.303
184 HD2 ARG 89 2HD ARG 89 12.438 6.951 -10.390
185 HD3 ARG 89 1HD ARG 89 13.684 7.315 -9.208
186 HE ARG 89 HE ARG 89 14.066 5.217 -11.200
187 HH11 ARG 89 1HH1 ARG 89 15.138 8.259 -9.700
188 HH12 ARG 89 2HH1 ARG 89 16.468 8.483 -10.728
189 HH21 ARG 89 1HH2 ARG 89 15.969 5.524 -12.626
190 HH22 ARG 89 2HH2 ARG 89 16.965 6.897 -12.394
191 H ASN 90 H ASN 90 14.762 2.147 -6.825
192 HA ASN 90 HA ASN 90 17.141 3.150 -5.504
193 HB2 ASN 90 2HB ASN 90 14.889 1.444 -4.663
194 HB3 ASN 90 1HB ASN 90 16.366 1.470 -3.681
195 HD21 ASN 90 1HD2 ASN 90 13.582 3.191 -4.770
196 HD22 ASN 90 2HD2 ASN 90 13.731 4.524 -3.684
197 H GLY 91 H GLY 91 16.434 0.620 -7.620
198 HA2 GLY 91 2HA GLY 91 18.124 -0.702 -8.572
199 HA3 GLY 91 1HA GLY 91 19.161 -0.321 -7.208
200 H HIS 92 H HIS 92 15.901 -1.518 -6.968
201 HA HIS 92 HA HIS 92 16.878 -3.922 -5.625
202 HB2 HIS 92 2HB HIS 92 14.235 -2.535 -5.752
203 HB3 HIS 92 1HB HIS 92 14.398 -4.133 -5.027
204 HD1 HIS 92 1HD HIS 92 16.034 -4.141 -2.834
205 HD2 HIS 92 2HD HIS 92 14.709 -0.462 -4.173
206 HE1 HIS 92 1HE HIS 92 16.405 -2.524 -0.916
207 H ASN 93 H ASN 93 15.726 -5.937 -6.154
208 HA ASN 93 HA ASN 93 15.035 -5.958 -8.994
209 HB2 ASN 93 2HB ASN 93 16.533 -8.042 -7.415
210 HB3 ASN 93 1HB ASN 93 15.811 -8.366 -8.989
211 HD21 ASN 93 1HD2 ASN 93 18.628 -8.392 -8.202
212 HD22 ASN 93 2HD2 ASN 93 19.401 -7.254 -9.238
213 H VAL 94 H VAL 94 13.012 -6.118 -9.236
214 HA VAL 94 HA VAL 94 11.472 -7.931 -7.530
215 HB VAL 94 HB VAL 94 10.624 -5.365 -8.934
216 HG11 VAL 94 1HG1 VAL 94 8.794 -6.977 -8.966
217 HG12 VAL 94 2HG1 VAL 94 8.478 -5.642 -7.847
218 HG13 VAL 94 3HG1 VAL 94 8.980 -7.212 -7.220
219 HG21 VAL 94 1HG2 VAL 94 11.914 -4.956 -6.924
220 HG22 VAL 94 2HG2 VAL 94 10.841 -6.016 -6.009
221 HG23 VAL 94 3HG2 VAL 94 10.223 -4.510 -6.688
222 H SER 95 H SER 95 10.492 -9.568 -8.631
223 HA SER 95 HA SER 95 10.970 -9.828 -11.400
224 HB2 SER 95 2HB SER 95 10.929 -11.830 -10.033
225 HB3 SER 95 1HB SER 95 9.282 -11.471 -9.506
226 HG SER 95 HG SER 95 9.863 -12.996 -11.400
227 H THR 96 H THR 96 9.635 -9.404 -13.057
228 HA THR 96 HA THR 96 7.101 -8.175 -12.460
229 HB THR 96 HB THR 96 7.083 -7.981 -15.028
230 HG1 THR 96 1HG THR 96 8.667 -8.966 -15.959
231 HG21 THR 96 1HG2 THR 96 8.580 -6.019 -14.942
232 HG22 THR 96 2HG2 THR 96 9.215 -6.592 -13.397
233 HG23 THR 96 3HG2 THR 96 7.525 -6.098 -13.527
234 H ARG 97 H ARG 97 8.242 -11.220 -12.853
235 HA ARG 97 HA ARG 97 5.974 -12.266 -14.316
236 HB2 ARG 97 2HB ARG 97 8.348 -13.635 -13.039
237 HB3 ARG 97 1HB ARG 97 7.003 -14.531 -13.704
238 HG2 ARG 97 2HG ARG 97 8.749 -14.566 -15.299
239 HG3 ARG 97 1HG ARG 97 7.508 -13.489 -15.920
240 HD2 ARG 97 2HD ARG 97 8.836 -11.560 -15.210
241 HD3 ARG 97 1HD ARG 97 10.063 -12.642 -14.548
242 HE ARG 97 HE ARG 97 9.742 -13.454 -17.114
243 HH11 ARG 97 1HH1 ARG 97 10.809 -10.423 -15.582
244 HH12 ARG 97 2HH1 ARG 97 11.695 -9.908 -16.935
245 HH21 ARG 97 1HH2 ARG 97 10.954 -12.735 -18.935
246 HH22 ARG 97 2HH2 ARG 97 11.793 -11.249 -18.880
247 H GLY 98 H GLY 98 7.417 -12.571 -11.101
248 HA2 GLY 98 2HA GLY 98 5.012 -13.831 -10.090
249 HA3 GLY 98 1HA GLY 98 6.512 -13.569 -9.213
250 H ARG 99 H ARG 99 5.646 -12.644 -7.450
251 HA ARG 99 HA ARG 99 3.991 -10.255 -7.819
252 HB2 ARG 99 2HB ARG 99 3.389 -10.474 -5.486
253 HB3 ARG 99 1HB ARG 99 3.111 -11.997 -6.303
254 HG2 ARG 99 2HG ARG 99 5.212 -12.871 -5.335
255 HG3 ARG 99 1HG ARG 99 5.424 -11.341 -4.484
256 HD2 ARG 99 2HD ARG 99 3.226 -11.692 -3.402
257 HD3 ARG 99 1HD ARG 99 3.133 -13.257 -4.201
258 HE ARG 99 HE ARG 99 5.492 -13.275 -2.822
259 HH11 ARG 99 1HH1 ARG 99 2.067 -12.958 -2.020
260 HH12 ARG 99 2HH1 ARG 99 2.248 -13.537 -0.418
261 HH21 ARG 99 1HH2 ARG 99 5.730 -14.098 -0.669
262 HH22 ARG 99 2HH2 ARG 99 4.376 -14.201 0.373
263 H ILE 100 H ILE 100 4.469 -8.686 -5.806
264 HA ILE 100 HA ILE 100 7.247 -7.990 -6.125
265 HB ILE 100 HB ILE 100 5.016 -6.510 -4.680
266 HG12 ILE 100 2HG1 ILE 100 6.178 -6.071 -7.436
267 HG13 ILE 100 1HG1 ILE 100 4.604 -6.783 -7.098
268 HG21 ILE 100 1HG2 ILE 100 7.256 -5.890 -3.889
269 HG22 ILE 100 2HG2 ILE 100 6.531 -4.575 -4.823
270 HG23 ILE 100 3HG2 ILE 100 7.766 -5.593 -5.555
271 HD11 ILE 100 1HD1 ILE 100 5.466 -3.989 -6.435
272 HD12 ILE 100 2HD1 ILE 100 3.873 -4.683 -6.110
273 HD13 ILE 100 3HD1 ILE 100 4.426 -4.466 -7.777
274 HA PRO 101 HA PRO 101 8.173 -10.194 -2.349
275 HB2 PRO 101 2HB PRO 101 10.510 -8.373 -2.216
276 HB3 PRO 101 1HB PRO 101 10.485 -10.149 -2.263
277 HG2 PRO 101 2HG PRO 101 11.282 -8.752 -4.362
278 HG3 PRO 101 1HG PRO 101 10.341 -10.246 -4.539
279 HD2 PRO 101 2HD PRO 101 9.431 -7.421 -4.840
280 HD3 PRO 101 1HD PRO 101 8.969 -8.874 -5.748
281 H ALA 102 H ALA 102 7.575 -9.828 -0.352
282 HA ALA 102 HA ALA 102 6.413 -7.456 0.516
283 HB1 ALA 102 1HB ALA 102 5.891 -9.649 1.471
284 HB2 ALA 102 2HB ALA 102 6.318 -8.485 2.722
285 HB3 ALA 102 3HB ALA 102 7.490 -9.700 2.210
286 H ASP 103 H ASP 103 9.687 -8.590 0.771
287 HA ASP 103 HA ASP 103 10.675 -6.780 2.675
288 HB2 ASP 103 2HB ASP 103 12.111 -7.929 0.277
289 HB3 ASP 103 1HB ASP 103 12.883 -7.134 1.637
290 H VAL 104 H VAL 104 10.159 -6.460 -0.792
291 HA VAL 104 HA VAL 104 11.421 -3.883 -0.897
292 HB VAL 104 HB VAL 104 9.735 -5.367 -2.952
293 HG11 VAL 104 1HG1 VAL 104 9.533 -2.923 -3.271
294 HG12 VAL 104 2HG1 VAL 104 10.452 -3.685 -4.570
295 HG13 VAL 104 3HG1 VAL 104 11.294 -2.798 -3.301
296 HG21 VAL 104 1HG2 VAL 104 11.855 -5.658 -4.114
297 HG22 VAL 104 2HG2 VAL 104 11.937 -6.341 -2.483
298 HG23 VAL 104 3HG2 VAL 104 12.678 -4.772 -2.835
299 H ILE 105 H ILE 105 8.185 -5.166 -0.763
300 HA ILE 105 HA ILE 105 6.761 -2.742 -0.980
301 HB ILE 105 HB ILE 105 6.013 -5.240 0.579
302 HG12 ILE 105 2HG1 ILE 105 5.299 -4.408 -2.241
303 HG13 ILE 105 1HG1 ILE 105 6.484 -5.631 -1.808
304 HG21 ILE 105 1HG2 ILE 105 4.262 -2.974 -0.402
305 HG22 ILE 105 2HG2 ILE 105 4.679 -3.325 1.273
306 HG23 ILE 105 3HG2 ILE 105 3.697 -4.471 0.351
307 HD11 ILE 105 1HD1 ILE 105 3.527 -5.762 -1.248
308 HD12 ILE 105 2HD1 ILE 105 4.723 -6.996 -0.838
309 HD13 ILE 105 3HD1 ILE 105 4.396 -6.616 -2.524
310 H ASP 106 H ASP 106 8.084 -4.444 1.799
311 HA ASP 106 HA ASP 106 7.122 -2.702 3.795
312 HB2 ASP 106 2HB ASP 106 7.849 -4.957 4.336
313 HB3 ASP 106 1HB ASP 106 9.480 -4.591 3.779
314 H ALA 107 H ALA 107 10.188 -2.973 2.103
315 HA ALA 107 HA ALA 107 11.503 -0.836 3.313
316 HB1 ALA 107 1HB ALA 107 11.815 -1.884 0.509
317 HB2 ALA 107 2HB ALA 107 12.576 -2.560 1.939
318 HB3 ALA 107 3HB ALA 107 13.015 -0.933 1.401
319 H TYR 108 H TYR 108 9.415 -0.989 0.495
320 HA TYR 108 HA TYR 108 9.551 1.624 -0.416
321 HB2 TYR 108 2HB TYR 108 8.436 -0.099 -1.695
322 HB3 TYR 108 1HB TYR 108 7.260 -0.351 -0.416
323 HD1 TYR 108 1HD TYR 108 8.377 2.040 -3.004
324 HD2 TYR 108 2HD TYR 108 5.259 0.928 -0.341
325 HE1 TYR 108 1HE TYR 108 6.904 3.602 -4.112
326 HE2 TYR 108 2HE TYR 108 3.741 2.515 -1.449
327 HH TYR 108 HH TYR 108 3.821 4.463 -2.801
328 H HIS 109 H HIS 109 7.156 0.206 1.798
329 HA HIS 109 HA HIS 109 5.981 2.687 2.372
330 HB2 HIS 109 2HB HIS 109 5.771 0.042 3.794
331 HB3 HIS 109 1HB HIS 109 4.921 1.476 4.357
332 HD1 HIS 109 1HD HIS 109 2.926 2.338 2.851
333 HD2 HIS 109 2HD HIS 109 4.708 -1.183 1.555
334 HE1 HIS 109 1HE HIS 109 1.379 1.379 1.128
335 H ALA 110 H ALA 110 8.728 1.119 3.704
336 HA ALA 110 HA ALA 110 8.840 2.735 6.075
337 HB1 ALA 110 1HB ALA 110 11.010 1.085 4.778
338 HB2 ALA 110 2HB ALA 110 9.888 0.511 6.011
339 HB3 ALA 110 3HB ALA 110 11.059 1.771 6.402
340 H ALA 111 H ALA 111 10.045 2.980 2.804
341 HA ALA 111 HA ALA 111 11.810 5.175 3.465
342 HB1 ALA 111 1HB ALA 111 12.397 5.192 1.122
343 HB2 ALA 111 2HB ALA 111 11.092 4.052 0.769
344 HB3 ALA 111 3HB ALA 111 12.459 3.549 1.762
345 H THR 112 H THR 112 8.839 4.803 1.521
346 HA THR 112 HA THR 112 8.731 7.695 1.467
347 HB THR 112 HB THR 112 8.550 6.644 -0.744
348 HG1 THR 112 1HG THR 112 5.939 7.604 -0.194
349 HG21 THR 112 1HG2 THR 112 7.563 4.495 -0.178
350 HG22 THR 112 2HG2 THR 112 6.588 5.289 -1.413
351 HG23 THR 112 3HG2 THR 112 6.046 5.276 0.262
Start of MODEL 10
1 H MET 65 1HT MET 65 4.433 24.636 -19.935
2 HA MET 65 HA MET 65 4.904 22.579 -18.883
3 HB2 MET 65 2HB MET 65 6.955 22.331 -21.080
4 HB3 MET 65 1HB MET 65 7.072 21.429 -19.584
5 HG2 MET 65 2HG MET 65 4.873 20.407 -20.081
6 HG3 MET 65 1HG MET 65 4.866 21.259 -21.621
7 HE1 MET 65 1HE MET 65 5.559 17.485 -22.548
8 HE2 MET 65 2HE MET 65 4.465 18.853 -22.760
9 HE3 MET 65 3HE MET 65 4.589 18.059 -21.190
10 H SER 66 H SER 66 5.629 23.298 -17.062
11 HA SER 66 HA SER 66 8.220 24.510 -16.860
12 HB2 SER 66 2HB SER 66 5.691 25.873 -15.877
13 HB3 SER 66 1HB SER 66 7.335 26.449 -15.614
14 HG SER 66 HG SER 66 7.091 26.100 -18.190
15 H GLY 67 H GLY 67 9.009 24.141 -14.767
16 HA2 GLY 67 2HA GLY 67 7.566 22.106 -13.290
17 HA3 GLY 67 1HA GLY 67 9.214 22.648 -12.986
18 H SER 68 H SER 68 5.830 23.585 -12.676
19 HA SER 68 HA SER 68 6.165 25.822 -11.054
20 HB2 SER 68 2HB SER 68 3.766 25.179 -10.358
21 HB3 SER 68 1HB SER 68 4.057 25.495 -12.069
22 HG SER 68 HG SER 68 3.143 23.584 -12.252
23 H GLY 69 H GLY 69 5.258 22.547 -10.160
24 HA2 GLY 69 2HA GLY 69 7.021 22.477 -7.921
25 HA3 GLY 69 1HA GLY 69 5.305 22.532 -7.482
26 H ARG 70 H ARG 70 7.511 20.380 -7.477
27 HA ARG 70 HA ARG 70 6.354 18.415 -9.262
28 HB2 ARG 70 2HB ARG 70 8.502 18.092 -7.179
29 HB3 ARG 70 1HB ARG 70 8.005 16.881 -8.344
30 HG2 ARG 70 2HG ARG 70 8.633 18.555 -10.136
31 HG3 ARG 70 1HG ARG 70 9.433 19.458 -8.841
32 HD2 ARG 70 2HD ARG 70 10.659 17.400 -8.252
33 HD3 ARG 70 1HD ARG 70 9.869 16.651 -9.651
34 HE ARG 70 HE ARG 70 11.222 19.037 -10.371
35 HH11 ARG 70 1HH1 ARG 70 11.899 15.592 -9.723
36 HH12 ARG 70 2HH1 ARG 70 13.314 15.547 -10.661
37 HH21 ARG 70 1HH2 ARG 70 13.207 18.986 -11.612
38 HH22 ARG 70 2HH2 ARG 70 14.087 17.542 -11.764
39 H GLY 71 H GLY 71 7.095 18.348 -5.795
40 HA2 GLY 71 2HA GLY 71 5.806 17.722 -3.998
41 HA3 GLY 71 1HA GLY 71 4.424 17.678 -5.077
42 H ARG 72 H ARG 72 3.818 15.750 -4.029
43 HA ARG 72 HA ARG 72 5.393 13.355 -4.607
44 HB2 ARG 72 2HB ARG 72 2.656 13.689 -3.316
45 HB3 ARG 72 1HB ARG 72 3.434 12.149 -3.577
46 HG2 ARG 72 2HG ARG 72 3.631 12.725 -1.274
47 HG3 ARG 72 1HG ARG 72 5.230 12.870 -1.991
48 HD2 ARG 72 2HD ARG 72 5.066 15.267 -1.997
49 HD3 ARG 72 1HD ARG 72 3.364 15.204 -1.540
50 HE ARG 72 HE ARG 72 4.440 13.931 0.481
51 HH11 ARG 72 1HH1 ARG 72 5.659 16.928 -1.022
52 HH12 ARG 72 2HH1 ARG 72 6.202 17.576 0.451
53 HH21 ARG 72 1HH2 ARG 72 5.219 14.915 2.513
54 HH22 ARG 72 2HH2 ARG 72 5.958 16.448 2.433
55 H GLY 73 H GLY 73 2.692 15.217 -5.609
56 HA2 GLY 73 2HA GLY 73 1.584 15.194 -7.626
57 HA3 GLY 73 1HA GLY 73 2.308 13.618 -7.984
58 H ALA 74 H ALA 74 0.689 12.272 -8.221
59 HA ALA 74 HA ALA 74 -0.955 11.693 -5.908
60 HB1 ALA 74 1HB ALA 74 -2.347 13.269 -7.215
61 HB2 ALA 74 2HB ALA 74 -3.007 11.633 -7.229
62 HB3 ALA 74 3HB ALA 74 -2.139 12.243 -8.637
63 H ILE 75 H ILE 75 -1.913 9.667 -6.134
64 HA ILE 75 HA ILE 75 -0.100 7.860 -7.453
65 HB ILE 75 HB ILE 75 -2.540 7.317 -5.780
66 HG12 ILE 75 2HG1 ILE 75 0.331 7.407 -4.907
67 HG13 ILE 75 1HG1 ILE 75 -0.778 8.758 -4.728
68 HG21 ILE 75 1HG2 ILE 75 -0.114 5.604 -6.414
69 HG22 ILE 75 2HG2 ILE 75 -1.710 5.397 -7.126
70 HG23 ILE 75 3HG2 ILE 75 -1.476 5.116 -5.399
71 HD11 ILE 75 1HD1 ILE 75 -2.185 7.408 -3.286
72 HD12 ILE 75 2HD1 ILE 75 -0.548 7.562 -2.653
73 HD13 ILE 75 3HD1 ILE 75 -1.060 6.048 -3.425
74 H ASP 76 H ASP 76 -0.519 8.008 -9.435
75 HA ASP 76 HA ASP 76 -3.229 8.059 -10.549
76 HB2 ASP 76 2HB ASP 76 -1.525 9.557 -11.518
77 HB3 ASP 76 1HB ASP 76 -0.580 8.158 -12.012
78 H ARG 77 H ARG 77 -0.367 6.059 -10.750
79 HA ARG 77 HA ARG 77 -1.957 3.918 -11.946
80 HB2 ARG 77 2HB ARG 77 1.022 4.013 -11.369
81 HB3 ARG 77 1HB ARG 77 0.189 2.750 -12.264
82 HG2 ARG 77 2HG ARG 77 -0.427 4.390 -13.984
83 HG3 ARG 77 1HG ARG 77 0.438 5.635 -13.096
84 HD2 ARG 77 2HD ARG 77 2.513 4.262 -13.338
85 HD3 ARG 77 1HD ARG 77 1.602 3.169 -14.381
86 HE ARG 77 HE ARG 77 1.318 5.821 -15.255
87 HH11 ARG 77 1HH1 ARG 77 3.620 3.126 -15.395
88 HH12 ARG 77 2HH1 ARG 77 4.534 3.783 -16.653
89 HH21 ARG 77 1HH2 ARG 77 2.563 6.698 -17.050
90 HH22 ARG 77 2HH2 ARG 77 3.916 5.855 -17.621
91 H GLU 78 H GLU 78 -1.233 1.662 -10.934
92 HA GLU 78 HA GLU 78 -2.314 1.535 -8.370
93 HB2 GLU 78 2HB GLU 78 -0.409 -0.499 -9.537
94 HB3 GLU 78 1HB GLU 78 -1.633 -0.776 -8.317
95 HG2 GLU 78 2HG GLU 78 -2.613 -1.693 -10.181
96 HG3 GLU 78 1HG GLU 78 -3.275 -0.063 -10.191
97 H GLN 79 H GLN 79 -1.341 1.106 -6.340
98 HA GLN 79 HA GLN 79 1.121 2.485 -5.958
99 HB2 GLN 79 2HB GLN 79 -0.405 0.754 -3.998
100 HB3 GLN 79 1HB GLN 79 1.012 1.710 -3.584
101 HG2 GLN 79 2HG GLN 79 -0.227 3.724 -4.340
102 HG3 GLN 79 1HG GLN 79 -1.667 2.715 -4.496
103 HE21 GLN 79 1HE2 GLN 79 -2.796 3.809 -2.930
104 HE22 GLN 79 2HE2 GLN 79 -2.412 3.721 -1.258
105 H SER 80 H SER 80 0.202 -0.787 -6.426
106 HA SER 80 HA SER 80 2.610 -2.072 -5.782
107 HB2 SER 80 2HB SER 80 0.673 -2.751 -7.993
108 HB3 SER 80 1HB SER 80 1.728 -3.871 -7.123
109 HG SER 80 HG SER 80 0.564 -3.235 -5.199
110 H ALA 81 H ALA 81 1.522 -0.406 -8.726
111 HA ALA 81 HA ALA 81 3.818 -0.989 -10.293
112 HB1 ALA 81 1HB ALA 81 1.690 -0.283 -11.301
113 HB2 ALA 81 2HB ALA 81 2.999 0.810 -11.762
114 HB3 ALA 81 3HB ALA 81 1.842 1.292 -10.523
115 H ALA 82 H ALA 82 2.881 1.589 -8.130
116 HA ALA 82 HA ALA 82 5.140 3.222 -8.526
117 HB1 ALA 82 1HB ALA 82 3.437 2.980 -6.044
118 HB2 ALA 82 2HB ALA 82 3.098 4.024 -7.425
119 HB3 ALA 82 3HB ALA 82 4.526 4.311 -6.430
120 H ILE 83 H ILE 83 4.558 0.502 -6.314
121 HA ILE 83 HA ILE 83 7.002 0.668 -4.922
122 HB ILE 83 HB ILE 83 5.374 -1.838 -5.516
123 HG12 ILE 83 2HG1 ILE 83 5.357 -0.023 -3.096
124 HG13 ILE 83 1HG1 ILE 83 4.102 -0.089 -4.325
125 HG21 ILE 83 1HG2 ILE 83 6.513 -2.801 -3.546
126 HG22 ILE 83 2HG2 ILE 83 7.495 -1.341 -3.414
127 HG23 ILE 83 3HG2 ILE 83 7.654 -2.386 -4.826
128 HD11 ILE 83 1HD1 ILE 83 4.873 -2.292 -2.424
129 HD12 ILE 83 2HD1 ILE 83 3.637 -2.408 -3.681
130 HD13 ILE 83 3HD1 ILE 83 3.428 -1.279 -2.343
131 H ARG 84 H ARG 84 6.053 -1.006 -7.856
132 HA ARG 84 HA ARG 84 8.428 -2.337 -8.411
133 HB2 ARG 84 2HB ARG 84 6.281 -1.262 -10.207
134 HB3 ARG 84 1HB ARG 84 7.643 -2.198 -10.813
135 HG2 ARG 84 2HG ARG 84 7.001 -4.112 -9.602
136 HG3 ARG 84 1HG ARG 84 5.841 -3.199 -8.639
137 HD2 ARG 84 2HD ARG 84 4.777 -4.567 -10.353
138 HD3 ARG 84 1HD ARG 84 4.458 -2.848 -10.547
139 HE ARG 84 HE ARG 84 6.673 -3.494 -12.109
140 HH11 ARG 84 1HH1 ARG 84 3.197 -4.196 -12.081
141 HH12 ARG 84 2HH1 ARG 84 3.112 -4.405 -13.772
142 HH21 ARG 84 1HH2 ARG 84 6.517 -3.768 -14.388
143 HH22 ARG 84 2HH2 ARG 84 5.003 -4.146 -15.096
144 H GLU 85 H GLU 85 7.316 0.859 -9.458
145 HA GLU 85 HA GLU 85 9.588 1.690 -10.834
146 HB2 GLU 85 2HB GLU 85 7.442 3.160 -9.360
147 HB3 GLU 85 1HB GLU 85 8.808 4.028 -10.043
148 HG2 GLU 85 2HG GLU 85 6.999 2.225 -11.616
149 HG3 GLU 85 1HG GLU 85 6.812 3.977 -11.489
150 H TRP 86 H TRP 86 8.752 2.115 -7.399
151 HA TRP 86 HA TRP 86 10.970 3.618 -6.676
152 HB2 TRP 86 2HB TRP 86 8.948 3.487 -5.337
153 HB3 TRP 86 1HB TRP 86 9.172 1.759 -5.116
154 HD1 TRP 86 HD TRP 86 10.325 5.126 -3.787
155 HE1 TRP 86 1HE TRP 86 11.701 4.758 -1.673
156 HE3 TRP 86 3HE TRP 86 10.672 0.080 -4.016
157 HZ2 TRP 86 2HZ TRP 86 12.828 2.542 -0.261
158 HZ3 TRP 86 3HZ TRP 86 11.924 -1.121 -2.235
159 HH2 TRP 86 HH TRP 86 12.967 0.099 -0.408
160 H ALA 87 H ALA 87 10.344 0.152 -6.652
161 HA ALA 87 HA ALA 87 12.682 -0.787 -5.518
162 HB1 ALA 87 1HB ALA 87 12.191 -2.872 -6.749
163 HB2 ALA 87 2HB ALA 87 11.018 -1.993 -7.727
164 HB3 ALA 87 3HB ALA 87 10.751 -2.191 -5.997
165 H ARG 88 H ARG 88 11.919 -0.181 -8.893
166 HA ARG 88 HA ARG 88 14.455 -0.850 -9.911
167 HB2 ARG 88 2HB ARG 88 12.273 0.842 -11.064
168 HB3 ARG 88 1HB ARG 88 13.767 0.484 -11.918
169 HG2 ARG 88 2HG ARG 88 13.236 -1.959 -11.618
170 HG3 ARG 88 1HG ARG 88 11.649 -1.451 -11.031
171 HD2 ARG 88 2HD ARG 88 11.222 -0.295 -13.072
172 HD3 ARG 88 1HD ARG 88 12.868 -0.662 -13.614
173 HE ARG 88 HE ARG 88 11.807 -3.114 -13.192
174 HH11 ARG 88 1HH1 ARG 88 10.599 -0.358 -15.083
175 HH12 ARG 88 2HH1 ARG 88 9.889 -1.310 -16.300
176 HH21 ARG 88 1HH2 ARG 88 10.804 -4.424 -14.849
177 HH22 ARG 88 2HH2 ARG 88 9.998 -3.701 -16.169
178 H ARG 89 H ARG 89 13.148 2.217 -8.781
179 HA ARG 89 HA ARG 89 15.332 3.871 -9.572
180 HB2 ARG 89 2HB ARG 89 13.521 4.279 -7.170
181 HB3 ARG 89 1HB ARG 89 14.512 5.502 -7.944
182 HG2 ARG 89 2HG ARG 89 12.153 4.102 -9.184
183 HG3 ARG 89 1HG ARG 89 12.166 5.740 -8.532
184 HD2 ARG 89 2HD ARG 89 13.631 6.493 -10.212
185 HD3 ARG 89 1HD ARG 89 13.995 4.841 -10.727
186 HE ARG 89 HE ARG 89 11.238 5.477 -10.944
187 HH11 ARG 89 1HH1 ARG 89 14.354 5.990 -12.535
188 HH12 ARG 89 2HH1 ARG 89 13.754 5.891 -14.120
189 HH21 ARG 89 1HH2 ARG 89 10.386 5.225 -13.140
190 HH22 ARG 89 2HH2 ARG 89 11.436 5.474 -14.462
191 H ASN 90 H ASN 90 14.743 1.882 -6.784
192 HA ASN 90 HA ASN 90 17.128 2.890 -5.473
193 HB2 ASN 90 2HB ASN 90 14.874 1.164 -4.591
194 HB3 ASN 90 1HB ASN 90 16.338 1.294 -3.595
195 HD21 ASN 90 1HD2 ASN 90 13.537 2.900 -4.836
196 HD22 ASN 90 2HD2 ASN 90 13.595 4.276 -3.795
197 H GLY 91 H GLY 91 16.319 0.319 -7.472
198 HA2 GLY 91 2HA GLY 91 18.017 -0.960 -8.492
199 HA3 GLY 91 1HA GLY 91 19.027 -0.711 -7.081
200 H HIS 92 H HIS 92 15.741 -1.668 -6.662
201 HA HIS 92 HA HIS 92 16.597 -4.204 -5.566
202 HB2 HIS 92 2HB HIS 92 13.909 -2.852 -5.784
203 HB3 HIS 92 1HB HIS 92 14.096 -4.479 -5.158
204 HD1 HIS 92 1HD HIS 92 14.655 -4.646 -2.664
205 HD2 HIS 92 2HD HIS 92 15.005 -0.809 -4.188
206 HE1 HIS 92 1HE HIS 92 14.866 -3.136 -0.673
207 H ASN 93 H ASN 93 16.719 -5.950 -6.797
208 HA ASN 93 HA ASN 93 15.713 -5.913 -9.483
209 HB2 ASN 93 2HB ASN 93 16.987 -8.206 -7.952
210 HB3 ASN 93 1HB ASN 93 16.637 -8.197 -9.673
211 HD21 ASN 93 1HD2 ASN 93 18.745 -7.078 -7.172
212 HD22 ASN 93 2HD2 ASN 93 19.940 -6.398 -8.216
213 H VAL 94 H VAL 94 13.554 -5.854 -9.460
214 HA VAL 94 HA VAL 94 12.167 -7.979 -7.994
215 HB VAL 94 HB VAL 94 11.117 -5.275 -8.910
216 HG11 VAL 94 1HG1 VAL 94 9.015 -5.890 -7.778
217 HG12 VAL 94 2HG1 VAL 94 9.656 -7.506 -7.479
218 HG13 VAL 94 3HG1 VAL 94 9.362 -6.967 -9.131
219 HG21 VAL 94 1HG2 VAL 94 12.520 -5.181 -6.920
220 HG22 VAL 94 2HG2 VAL 94 11.534 -6.428 -6.157
221 HG23 VAL 94 3HG2 VAL 94 10.833 -4.850 -6.519
222 H SER 95 H SER 95 11.402 -9.548 -9.153
223 HA SER 95 HA SER 95 11.305 -9.353 -12.004
224 HB2 SER 95 2HB SER 95 12.090 -11.417 -10.848
225 HB3 SER 95 1HB SER 95 10.486 -11.614 -10.149
226 HG SER 95 HG SER 95 10.582 -12.885 -11.931
227 H THR 96 H THR 96 9.518 -8.646 -13.065
228 HA THR 96 HA THR 96 7.114 -8.221 -11.588
229 HB THR 96 HB THR 96 6.316 -7.216 -13.758
230 HG1 THR 96 1HG THR 96 8.068 -6.854 -15.266
231 HG21 THR 96 1HG2 THR 96 7.833 -5.310 -13.631
232 HG22 THR 96 2HG2 THR 96 8.974 -6.292 -12.698
233 HG23 THR 96 3HG2 THR 96 7.390 -5.894 -12.024
234 H ARG 97 H ARG 97 8.441 -10.711 -13.231
235 HA ARG 97 HA ARG 97 5.938 -11.890 -14.052
236 HB2 ARG 97 2HB ARG 97 8.753 -13.004 -14.094
237 HB3 ARG 97 1HB ARG 97 7.338 -13.851 -14.698
238 HG2 ARG 97 2HG ARG 97 7.029 -12.198 -16.416
239 HG3 ARG 97 1HG ARG 97 8.353 -11.233 -15.759
240 HD2 ARG 97 2HD ARG 97 9.924 -13.036 -16.230
241 HD3 ARG 97 1HD ARG 97 8.610 -14.039 -16.828
242 HE ARG 97 HE ARG 97 8.382 -12.619 -18.682
243 HH11 ARG 97 1HH1 ARG 97 11.170 -11.714 -16.685
244 HH12 ARG 97 2HH1 ARG 97 12.047 -11.017 -17.963
245 HH21 ARG 97 1HH2 ARG 97 9.613 -11.644 -20.449
246 HH22 ARG 97 2HH2 ARG 97 11.149 -10.966 -20.131
247 H GLY 98 H GLY 98 5.195 -11.664 -11.804
248 HA2 GLY 98 2HA GLY 98 4.765 -13.914 -10.475
249 HA3 GLY 98 1HA GLY 98 6.373 -13.479 -9.894
250 H ARG 99 H ARG 99 6.439 -12.278 -8.145
251 HA ARG 99 HA ARG 99 4.057 -10.728 -7.376
252 HB2 ARG 99 2HB ARG 99 5.725 -12.561 -5.649
253 HB3 ARG 99 1HB ARG 99 4.503 -11.460 -5.047
254 HG2 ARG 99 2HG ARG 99 3.976 -13.721 -6.956
255 HG3 ARG 99 1HG ARG 99 3.751 -13.811 -5.210
256 HD2 ARG 99 2HD ARG 99 2.325 -11.944 -7.107
257 HD3 ARG 99 1HD ARG 99 1.650 -13.371 -6.327
258 HE ARG 99 HE ARG 99 2.724 -11.492 -4.466
259 HH11 ARG 99 1HH1 ARG 99 -0.177 -12.312 -6.319
260 HH12 ARG 99 2HH1 ARG 99 -1.227 -11.479 -5.267
261 HH21 ARG 99 1HH2 ARG 99 1.336 -10.342 -3.099
262 HH22 ARG 99 2HH2 ARG 99 -0.348 -10.296 -3.382
263 H ILE 100 H ILE 100 4.533 -8.967 -5.955
264 HA ILE 100 HA ILE 100 7.232 -7.975 -6.197
265 HB ILE 100 HB ILE 100 4.812 -6.744 -4.812
266 HG12 ILE 100 2HG1 ILE 100 6.019 -6.133 -7.520
267 HG13 ILE 100 1HG1 ILE 100 4.496 -6.971 -7.250
268 HG21 ILE 100 1HG2 ILE 100 7.483 -5.522 -5.528
269 HG22 ILE 100 2HG2 ILE 100 6.920 -5.907 -3.901
270 HG23 ILE 100 3HG2 ILE 100 6.112 -4.652 -4.838
271 HD11 ILE 100 1HD1 ILE 100 4.117 -4.664 -7.868
272 HD12 ILE 100 2HD1 ILE 100 5.127 -4.117 -6.538
273 HD13 ILE 100 3HD1 ILE 100 3.598 -4.933 -6.203
274 HA PRO 101 HA PRO 101 8.281 -10.060 -2.404
275 HB2 PRO 101 2HB PRO 101 10.479 -8.092 -2.250
276 HB3 PRO 101 1HB PRO 101 10.573 -9.860 -2.326
277 HG2 PRO 101 2HG PRO 101 11.259 -8.337 -4.400
278 HG3 PRO 101 1HG PRO 101 10.504 -9.930 -4.599
279 HD2 PRO 101 2HD PRO 101 9.314 -7.232 -4.945
280 HD3 PRO 101 1HD PRO 101 8.987 -8.756 -5.797
281 H ALA 102 H ALA 102 7.575 -9.782 -0.437
282 HA ALA 102 HA ALA 102 6.304 -7.460 0.498
283 HB1 ALA 102 1HB ALA 102 7.341 -9.797 2.102
284 HB2 ALA 102 2HB ALA 102 5.770 -9.725 1.308
285 HB3 ALA 102 3HB ALA 102 6.138 -8.625 2.640
286 H ASP 103 H ASP 103 9.556 -8.605 0.821
287 HA ASP 103 HA ASP 103 10.488 -6.882 2.837
288 HB2 ASP 103 2HB ASP 103 11.796 -8.789 1.982
289 HB3 ASP 103 1HB ASP 103 11.967 -7.982 0.430
290 H VAL 104 H VAL 104 10.106 -6.466 -0.645
291 HA VAL 104 HA VAL 104 11.368 -3.891 -0.730
292 HB VAL 104 HB VAL 104 9.670 -5.365 -2.791
293 HG11 VAL 104 1HG1 VAL 104 11.299 -2.843 -3.162
294 HG12 VAL 104 2HG1 VAL 104 9.541 -2.917 -3.134
295 HG13 VAL 104 3HG1 VAL 104 10.438 -3.724 -4.424
296 HG21 VAL 104 1HG2 VAL 104 11.837 -6.395 -2.309
297 HG22 VAL 104 2HG2 VAL 104 12.617 -4.838 -2.653
298 HG23 VAL 104 3HG2 VAL 104 11.777 -5.702 -3.937
299 H ILE 105 H ILE 105 8.137 -5.180 -0.550
300 HA ILE 105 HA ILE 105 6.703 -2.771 -0.837
301 HB ILE 105 HB ILE 105 5.944 -5.237 0.768
302 HG12 ILE 105 2HG1 ILE 105 5.221 -4.463 -2.078
303 HG13 ILE 105 1HG1 ILE 105 6.431 -5.656 -1.635
304 HG21 ILE 105 1HG2 ILE 105 4.620 -3.292 1.416
305 HG22 ILE 105 2HG2 ILE 105 3.625 -4.449 0.525
306 HG23 ILE 105 3HG2 ILE 105 4.213 -2.981 -0.267
307 HD11 ILE 105 1HD1 ILE 105 4.355 -6.695 -2.330
308 HD12 ILE 105 2HD1 ILE 105 3.476 -5.839 -1.061
309 HD13 ILE 105 3HD1 ILE 105 4.690 -7.051 -0.640
310 H ASP 106 H ASP 106 7.971 -4.411 2.046
311 HA ASP 106 HA ASP 106 7.020 -2.517 3.921
312 HB2 ASP 106 2HB ASP 106 7.718 -4.742 4.638
313 HB3 ASP 106 1HB ASP 106 9.363 -4.425 4.097
314 H ALA 107 H ALA 107 10.024 -2.892 2.176
315 HA ALA 107 HA ALA 107 11.452 -0.770 3.327
316 HB1 ALA 107 1HB ALA 107 12.452 -2.564 1.988
317 HB2 ALA 107 2HB ALA 107 12.906 -0.964 1.393
318 HB3 ALA 107 3HB ALA 107 11.669 -1.910 0.552
319 H TYR 108 H TYR 108 9.319 -0.956 0.547
320 HA TYR 108 HA TYR 108 9.505 1.637 -0.425
321 HB2 TYR 108 2HB TYR 108 8.377 -0.109 -1.664
322 HB3 TYR 108 1HB TYR 108 7.189 -0.308 -0.391
323 HD1 TYR 108 1HD TYR 108 8.371 1.984 -3.024
324 HD2 TYR 108 2HD TYR 108 5.212 1.027 -0.360
325 HE1 TYR 108 1HE TYR 108 6.912 3.552 -4.208
326 HE2 TYR 108 2HE TYR 108 3.731 2.600 -1.532
327 HH TYR 108 HH TYR 108 3.860 4.528 -2.973
328 H HIS 109 H HIS 109 7.130 0.253 1.831
329 HA HIS 109 HA HIS 109 5.995 2.770 2.315
330 HB2 HIS 109 2HB HIS 109 5.586 0.139 3.709
331 HB3 HIS 109 1HB HIS 109 4.761 1.606 4.226
332 HD1 HIS 109 1HD HIS 109 3.114 2.718 2.349
333 HD2 HIS 109 2HD HIS 109 4.472 -1.142 1.587
334 HE1 HIS 109 1HE HIS 109 1.626 1.800 0.552
335 H ALA 110 H ALA 110 8.752 1.309 3.614
336 HA ALA 110 HA ALA 110 8.782 2.975 5.982
337 HB1 ALA 110 1HB ALA 110 10.998 2.029 6.384
338 HB2 ALA 110 2HB ALA 110 10.977 1.279 4.788
339 HB3 ALA 110 3HB ALA 110 9.836 0.749 6.023
340 H ALA 111 H ALA 111 10.088 3.047 2.738
341 HA ALA 111 HA ALA 111 11.846 5.254 3.331
342 HB1 ALA 111 1HB ALA 111 12.460 5.173 0.997
343 HB2 ALA 111 2HB ALA 111 11.138 4.046 0.672
344 HB3 ALA 111 3HB ALA 111 12.480 3.555 1.699
345 H THR 112 H THR 112 8.808 4.843 1.518
346 HA THR 112 HA THR 112 8.847 7.713 1.272
347 HB THR 112 HB THR 112 8.560 6.587 -0.883
348 HG1 THR 112 1HG THR 112 7.309 8.586 -0.172
349 HG21 THR 112 1HG2 THR 112 7.406 4.546 -0.172
350 HG22 THR 112 2HG2 THR 112 6.502 5.358 -1.451
351 HG23 THR 112 3HG2 THR 112 5.971 5.487 0.230
Start of MODEL 11
1 H MET 65 1HT MET 65 -17.745 12.579 -16.421
2 HA MET 65 HA MET 65 -16.822 13.085 -14.270
3 HB2 MET 65 2HB MET 65 -18.729 10.733 -14.289
4 HB3 MET 65 1HB MET 65 -18.382 11.690 -12.863
5 HG2 MET 65 2HG MET 65 -19.286 13.675 -14.013
6 HG3 MET 65 1HG MET 65 -19.686 12.661 -15.397
7 HE1 MET 65 1HE MET 65 -23.197 13.457 -13.787
8 HE2 MET 65 2HE MET 65 -22.224 13.541 -15.254
9 HE3 MET 65 3HE MET 65 -21.800 14.531 -13.855
10 H SER 66 H SER 66 -14.640 12.654 -14.050
11 HA SER 66 HA SER 66 -13.921 10.817 -12.119
12 HB2 SER 66 2HB SER 66 -14.081 9.129 -13.971
13 HB3 SER 66 1HB SER 66 -12.944 10.088 -14.917
14 HG SER 66 HG SER 66 -11.968 8.305 -13.720
15 H GLY 67 H GLY 67 -11.966 11.557 -11.268
16 HA2 GLY 67 2HA GLY 67 -9.774 12.474 -11.628
17 HA3 GLY 67 1HA GLY 67 -10.424 13.386 -12.977
18 H SER 68 H SER 68 -12.769 13.710 -10.784
19 HA SER 68 HA SER 68 -11.794 16.294 -10.013
20 HB2 SER 68 2HB SER 68 -14.385 14.897 -9.281
21 HB3 SER 68 1HB SER 68 -13.994 16.574 -8.926
22 HG SER 68 HG SER 68 -14.158 15.428 -11.530
23 H GLY 69 H GLY 69 -10.129 16.037 -8.676
24 HA2 GLY 69 2HA GLY 69 -10.407 15.999 -6.002
25 HA3 GLY 69 1HA GLY 69 -10.213 14.291 -6.400
26 H ARG 70 H ARG 70 -8.797 17.351 -7.440
27 HA ARG 70 HA ARG 70 -6.217 16.180 -7.851
28 HB2 ARG 70 2HB ARG 70 -6.916 19.109 -7.553
29 HB3 ARG 70 1HB ARG 70 -5.443 18.448 -8.235
30 HG2 ARG 70 2HG ARG 70 -8.200 18.182 -9.415
31 HG3 ARG 70 1HG ARG 70 -6.956 19.300 -9.956
32 HD2 ARG 70 2HD ARG 70 -5.528 17.380 -10.540
33 HD3 ARG 70 1HD ARG 70 -6.814 16.288 -10.016
34 HE ARG 70 HE ARG 70 -7.465 18.262 -12.033
35 HH11 ARG 70 1HH1 ARG 70 -6.613 14.886 -11.385
36 HH12 ARG 70 2HH1 ARG 70 -7.329 14.272 -12.787
37 HH21 ARG 70 1HH2 ARG 70 -8.438 17.426 -13.995
38 HH22 ARG 70 2HH2 ARG 70 -8.381 15.752 -14.315
39 H GLY 71 H GLY 71 -4.635 15.927 -6.387
40 HA2 GLY 71 2HA GLY 71 -3.722 17.409 -4.413
41 HA3 GLY 71 1HA GLY 71 -5.167 16.730 -3.668
42 H ARG 72 H ARG 72 -2.913 16.085 -2.468
43 HA ARG 72 HA ARG 72 -1.908 13.645 -3.618
44 HB2 ARG 72 2HB ARG 72 -1.147 15.087 -1.090
45 HB3 ARG 72 1HB ARG 72 -0.380 13.609 -1.660
46 HG2 ARG 72 2HG ARG 72 0.387 14.718 -3.654
47 HG3 ARG 72 1HG ARG 72 -0.492 16.180 -3.213
48 HD2 ARG 72 2HD ARG 72 1.808 14.961 -1.692
49 HD3 ARG 72 1HD ARG 72 1.869 16.381 -2.735
50 HE ARG 72 HE ARG 72 0.203 16.282 -0.321
51 HH11 ARG 72 1HH1 ARG 72 2.679 17.929 -2.252
52 HH12 ARG 72 2HH1 ARG 72 2.660 19.333 -1.295
53 HH21 ARG 72 1HH2 ARG 72 0.234 18.162 0.996
54 HH22 ARG 72 2HH2 ARG 72 1.247 19.474 0.601
55 H GLY 73 H GLY 73 -3.902 12.759 -3.586
56 HA2 GLY 73 2HA GLY 73 -4.307 11.022 -1.293
57 HA3 GLY 73 1HA GLY 73 -5.701 11.966 -1.842
58 H ALA 74 H ALA 74 -5.338 12.061 -4.499
59 HA ALA 74 HA ALA 74 -5.939 9.447 -5.417
60 HB1 ALA 74 1HB ALA 74 -6.845 11.432 -6.537
61 HB2 ALA 74 2HB ALA 74 -5.879 10.443 -7.636
62 HB3 ALA 74 3HB ALA 74 -5.202 11.937 -6.974
63 H ILE 75 H ILE 75 -4.624 8.050 -6.460
64 HA ILE 75 HA ILE 75 -1.876 8.295 -5.658
65 HB ILE 75 HB ILE 75 -3.211 5.980 -7.099
66 HG12 ILE 75 2HG1 ILE 75 -2.942 6.330 -4.126
67 HG13 ILE 75 1HG1 ILE 75 -4.380 6.859 -4.987
68 HG21 ILE 75 1HG2 ILE 75 -1.464 4.677 -5.926
69 HG22 ILE 75 2HG2 ILE 75 -0.860 6.153 -5.176
70 HG23 ILE 75 3HG2 ILE 75 -0.723 5.934 -6.921
71 HD11 ILE 75 1HD1 ILE 75 -4.672 4.682 -3.973
72 HD12 ILE 75 2HD1 ILE 75 -3.319 4.045 -4.930
73 HD13 ILE 75 3HD1 ILE 75 -4.791 4.625 -5.728
74 H ASP 76 H ASP 76 -0.193 8.467 -6.965
75 HA ASP 76 HA ASP 76 -0.515 9.808 -9.426
76 HB2 ASP 76 2HB ASP 76 1.388 10.232 -7.963
77 HB3 ASP 76 1HB ASP 76 1.949 8.579 -8.181
78 H ARG 77 H ARG 77 0.160 6.493 -8.644
79 HA ARG 77 HA ARG 77 -0.175 5.706 -11.460
80 HB2 ARG 77 2HB ARG 77 2.001 4.703 -9.605
81 HB3 ARG 77 1HB ARG 77 1.703 4.106 -11.222
82 HG2 ARG 77 2HG ARG 77 2.351 6.272 -12.143
83 HG3 ARG 77 1HG ARG 77 2.624 6.880 -10.507
84 HD2 ARG 77 2HD ARG 77 4.282 5.105 -10.165
85 HD3 ARG 77 1HD ARG 77 4.072 4.588 -11.825
86 HE ARG 77 HE ARG 77 5.020 7.244 -11.051
87 HH11 ARG 77 1HH1 ARG 77 5.037 4.621 -13.400
88 HH12 ARG 77 2HH1 ARG 77 6.641 4.908 -13.938
89 HH21 ARG 77 1HH2 ARG 77 7.205 7.720 -11.888
90 HH22 ARG 77 2HH2 ARG 77 7.883 6.724 -13.094
91 H GLU 78 H GLU 78 0.054 2.968 -11.074
92 HA GLU 78 HA GLU 78 -2.066 2.300 -9.228
93 HB2 GLU 78 2HB GLU 78 -0.055 0.420 -10.500
94 HB3 GLU 78 1HB GLU 78 -1.598 -0.015 -9.800
95 HG2 GLU 78 2HG GLU 78 -2.731 1.218 -11.591
96 HG3 GLU 78 1HG GLU 78 -1.162 1.566 -12.315
97 H GLN 79 H GLN 79 -1.759 1.308 -7.171
98 HA GLN 79 HA GLN 79 0.319 2.168 -5.588
99 HB2 GLN 79 2HB GLN 79 -1.308 -0.352 -5.192
100 HB3 GLN 79 1HB GLN 79 -0.285 0.370 -3.971
101 HG2 GLN 79 2HG GLN 79 -2.345 1.103 -3.327
102 HG3 GLN 79 1HG GLN 79 -1.805 2.446 -4.311
103 HE21 GLN 79 1HE2 GLN 79 -4.459 1.476 -3.571
104 HE22 GLN 79 2HE2 GLN 79 -5.355 1.290 -5.032
105 H SER 80 H SER 80 -0.078 -1.156 -6.755
106 HA SER 80 HA SER 80 2.394 -2.079 -5.941
107 HB2 SER 80 2HB SER 80 0.625 -3.075 -8.159
108 HB3 SER 80 1HB SER 80 1.801 -4.023 -7.234
109 HG SER 80 HG SER 80 -0.213 -4.331 -6.400
110 H ALA 81 H ALA 81 1.399 -0.514 -8.958
111 HA ALA 81 HA ALA 81 3.761 -1.158 -10.404
112 HB1 ALA 81 1HB ALA 81 3.062 0.534 -12.007
113 HB2 ALA 81 2HB ALA 81 1.880 1.161 -10.862
114 HB3 ALA 81 3HB ALA 81 1.681 -0.459 -11.536
115 H ALA 82 H ALA 82 2.798 1.498 -8.327
116 HA ALA 82 HA ALA 82 5.065 3.117 -8.725
117 HB1 ALA 82 1HB ALA 82 3.204 2.923 -6.357
118 HB2 ALA 82 2HB ALA 82 2.987 3.976 -7.756
119 HB3 ALA 82 3HB ALA 82 4.337 4.236 -6.656
120 H ILE 83 H ILE 83 4.273 0.570 -6.392
121 HA ILE 83 HA ILE 83 6.644 0.708 -4.886
122 HB ILE 83 HB ILE 83 5.064 -1.829 -5.495
123 HG12 ILE 83 2HG1 ILE 83 4.759 0.126 -3.197
124 HG13 ILE 83 1HG1 ILE 83 3.641 -0.035 -4.542
125 HG21 ILE 83 1HG2 ILE 83 6.948 -1.153 -3.221
126 HG22 ILE 83 2HG2 ILE 83 7.262 -2.292 -4.529
127 HG23 ILE 83 3HG2 ILE 83 6.000 -2.632 -3.347
128 HD11 ILE 83 1HD1 ILE 83 4.238 -2.129 -2.459
129 HD12 ILE 83 2HD1 ILE 83 3.133 -2.326 -3.819
130 HD13 ILE 83 3HD1 ILE 83 2.783 -1.137 -2.563
131 H ARG 84 H ARG 84 5.852 -1.103 -7.795
132 HA ARG 84 HA ARG 84 8.311 -2.400 -8.167
133 HB2 ARG 84 2HB ARG 84 6.139 -1.594 -10.073
134 HB3 ARG 84 1HB ARG 84 7.573 -2.458 -10.618
135 HG2 ARG 84 2HG ARG 84 7.015 -4.366 -9.400
136 HG3 ARG 84 1HG ARG 84 5.868 -3.490 -8.387
137 HD2 ARG 84 2HD ARG 84 4.723 -4.899 -10.002
138 HD3 ARG 84 1HD ARG 84 4.411 -3.184 -10.271
139 HE ARG 84 HE ARG 84 6.504 -4.419 -11.853
140 HH11 ARG 84 1HH1 ARG 84 3.161 -3.305 -11.710
141 HH12 ARG 84 2HH1 ARG 84 2.918 -3.274 -13.392
142 HH21 ARG 84 1HH2 ARG 84 6.170 -4.411 -14.213
143 HH22 ARG 84 2HH2 ARG 84 4.656 -3.921 -14.820
144 H GLU 85 H GLU 85 7.165 0.754 -9.323
145 HA GLU 85 HA GLU 85 9.404 1.521 -10.810
146 HB2 GLU 85 2HB GLU 85 7.431 3.142 -9.221
147 HB3 GLU 85 1HB GLU 85 8.687 3.874 -10.211
148 HG2 GLU 85 2HG GLU 85 6.528 2.039 -11.203
149 HG3 GLU 85 1HG GLU 85 6.512 3.796 -11.324
150 H TRP 86 H TRP 86 8.617 2.065 -7.389
151 HA TRP 86 HA TRP 86 10.871 3.505 -6.673
152 HB2 TRP 86 2HB TRP 86 8.842 3.374 -5.334
153 HB3 TRP 86 1HB TRP 86 9.060 1.646 -5.127
154 HD1 TRP 86 HD TRP 86 10.142 4.981 -3.747
155 HE1 TRP 86 1HE TRP 86 11.542 4.596 -1.612
156 HE3 TRP 86 3HE TRP 86 10.633 -0.004 -4.090
157 HZ2 TRP 86 2HZ TRP 86 12.718 2.409 -0.264
158 HZ3 TRP 86 3HZ TRP 86 11.929 -1.230 -2.339
159 HH2 TRP 86 HH TRP 86 12.936 -0.027 -0.476
160 H ALA 87 H ALA 87 10.147 0.074 -6.641
161 HA ALA 87 HA ALA 87 12.495 -0.934 -5.551
162 HB1 ALA 87 1HB ALA 87 10.704 -2.151 -7.640
163 HB2 ALA 87 2HB ALA 87 10.463 -2.240 -5.900
164 HB3 ALA 87 3HB ALA 87 11.844 -3.044 -6.642
165 H ARG 88 H ARG 88 11.663 -0.176 -8.869
166 HA ARG 88 HA ARG 88 14.065 -1.097 -10.047
167 HB2 ARG 88 2HB ARG 88 12.031 0.914 -11.021
168 HB3 ARG 88 1HB ARG 88 13.393 0.392 -11.992
169 HG2 ARG 88 2HG ARG 88 11.167 -1.364 -10.956
170 HG3 ARG 88 1HG ARG 88 11.359 -0.788 -12.614
171 HD2 ARG 88 2HD ARG 88 13.488 -1.983 -12.779
172 HD3 ARG 88 1HD ARG 88 13.289 -2.570 -11.131
173 HE ARG 88 HE ARG 88 11.040 -3.305 -12.586
174 HH11 ARG 88 1HH1 ARG 88 14.478 -4.067 -12.409
175 HH12 ARG 88 2HH1 ARG 88 14.316 -5.630 -13.064
176 HH21 ARG 88 1HH2 ARG 88 10.814 -5.417 -13.472
177 HH22 ARG 88 2HH2 ARG 88 12.189 -6.413 -13.737
178 H ARG 89 H ARG 89 13.108 1.986 -8.704
179 HA ARG 89 HA ARG 89 15.435 3.419 -9.595
180 HB2 ARG 89 2HB ARG 89 13.707 4.157 -7.215
181 HB3 ARG 89 1HB ARG 89 14.696 5.233 -8.187
182 HG2 ARG 89 2HG ARG 89 12.154 3.852 -9.011
183 HG3 ARG 89 1HG ARG 89 12.400 5.575 -8.753
184 HD2 ARG 89 2HD ARG 89 13.732 5.772 -10.684
185 HD3 ARG 89 1HD ARG 89 13.953 4.024 -10.776
186 HE ARG 89 HE ARG 89 11.237 4.971 -11.062
187 HH11 ARG 89 1HH1 ARG 89 14.228 4.034 -12.718
188 HH12 ARG 89 2HH1 ARG 89 13.467 3.514 -14.144
189 HH21 ARG 89 1HH2 ARG 89 10.128 4.177 -13.099
190 HH22 ARG 89 2HH2 ARG 89 11.113 3.609 -14.340
191 H ASN 90 H ASN 90 14.585 1.729 -6.683
192 HA ASN 90 HA ASN 90 17.025 2.492 -5.346
193 HB2 ASN 90 2HB ASN 90 14.701 0.780 -4.566
194 HB3 ASN 90 1HB ASN 90 16.142 0.890 -3.546
195 HD21 ASN 90 1HD2 ASN 90 13.453 2.626 -4.906
196 HD22 ASN 90 2HD2 ASN 90 13.493 3.953 -3.814
197 H GLY 91 H GLY 91 16.009 -0.122 -7.297
198 HA2 GLY 91 2HA GLY 91 17.652 -1.448 -8.391
199 HA3 GLY 91 1HA GLY 91 18.718 -1.174 -7.021
200 H HIS 92 H HIS 92 15.376 -2.301 -6.996
201 HA HIS 92 HA HIS 92 16.274 -4.696 -5.610
202 HB2 HIS 92 2HB HIS 92 13.598 -3.377 -5.921
203 HB3 HIS 92 1HB HIS 92 13.773 -4.976 -5.210
204 HD1 HIS 92 1HD HIS 92 14.467 -5.022 -2.720
205 HD2 HIS 92 2HD HIS 92 14.668 -1.258 -4.458
206 HE1 HIS 92 1HE HIS 92 14.809 -3.416 -0.840
207 H ASN 93 H ASN 93 15.556 -6.721 -6.296
208 HA ASN 93 HA ASN 93 15.052 -6.808 -9.172
209 HB2 ASN 93 2HB ASN 93 16.190 -8.940 -7.340
210 HB3 ASN 93 1HB ASN 93 15.877 -9.159 -9.050
211 HD21 ASN 93 1HD2 ASN 93 17.298 -8.272 -10.538
212 HD22 ASN 93 2HD2 ASN 93 18.806 -7.564 -10.100
213 H VAL 94 H VAL 94 12.900 -6.414 -8.977
214 HA VAL 94 HA VAL 94 11.221 -8.282 -7.503
215 HB VAL 94 HB VAL 94 10.468 -5.849 -9.177
216 HG11 VAL 94 1HG1 VAL 94 8.762 -7.464 -7.280
217 HG12 VAL 94 2HG1 VAL 94 8.583 -7.407 -9.034
218 HG13 VAL 94 3HG1 VAL 94 8.281 -5.961 -8.067
219 HG21 VAL 94 1HG2 VAL 94 10.115 -4.745 -7.028
220 HG22 VAL 94 2HG2 VAL 94 11.785 -5.281 -7.223
221 HG23 VAL 94 3HG2 VAL 94 10.680 -6.193 -6.196
222 H SER 95 H SER 95 12.519 -7.889 -10.595
223 HA SER 95 HA SER 95 12.422 -8.987 -12.486
224 HB2 SER 95 2HB SER 95 12.330 -11.084 -11.211
225 HB3 SER 95 1HB SER 95 10.591 -10.905 -11.016
226 HG SER 95 HG SER 95 10.805 -12.275 -12.624
227 H THR 96 H THR 96 11.046 -9.428 -14.358
228 HA THR 96 HA THR 96 8.998 -7.485 -14.671
229 HB THR 96 HB THR 96 9.186 -9.628 -16.659
230 HG1 THR 96 1HG THR 96 11.504 -8.029 -16.240
231 HG21 THR 96 1HG2 THR 96 9.627 -7.703 -18.149
232 HG22 THR 96 2HG2 THR 96 9.753 -6.651 -16.740
233 HG23 THR 96 3HG2 THR 96 8.214 -7.419 -17.134
234 H ARG 97 H ARG 97 9.070 -10.613 -13.414
235 HA ARG 97 HA ARG 97 6.171 -10.956 -13.713
236 HB2 ARG 97 2HB ARG 97 8.328 -13.061 -13.793
237 HB3 ARG 97 1HB ARG 97 6.627 -13.421 -13.602
238 HG2 ARG 97 2HG ARG 97 6.169 -12.556 -15.814
239 HG3 ARG 97 1HG ARG 97 7.857 -12.062 -15.993
240 HD2 ARG 97 2HD ARG 97 7.395 -14.186 -17.128
241 HD3 ARG 97 1HD ARG 97 8.583 -14.375 -15.844
242 HE ARG 97 HE ARG 97 5.793 -15.268 -15.810
243 HH11 ARG 97 1HH1 ARG 97 8.982 -15.284 -14.249
244 HH12 ARG 97 2HH1 ARG 97 8.693 -16.662 -13.305
245 HH21 ARG 97 1HH2 ARG 97 5.404 -17.234 -14.521
246 HH22 ARG 97 2HH2 ARG 97 6.614 -17.809 -13.469
247 H GLY 98 H GLY 98 5.623 -12.807 -11.985
248 HA2 GLY 98 2HA GLY 98 5.757 -13.641 -9.858
249 HA3 GLY 98 1HA GLY 98 7.239 -12.733 -9.608
250 H ARG 99 H ARG 99 6.118 -12.460 -7.534
251 HA ARG 99 HA ARG 99 4.077 -10.348 -7.554
252 HB2 ARG 99 2HB ARG 99 3.716 -10.883 -5.218
253 HB3 ARG 99 1HB ARG 99 3.683 -12.377 -6.148
254 HG2 ARG 99 2HG ARG 99 5.939 -12.909 -5.451
255 HG3 ARG 99 1HG ARG 99 6.060 -11.374 -4.602
256 HD2 ARG 99 2HD ARG 99 4.229 -12.084 -3.113
257 HD3 ARG 99 1HD ARG 99 4.187 -13.640 -3.947
258 HE ARG 99 HE ARG 99 6.780 -12.933 -2.997
259 HH11 ARG 99 1HH1 ARG 99 3.727 -14.361 -1.910
260 HH12 ARG 99 2HH1 ARG 99 4.453 -15.385 -0.772
261 HH21 ARG 99 1HH2 ARG 99 7.768 -14.296 -1.405
262 HH22 ARG 99 2HH2 ARG 99 6.809 -15.337 -0.466
263 H ILE 100 H ILE 100 4.446 -8.746 -5.696
264 HA ILE 100 HA ILE 100 7.173 -7.786 -5.860
265 HB ILE 100 HB ILE 100 4.807 -6.563 -4.400
266 HG12 ILE 100 2HG1 ILE 100 5.885 -5.930 -7.157
267 HG13 ILE 100 1HG1 ILE 100 4.374 -6.765 -6.815
268 HG21 ILE 100 1HG2 ILE 100 7.462 -5.390 -5.262
269 HG22 ILE 100 2HG2 ILE 100 6.997 -5.795 -3.610
270 HG23 ILE 100 3HG2 ILE 100 6.157 -4.505 -4.470
271 HD11 ILE 100 1HD1 ILE 100 3.525 -4.773 -5.713
272 HD12 ILE 100 2HD1 ILE 100 4.016 -4.435 -7.379
273 HD13 ILE 100 3HD1 ILE 100 5.055 -3.956 -6.034
274 HA PRO 101 HA PRO 101 8.011 -9.969 -2.046
275 HB2 PRO 101 2HB PRO 101 10.337 -8.180 -1.841
276 HB3 PRO 101 1HB PRO 101 10.307 -9.945 -1.969
277 HG2 PRO 101 2HG PRO 101 11.144 -8.399 -3.975
278 HG3 PRO 101 1HG PRO 101 10.323 -9.949 -4.231
279 HD2 PRO 101 2HD PRO 101 9.249 -7.187 -4.550
280 HD3 PRO 101 1HD PRO 101 8.886 -8.676 -5.447
281 H ALA 102 H ALA 102 7.476 -9.589 -0.023
282 HA ALA 102 HA ALA 102 6.230 -7.196 0.793
283 HB1 ALA 102 1HB ALA 102 5.682 -9.399 1.747
284 HB2 ALA 102 2HB ALA 102 6.103 -8.235 3.004
285 HB3 ALA 102 3HB ALA 102 7.272 -9.457 2.506
286 H ASP 103 H ASP 103 9.468 -8.323 1.008
287 HA ASP 103 HA ASP 103 10.493 -6.529 2.925
288 HB2 ASP 103 2HB ASP 103 11.754 -8.472 2.099
289 HB3 ASP 103 1HB ASP 103 11.844 -7.712 0.517
290 H VAL 104 H VAL 104 9.958 -6.288 -0.530
291 HA VAL 104 HA VAL 104 11.285 -3.768 -0.843
292 HB VAL 104 HB VAL 104 9.329 -5.243 -2.653
293 HG11 VAL 104 1HG1 VAL 104 11.091 -2.878 -3.305
294 HG12 VAL 104 2HG1 VAL 104 9.339 -2.822 -3.112
295 HG13 VAL 104 3HG1 VAL 104 10.054 -3.750 -4.434
296 HG21 VAL 104 1HG2 VAL 104 12.319 -4.968 -2.785
297 HG22 VAL 104 2HG2 VAL 104 11.311 -5.824 -3.952
298 HG23 VAL 104 3HG2 VAL 104 11.440 -6.413 -2.293
299 H ILE 105 H ILE 105 8.020 -4.939 -0.460
300 HA ILE 105 HA ILE 105 6.657 -2.484 -0.658
301 HB ILE 105 HB ILE 105 5.910 -4.944 0.959
302 HG12 ILE 105 2HG1 ILE 105 5.073 -4.137 -1.842
303 HG13 ILE 105 1HG1 ILE 105 6.295 -5.342 -1.473
304 HG21 ILE 105 1HG2 ILE 105 3.611 -4.108 0.827
305 HG22 ILE 105 2HG2 ILE 105 4.183 -2.648 0.000
306 HG23 ILE 105 3HG2 ILE 105 4.659 -2.958 1.665
307 HD11 ILE 105 1HD1 ILE 105 4.168 -6.344 -2.075
308 HD12 ILE 105 2HD1 ILE 105 3.379 -5.532 -0.718
309 HD13 ILE 105 3HD1 ILE 105 4.624 -6.752 -0.429
310 H ASP 106 H ASP 106 8.133 -4.153 2.065
311 HA ASP 106 HA ASP 106 7.263 -2.416 4.112
312 HB2 ASP 106 2HB ASP 106 8.147 -4.673 4.578
313 HB3 ASP 106 1HB ASP 106 9.732 -4.169 4.002
314 H ALA 107 H ALA 107 10.269 -2.675 2.310
315 HA ALA 107 HA ALA 107 11.563 -0.468 3.427
316 HB1 ALA 107 1HB ALA 107 12.664 -2.224 2.138
317 HB2 ALA 107 2HB ALA 107 13.042 -0.623 1.496
318 HB3 ALA 107 3HB ALA 107 11.849 -1.661 0.684
319 H TYR 108 H TYR 108 9.443 -0.764 0.639
320 HA TYR 108 HA TYR 108 9.519 1.794 -0.404
321 HB2 TYR 108 2HB TYR 108 8.372 -0.061 -1.495
322 HB3 TYR 108 1HB TYR 108 7.225 -0.157 -0.172
323 HD1 TYR 108 1HD TYR 108 8.347 2.011 -2.962
324 HD2 TYR 108 2HD TYR 108 5.207 1.061 -0.279
325 HE1 TYR 108 1HE TYR 108 6.841 3.428 -4.252
326 HE2 TYR 108 2HE TYR 108 3.676 2.493 -1.554
327 HH TYR 108 HH TYR 108 3.682 4.268 -3.115
328 H HIS 109 H HIS 109 7.280 0.500 2.049
329 HA HIS 109 HA HIS 109 6.231 3.087 2.475
330 HB2 HIS 109 2HB HIS 109 5.680 0.489 3.871
331 HB3 HIS 109 1HB HIS 109 4.966 2.005 4.416
332 HD1 HIS 109 1HD HIS 109 3.375 3.237 2.634
333 HD2 HIS 109 2HD HIS 109 4.481 -0.657 1.718
334 HE1 HIS 109 1HE HIS 109 1.867 2.531 0.768
335 H ALA 110 H ALA 110 8.910 1.488 3.734
336 HA ALA 110 HA ALA 110 9.003 3.139 6.111
337 HB1 ALA 110 1HB ALA 110 11.061 1.960 6.641
338 HB2 ALA 110 2HB ALA 110 11.045 1.192 5.051
339 HB3 ALA 110 3HB ALA 110 9.785 0.817 6.223
340 H ALA 111 H ALA 111 10.019 3.388 2.833
341 HA ALA 111 HA ALA 111 12.089 5.351 3.507
342 HB1 ALA 111 1HB ALA 111 12.617 3.637 1.802
343 HB2 ALA 111 2HB ALA 111 12.597 5.275 1.131
344 HB3 ALA 111 3HB ALA 111 11.227 4.202 0.865
345 H THR 112 H THR 112 9.101 4.805 1.888
346 HA THR 112 HA THR 112 8.747 7.618 1.432
347 HB THR 112 HB THR 112 8.124 5.125 -0.126
348 HG1 THR 112 1HG THR 112 9.898 7.223 -0.280
349 HG21 THR 112 1HG2 THR 112 7.075 6.539 -1.774
350 HG22 THR 112 2HG2 THR 112 7.227 7.931 -0.651
351 HG23 THR 112 3HG2 THR 112 6.235 6.505 -0.215
Start of MODEL 12
1 H MET 65 1HT MET 65 17.326 7.263 -16.988
2 HA MET 65 HA MET 65 16.827 8.566 -15.053
3 HB2 MET 65 2HB MET 65 16.633 10.776 -16.104
4 HB3 MET 65 1HB MET 65 17.733 9.765 -17.014
5 HG2 MET 65 2HG MET 65 14.864 10.294 -17.756
6 HG3 MET 65 1HG MET 65 16.240 11.174 -18.410
7 HE1 MET 65 1HE MET 65 18.411 8.850 -18.848
8 HE2 MET 65 2HE MET 65 18.035 10.112 -20.019
9 HE3 MET 65 3HE MET 65 18.045 8.418 -20.518
10 H SER 66 H SER 66 15.407 9.502 -13.690
11 HA SER 66 HA SER 66 12.626 9.713 -14.468
12 HB2 SER 66 2HB SER 66 13.020 7.408 -13.491
13 HB3 SER 66 1HB SER 66 13.579 8.186 -12.014
14 HG SER 66 HG SER 66 11.564 8.927 -11.613
15 H GLY 67 H GLY 67 11.493 11.080 -12.807
16 HA2 GLY 67 2HA GLY 67 12.435 12.190 -10.565
17 HA3 GLY 67 1HA GLY 67 13.284 13.104 -11.811
18 H SER 68 H SER 68 10.008 11.971 -11.041
19 HA SER 68 HA SER 68 8.873 14.105 -12.533
20 HB2 SER 68 2HB SER 68 6.725 13.164 -11.385
21 HB3 SER 68 1HB SER 68 7.554 12.178 -12.589
22 HG SER 68 HG SER 68 8.151 10.827 -11.126
23 H GLY 69 H GLY 69 7.845 15.946 -11.751
24 HA2 GLY 69 2HA GLY 69 8.339 16.482 -8.909
25 HA3 GLY 69 1HA GLY 69 8.781 17.648 -10.149
26 H ARG 70 H ARG 70 7.356 18.755 -8.465
27 HA ARG 70 HA ARG 70 5.569 19.975 -8.019
28 HB2 ARG 70 2HB ARG 70 4.651 19.232 -10.812
29 HB3 ARG 70 1HB ARG 70 3.816 20.373 -9.779
30 HG2 ARG 70 2HG ARG 70 5.124 21.622 -11.379
31 HG3 ARG 70 1HG ARG 70 5.887 21.802 -9.800
32 HD2 ARG 70 2HD ARG 70 7.539 20.108 -10.403
33 HD3 ARG 70 1HD ARG 70 6.712 19.867 -11.931
34 HE ARG 70 HE ARG 70 7.263 22.266 -12.366
35 HH11 ARG 70 1HH1 ARG 70 9.355 20.363 -10.224
36 HH12 ARG 70 2HH1 ARG 70 10.817 20.973 -10.834
37 HH21 ARG 70 1HH2 ARG 70 9.311 23.175 -13.175
38 HH22 ARG 70 2HH2 ARG 70 10.792 22.629 -12.506
39 H GLY 71 H GLY 71 5.008 18.693 -6.344
40 HA2 GLY 71 2HA GLY 71 3.158 17.827 -5.221
41 HA3 GLY 71 1HA GLY 71 2.513 17.278 -6.772
42 H ARG 72 H ARG 72 2.517 15.201 -6.984
43 HA ARG 72 HA ARG 72 3.115 13.018 -7.043
44 HB2 ARG 72 2HB ARG 72 5.947 13.960 -6.544
45 HB3 ARG 72 1HB ARG 72 5.468 12.406 -7.195
46 HG2 ARG 72 2HG ARG 72 5.166 15.088 -8.526
47 HG3 ARG 72 1HG ARG 72 6.317 13.828 -8.947
48 HD2 ARG 72 2HD ARG 72 3.310 13.617 -9.148
49 HD3 ARG 72 1HD ARG 72 4.429 13.892 -10.477
50 HE ARG 72 HE ARG 72 4.825 11.469 -8.922
51 HH11 ARG 72 1HH1 ARG 72 3.486 12.955 -11.826
52 HH12 ARG 72 2HH1 ARG 72 3.441 11.514 -12.723
53 HH21 ARG 72 1HH2 ARG 72 4.734 9.482 -10.126
54 HH22 ARG 72 2HH2 ARG 72 4.159 9.462 -11.709
55 H GLY 73 H GLY 73 2.494 14.382 -4.498
56 HA2 GLY 73 2HA GLY 73 4.035 12.936 -2.502
57 HA3 GLY 73 1HA GLY 73 2.666 14.011 -2.200
58 H ALA 74 H ALA 74 1.136 12.694 -4.241
59 HA ALA 74 HA ALA 74 0.076 10.443 -2.687
60 HB1 ALA 74 1HB ALA 74 -1.817 10.640 -4.222
61 HB2 ALA 74 2HB ALA 74 -0.962 11.884 -5.130
62 HB3 ALA 74 3HB ALA 74 -1.466 12.195 -3.466
63 H ILE 75 H ILE 75 -0.615 8.595 -3.906
64 HA ILE 75 HA ILE 75 1.588 7.617 -5.494
65 HB ILE 75 HB ILE 75 -0.929 6.233 -4.543
66 HG12 ILE 75 2HG1 ILE 75 1.821 6.133 -3.336
67 HG13 ILE 75 1HG1 ILE 75 0.586 7.255 -2.780
68 HG21 ILE 75 1HG2 ILE 75 1.723 5.119 -5.523
69 HG22 ILE 75 2HG2 ILE 75 0.196 5.066 -6.402
70 HG23 ILE 75 3HG2 ILE 75 0.377 4.160 -4.903
71 HD11 ILE 75 1HD1 ILE 75 -0.827 5.378 -2.182
72 HD12 ILE 75 2HD1 ILE 75 0.719 5.345 -1.341
73 HD13 ILE 75 3HD1 ILE 75 0.431 4.244 -2.702
74 H ASP 76 H ASP 76 1.536 7.920 -7.499
75 HA ASP 76 HA ASP 76 -0.734 8.923 -8.963
76 HB2 ASP 76 2HB ASP 76 1.538 9.667 -9.502
77 HB3 ASP 76 1HB ASP 76 1.965 8.044 -10.017
78 H ARG 77 H ARG 77 0.925 5.869 -8.857
79 HA ARG 77 HA ARG 77 -0.971 4.767 -10.819
80 HB2 ARG 77 2HB ARG 77 1.881 3.952 -10.208
81 HB3 ARG 77 1HB ARG 77 0.833 3.175 -11.394
82 HG2 ARG 77 2HG ARG 77 0.739 5.154 -12.728
83 HG3 ARG 77 1HG ARG 77 1.562 6.085 -11.491
84 HD2 ARG 77 2HD ARG 77 3.583 4.761 -11.848
85 HD3 ARG 77 1HD ARG 77 2.745 3.822 -13.089
86 HE ARG 77 HE ARG 77 2.511 6.532 -13.701
87 HH11 ARG 77 1HH1 ARG 77 5.104 4.143 -13.527
88 HH12 ARG 77 2HH1 ARG 77 6.006 4.833 -14.801
89 HH21 ARG 77 1HH2 ARG 77 3.739 7.462 -15.434
90 HH22 ARG 77 2HH2 ARG 77 5.201 6.721 -15.938
91 H GLU 78 H GLU 78 -0.544 2.086 -10.399
92 HA GLU 78 HA GLU 78 -2.046 1.416 -8.123
93 HB2 GLU 78 2HB GLU 78 -0.012 -0.319 -9.529
94 HB3 GLU 78 1HB GLU 78 -1.370 -0.869 -8.568
95 HG2 GLU 78 2HG GLU 78 -2.906 -0.031 -10.275
96 HG3 GLU 78 1HG GLU 78 -1.530 0.551 -11.208
97 H GLN 79 H GLN 79 -1.338 0.613 -6.085
98 HA GLN 79 HA GLN 79 1.058 1.555 -4.972
99 HB2 GLN 79 2HB GLN 79 -0.480 -0.915 -4.135
100 HB3 GLN 79 1HB GLN 79 0.777 -0.154 -3.188
101 HG2 GLN 79 2HG GLN 79 -0.638 1.864 -3.024
102 HG3 GLN 79 1HG GLN 79 -1.910 0.994 -3.884
103 HE21 GLN 79 1HE2 GLN 79 -0.137 1.248 -0.917
104 HE22 GLN 79 2HE2 GLN 79 -1.162 0.214 0.007
105 H SER 80 H SER 80 0.228 -1.649 -6.215
106 HA SER 80 HA SER 80 2.594 -2.982 -5.896
107 HB2 SER 80 2HB SER 80 0.742 -3.251 -8.250
108 HB3 SER 80 1HB SER 80 1.654 -4.520 -7.422
109 HG SER 80 HG SER 80 0.342 -4.252 -5.631
110 H ALA 81 H ALA 81 1.489 -1.075 -8.692
111 HA ALA 81 HA ALA 81 3.739 -1.515 -10.312
112 HB1 ALA 81 1HB ALA 81 2.946 0.361 -11.645
113 HB2 ALA 81 2HB ALA 81 1.833 0.825 -10.360
114 HB3 ALA 81 3HB ALA 81 1.606 -0.707 -11.216
115 H ALA 82 H ALA 82 2.914 1.045 -8.055
116 HA ALA 82 HA ALA 82 5.163 2.645 -8.586
117 HB1 ALA 82 1HB ALA 82 3.136 3.514 -7.522
118 HB2 ALA 82 2HB ALA 82 4.570 3.847 -6.554
119 HB3 ALA 82 3HB ALA 82 3.473 2.538 -6.094
120 H ILE 83 H ILE 83 4.578 0.031 -6.255
121 HA ILE 83 HA ILE 83 7.026 0.325 -4.880
122 HB ILE 83 HB ILE 83 5.426 -2.231 -5.294
123 HG12 ILE 83 2HG1 ILE 83 5.423 -0.296 -2.964
124 HG13 ILE 83 1HG1 ILE 83 4.162 -0.413 -4.184
125 HG21 ILE 83 1HG2 ILE 83 6.605 -3.039 -3.269
126 HG22 ILE 83 2HG2 ILE 83 7.577 -1.567 -3.267
127 HG23 ILE 83 3HG2 ILE 83 7.721 -2.714 -4.598
128 HD11 ILE 83 1HD1 ILE 83 3.516 -1.530 -2.142
129 HD12 ILE 83 2HD1 ILE 83 4.952 -2.554 -2.241
130 HD13 ILE 83 3HD1 ILE 83 3.679 -2.695 -3.459
131 H ARG 84 H ARG 84 6.090 -1.607 -7.680
132 HA ARG 84 HA ARG 84 8.551 -2.859 -8.097
133 HB2 ARG 84 2HB ARG 84 6.274 -2.210 -9.960
134 HB3 ARG 84 1HB ARG 84 7.710 -3.070 -10.503
135 HG2 ARG 84 2HG ARG 84 7.295 -4.903 -9.132
136 HG3 ARG 84 1HG ARG 84 6.178 -3.995 -8.119
137 HD2 ARG 84 2HD ARG 84 5.014 -5.604 -9.511
138 HD3 ARG 84 1HD ARG 84 4.560 -3.949 -9.908
139 HE ARG 84 HE ARG 84 6.372 -4.385 -11.754
140 HH11 ARG 84 1HH1 ARG 84 3.848 -6.632 -10.634
141 HH12 ARG 84 2HH1 ARG 84 3.532 -7.288 -12.159
142 HH21 ARG 84 1HH2 ARG 84 5.926 -5.294 -13.890
143 HH22 ARG 84 2HH2 ARG 84 4.783 -6.527 -14.072
144 H GLU 85 H GLU 85 7.286 0.198 -9.305
145 HA GLU 85 HA GLU 85 9.528 0.898 -10.866
146 HB2 GLU 85 2HB GLU 85 7.405 2.563 -9.556
147 HB3 GLU 85 1HB GLU 85 8.631 3.233 -10.631
148 HG2 GLU 85 2HG GLU 85 7.826 1.859 -12.445
149 HG3 GLU 85 1HG GLU 85 6.666 1.086 -11.366
150 H TRP 86 H TRP 86 8.722 1.560 -7.457
151 HA TRP 86 HA TRP 86 10.887 3.265 -6.940
152 HB2 TRP 86 2HB TRP 86 8.925 3.164 -5.507
153 HB3 TRP 86 1HB TRP 86 9.219 1.471 -5.172
154 HD1 TRP 86 HD TRP 86 10.388 4.971 -4.186
155 HE1 TRP 86 1HE TRP 86 11.789 4.788 -2.038
156 HE3 TRP 86 3HE TRP 86 10.685 -0.080 -3.901
157 HZ2 TRP 86 2HZ TRP 86 12.890 2.738 -0.425
158 HZ3 TRP 86 3HZ TRP 86 11.939 -1.107 -2.002
159 HH2 TRP 86 HH TRP 86 13.009 0.289 -0.317
160 H ALA 87 H ALA 87 10.367 -0.189 -6.616
161 HA ALA 87 HA ALA 87 12.786 -0.977 -5.506
162 HB1 ALA 87 1HB ALA 87 10.845 -2.440 -5.737
163 HB2 ALA 87 2HB ALA 87 12.266 -3.185 -6.484
164 HB3 ALA 87 3HB ALA 87 11.035 -2.426 -7.484
165 H ARG 88 H ARG 88 11.825 -0.793 -8.879
166 HA ARG 88 HA ARG 88 14.294 -1.536 -9.959
167 HB2 ARG 88 2HB ARG 88 11.886 -0.157 -11.070
168 HB3 ARG 88 1HB ARG 88 13.337 -0.303 -12.049
169 HG2 ARG 88 2HG ARG 88 11.998 -2.664 -10.757
170 HG3 ARG 88 1HG ARG 88 11.608 -2.102 -12.385
171 HD2 ARG 88 2HD ARG 88 13.901 -2.412 -13.081
172 HD3 ARG 88 1HD ARG 88 14.371 -2.877 -11.454
173 HE ARG 88 HE ARG 88 13.329 -4.919 -11.738
174 HH11 ARG 88 1HH1 ARG 88 12.671 -2.965 -14.614
175 HH12 ARG 88 2HH1 ARG 88 12.640 -4.277 -15.680
176 HH21 ARG 88 1HH2 ARG 88 13.349 -6.702 -13.201
177 HH22 ARG 88 2HH2 ARG 88 12.994 -6.481 -14.861
178 H ARG 89 H ARG 89 13.017 1.657 -9.199
179 HA ARG 89 HA ARG 89 15.219 3.063 -10.295
180 HB2 ARG 89 2HB ARG 89 13.097 3.912 -8.356
181 HB3 ARG 89 1HB ARG 89 14.349 4.994 -8.963
182 HG2 ARG 89 2HG ARG 89 13.599 4.351 -11.285
183 HG3 ARG 89 1HG ARG 89 12.206 3.592 -10.518
184 HD2 ARG 89 2HD ARG 89 13.039 6.418 -10.182
185 HD3 ARG 89 1HD ARG 89 11.825 5.890 -11.353
186 HE ARG 89 HE ARG 89 11.499 5.498 -8.439
187 HH11 ARG 89 1HH1 ARG 89 10.241 6.750 -11.522
188 HH12 ARG 89 2HH1 ARG 89 8.727 7.184 -10.909
189 HH21 ARG 89 1HH2 ARG 89 9.368 6.198 -7.558
190 HH22 ARG 89 2HH2 ARG 89 8.232 6.861 -8.631
191 H ASN 90 H ASN 90 14.637 1.604 -7.214
192 HA ASN 90 HA ASN 90 17.026 2.862 -6.130
193 HB2 ASN 90 2HB ASN 90 14.817 1.285 -4.914
194 HB3 ASN 90 1HB ASN 90 16.331 1.484 -4.019
195 HD21 ASN 90 1HD2 ASN 90 13.475 2.998 -5.203
196 HD22 ASN 90 2HD2 ASN 90 13.680 4.505 -4.371
197 H GLY 91 H GLY 91 16.249 0.042 -7.735
198 HA2 GLY 91 2HA GLY 91 17.979 -1.318 -8.609
199 HA3 GLY 91 1HA GLY 91 18.991 -0.842 -7.257
200 H HIS 92 H HIS 92 15.752 -1.873 -6.642
201 HA HIS 92 HA HIS 92 16.753 -4.158 -5.207
202 HB2 HIS 92 2HB HIS 92 14.005 -2.974 -5.526
203 HB3 HIS 92 1HB HIS 92 14.280 -4.496 -4.693
204 HD1 HIS 92 1HD HIS 92 15.185 -4.340 -2.293
205 HD2 HIS 92 2HD HIS 92 14.922 -0.693 -4.237
206 HE1 HIS 92 1HE HIS 92 15.489 -2.570 -0.517
207 H ASN 93 H ASN 93 16.279 -6.254 -5.707
208 HA ASN 93 HA ASN 93 15.804 -6.702 -8.498
209 HB2 ASN 93 2HB ASN 93 16.602 -8.586 -6.289
210 HB3 ASN 93 1HB ASN 93 16.227 -9.146 -7.917
211 HD21 ASN 93 1HD2 ASN 93 17.634 -8.675 -9.584
212 HD22 ASN 93 2HD2 ASN 93 19.226 -8.078 -9.311
213 H VAL 94 H VAL 94 13.762 -6.022 -8.656
214 HA VAL 94 HA VAL 94 11.779 -8.077 -8.049
215 HB VAL 94 HB VAL 94 11.274 -5.071 -8.069
216 HG11 VAL 94 1HG1 VAL 94 9.375 -6.332 -8.913
217 HG12 VAL 94 2HG1 VAL 94 9.001 -5.648 -7.332
218 HG13 VAL 94 3HG1 VAL 94 9.400 -7.361 -7.481
219 HG21 VAL 94 1HG2 VAL 94 11.268 -6.992 -5.744
220 HG22 VAL 94 2HG2 VAL 94 10.740 -5.312 -5.677
221 HG23 VAL 94 3HG2 VAL 94 12.431 -5.694 -6.028
222 H SER 95 H SER 95 11.419 -8.923 -9.956
223 HA SER 95 HA SER 95 11.850 -7.308 -12.307
224 HB2 SER 95 2HB SER 95 12.981 -9.509 -12.111
225 HB3 SER 95 1HB SER 95 11.409 -10.297 -12.039
226 HG SER 95 HG SER 95 12.820 -9.422 -14.193
227 H THR 96 H THR 96 10.214 -8.456 -14.127
228 HA THR 96 HA THR 96 7.729 -7.163 -13.446
229 HB THR 96 HB THR 96 7.395 -7.507 -15.959
230 HG1 THR 96 1HG THR 96 8.912 -8.595 -16.932
231 HG21 THR 96 1HG2 THR 96 9.761 -5.899 -14.979
232 HG22 THR 96 2HG2 THR 96 8.079 -5.389 -14.889
233 HG23 THR 96 3HG2 THR 96 8.850 -5.606 -16.466
234 H ARG 97 H ARG 97 8.426 -10.048 -12.582
235 HA ARG 97 HA ARG 97 6.678 -11.639 -14.176
236 HB2 ARG 97 2HB ARG 97 7.997 -12.284 -11.539
237 HB3 ARG 97 1HB ARG 97 6.866 -13.378 -12.311
238 HG2 ARG 97 2HG ARG 97 8.991 -14.171 -12.882
239 HG3 ARG 97 1HG ARG 97 8.414 -13.337 -14.316
240 HD2 ARG 97 2HD ARG 97 9.722 -11.371 -13.697
241 HD3 ARG 97 1HD ARG 97 10.301 -12.211 -12.263
242 HE ARG 97 HE ARG 97 10.849 -13.052 -15.018
243 HH11 ARG 97 1HH1 ARG 97 11.833 -12.907 -11.614
244 HH12 ARG 97 2HH1 ARG 97 13.469 -13.275 -11.919
245 HH21 ARG 97 1HH2 ARG 97 13.142 -13.609 -15.420
246 HH22 ARG 97 2HH2 ARG 97 14.211 -13.706 -14.102
247 H GLY 98 H GLY 98 6.404 -10.220 -10.952
248 HA2 GLY 98 2HA GLY 98 3.983 -9.212 -11.078
249 HA3 GLY 98 1HA GLY 98 3.597 -10.921 -10.983
250 H ARG 99 H ARG 99 5.609 -11.718 -9.150
251 HA ARG 99 HA ARG 99 4.280 -10.658 -6.836
252 HB2 ARG 99 2HB ARG 99 6.269 -12.894 -7.035
253 HB3 ARG 99 1HB ARG 99 5.516 -12.363 -5.539
254 HG2 ARG 99 2HG ARG 99 3.301 -12.810 -6.602
255 HG3 ARG 99 1HG ARG 99 4.173 -13.574 -7.931
256 HD2 ARG 99 2HD ARG 99 5.230 -15.086 -6.333
257 HD3 ARG 99 1HD ARG 99 4.308 -14.314 -5.040
258 HE ARG 99 HE ARG 99 3.168 -15.894 -7.249
259 HH11 ARG 99 1HH1 ARG 99 2.883 -14.616 -3.948
260 HH12 ARG 99 2HH1 ARG 99 1.435 -15.451 -3.618
261 HH21 ARG 99 1HH2 ARG 99 1.144 -16.980 -6.778
262 HH22 ARG 99 2HH2 ARG 99 0.432 -16.789 -5.227
263 H ILE 100 H ILE 100 4.884 -9.195 -5.659
264 HA ILE 100 HA ILE 100 7.601 -8.155 -5.783
265 HB ILE 100 HB ILE 100 5.230 -7.029 -4.265
266 HG12 ILE 100 2HG1 ILE 100 6.279 -6.205 -6.979
267 HG13 ILE 100 1HG1 ILE 100 4.809 -7.131 -6.721
268 HG21 ILE 100 1HG2 ILE 100 7.428 -6.258 -3.475
269 HG22 ILE 100 2HG2 ILE 100 6.551 -4.952 -4.276
270 HG23 ILE 100 3HG2 ILE 100 7.855 -5.781 -5.120
271 HD11 ILE 100 1HD1 ILE 100 5.360 -4.352 -5.756
272 HD12 ILE 100 2HD1 ILE 100 3.876 -5.256 -5.446
273 HD13 ILE 100 3HD1 ILE 100 4.303 -4.795 -7.098
274 HA PRO 101 HA PRO 101 8.399 -10.269 -1.901
275 HB2 PRO 101 2HB PRO 101 10.725 -8.483 -1.663
276 HB3 PRO 101 1HB PRO 101 10.696 -10.253 -1.815
277 HG2 PRO 101 2HG PRO 101 11.568 -8.668 -3.796
278 HG3 PRO 101 1HG PRO 101 10.760 -10.223 -4.083
279 HD2 PRO 101 2HD PRO 101 9.659 -7.465 -4.343
280 HD3 PRO 101 1HD PRO 101 9.360 -8.921 -5.321
281 H ALA 102 H ALA 102 7.637 -9.759 0.050
282 HA ALA 102 HA ALA 102 6.465 -7.264 0.580
283 HB1 ALA 102 1HB ALA 102 5.644 -9.366 1.540
284 HB2 ALA 102 2HB ALA 102 5.943 -8.143 2.778
285 HB3 ALA 102 3HB ALA 102 7.093 -9.457 2.544
286 H ASP 103 H ASP 103 9.600 -8.462 1.173
287 HA ASP 103 HA ASP 103 10.487 -6.734 3.213
288 HB2 ASP 103 2HB ASP 103 12.136 -7.693 0.870
289 HB3 ASP 103 1HB ASP 103 12.699 -7.312 2.495
290 H VAL 104 H VAL 104 10.242 -6.449 -0.287
291 HA VAL 104 HA VAL 104 11.490 -3.866 -0.391
292 HB VAL 104 HB VAL 104 9.964 -5.466 -2.493
293 HG11 VAL 104 1HG1 VAL 104 11.515 -2.899 -2.877
294 HG12 VAL 104 2HG1 VAL 104 9.761 -3.021 -2.903
295 HG13 VAL 104 3HG1 VAL 104 10.719 -3.842 -4.138
296 HG21 VAL 104 1HG2 VAL 104 12.150 -6.373 -1.855
297 HG22 VAL 104 2HG2 VAL 104 12.873 -4.793 -2.236
298 HG23 VAL 104 3HG2 VAL 104 12.141 -5.753 -3.511
299 H ILE 105 H ILE 105 8.270 -5.217 -0.387
300 HA ILE 105 HA ILE 105 6.801 -2.853 -0.806
301 HB ILE 105 HB ILE 105 6.018 -5.234 0.912
302 HG12 ILE 105 2HG1 ILE 105 5.406 -4.630 -1.995
303 HG13 ILE 105 1HG1 ILE 105 6.579 -5.808 -1.430
304 HG21 ILE 105 1HG2 ILE 105 4.279 -3.058 -0.283
305 HG22 ILE 105 2HG2 ILE 105 4.633 -3.288 1.417
306 HG23 ILE 105 3HG2 ILE 105 3.687 -4.499 0.547
307 HD11 ILE 105 1HD1 ILE 105 4.547 -6.879 -2.150
308 HD12 ILE 105 2HD1 ILE 105 3.594 -5.918 -1.021
309 HD13 ILE 105 3HD1 ILE 105 4.750 -7.107 -0.417
310 H ASP 106 H ASP 106 7.986 -4.315 2.191
311 HA ASP 106 HA ASP 106 6.876 -2.336 3.886
312 HB2 ASP 106 2HB ASP 106 7.479 -4.553 4.733
313 HB3 ASP 106 1HB ASP 106 9.170 -4.229 4.379
314 H ALA 107 H ALA 107 10.090 -2.846 2.513
315 HA ALA 107 HA ALA 107 11.365 -0.640 3.612
316 HB1 ALA 107 1HB ALA 107 11.757 -1.846 0.880
317 HB2 ALA 107 2HB ALA 107 12.499 -2.416 2.371
318 HB3 ALA 107 3HB ALA 107 12.926 -0.822 1.728
319 H TYR 108 H TYR 108 9.445 -0.929 0.662
320 HA TYR 108 HA TYR 108 9.609 1.637 -0.369
321 HB2 TYR 108 2HB TYR 108 8.582 -0.117 -1.645
322 HB3 TYR 108 1HB TYR 108 7.385 -0.406 -0.398
323 HD1 TYR 108 1HD TYR 108 5.394 0.981 -0.258
324 HD2 TYR 108 2HD TYR 108 8.373 1.787 -3.167
325 HE1 TYR 108 1HE TYR 108 3.818 2.432 -1.444
326 HE2 TYR 108 2HE TYR 108 6.817 3.240 -4.369
327 HH TYR 108 HH TYR 108 4.344 3.484 -4.573
328 H HIS 109 H HIS 109 7.113 0.327 1.792
329 HA HIS 109 HA HIS 109 5.850 2.818 2.067
330 HB2 HIS 109 2HB HIS 109 5.503 0.266 3.619
331 HB3 HIS 109 1HB HIS 109 4.603 1.729 4.005
332 HD1 HIS 109 1HD HIS 109 2.780 2.509 2.223
333 HD2 HIS 109 2HD HIS 109 4.682 -1.080 1.340
334 HE1 HIS 109 1HE HIS 109 1.459 1.460 0.390
335 H ALA 110 H ALA 110 8.453 1.393 3.771
336 HA ALA 110 HA ALA 110 8.314 3.275 5.946
337 HB1 ALA 110 1HB ALA 110 9.183 1.009 6.330
338 HB2 ALA 110 2HB ALA 110 10.382 2.239 6.727
339 HB3 ALA 110 3HB ALA 110 10.510 1.337 5.216
340 H ALA 111 H ALA 111 9.711 3.158 2.818
341 HA ALA 111 HA ALA 111 11.600 5.259 3.478
342 HB1 ALA 111 1HB ALA 111 11.181 3.922 0.823
343 HB2 ALA 111 2HB ALA 111 12.336 3.400 2.046
344 HB3 ALA 111 3HB ALA 111 12.521 4.972 1.271
345 H THR 112 H THR 112 8.787 4.888 1.300
346 HA THR 112 HA THR 112 9.151 7.685 0.680
347 HB THR 112 HB THR 112 8.941 6.031 -1.212
348 HG1 THR 112 1HG THR 112 6.883 7.483 -1.990
349 HG21 THR 112 1HG2 THR 112 7.173 4.580 -0.317
350 HG22 THR 112 2HG2 THR 112 6.727 5.237 -1.891
351 HG23 THR 112 3HG2 THR 112 6.023 5.917 -0.424
Start of MODEL 13
1 H MET 65 1HT MET 65 9.953 11.765 -22.066
2 HA MET 65 HA MET 65 7.509 11.729 -23.764
3 HB2 MET 65 2HB MET 65 9.718 9.664 -23.537
4 HB3 MET 65 1HB MET 65 8.206 9.447 -24.393
5 HG2 MET 65 2HG MET 65 10.325 11.472 -25.077
6 HG3 MET 65 1HG MET 65 10.019 9.954 -25.924
7 HE1 MET 65 1HE MET 65 8.779 12.700 -28.450
8 HE2 MET 65 2HE MET 65 9.875 11.340 -28.202
9 HE3 MET 65 3HE MET 65 10.132 12.851 -27.328
10 H SER 66 H SER 66 9.193 9.626 -21.449
11 HA SER 66 HA SER 66 6.779 9.562 -19.894
12 HB2 SER 66 2HB SER 66 8.047 7.174 -21.227
13 HB3 SER 66 1HB SER 66 6.751 7.062 -20.009
14 HG SER 66 HG SER 66 5.792 8.671 -21.721
15 H GLY 67 H GLY 67 7.280 9.046 -17.742
16 HA2 GLY 67 2HA GLY 67 9.484 7.742 -16.777
17 HA3 GLY 67 1HA GLY 67 9.983 9.419 -16.977
18 H SER 68 H SER 68 8.121 10.974 -16.169
19 HA SER 68 HA SER 68 7.238 9.925 -13.584
20 HB2 SER 68 2HB SER 68 8.237 12.727 -14.161
21 HB3 SER 68 1HB SER 68 7.626 12.149 -12.610
22 HG SER 68 HG SER 68 9.873 11.148 -14.009
23 H GLY 69 H GLY 69 5.168 9.948 -13.344
24 HA2 GLY 69 2HA GLY 69 3.495 12.102 -14.179
25 HA3 GLY 69 1HA GLY 69 3.237 10.615 -15.105
26 H ARG 70 H ARG 70 3.656 11.773 -11.837
27 HA ARG 70 HA ARG 70 2.801 11.192 -9.851
28 HB2 ARG 70 2HB ARG 70 0.716 9.790 -11.536
29 HB3 ARG 70 1HB ARG 70 0.703 9.635 -9.785
30 HG2 ARG 70 2HG ARG 70 -0.899 11.295 -10.422
31 HG3 ARG 70 1HG ARG 70 0.438 12.118 -9.638
32 HD2 ARG 70 2HD ARG 70 -0.216 13.414 -11.537
33 HD3 ARG 70 1HD ARG 70 1.323 12.643 -11.915
34 HE ARG 70 HE ARG 70 -0.843 11.056 -12.842
35 HH11 ARG 70 1HH1 ARG 70 0.991 13.973 -13.639
36 HH12 ARG 70 2HH1 ARG 70 0.554 13.942 -15.282
37 HH21 ARG 70 1HH2 ARG 70 -1.436 11.029 -15.043
38 HH22 ARG 70 2HH2 ARG 70 -0.873 12.233 -16.120
39 H GLY 71 H GLY 71 1.986 8.703 -8.753
40 HA2 GLY 71 2HA GLY 71 2.919 6.646 -8.209
41 HA3 GLY 71 1HA GLY 71 3.894 6.744 -9.674
42 H ARG 72 H ARG 72 3.710 9.260 -7.375
43 HA ARG 72 HA ARG 72 6.509 8.858 -6.515
44 HB2 ARG 72 2HB ARG 72 5.078 11.399 -7.313
45 HB3 ARG 72 1HB ARG 72 6.647 11.364 -6.535
46 HG2 ARG 72 2HG ARG 72 7.653 10.342 -8.442
47 HG3 ARG 72 1HG ARG 72 6.075 10.051 -9.180
48 HD2 ARG 72 2HD ARG 72 7.312 11.993 -10.142
49 HD3 ARG 72 1HD ARG 72 5.718 12.387 -9.503
50 HE ARG 72 HE ARG 72 7.709 12.807 -7.535
51 HH11 ARG 72 1HH1 ARG 72 6.476 14.268 -10.519
52 HH12 ARG 72 2HH1 ARG 72 6.861 15.861 -10.041
53 HH21 ARG 72 1HH2 ARG 72 8.189 14.944 -6.896
54 HH22 ARG 72 2HH2 ARG 72 7.836 16.272 -7.913
55 H GLY 73 H GLY 73 3.744 8.336 -5.400
56 HA2 GLY 73 2HA GLY 73 3.234 8.452 -3.020
57 HA3 GLY 73 1HA GLY 73 3.849 10.105 -3.038
58 H ALA 74 H ALA 74 1.954 8.854 -5.613
59 HA ALA 74 HA ALA 74 -0.542 9.871 -4.751
60 HB1 ALA 74 1HB ALA 74 -0.823 11.473 -6.531
61 HB2 ALA 74 2HB ALA 74 0.864 11.247 -7.028
62 HB3 ALA 74 3HB ALA 74 0.484 11.972 -5.449
63 H ILE 75 H ILE 75 -1.988 8.674 -5.667
64 HA ILE 75 HA ILE 75 -0.946 6.650 -7.426
65 HB ILE 75 HB ILE 75 -3.366 6.753 -5.704
66 HG12 ILE 75 2HG1 ILE 75 -0.844 5.170 -5.309
67 HG13 ILE 75 1HG1 ILE 75 -1.037 6.807 -4.700
68 HG21 ILE 75 1HG2 ILE 75 -3.682 5.189 -7.595
69 HG22 ILE 75 2HG2 ILE 75 -3.479 4.281 -6.096
70 HG23 ILE 75 3HG2 ILE 75 -2.135 4.429 -7.229
71 HD11 ILE 75 1HD1 ILE 75 -2.733 4.450 -3.987
72 HD12 ILE 75 2HD1 ILE 75 -2.889 6.120 -3.394
73 HD13 ILE 75 3HD1 ILE 75 -1.445 5.180 -3.014
74 H ASP 76 H ASP 76 -1.071 7.556 -9.194
75 HA ASP 76 HA ASP 76 -3.704 7.620 -10.569
76 HB2 ASP 76 2HB ASP 76 -2.660 9.856 -10.652
77 HB3 ASP 76 1HB ASP 76 -1.166 9.155 -11.237
78 H ARG 77 H ARG 77 -1.162 5.971 -9.824
79 HA ARG 77 HA ARG 77 -1.129 4.184 -12.069
80 HB2 ARG 77 2HB ARG 77 1.335 5.266 -10.624
81 HB3 ARG 77 1HB ARG 77 1.335 3.958 -11.804
82 HG2 ARG 77 2HG ARG 77 0.717 5.428 -13.552
83 HG3 ARG 77 1HG ARG 77 0.421 6.735 -12.410
84 HD2 ARG 77 2HD ARG 77 2.521 7.121 -13.543
85 HD3 ARG 77 1HD ARG 77 2.832 6.742 -11.859
86 HE ARG 77 HE ARG 77 3.528 4.562 -12.544
87 HH11 ARG 77 1HH1 ARG 77 3.123 6.854 -15.244
88 HH12 ARG 77 2HH1 ARG 77 4.389 6.202 -16.165
89 HH21 ARG 77 1HH2 ARG 77 5.302 3.710 -13.852
90 HH22 ARG 77 2HH2 ARG 77 5.609 4.367 -15.399
91 H GLU 78 H GLU 78 -0.679 2.122 -11.182
92 HA GLU 78 HA GLU 78 -2.004 1.828 -8.696
93 HB2 GLU 78 2HB GLU 78 -0.572 -0.270 -10.303
94 HB3 GLU 78 1HB GLU 78 -1.707 -0.567 -8.993
95 HG2 GLU 78 2HG GLU 78 -2.284 0.653 -11.675
96 HG3 GLU 78 1HG GLU 78 -2.843 -0.894 -11.044
97 H GLN 79 H GLN 79 -1.341 1.135 -6.742
98 HA GLN 79 HA GLN 79 1.070 1.913 -5.654
99 HB2 GLN 79 2HB GLN 79 -0.739 -0.309 -4.683
100 HB3 GLN 79 1HB GLN 79 0.531 0.446 -3.739
101 HG2 GLN 79 2HG GLN 79 -0.641 2.546 -3.760
102 HG3 GLN 79 1HG GLN 79 -1.883 1.881 -4.821
103 HE21 GLN 79 1HE2 GLN 79 -3.525 2.259 -3.353
104 HE22 GLN 79 2HE2 GLN 79 -3.710 1.343 -1.907
105 H SER 80 H SER 80 0.105 -1.365 -6.641
106 HA SER 80 HA SER 80 2.432 -2.718 -5.980
107 HB2 SER 80 2HB SER 80 0.355 -3.856 -6.612
108 HB3 SER 80 1HB SER 80 0.499 -3.240 -8.257
109 HG SER 80 HG SER 80 1.474 -5.047 -8.576
110 H ALA 81 H ALA 81 1.587 -1.154 -9.066
111 HA ALA 81 HA ALA 81 4.007 -1.785 -10.359
112 HB1 ALA 81 1HB ALA 81 2.096 0.476 -10.924
113 HB2 ALA 81 2HB ALA 81 1.985 -1.160 -11.580
114 HB3 ALA 81 3HB ALA 81 3.346 -0.127 -12.015
115 H ALA 82 H ALA 82 2.957 0.973 -8.435
116 HA ALA 82 HA ALA 82 5.207 2.602 -8.839
117 HB1 ALA 82 1HB ALA 82 3.101 3.425 -7.871
118 HB2 ALA 82 2HB ALA 82 4.490 3.804 -6.849
119 HB3 ALA 82 3HB ALA 82 3.412 2.476 -6.416
120 H ILE 83 H ILE 83 4.560 0.073 -6.459
121 HA ILE 83 HA ILE 83 6.955 0.414 -4.981
122 HB ILE 83 HB ILE 83 5.362 -2.148 -5.356
123 HG12 ILE 83 2HG1 ILE 83 5.196 -0.090 -3.144
124 HG13 ILE 83 1HG1 ILE 83 4.019 -0.281 -4.432
125 HG21 ILE 83 1HG2 ILE 83 7.604 -2.591 -4.478
126 HG22 ILE 83 2HG2 ILE 83 6.399 -2.853 -3.215
127 HG23 ILE 83 3HG2 ILE 83 7.364 -1.377 -3.221
128 HD11 ILE 83 1HD1 ILE 83 4.670 -2.310 -2.303
129 HD12 ILE 83 2HD1 ILE 83 3.497 -2.526 -3.601
130 HD13 ILE 83 3HD1 ILE 83 3.233 -1.287 -2.370
131 H ARG 84 H ARG 84 6.100 -1.615 -7.705
132 HA ARG 84 HA ARG 84 8.515 -3.001 -8.080
133 HB2 ARG 84 2HB ARG 84 6.265 -2.206 -9.878
134 HB3 ARG 84 1HB ARG 84 7.693 -2.977 -10.546
135 HG2 ARG 84 2HG ARG 84 7.250 -4.980 -9.530
136 HG3 ARG 84 1HG ARG 84 6.323 -4.230 -8.230
137 HD2 ARG 84 2HD ARG 84 5.055 -5.574 -9.992
138 HD3 ARG 84 1HD ARG 84 4.432 -3.987 -9.553
139 HE ARG 84 HE ARG 84 5.906 -3.366 -11.668
140 HH11 ARG 84 1HH1 ARG 84 3.762 -6.178 -11.342
141 HH12 ARG 84 2HH1 ARG 84 3.199 -6.073 -12.949
142 HH21 ARG 84 1HH2 ARG 84 5.042 -3.212 -13.859
143 HH22 ARG 84 2HH2 ARG 84 3.911 -4.385 -14.368
144 H GLU 85 H GLU 85 7.407 0.056 -9.410
145 HA GLU 85 HA GLU 85 9.739 0.555 -10.911
146 HB2 GLU 85 2HB GLU 85 7.566 2.352 -9.915
147 HB3 GLU 85 1HB GLU 85 8.854 2.902 -10.989
148 HG2 GLU 85 2HG GLU 85 8.149 1.244 -12.650
149 HG3 GLU 85 1HG GLU 85 6.854 0.734 -11.567
150 H TRP 86 H TRP 86 8.771 1.420 -7.620
151 HA TRP 86 HA TRP 86 10.910 3.118 -7.028
152 HB2 TRP 86 2HB TRP 86 8.904 2.995 -5.653
153 HB3 TRP 86 1HB TRP 86 9.181 1.295 -5.337
154 HD1 TRP 86 HD TRP 86 10.225 4.763 -4.187
155 HE1 TRP 86 1HE TRP 86 11.597 4.545 -2.038
156 HE3 TRP 86 3HE TRP 86 10.710 -0.274 -4.103
157 HZ2 TRP 86 2HZ TRP 86 12.738 2.475 -0.480
158 HZ3 TRP 86 3HZ TRP 86 11.969 -1.329 -2.228
159 HH2 TRP 86 HH TRP 86 12.948 0.032 -0.469
160 H ALA 87 H ALA 87 10.393 -0.340 -6.798
161 HA ALA 87 HA ALA 87 12.770 -1.127 -5.628
162 HB1 ALA 87 1HB ALA 87 11.089 -2.576 -7.662
163 HB2 ALA 87 2HB ALA 87 10.856 -2.602 -5.916
164 HB3 ALA 87 3HB ALA 87 12.295 -3.330 -6.627
165 H ARG 88 H ARG 88 11.958 -0.745 -9.065
166 HA ARG 88 HA ARG 88 14.518 -1.490 -10.018
167 HB2 ARG 88 2HB ARG 88 12.508 0.320 -11.344
168 HB3 ARG 88 1HB ARG 88 13.942 -0.327 -12.115
169 HG2 ARG 88 2HG ARG 88 12.938 -2.635 -11.506
170 HG3 ARG 88 1HG ARG 88 11.428 -1.731 -11.314
171 HD2 ARG 88 2HD ARG 88 11.800 -0.766 -13.568
172 HD3 ARG 88 1HD ARG 88 13.201 -1.816 -13.719
173 HE ARG 88 HE ARG 88 10.395 -2.583 -13.736
174 HH11 ARG 88 1HH1 ARG 88 13.748 -3.681 -13.835
175 HH12 ARG 88 2HH1 ARG 88 13.480 -5.023 -14.829
176 HH21 ARG 88 1HH2 ARG 88 9.980 -4.501 -15.199
177 HH22 ARG 88 2HH2 ARG 88 11.272 -5.483 -15.645
178 H ARG 89 H ARG 89 13.154 1.661 -9.200
179 HA ARG 89 HA ARG 89 15.275 3.320 -10.006
180 HB2 ARG 89 2HB ARG 89 13.255 3.651 -7.785
181 HB3 ARG 89 1HB ARG 89 14.394 4.902 -8.228
182 HG2 ARG 89 2HG ARG 89 12.324 3.746 -10.094
183 HG3 ARG 89 1HG ARG 89 12.098 5.208 -9.141
184 HD2 ARG 89 2HD ARG 89 14.133 6.134 -10.253
185 HD3 ARG 89 1HD ARG 89 14.123 4.735 -11.325
186 HE ARG 89 HE ARG 89 11.694 5.597 -11.732
187 HH11 ARG 89 1HH1 ARG 89 14.611 7.603 -11.396
188 HH12 ARG 89 2HH1 ARG 89 14.082 8.832 -12.426
189 HH21 ARG 89 1HH2 ARG 89 10.933 7.343 -13.118
190 HH22 ARG 89 2HH2 ARG 89 11.949 8.686 -13.422
191 H ASN 90 H ASN 90 14.733 1.535 -7.063
192 HA ASN 90 HA ASN 90 17.062 2.691 -5.786
193 HB2 ASN 90 2HB ASN 90 14.846 0.941 -4.888
194 HB3 ASN 90 1HB ASN 90 16.295 1.077 -3.875
195 HD21 ASN 90 1HD2 ASN 90 13.504 2.683 -5.175
196 HD22 ASN 90 2HD2 ASN 90 13.546 4.075 -4.182
197 H GLY 91 H GLY 91 16.299 -0.180 -7.500
198 HA2 GLY 91 2HA GLY 91 18.073 -1.451 -8.469
199 HA3 GLY 91 1HA GLY 91 19.086 -1.033 -7.099
200 H HIS 92 H HIS 92 15.789 -2.243 -6.895
201 HA HIS 92 HA HIS 92 16.780 -4.530 -5.401
202 HB2 HIS 92 2HB HIS 92 14.034 -3.336 -5.714
203 HB3 HIS 92 1HB HIS 92 14.327 -4.852 -4.877
204 HD1 HIS 92 1HD HIS 92 15.155 -4.643 -2.419
205 HD2 HIS 92 2HD HIS 92 14.942 -1.043 -4.460
206 HE1 HIS 92 1HE HIS 92 15.463 -2.856 -0.693
207 H ASN 93 H ASN 93 15.673 -6.569 -5.760
208 HA ASN 93 HA ASN 93 15.391 -7.141 -8.621
209 HB2 ASN 93 2HB ASN 93 15.734 -8.995 -6.234
210 HB3 ASN 93 1HB ASN 93 15.549 -9.533 -7.894
211 HD21 ASN 93 1HD2 ASN 93 17.649 -8.037 -5.592
212 HD22 ASN 93 2HD2 ASN 93 19.098 -8.122 -6.509
213 H VAL 94 H VAL 94 13.307 -6.662 -9.113
214 HA VAL 94 HA VAL 94 11.250 -8.309 -7.850
215 HB VAL 94 HB VAL 94 10.863 -5.315 -8.307
216 HG11 VAL 94 1HG1 VAL 94 8.617 -5.642 -7.370
217 HG12 VAL 94 2HG1 VAL 94 8.912 -7.378 -7.282
218 HG13 VAL 94 3HG1 VAL 94 8.848 -6.574 -8.849
219 HG21 VAL 94 1HG2 VAL 94 10.470 -5.186 -5.883
220 HG22 VAL 94 2HG2 VAL 94 12.104 -5.743 -6.258
221 HG23 VAL 94 3HG2 VAL 94 10.877 -6.897 -5.738
222 H SER 95 H SER 95 11.953 -5.902 -10.344
223 HA SER 95 HA SER 95 11.499 -5.728 -12.513
224 HB2 SER 95 2HB SER 95 12.607 -8.013 -12.537
225 HB3 SER 95 1HB SER 95 11.001 -8.715 -12.392
226 HG SER 95 HG SER 95 11.426 -8.774 -14.484
227 H THR 96 H THR 96 9.568 -7.050 -14.088
228 HA THR 96 HA THR 96 7.096 -6.106 -12.840
229 HB THR 96 HB THR 96 6.406 -6.046 -15.343
230 HG1 THR 96 1HG THR 96 7.945 -6.867 -16.515
231 HG21 THR 96 1HG2 THR 96 7.460 -3.829 -15.609
232 HG22 THR 96 2HG2 THR 96 8.509 -4.191 -14.227
233 HG23 THR 96 3HG2 THR 96 6.764 -4.066 -14.006
234 H ARG 97 H ARG 97 8.478 -8.826 -12.749
235 HA ARG 97 HA ARG 97 6.250 -10.407 -13.803
236 HB2 ARG 97 2HB ARG 97 9.174 -11.182 -13.791
237 HB3 ARG 97 1HB ARG 97 7.858 -12.239 -14.272
238 HG2 ARG 97 2HG ARG 97 7.357 -10.821 -16.157
239 HG3 ARG 97 1HG ARG 97 8.584 -9.658 -15.645
240 HD2 ARG 97 2HD ARG 97 9.396 -11.046 -17.455
241 HD3 ARG 97 1HD ARG 97 10.313 -11.367 -15.992
242 HE ARG 97 HE ARG 97 8.122 -13.077 -16.927
243 HH11 ARG 97 1HH1 ARG 97 11.359 -12.749 -15.513
244 HH12 ARG 97 2HH1 ARG 97 11.733 -14.406 -15.626
245 HH21 ARG 97 1HH2 ARG 97 8.644 -15.362 -17.093
246 HH22 ARG 97 2HH2 ARG 97 10.134 -15.949 -16.554
247 H GLY 98 H GLY 98 5.196 -11.188 -12.039
248 HA2 GLY 98 2HA GLY 98 5.271 -12.906 -10.329
249 HA3 GLY 98 1HA GLY 98 6.838 -12.268 -9.857
250 H ARG 99 H ARG 99 5.458 -12.411 -7.787
251 HA ARG 99 HA ARG 99 3.993 -9.919 -7.444
252 HB2 ARG 99 2HB ARG 99 2.792 -11.919 -6.704
253 HB3 ARG 99 1HB ARG 99 4.148 -12.392 -5.695
254 HG2 ARG 99 2HG ARG 99 3.758 -10.621 -4.182
255 HG3 ARG 99 1HG ARG 99 2.616 -9.846 -5.282
256 HD2 ARG 99 2HD ARG 99 2.196 -12.551 -4.019
257 HD3 ARG 99 1HD ARG 99 1.542 -11.044 -3.376
258 HE ARG 99 HE ARG 99 0.914 -11.885 -6.116
259 HH11 ARG 99 1HH1 ARG 99 -0.249 -11.186 -2.830
260 HH12 ARG 99 2HH1 ARG 99 -1.877 -11.089 -3.278
261 HH21 ARG 99 1HH2 ARG 99 -1.301 -11.785 -6.715
262 HH22 ARG 99 2HH2 ARG 99 -2.508 -11.436 -5.543
263 H ILE 100 H ILE 100 4.585 -8.492 -5.804
264 HA ILE 100 HA ILE 100 7.388 -8.105 -5.637
265 HB ILE 100 HB ILE 100 5.215 -6.677 -4.105
266 HG12 ILE 100 2HG1 ILE 100 6.332 -6.025 -6.830
267 HG13 ILE 100 1HG1 ILE 100 4.756 -6.757 -6.551
268 HG21 ILE 100 1HG2 ILE 100 7.475 -6.203 -3.328
269 HG22 ILE 100 2HG2 ILE 100 6.788 -4.799 -4.147
270 HG23 ILE 100 3HG2 ILE 100 7.976 -5.807 -4.979
271 HD11 ILE 100 1HD1 ILE 100 4.550 -4.388 -6.947
272 HD12 ILE 100 2HD1 ILE 100 5.671 -4.077 -5.618
273 HD13 ILE 100 3HD1 ILE 100 4.087 -4.780 -5.286
274 HA PRO 101 HA PRO 101 8.124 -10.372 -1.828
275 HB2 PRO 101 2HB PRO 101 10.558 -8.700 -1.676
276 HB3 PRO 101 1HB PRO 101 10.425 -10.469 -1.751
277 HG2 PRO 101 2HG PRO 101 11.323 -9.034 -3.807
278 HG3 PRO 101 1HG PRO 101 10.389 -10.532 -4.020
279 HD2 PRO 101 2HD PRO 101 9.517 -7.711 -4.371
280 HD3 PRO 101 1HD PRO 101 9.038 -9.178 -5.253
281 H ALA 102 H ALA 102 7.544 -9.871 0.179
282 HA ALA 102 HA ALA 102 6.473 -7.375 0.842
283 HB1 ALA 102 1HB ALA 102 7.211 -9.622 2.696
284 HB2 ALA 102 2HB ALA 102 5.685 -9.469 1.823
285 HB3 ALA 102 3HB ALA 102 6.113 -8.294 3.069
286 H ASP 103 H ASP 103 9.658 -8.587 1.218
287 HA ASP 103 HA ASP 103 10.634 -6.817 3.195
288 HB2 ASP 103 2HB ASP 103 12.137 -7.977 0.826
289 HB3 ASP 103 1HB ASP 103 12.868 -7.239 2.245
290 H VAL 104 H VAL 104 10.294 -6.577 -0.307
291 HA VAL 104 HA VAL 104 11.523 -4.005 -0.495
292 HB VAL 104 HB VAL 104 9.797 -5.560 -2.471
293 HG11 VAL 104 1HG1 VAL 104 10.511 -3.975 -4.172
294 HG12 VAL 104 2HG1 VAL 104 11.458 -3.096 -2.989
295 HG13 VAL 104 3HG1 VAL 104 9.692 -3.099 -2.873
296 HG21 VAL 104 1HG2 VAL 104 11.887 -5.968 -3.635
297 HG22 VAL 104 2HG2 VAL 104 11.991 -6.567 -1.971
298 HG23 VAL 104 3HG2 VAL 104 12.752 -5.034 -2.425
299 H ILE 105 H ILE 105 8.288 -5.303 -0.314
300 HA ILE 105 HA ILE 105 6.856 -2.916 -0.655
301 HB ILE 105 HB ILE 105 6.092 -5.326 1.021
302 HG12 ILE 105 2HG1 ILE 105 5.417 -4.575 -1.827
303 HG13 ILE 105 1HG1 ILE 105 6.554 -5.818 -1.333
304 HG21 ILE 105 1HG2 ILE 105 4.350 -3.093 -0.042
305 HG22 ILE 105 2HG2 ILE 105 4.744 -3.379 1.650
306 HG23 ILE 105 3HG2 ILE 105 3.766 -4.547 0.765
307 HD11 ILE 105 1HD1 ILE 105 4.473 -6.756 -2.049
308 HD12 ILE 105 2HD1 ILE 105 3.590 -5.822 -0.835
309 HD13 ILE 105 3HD1 ILE 105 4.722 -7.085 -0.338
310 H ASP 106 H ASP 106 8.132 -4.367 2.339
311 HA ASP 106 HA ASP 106 7.111 -2.314 4.011
312 HB2 ASP 106 2HB ASP 106 7.756 -4.433 5.017
313 HB3 ASP 106 1HB ASP 106 9.421 -4.211 4.485
314 H ALA 107 H ALA 107 10.208 -2.839 2.445
315 HA ALA 107 HA ALA 107 11.551 -0.597 3.425
316 HB1 ALA 107 1HB ALA 107 12.626 -2.419 2.202
317 HB2 ALA 107 2HB ALA 107 13.014 -0.856 1.470
318 HB3 ALA 107 3HB ALA 107 11.801 -1.916 0.733
319 H TYR 108 H TYR 108 9.459 -0.970 0.616
320 HA TYR 108 HA TYR 108 9.580 1.583 -0.475
321 HB2 TYR 108 2HB TYR 108 8.541 -0.229 -1.674
322 HB3 TYR 108 1HB TYR 108 7.339 -0.447 -0.410
323 HD1 TYR 108 1HD TYR 108 8.411 1.712 -3.199
324 HD2 TYR 108 2HD TYR 108 5.351 0.919 -0.357
325 HE1 TYR 108 1HE TYR 108 6.916 3.178 -4.425
326 HE2 TYR 108 2HE TYR 108 3.820 2.403 -1.585
327 HH TYR 108 HH TYR 108 3.895 4.209 -3.130
328 H HIS 109 H HIS 109 7.122 0.272 1.742
329 HA HIS 109 HA HIS 109 5.859 2.772 2.087
330 HB2 HIS 109 2HB HIS 109 5.626 0.206 3.665
331 HB3 HIS 109 1HB HIS 109 4.690 1.642 4.051
332 HD1 HIS 109 1HD HIS 109 2.742 2.259 2.402
333 HD2 HIS 109 2HD HIS 109 4.816 -1.193 1.398
334 HE1 HIS 109 1HE HIS 109 1.354 1.099 0.659
335 H ALA 110 H ALA 110 8.615 1.441 3.553
336 HA ALA 110 HA ALA 110 8.583 3.195 5.835
337 HB1 ALA 110 1HB ALA 110 10.829 1.537 4.692
338 HB2 ALA 110 2HB ALA 110 9.707 1.022 5.950
339 HB3 ALA 110 3HB ALA 110 10.840 2.337 6.262
340 H ALA 111 H ALA 111 9.945 3.182 2.610
341 HA ALA 111 HA ALA 111 11.606 5.486 3.141
342 HB1 ALA 111 1HB ALA 111 12.392 3.703 1.666
343 HB2 ALA 111 2HB ALA 111 12.356 5.269 0.852
344 HB3 ALA 111 3HB ALA 111 11.094 4.077 0.532
345 H THR 112 H THR 112 8.513 4.886 1.540
346 HA THR 112 HA THR 112 8.486 7.731 1.016
347 HB THR 112 HB THR 112 8.484 6.420 -1.082
348 HG1 THR 112 1HG THR 112 7.505 8.319 -1.308
349 HG21 THR 112 1HG2 THR 112 7.309 4.404 -0.366
350 HG22 THR 112 2HG2 THR 112 6.542 5.097 -1.790
351 HG23 THR 112 3HG2 THR 112 5.809 5.320 -0.200
Start of MODEL 14
1 H MET 65 1HT MET 65 18.254 22.973 -12.389
2 HA MET 65 HA MET 65 17.967 23.692 -10.105
3 HB2 MET 65 2HB MET 65 19.083 25.212 -11.756
4 HB3 MET 65 1HB MET 65 17.528 25.949 -12.096
5 HG2 MET 65 2HG MET 65 17.394 26.707 -9.762
6 HG3 MET 65 1HG MET 65 18.976 25.995 -9.460
7 HE1 MET 65 1HE MET 65 18.340 28.975 -8.745
8 HE2 MET 65 2HE MET 65 19.780 29.802 -9.343
9 HE3 MET 65 3HE MET 65 19.930 28.249 -8.519
10 H SER 66 H SER 66 16.621 24.445 -8.514
11 HA SER 66 HA SER 66 14.746 24.810 -7.408
12 HB2 SER 66 2HB SER 66 13.627 25.912 -10.005
13 HB3 SER 66 1HB SER 66 12.904 26.126 -8.405
14 HG SER 66 HG SER 66 15.367 26.852 -8.119
15 H GLY 67 H GLY 67 14.418 22.838 -6.845
16 HA2 GLY 67 2HA GLY 67 13.147 20.929 -8.592
17 HA3 GLY 67 1HA GLY 67 13.725 20.648 -6.954
18 H SER 68 H SER 68 11.292 22.585 -8.593
19 HA SER 68 HA SER 68 9.439 22.647 -6.483
20 HB2 SER 68 2HB SER 68 8.904 22.852 -9.448
21 HB3 SER 68 1HB SER 68 7.945 23.541 -8.141
22 HG SER 68 HG SER 68 9.385 25.093 -7.850
23 H GLY 69 H GLY 69 8.200 21.008 -5.775
24 HA2 GLY 69 2HA GLY 69 7.950 18.616 -7.419
25 HA3 GLY 69 1HA GLY 69 7.606 18.734 -5.697
26 H ARG 70 H ARG 70 5.739 19.722 -5.006
27 HA ARG 70 HA ARG 70 3.540 19.903 -4.920
28 HB2 ARG 70 2HB ARG 70 3.908 21.365 -7.495
29 HB3 ARG 70 1HB ARG 70 2.432 21.362 -6.538
30 HG2 ARG 70 2HG ARG 70 3.877 22.197 -4.610
31 HG3 ARG 70 1HG ARG 70 5.103 22.532 -5.836
32 HD2 ARG 70 2HD ARG 70 3.436 23.846 -7.072
33 HD3 ARG 70 1HD ARG 70 2.310 23.510 -5.753
34 HE ARG 70 HE ARG 70 4.726 24.738 -4.840
35 HH11 ARG 70 1HH1 ARG 70 1.538 25.417 -6.167
36 HH12 ARG 70 2HH1 ARG 70 1.492 27.037 -5.611
37 HH21 ARG 70 1HH2 ARG 70 4.664 26.960 -4.074
38 HH22 ARG 70 2HH2 ARG 70 3.312 27.935 -4.408
39 H GLY 71 H GLY 71 3.087 17.769 -4.976
40 HA2 GLY 71 2HA GLY 71 1.485 16.993 -7.220
41 HA3 GLY 71 1HA GLY 71 2.910 15.993 -6.937
42 H ARG 72 H ARG 72 1.517 14.241 -6.467
43 HA ARG 72 HA ARG 72 -0.193 14.505 -4.154
44 HB2 ARG 72 2HB ARG 72 0.327 12.125 -5.927
45 HB3 ARG 72 1HB ARG 72 -0.852 12.190 -4.631
46 HG2 ARG 72 2HG ARG 72 -1.941 14.082 -5.887
47 HG3 ARG 72 1HG ARG 72 -0.875 13.685 -7.236
48 HD2 ARG 72 2HD ARG 72 -3.031 12.584 -7.516
49 HD3 ARG 72 1HD ARG 72 -1.764 11.385 -7.237
50 HE ARG 72 HE ARG 72 -2.629 11.766 -4.766
51 HH11 ARG 72 1HH1 ARG 72 -4.484 11.135 -7.725
52 HH12 ARG 72 2HH1 ARG 72 -5.823 10.490 -6.890
53 HH21 ARG 72 1HH2 ARG 72 -4.422 10.842 -3.658
54 HH22 ARG 72 2HH2 ARG 72 -5.787 10.288 -4.520
55 H GLY 73 H GLY 73 0.687 14.304 -2.254
56 HA2 GLY 73 2HA GLY 73 3.082 12.740 -1.796
57 HA3 GLY 73 1HA GLY 73 2.155 13.615 -0.574
58 H ALA 74 H ALA 74 1.717 10.968 -2.816
59 HA ALA 74 HA ALA 74 0.794 9.143 -0.798
60 HB1 ALA 74 1HB ALA 74 -1.249 10.464 -1.276
61 HB2 ALA 74 2HB ALA 74 -1.392 8.793 -1.820
62 HB3 ALA 74 3HB ALA 74 -1.075 10.074 -2.986
63 H ILE 75 H ILE 75 -0.273 7.299 -2.354
64 HA ILE 75 HA ILE 75 1.952 6.580 -4.106
65 HB ILE 75 HB ILE 75 -0.241 4.860 -2.890
66 HG12 ILE 75 2HG1 ILE 75 2.605 5.158 -1.946
67 HG13 ILE 75 1HG1 ILE 75 1.265 6.071 -1.270
68 HG21 ILE 75 1HG2 ILE 75 2.424 4.123 -4.126
69 HG22 ILE 75 2HG2 ILE 75 0.851 3.898 -4.885
70 HG23 ILE 75 3HG2 ILE 75 1.265 2.992 -3.425
71 HD11 ILE 75 1HD1 ILE 75 1.802 4.186 0.107
72 HD12 ILE 75 2HD1 ILE 75 1.589 3.092 -1.262
73 HD13 ILE 75 3HD1 ILE 75 0.204 3.978 -0.607
74 H ASP 76 H ASP 76 1.447 5.807 -6.185
75 HA ASP 76 HA ASP 76 -0.677 6.982 -7.568
76 HB2 ASP 76 2HB ASP 76 1.381 6.271 -8.712
77 HB3 ASP 76 1HB ASP 76 1.021 4.590 -8.348
78 H ARG 77 H ARG 77 -2.396 5.864 -8.739
79 HA ARG 77 HA ARG 77 -4.111 4.381 -7.100
80 HB2 ARG 77 2HB ARG 77 -4.109 4.689 -10.107
81 HB3 ARG 77 1HB ARG 77 -5.453 4.043 -9.164
82 HG2 ARG 77 2HG ARG 77 -5.599 6.120 -7.944
83 HG3 ARG 77 1HG ARG 77 -4.278 6.790 -8.883
84 HD2 ARG 77 2HD ARG 77 -6.453 7.570 -9.709
85 HD3 ARG 77 1HD ARG 77 -5.580 6.642 -10.913
86 HE ARG 77 HE ARG 77 -7.042 4.738 -10.254
87 HH11 ARG 77 1HH1 ARG 77 -8.216 8.013 -9.596
88 HH12 ARG 77 2HH1 ARG 77 -9.835 7.642 -9.958
89 HH21 ARG 77 1HH2 ARG 77 -9.235 4.237 -10.679
90 HH22 ARG 77 2HH2 ARG 77 -10.457 5.422 -10.557
91 H GLU 78 H GLU 78 -1.815 3.417 -9.553
92 HA GLU 78 HA GLU 78 -2.302 0.652 -8.915
93 HB2 GLU 78 2HB GLU 78 -0.647 2.014 -11.021
94 HB3 GLU 78 1HB GLU 78 -0.328 0.340 -10.580
95 HG2 GLU 78 2HG GLU 78 -3.000 1.353 -11.493
96 HG3 GLU 78 1HG GLU 78 -1.797 0.611 -12.550
97 H GLN 79 H GLN 79 -1.745 0.827 -6.830
98 HA GLN 79 HA GLN 79 0.586 1.829 -5.704
99 HB2 GLN 79 2HB GLN 79 -1.231 -0.381 -4.803
100 HB3 GLN 79 1HB GLN 79 0.058 0.289 -3.815
101 HG2 GLN 79 2HG GLN 79 -0.987 2.475 -3.914
102 HG3 GLN 79 1HG GLN 79 -2.264 1.814 -4.939
103 HE21 GLN 79 1HE2 GLN 79 -0.856 1.788 -1.792
104 HE22 GLN 79 2HE2 GLN 79 -2.227 1.163 -0.961
105 H SER 80 H SER 80 -0.154 -1.451 -6.790
106 HA SER 80 HA SER 80 2.235 -2.636 -6.004
107 HB2 SER 80 2HB SER 80 0.515 -3.337 -8.384
108 HB3 SER 80 1HB SER 80 1.580 -4.425 -7.493
109 HG SER 80 HG SER 80 -0.844 -4.283 -7.021
110 H ALA 81 H ALA 81 1.314 -0.913 -8.931
111 HA ALA 81 HA ALA 81 3.658 -1.460 -10.414
112 HB1 ALA 81 1HB ALA 81 1.745 0.845 -10.682
113 HB2 ALA 81 2HB ALA 81 1.568 -0.729 -11.461
114 HB3 ALA 81 3HB ALA 81 2.923 0.324 -11.884
115 H ALA 82 H ALA 82 2.668 1.142 -8.294
116 HA ALA 82 HA ALA 82 4.847 2.849 -8.675
117 HB1 ALA 82 1HB ALA 82 3.123 2.500 -6.222
118 HB2 ALA 82 2HB ALA 82 2.744 3.517 -7.611
119 HB3 ALA 82 3HB ALA 82 4.124 3.906 -6.589
120 H ILE 83 H ILE 83 4.309 0.222 -6.377
121 HA ILE 83 HA ILE 83 6.733 0.517 -4.968
122 HB ILE 83 HB ILE 83 5.126 -2.034 -5.363
123 HG12 ILE 83 2HG1 ILE 83 5.043 -0.032 -3.093
124 HG13 ILE 83 1HG1 ILE 83 3.828 -0.161 -4.357
125 HG21 ILE 83 1HG2 ILE 83 7.191 -1.307 -3.276
126 HG22 ILE 83 2HG2 ILE 83 7.400 -2.489 -4.566
127 HG23 ILE 83 3HG2 ILE 83 6.228 -2.784 -3.278
128 HD11 ILE 83 1HD1 ILE 83 4.515 -2.283 -2.335
129 HD12 ILE 83 2HD1 ILE 83 3.286 -2.423 -3.593
130 HD13 ILE 83 3HD1 ILE 83 3.096 -1.236 -2.300
131 H ARG 84 H ARG 84 5.873 -1.502 -7.757
132 HA ARG 84 HA ARG 84 8.322 -2.802 -8.125
133 HB2 ARG 84 2HB ARG 84 6.252 -1.951 -10.145
134 HB3 ARG 84 1HB ARG 84 7.575 -3.054 -10.512
135 HG2 ARG 84 2HG ARG 84 6.719 -4.724 -9.144
136 HG3 ARG 84 1HG ARG 84 5.710 -3.588 -8.249
137 HD2 ARG 84 2HD ARG 84 4.177 -4.703 -9.536
138 HD3 ARG 84 1HD ARG 84 4.504 -3.260 -10.482
139 HE ARG 84 HE ARG 84 5.724 -5.854 -11.035
140 HH11 ARG 84 1HH1 ARG 84 4.499 -2.831 -12.348
141 HH12 ARG 84 2HH1 ARG 84 3.920 -3.490 -13.805
142 HH21 ARG 84 1HH2 ARG 84 4.892 -6.836 -13.169
143 HH22 ARG 84 2HH2 ARG 84 4.191 -5.782 -14.281
144 H GLU 85 H GLU 85 7.155 0.279 -9.400
145 HA GLU 85 HA GLU 85 9.425 0.952 -10.888
146 HB2 GLU 85 2HB GLU 85 7.218 2.577 -9.691
147 HB3 GLU 85 1HB GLU 85 8.555 3.333 -10.541
148 HG2 GLU 85 2HG GLU 85 6.703 1.263 -11.687
149 HG3 GLU 85 1HG GLU 85 6.623 2.999 -11.992
150 H TRP 86 H TRP 86 8.615 1.595 -7.494
151 HA TRP 86 HA TRP 86 10.803 3.280 -6.952
152 HB2 TRP 86 2HB TRP 86 8.851 3.240 -5.545
153 HB3 TRP 86 1HB TRP 86 9.051 1.525 -5.227
154 HD1 TRP 86 HD TRP 86 10.195 4.948 -4.057
155 HE1 TRP 86 1HE TRP 86 11.620 4.690 -1.951
156 HE3 TRP 86 3HE TRP 86 10.673 -0.123 -4.053
157 HZ2 TRP 86 2HZ TRP 86 12.794 2.596 -0.454
158 HZ3 TRP 86 3HZ TRP 86 11.972 -1.186 -2.226
159 HH2 TRP 86 HH TRP 86 12.999 0.156 -0.477
160 H ALA 87 H ALA 87 10.203 -0.159 -6.706
161 HA ALA 87 HA ALA 87 12.541 -1.012 -5.490
162 HB1 ALA 87 1HB ALA 87 10.887 -2.425 -7.569
163 HB2 ALA 87 2HB ALA 87 10.572 -2.414 -5.837
164 HB3 ALA 87 3HB ALA 87 12.026 -3.189 -6.465
165 H ARG 88 H ARG 88 11.787 -0.571 -8.889
166 HA ARG 88 HA ARG 88 14.357 -1.387 -9.773
167 HB2 ARG 88 2HB ARG 88 12.253 0.229 -11.210
168 HB3 ARG 88 1HB ARG 88 13.731 -0.338 -11.966
169 HG2 ARG 88 2HG ARG 88 11.518 -2.046 -10.839
170 HG3 ARG 88 1HG ARG 88 11.883 -1.780 -12.541
171 HD2 ARG 88 2HD ARG 88 13.565 -3.243 -10.504
172 HD3 ARG 88 1HD ARG 88 12.762 -3.921 -11.913
173 HE ARG 88 HE ARG 88 15.047 -2.061 -12.026
174 HH11 ARG 88 1HH1 ARG 88 13.256 -4.761 -13.435
175 HH12 ARG 88 2HH1 ARG 88 14.412 -5.107 -14.616
176 HH21 ARG 88 1HH2 ARG 88 16.651 -2.517 -13.607
177 HH22 ARG 88 2HH2 ARG 88 16.440 -3.777 -14.723
178 H ARG 89 H ARG 89 12.990 1.738 -8.941
179 HA ARG 89 HA ARG 89 15.104 3.370 -9.809
180 HB2 ARG 89 2HB ARG 89 12.986 3.691 -7.746
181 HB3 ARG 89 1HB ARG 89 14.282 4.873 -7.875
182 HG2 ARG 89 2HG ARG 89 13.733 5.147 -10.267
183 HG3 ARG 89 1HG ARG 89 12.349 4.080 -10.021
184 HD2 ARG 89 2HD ARG 89 12.784 6.408 -8.286
185 HD3 ARG 89 1HD ARG 89 12.110 6.650 -9.896
186 HE ARG 89 HE ARG 89 10.341 5.031 -9.192
187 HH11 ARG 89 1HH1 ARG 89 11.976 6.912 -6.630
188 HH12 ARG 89 2HH1 ARG 89 10.598 7.056 -5.665
189 HH21 ARG 89 1HH2 ARG 89 8.389 5.344 -7.856
190 HH22 ARG 89 2HH2 ARG 89 8.487 6.189 -6.412
191 H ASN 90 H ASN 90 14.622 1.586 -6.870
192 HA ASN 90 HA ASN 90 17.032 2.682 -5.705
193 HB2 ASN 90 2HB ASN 90 14.834 0.948 -4.734
194 HB3 ASN 90 1HB ASN 90 16.326 1.063 -3.785
195 HD21 ASN 90 1HD2 ASN 90 13.507 2.707 -4.955
196 HD22 ASN 90 2HD2 ASN 90 13.622 4.085 -3.929
197 H GLY 91 H GLY 91 16.010 -0.297 -7.199
198 HA2 GLY 91 2HA GLY 91 17.683 -1.646 -8.277
199 HA3 GLY 91 1HA GLY 91 18.811 -1.179 -7.013
200 H HIS 92 H HIS 92 15.501 -2.378 -6.763
201 HA HIS 92 HA HIS 92 16.492 -4.550 -5.109
202 HB2 HIS 92 2HB HIS 92 13.776 -3.312 -5.455
203 HB3 HIS 92 1HB HIS 92 14.027 -4.802 -4.548
204 HD1 HIS 92 1HD HIS 92 14.998 -4.514 -2.112
205 HD2 HIS 92 2HD HIS 92 14.788 -0.998 -4.309
206 HE1 HIS 92 1HE HIS 92 15.434 -2.654 -0.488
207 H ASN 93 H ASN 93 15.779 -6.679 -5.551
208 HA ASN 93 HA ASN 93 15.595 -7.060 -8.395
209 HB2 ASN 93 2HB ASN 93 16.013 -9.109 -6.208
210 HB3 ASN 93 1HB ASN 93 15.901 -9.506 -7.915
211 HD21 ASN 93 1HD2 ASN 93 17.964 -10.272 -8.128
212 HD22 ASN 93 2HD2 ASN 93 19.367 -9.268 -7.979
213 H VAL 94 H VAL 94 13.552 -6.104 -8.395
214 HA VAL 94 HA VAL 94 11.438 -8.073 -7.952
215 HB VAL 94 HB VAL 94 11.171 -5.061 -8.258
216 HG11 VAL 94 1HG1 VAL 94 9.230 -6.243 -9.159
217 HG12 VAL 94 2HG1 VAL 94 8.806 -5.412 -7.662
218 HG13 VAL 94 3HG1 VAL 94 9.072 -7.155 -7.660
219 HG21 VAL 94 1HG2 VAL 94 12.130 -5.649 -6.112
220 HG22 VAL 94 2HG2 VAL 94 10.849 -6.827 -5.839
221 HG23 VAL 94 3HG2 VAL 94 10.462 -5.105 -5.905
222 H SER 95 H SER 95 10.933 -9.057 -9.705
223 HA SER 95 HA SER 95 11.445 -7.842 -12.282
224 HB2 SER 95 2HB SER 95 12.148 -10.175 -11.929
225 HB3 SER 95 1HB SER 95 10.500 -10.613 -11.497
226 HG SER 95 HG SER 95 11.312 -11.004 -13.687
227 H THR 96 H THR 96 9.774 -7.344 -13.692
228 HA THR 96 HA THR 96 7.257 -6.771 -12.603
229 HB THR 96 HB THR 96 6.875 -6.464 -15.188
230 HG1 THR 96 1HG THR 96 8.931 -6.099 -16.190
231 HG21 THR 96 1HG2 THR 96 7.948 -4.251 -15.004
232 HG22 THR 96 2HG2 THR 96 8.787 -4.789 -13.544
233 HG23 THR 96 3HG2 THR 96 7.032 -4.648 -13.558
234 H ARG 97 H ARG 97 8.636 -9.584 -13.770
235 HA ARG 97 HA ARG 97 6.127 -10.757 -14.736
236 HB2 ARG 97 2HB ARG 97 8.986 -11.741 -14.906
237 HB3 ARG 97 1HB ARG 97 7.603 -12.691 -15.405
238 HG2 ARG 97 2HG ARG 97 8.623 -11.761 -17.348
239 HG3 ARG 97 1HG ARG 97 7.086 -10.945 -17.091
240 HD2 ARG 97 2HD ARG 97 8.814 -9.344 -17.741
241 HD3 ARG 97 1HD ARG 97 8.260 -9.047 -16.102
242 HE ARG 97 HE ARG 97 10.303 -10.007 -15.280
243 HH11 ARG 97 1HH1 ARG 97 10.289 -9.499 -18.771
244 HH12 ARG 97 2HH1 ARG 97 11.953 -9.145 -18.860
245 HH21 ARG 97 1HH2 ARG 97 12.644 -9.543 -15.421
246 HH22 ARG 97 2HH2 ARG 97 13.287 -9.195 -16.948
247 H GLY 98 H GLY 98 6.972 -10.199 -11.881
248 HA2 GLY 98 2HA GLY 98 6.186 -12.788 -10.857
249 HA3 GLY 98 1HA GLY 98 7.721 -12.133 -10.289
250 H ARG 99 H ARG 99 6.200 -12.443 -8.286
251 HA ARG 99 HA ARG 99 4.509 -10.115 -7.931
252 HB2 ARG 99 2HB ARG 99 5.088 -12.414 -6.067
253 HB3 ARG 99 1HB ARG 99 4.032 -11.063 -5.675
254 HG2 ARG 99 2HG ARG 99 2.635 -11.681 -7.644
255 HG3 ARG 99 1HG ARG 99 3.638 -13.120 -7.832
256 HD2 ARG 99 2HD ARG 99 2.043 -12.390 -5.387
257 HD3 ARG 99 1HD ARG 99 1.576 -13.579 -6.597
258 HE ARG 99 HE ARG 99 3.668 -14.777 -5.941
259 HH11 ARG 99 1HH1 ARG 99 2.129 -12.592 -3.595
260 HH12 ARG 99 2HH1 ARG 99 2.512 -13.550 -2.254
261 HH21 ARG 99 1HH2 ARG 99 4.201 -16.057 -4.101
262 HH22 ARG 99 2HH2 ARG 99 3.773 -15.555 -2.526
263 H ILE 100 H ILE 100 4.699 -8.864 -5.911
264 HA ILE 100 HA ILE 100 7.409 -7.856 -5.790
265 HB ILE 100 HB ILE 100 4.970 -6.822 -4.327
266 HG12 ILE 100 2HG1 ILE 100 6.021 -5.972 -7.030
267 HG13 ILE 100 1HG1 ILE 100 4.566 -6.929 -6.776
268 HG21 ILE 100 1HG2 ILE 100 6.219 -4.712 -4.311
269 HG22 ILE 100 2HG2 ILE 100 7.559 -5.491 -5.150
270 HG23 ILE 100 3HG2 ILE 100 7.137 -5.989 -3.509
271 HD11 ILE 100 1HD1 ILE 100 4.028 -4.597 -7.155
272 HD12 ILE 100 2HD1 ILE 100 5.063 -4.150 -5.794
273 HD13 ILE 100 3HD1 ILE 100 3.594 -5.085 -5.509
274 HA PRO 101 HA PRO 101 8.052 -10.110 -1.958
275 HB2 PRO 101 2HB PRO 101 10.437 -8.430 -1.619
276 HB3 PRO 101 1HB PRO 101 10.350 -10.185 -1.852
277 HG2 PRO 101 2HG PRO 101 11.306 -8.559 -3.748
278 HG3 PRO 101 1HG PRO 101 10.417 -10.050 -4.120
279 HD2 PRO 101 2HD PRO 101 9.435 -7.224 -4.212
280 HD3 PRO 101 1HD PRO 101 9.118 -8.587 -5.305
281 H ALA 102 H ALA 102 7.405 -9.681 0.070
282 HA ALA 102 HA ALA 102 6.289 -7.203 0.769
283 HB1 ALA 102 1HB ALA 102 5.905 -8.148 2.939
284 HB2 ALA 102 2HB ALA 102 7.090 -9.424 2.644
285 HB3 ALA 102 3HB ALA 102 5.587 -9.378 1.720
286 H ASP 103 H ASP 103 9.450 -8.503 1.266
287 HA ASP 103 HA ASP 103 10.482 -6.675 3.111
288 HB2 ASP 103 2HB ASP 103 11.866 -8.520 2.505
289 HB3 ASP 103 1HB ASP 103 11.783 -8.107 0.797
290 H VAL 104 H VAL 104 10.055 -6.409 -0.378
291 HA VAL 104 HA VAL 104 11.372 -3.873 -0.567
292 HB VAL 104 HB VAL 104 9.604 -5.367 -2.541
293 HG11 VAL 104 1HG1 VAL 104 9.576 -2.926 -2.966
294 HG12 VAL 104 2HG1 VAL 104 10.394 -3.828 -4.236
295 HG13 VAL 104 3HG1 VAL 104 11.342 -2.947 -3.041
296 HG21 VAL 104 1HG2 VAL 104 11.707 -6.482 -2.045
297 HG22 VAL 104 2HG2 VAL 104 12.580 -4.988 -2.417
298 HG23 VAL 104 3HG2 VAL 104 11.703 -5.833 -3.690
299 H ILE 105 H ILE 105 8.109 -5.066 -0.335
300 HA ILE 105 HA ILE 105 6.750 -2.611 -0.656
301 HB ILE 105 HB ILE 105 5.926 -4.982 1.038
302 HG12 ILE 105 2HG1 ILE 105 5.236 -4.335 -1.841
303 HG13 ILE 105 1HG1 ILE 105 6.428 -5.524 -1.339
304 HG21 ILE 105 1HG2 ILE 105 3.630 -4.138 0.725
305 HG22 ILE 105 2HG2 ILE 105 4.277 -2.723 -0.130
306 HG23 ILE 105 3HG2 ILE 105 4.647 -2.961 1.568
307 HD11 ILE 105 1HD1 ILE 105 4.336 -6.560 -1.988
308 HD12 ILE 105 2HD1 ILE 105 3.475 -5.629 -0.763
309 HD13 ILE 105 3HD1 ILE 105 4.658 -6.841 -0.282
310 H ASP 106 H ASP 106 8.029 -4.212 2.214
311 HA ASP 106 HA ASP 106 7.089 -2.350 4.127
312 HB2 ASP 106 2HB ASP 106 7.908 -4.698 4.589
313 HB3 ASP 106 1HB ASP 106 9.545 -4.117 4.317
314 H ALA 107 H ALA 107 10.117 -2.728 2.384
315 HA ALA 107 HA ALA 107 11.523 -0.537 3.436
316 HB1 ALA 107 1HB ALA 107 12.957 -0.768 1.478
317 HB2 ALA 107 2HB ALA 107 11.729 -1.780 0.703
318 HB3 ALA 107 3HB ALA 107 12.554 -2.356 2.143
319 H TYR 108 H TYR 108 9.404 -0.856 0.626
320 HA TYR 108 HA TYR 108 9.546 1.658 -0.487
321 HB2 TYR 108 2HB TYR 108 8.282 -0.187 -1.501
322 HB3 TYR 108 1HB TYR 108 7.120 -0.135 -0.184
323 HD1 TYR 108 1HD TYR 108 8.417 1.719 -3.072
324 HD2 TYR 108 2HD TYR 108 5.259 1.388 -0.264
325 HE1 TYR 108 1HE TYR 108 7.115 3.300 -4.375
326 HE2 TYR 108 2HE TYR 108 3.923 2.981 -1.571
327 HH TYR 108 HH TYR 108 4.326 4.781 -3.206
328 H HIS 109 H HIS 109 7.331 0.487 1.988
329 HA HIS 109 HA HIS 109 6.255 3.049 2.387
330 HB2 HIS 109 2HB HIS 109 5.907 0.495 3.918
331 HB3 HIS 109 1HB HIS 109 5.136 2.003 4.424
332 HD1 HIS 109 1HD HIS 109 3.269 2.960 2.854
333 HD2 HIS 109 2HD HIS 109 4.825 -0.694 1.663
334 HE1 HIS 109 1HE HIS 109 1.791 2.157 1.014
335 H ALA 110 H ALA 110 9.005 1.515 3.672
336 HA ALA 110 HA ALA 110 9.235 3.249 5.964
337 HB1 ALA 110 1HB ALA 110 11.422 2.229 6.286
338 HB2 ALA 110 2HB ALA 110 11.310 1.462 4.702
339 HB3 ALA 110 3HB ALA 110 10.208 0.981 5.990
340 H ALA 111 H ALA 111 10.138 3.394 2.609
341 HA ALA 111 HA ALA 111 12.144 5.475 3.105
342 HB1 ALA 111 1HB ALA 111 11.265 4.081 0.606
343 HB2 ALA 111 2HB ALA 111 12.695 3.655 1.557
344 HB3 ALA 111 3HB ALA 111 12.603 5.215 0.717
345 H THR 112 H THR 112 9.146 4.775 1.563
346 HA THR 112 HA THR 112 8.826 7.500 0.740
347 HB THR 112 HB THR 112 8.155 4.812 -0.401
348 HG1 THR 112 1HG THR 112 9.876 6.779 -0.896
349 HG21 THR 112 1HG2 THR 112 6.975 7.434 -1.246
350 HG22 THR 112 2HG2 THR 112 6.148 6.036 -0.485
351 HG23 THR 112 3HG2 THR 112 6.851 5.871 -2.107
Start of MODEL 15
1 H MET 65 1HT MET 65 11.229 8.804 -19.076
2 HA MET 65 HA MET 65 11.308 7.148 -17.401
3 HB2 MET 65 2HB MET 65 13.776 7.085 -17.170
4 HB3 MET 65 1HB MET 65 13.740 8.681 -16.439
5 HG2 MET 65 2HG MET 65 12.437 7.779 -14.567
6 HG3 MET 65 1HG MET 65 12.505 6.182 -15.302
7 HE1 MET 65 1HE MET 65 14.785 4.793 -15.618
8 HE2 MET 65 2HE MET 65 16.361 5.373 -15.079
9 HE3 MET 65 3HE MET 65 15.558 6.152 -16.436
10 H SER 66 H SER 66 9.411 7.911 -16.667
11 HA SER 66 HA SER 66 9.473 10.205 -14.889
12 HB2 SER 66 2HB SER 66 7.497 9.899 -17.173
13 HB3 SER 66 1HB SER 66 7.427 11.136 -15.920
14 HG SER 66 HG SER 66 9.835 11.242 -16.884
15 H GLY 67 H GLY 67 8.920 9.187 -13.045
16 HA2 GLY 67 2HA GLY 67 6.594 7.395 -13.083
17 HA3 GLY 67 1HA GLY 67 7.814 7.481 -11.803
18 H SER 68 H SER 68 5.331 9.371 -13.420
19 HA SER 68 HA SER 68 5.299 11.499 -11.590
20 HB2 SER 68 2HB SER 68 3.151 10.630 -13.529
21 HB3 SER 68 1HB SER 68 3.406 12.248 -12.867
22 HG SER 68 HG SER 68 5.545 12.099 -13.850
23 H GLY 69 H GLY 69 4.881 11.017 -9.542
24 HA2 GLY 69 2HA GLY 69 2.331 10.757 -8.576
25 HA3 GLY 69 1HA GLY 69 2.978 9.121 -8.641
26 H ARG 70 H ARG 70 3.509 12.344 -7.288
27 HA ARG 70 HA ARG 70 5.016 10.993 -5.174
28 HB2 ARG 70 2HB ARG 70 5.681 13.748 -6.246
29 HB3 ARG 70 1HB ARG 70 6.379 13.056 -4.797
30 HG2 ARG 70 2HG ARG 70 8.027 12.700 -6.376
31 HG3 ARG 70 1HG ARG 70 7.170 11.160 -6.389
32 HD2 ARG 70 2HD ARG 70 5.851 11.973 -8.327
33 HD3 ARG 70 1HD ARG 70 6.842 13.430 -8.335
34 HE ARG 70 HE ARG 70 8.029 10.771 -8.642
35 HH11 ARG 70 1HH1 ARG 70 7.637 14.103 -9.831
36 HH12 ARG 70 2HH1 ARG 70 8.653 13.887 -11.178
37 HH21 ARG 70 1HH2 ARG 70 9.422 10.499 -10.538
38 HH22 ARG 70 2HH2 ARG 70 9.686 11.819 -11.571
39 H GLY 71 H GLY 71 3.593 10.890 -3.575
40 HA2 GLY 71 2HA GLY 71 2.865 11.828 -1.558
41 HA3 GLY 71 1HA GLY 71 3.032 13.415 -2.280
42 H ARG 72 H ARG 72 1.290 14.450 -2.784
43 HA ARG 72 HA ARG 72 -1.252 13.381 -2.077
44 HB2 ARG 72 2HB ARG 72 -0.503 16.019 -3.316
45 HB3 ARG 72 1HB ARG 72 -2.160 15.576 -2.967
46 HG2 ARG 72 2HG ARG 72 -1.372 17.016 -1.243
47 HG3 ARG 72 1HG ARG 72 -1.538 15.407 -0.556
48 HD2 ARG 72 2HD ARG 72 0.514 16.516 0.198
49 HD3 ARG 72 1HD ARG 72 0.872 15.082 -0.760
50 HE ARG 72 HE ARG 72 0.847 17.180 -2.522
51 HH11 ARG 72 1HH1 ARG 72 2.641 16.538 0.467
52 HH12 ARG 72 2HH1 ARG 72 4.098 17.181 -0.109
53 HH21 ARG 72 1HH2 ARG 72 2.891 18.103 -3.292
54 HH22 ARG 72 2HH2 ARG 72 4.246 18.090 -2.240
55 H GLY 73 H GLY 73 -3.151 13.504 -3.432
56 HA2 GLY 73 2HA GLY 73 -4.224 13.449 -5.507
57 HA3 GLY 73 1HA GLY 73 -2.656 13.240 -6.279
58 H ALA 74 H ALA 74 -4.043 11.589 -7.338
59 HA ALA 74 HA ALA 74 -4.035 9.055 -5.848
60 HB1 ALA 74 1HB ALA 74 -5.266 8.187 -7.794
61 HB2 ALA 74 2HB ALA 74 -5.117 9.750 -8.597
62 HB3 ALA 74 3HB ALA 74 -6.089 9.600 -7.132
63 H ILE 75 H ILE 75 -3.286 7.223 -7.371
64 HA ILE 75 HA ILE 75 -0.660 8.116 -8.244
65 HB ILE 75 HB ILE 75 -1.580 5.294 -7.630
66 HG12 ILE 75 2HG1 ILE 75 0.071 7.139 -5.916
67 HG13 ILE 75 1HG1 ILE 75 -1.663 6.948 -5.716
68 HG21 ILE 75 1HG2 ILE 75 0.854 4.840 -7.528
69 HG22 ILE 75 2HG2 ILE 75 1.184 6.523 -7.937
70 HG23 ILE 75 3HG2 ILE 75 0.401 5.468 -9.115
71 HD11 ILE 75 1HD1 ILE 75 -0.413 5.648 -4.117
72 HD12 ILE 75 2HD1 ILE 75 0.387 4.758 -5.429
73 HD13 ILE 75 3HD1 ILE 75 -1.368 4.630 -5.184
74 H ASP 76 H ASP 76 -0.320 8.259 -10.246
75 HA ASP 76 HA ASP 76 -2.117 7.629 -12.304
76 HB2 ASP 76 2HB ASP 76 -0.509 9.355 -12.677
77 HB3 ASP 76 1HB ASP 76 0.835 8.264 -12.348
78 H ARG 77 H ARG 77 0.650 5.944 -11.068
79 HA ARG 77 HA ARG 77 0.333 3.724 -12.944
80 HB2 ARG 77 2HB ARG 77 2.210 3.992 -10.581
81 HB3 ARG 77 1HB ARG 77 2.273 2.760 -11.821
82 HG2 ARG 77 2HG ARG 77 2.795 5.688 -12.221
83 HG3 ARG 77 1HG ARG 77 4.022 4.434 -12.051
84 HD2 ARG 77 2HD ARG 77 1.997 4.687 -14.266
85 HD3 ARG 77 1HD ARG 77 3.722 5.021 -14.395
86 HE ARG 77 HE ARG 77 2.575 2.361 -13.874
87 HH11 ARG 77 1HH1 ARG 77 5.124 4.330 -15.330
88 HH12 ARG 77 2HH1 ARG 77 5.817 3.053 -16.212
89 HH21 ARG 77 1HH2 ARG 77 3.502 0.587 -15.129
90 HH22 ARG 77 2HH2 ARG 77 4.848 0.892 -16.118
91 H GLU 78 H GLU 78 0.263 1.547 -11.898
92 HA GLU 78 HA GLU 78 -1.703 1.252 -9.872
93 HB2 GLU 78 2HB GLU 78 -0.342 -0.417 -11.676
94 HB3 GLU 78 1HB GLU 78 0.087 -1.009 -10.079
95 HG2 GLU 78 2HG GLU 78 -2.743 -0.551 -10.975
96 HG3 GLU 78 1HG GLU 78 -1.898 -2.099 -11.106
97 H GLN 79 H GLN 79 -1.325 0.401 -7.715
98 HA GLN 79 HA GLN 79 0.782 1.743 -6.371
99 HB2 GLN 79 2HB GLN 79 -0.876 -0.577 -5.387
100 HB3 GLN 79 1HB GLN 79 0.191 0.391 -4.382
101 HG2 GLN 79 2HG GLN 79 -1.178 2.372 -4.942
102 HG3 GLN 79 1HG GLN 79 -2.292 1.301 -5.800
103 HE21 GLN 79 1HE2 GLN 79 -1.089 2.293 -2.708
104 HE22 GLN 79 2HE2 GLN 79 -2.308 1.493 -1.789
105 H SER 80 H SER 80 0.337 -1.582 -7.375
106 HA SER 80 HA SER 80 2.745 -2.662 -6.444
107 HB2 SER 80 2HB SER 80 0.730 -3.885 -7.411
108 HB3 SER 80 1HB SER 80 1.287 -3.390 -9.007
109 HG SER 80 HG SER 80 2.927 -4.772 -8.873
110 H ALA 81 H ALA 81 1.960 -0.917 -9.423
111 HA ALA 81 HA ALA 81 4.529 -1.251 -10.582
112 HB1 ALA 81 1HB ALA 81 2.389 0.772 -11.213
113 HB2 ALA 81 2HB ALA 81 2.571 -0.813 -11.964
114 HB3 ALA 81 3HB ALA 81 3.802 0.429 -12.213
115 H ALA 82 H ALA 82 3.046 1.207 -8.550
116 HA ALA 82 HA ALA 82 5.115 3.112 -8.688
117 HB1 ALA 82 1HB ALA 82 2.873 3.622 -7.815
118 HB2 ALA 82 2HB ALA 82 4.133 4.051 -6.656
119 HB3 ALA 82 3HB ALA 82 3.186 2.584 -6.422
120 H ILE 83 H ILE 83 4.541 0.358 -6.555
121 HA ILE 83 HA ILE 83 6.808 0.691 -4.908
122 HB ILE 83 HB ILE 83 5.526 -1.945 -5.744
123 HG12 ILE 83 2HG1 ILE 83 4.964 -0.212 -3.323
124 HG13 ILE 83 1HG1 ILE 83 3.914 -0.370 -4.726
125 HG21 ILE 83 1HG2 ILE 83 6.478 -2.808 -3.631
126 HG22 ILE 83 2HG2 ILE 83 7.267 -1.252 -3.367
127 HG23 ILE 83 3HG2 ILE 83 7.733 -2.253 -4.742
128 HD11 ILE 83 1HD1 ILE 83 3.595 -2.741 -4.202
129 HD12 ILE 83 2HD1 ILE 83 3.107 -1.698 -2.863
130 HD13 ILE 83 3HD1 ILE 83 4.643 -2.561 -2.793
131 H ARG 84 H ARG 84 6.324 -0.907 -7.993
132 HA ARG 84 HA ARG 84 8.935 -1.888 -8.238
133 HB2 ARG 84 2HB ARG 84 6.776 -1.384 -10.238
134 HB3 ARG 84 1HB ARG 84 8.349 -2.000 -10.727
135 HG2 ARG 84 2HG ARG 84 8.093 -3.941 -9.382
136 HG3 ARG 84 1HG ARG 84 6.635 -3.291 -8.625
137 HD2 ARG 84 2HD ARG 84 6.128 -4.980 -10.304
138 HD3 ARG 84 1HD ARG 84 5.465 -3.403 -10.726
139 HE ARG 84 HE ARG 84 8.021 -3.790 -11.887
140 HH11 ARG 84 1HH1 ARG 84 4.689 -4.899 -12.245
141 HH12 ARG 84 2HH1 ARG 84 4.772 -5.072 -13.943
142 HH21 ARG 84 1HH2 ARG 84 8.153 -4.035 -14.186
143 HH22 ARG 84 2HH2 ARG 84 6.809 -4.569 -15.076
144 H GLU 85 H GLU 85 7.451 1.137 -9.339
145 HA GLU 85 HA GLU 85 9.599 2.302 -10.700
146 HB2 GLU 85 2HB GLU 85 7.581 3.608 -8.854
147 HB3 GLU 85 1HB GLU 85 8.687 4.515 -9.867
148 HG2 GLU 85 2HG GLU 85 6.522 2.656 -10.855
149 HG3 GLU 85 1HG GLU 85 6.385 4.408 -10.750
150 H TRP 86 H TRP 86 8.814 2.329 -7.248
151 HA TRP 86 HA TRP 86 11.006 3.852 -6.395
152 HB2 TRP 86 2HB TRP 86 8.978 3.611 -5.080
153 HB3 TRP 86 1HB TRP 86 9.208 1.873 -4.982
154 HD1 TRP 86 HD TRP 86 10.304 5.139 -3.399
155 HE1 TRP 86 1HE TRP 86 11.715 4.614 -1.318
156 HE3 TRP 86 3HE TRP 86 10.778 0.122 -4.022
157 HZ2 TRP 86 2HZ TRP 86 12.887 2.354 -0.100
158 HZ3 TRP 86 3HZ TRP 86 12.080 -1.169 -2.355
159 HH2 TRP 86 HH TRP 86 13.102 -0.055 -0.437
160 H ALA 87 H ALA 87 10.384 0.392 -6.604
161 HA ALA 87 HA ALA 87 12.711 -0.637 -5.516
162 HB1 ALA 87 1HB ALA 87 10.760 -2.006 -6.061
163 HB2 ALA 87 2HB ALA 87 12.182 -2.669 -6.860
164 HB3 ALA 87 3HB ALA 87 11.026 -1.716 -7.772
165 H ARG 88 H ARG 88 11.986 0.277 -8.841
166 HA ARG 88 HA ARG 88 14.447 -0.431 -9.904
167 HB2 ARG 88 2HB ARG 88 12.186 1.202 -10.748
168 HB3 ARG 88 1HB ARG 88 13.709 1.447 -11.603
169 HG2 ARG 88 2HG ARG 88 13.732 -0.659 -12.459
170 HG3 ARG 88 1HG ARG 88 12.766 -1.327 -11.144
171 HD2 ARG 88 2HD ARG 88 11.622 -1.127 -13.347
172 HD3 ARG 88 1HD ARG 88 10.854 -0.412 -11.915
173 HE ARG 88 HE ARG 88 12.467 1.337 -13.580
174 HH11 ARG 88 1HH1 ARG 88 9.201 0.158 -12.923
175 HH12 ARG 88 2HH1 ARG 88 8.456 1.678 -13.163
176 HH21 ARG 88 1HH2 ARG 88 11.379 3.483 -13.880
177 HH22 ARG 88 2HH2 ARG 88 9.680 3.550 -13.656
178 H ARG 89 H ARG 89 13.261 2.602 -8.543
179 HA ARG 89 HA ARG 89 15.478 4.247 -9.091
180 HB2 ARG 89 2HB ARG 89 13.404 4.280 -6.919
181 HB3 ARG 89 1HB ARG 89 14.719 5.436 -6.926
182 HG2 ARG 89 2HG ARG 89 12.675 5.104 -9.119
183 HG3 ARG 89 1HG ARG 89 12.647 6.347 -7.866
184 HD2 ARG 89 2HD ARG 89 15.002 6.951 -8.695
185 HD3 ARG 89 1HD ARG 89 14.603 5.991 -10.116
186 HE ARG 89 HE ARG 89 12.558 7.834 -9.619
187 HH11 ARG 89 1HH1 ARG 89 15.842 7.648 -10.908
188 HH12 ARG 89 2HH1 ARG 89 15.805 9.176 -11.645
189 HH21 ARG 89 1HH2 ARG 89 12.526 9.993 -10.635
190 HH22 ARG 89 2HH2 ARG 89 13.900 10.517 -11.494
191 H ASN 90 H ASN 90 14.821 2.012 -6.512
192 HA ASN 90 HA ASN 90 17.289 2.714 -5.176
193 HB2 ASN 90 2HB ASN 90 14.946 1.060 -4.446
194 HB3 ASN 90 1HB ASN 90 16.437 0.910 -3.500
195 HD21 ASN 90 1HD2 ASN 90 13.755 2.919 -4.378
196 HD22 ASN 90 2HD2 ASN 90 14.004 4.134 -3.188
197 H GLY 91 H GLY 91 16.358 0.421 -7.452
198 HA2 GLY 91 2HA GLY 91 17.962 -0.857 -8.612
199 HA3 GLY 91 1HA GLY 91 19.045 -0.696 -7.237
200 H HIS 92 H HIS 92 15.712 -1.749 -7.084
201 HA HIS 92 HA HIS 92 16.588 -4.312 -6.043
202 HB2 HIS 92 2HB HIS 92 13.929 -2.894 -6.100
203 HB3 HIS 92 1HB HIS 92 14.085 -4.567 -5.576
204 HD1 HIS 92 1HD HIS 92 14.657 -4.866 -3.128
205 HD2 HIS 92 2HD HIS 92 15.222 -1.001 -4.485
206 HE1 HIS 92 1HE HIS 92 15.064 -3.457 -1.069
207 H ASN 93 H ASN 93 16.308 -6.150 -7.162
208 HA ASN 93 HA ASN 93 15.297 -5.932 -9.865
209 HB2 ASN 93 2HB ASN 93 16.696 -8.221 -8.449
210 HB3 ASN 93 1HB ASN 93 16.151 -8.268 -10.121
211 HD21 ASN 93 1HD2 ASN 93 18.815 -8.577 -9.069
212 HD22 ASN 93 2HD2 ASN 93 19.770 -7.350 -9.808
213 H VAL 94 H VAL 94 13.155 -5.773 -9.556
214 HA VAL 94 HA VAL 94 11.839 -7.861 -8.024
215 HB VAL 94 HB VAL 94 10.722 -5.302 -9.225
216 HG11 VAL 94 1HG1 VAL 94 8.690 -5.790 -7.953
217 HG12 VAL 94 2HG1 VAL 94 9.367 -7.337 -7.446
218 HG13 VAL 94 3HG1 VAL 94 9.002 -7.051 -9.149
219 HG21 VAL 94 1HG2 VAL 94 11.269 -6.076 -6.368
220 HG22 VAL 94 2HG2 VAL 94 10.522 -4.571 -6.902
221 HG23 VAL 94 3HG2 VAL 94 12.198 -4.927 -7.328
222 H SER 95 H SER 95 11.153 -9.540 -9.005
223 HA SER 95 HA SER 95 11.247 -9.889 -11.787
224 HB2 SER 95 2HB SER 95 11.527 -11.723 -10.187
225 HB3 SER 95 1HB SER 95 9.860 -11.529 -9.652
226 HG SER 95 HG SER 95 9.295 -12.729 -11.212
227 H THR 96 H THR 96 9.804 -9.411 -13.309
228 HA THR 96 HA THR 96 7.418 -8.035 -12.712
229 HB THR 96 HB THR 96 7.100 -8.214 -15.203
230 HG1 THR 96 1HG THR 96 8.444 -9.420 -16.361
231 HG21 THR 96 1HG2 THR 96 9.057 -6.840 -15.780
232 HG22 THR 96 2HG2 THR 96 9.840 -7.334 -14.278
233 HG23 THR 96 3HG2 THR 96 8.372 -6.358 -14.226
234 H ARG 97 H ARG 97 8.324 -11.272 -13.425
235 HA ARG 97 HA ARG 97 5.565 -12.168 -13.566
236 HB2 ARG 97 2HB ARG 97 8.136 -13.771 -13.751
237 HB3 ARG 97 1HB ARG 97 6.526 -14.378 -14.095
238 HG2 ARG 97 2HG ARG 97 8.038 -12.282 -15.654
239 HG3 ARG 97 1HG ARG 97 7.699 -13.936 -16.163
240 HD2 ARG 97 2HD ARG 97 5.310 -13.454 -16.211
241 HD3 ARG 97 1HD ARG 97 5.626 -11.829 -15.597
242 HE ARG 97 HE ARG 97 7.083 -12.219 -17.948
243 HH11 ARG 97 1HH1 ARG 97 3.704 -11.820 -16.935
244 HH12 ARG 97 2HH1 ARG 97 3.213 -11.078 -18.371
245 HH21 ARG 97 1HH2 ARG 97 6.434 -11.210 -19.887
246 HH22 ARG 97 2HH2 ARG 97 4.812 -10.698 -20.111
247 H GLY 98 H GLY 98 4.675 -12.170 -11.617
248 HA2 GLY 98 2HA GLY 98 4.625 -13.723 -9.638
249 HA3 GLY 98 1HA GLY 98 6.266 -13.147 -9.355
250 H ARG 99 H ARG 99 5.235 -12.563 -7.273
251 HA ARG 99 HA ARG 99 3.769 -10.022 -7.441
252 HB2 ARG 99 2HB ARG 99 2.617 -11.907 -6.275
253 HB3 ARG 99 1HB ARG 99 3.956 -11.988 -5.145
254 HG2 ARG 99 2HG ARG 99 3.427 -9.753 -4.330
255 HG3 ARG 99 1HG ARG 99 2.122 -9.617 -5.505
256 HD2 ARG 99 2HD ARG 99 1.055 -11.604 -4.470
257 HD3 ARG 99 1HD ARG 99 2.316 -11.589 -3.239
258 HE ARG 99 HE ARG 99 1.405 -9.147 -2.979
259 HH11 ARG 99 1HH1 ARG 99 -0.375 -12.190 -3.231
260 HH12 ARG 99 2HH1 ARG 99 -1.770 -11.619 -2.463
261 HH21 ARG 99 1HH2 ARG 99 -0.487 -8.354 -1.913
262 HH22 ARG 99 2HH2 ARG 99 -1.847 -9.364 -1.697
263 H ILE 100 H ILE 100 4.552 -8.286 -6.211
264 HA ILE 100 HA ILE 100 7.335 -8.062 -6.009
265 HB ILE 100 HB ILE 100 5.234 -6.378 -4.627
266 HG12 ILE 100 2HG1 ILE 100 6.545 -6.036 -7.324
267 HG13 ILE 100 1HG1 ILE 100 4.876 -6.521 -7.039
268 HG21 ILE 100 1HG2 ILE 100 6.949 -4.594 -4.690
269 HG22 ILE 100 2HG2 ILE 100 8.120 -5.752 -5.305
270 HG23 ILE 100 3HG2 ILE 100 7.424 -5.965 -3.687
271 HD11 ILE 100 1HD1 ILE 100 6.119 -3.908 -6.288
272 HD12 ILE 100 2HD1 ILE 100 4.450 -4.385 -5.965
273 HD13 ILE 100 3HD1 ILE 100 5.011 -4.195 -7.629
274 HA PRO 101 HA PRO 101 8.042 -10.250 -2.172
275 HB2 PRO 101 2HB PRO 101 10.474 -8.553 -2.054
276 HB3 PRO 101 1HB PRO 101 10.327 -10.324 -2.027
277 HG2 PRO 101 2HG PRO 101 11.248 -9.070 -4.158
278 HG3 PRO 101 1HG PRO 101 10.229 -10.521 -4.282
279 HD2 PRO 101 2HD PRO 101 9.509 -7.677 -4.771
280 HD3 PRO 101 1HD PRO 101 8.955 -9.160 -5.578
281 H ALA 102 H ALA 102 7.543 -9.832 -0.162
282 HA ALA 102 HA ALA 102 6.451 -7.410 0.684
283 HB1 ALA 102 1HB ALA 102 7.461 -9.683 2.385
284 HB2 ALA 102 2HB ALA 102 5.860 -9.588 1.654
285 HB3 ALA 102 3HB ALA 102 6.335 -8.426 2.895
286 H ASP 103 H ASP 103 9.675 -8.636 0.850
287 HA ASP 103 HA ASP 103 10.810 -6.894 2.728
288 HB2 ASP 103 2HB ASP 103 12.057 -8.787 1.826
289 HB3 ASP 103 1HB ASP 103 12.030 -8.064 0.221
290 H VAL 104 H VAL 104 10.206 -6.484 -0.743
291 HA VAL 104 HA VAL 104 11.476 -3.918 -0.867
292 HB VAL 104 HB VAL 104 9.633 -5.311 -2.863
293 HG11 VAL 104 1HG1 VAL 104 9.580 -2.859 -3.140
294 HG12 VAL 104 2HG1 VAL 104 10.361 -3.669 -4.495
295 HG13 VAL 104 3HG1 VAL 104 11.340 -2.853 -3.279
296 HG21 VAL 104 1HG2 VAL 104 11.655 -5.729 -4.124
297 HG22 VAL 104 2HG2 VAL 104 11.808 -6.423 -2.498
298 HG23 VAL 104 3HG2 VAL 104 12.598 -4.888 -2.903
299 H ILE 105 H ILE 105 8.221 -5.178 -0.640
300 HA ILE 105 HA ILE 105 6.837 -2.728 -0.789
301 HB ILE 105 HB ILE 105 6.041 -5.236 0.724
302 HG12 ILE 105 2HG1 ILE 105 5.417 -4.359 -2.109
303 HG13 ILE 105 1HG1 ILE 105 6.539 -5.629 -1.646
304 HG21 ILE 105 1HG2 ILE 105 3.732 -4.419 0.468
305 HG22 ILE 105 2HG2 ILE 105 4.344 -2.926 -0.256
306 HG23 ILE 105 3HG2 ILE 105 4.715 -3.308 1.420
307 HD11 ILE 105 1HD1 ILE 105 3.561 -5.651 -1.216
308 HD12 ILE 105 2HD1 ILE 105 4.691 -6.920 -0.726
309 HD13 ILE 105 3HD1 ILE 105 4.478 -6.541 -2.439
310 H ASP 106 H ASP 106 8.277 -4.430 1.918
311 HA ASP 106 HA ASP 106 7.318 -2.772 3.993
312 HB2 ASP 106 2HB ASP 106 8.187 -5.029 4.396
313 HB3 ASP 106 1HB ASP 106 9.767 -4.533 3.819
314 H ALA 107 H ALA 107 10.334 -2.878 2.190
315 HA ALA 107 HA ALA 107 11.570 -0.676 3.411
316 HB1 ALA 107 1HB ALA 107 12.736 -2.361 2.060
317 HB2 ALA 107 2HB ALA 107 13.059 -0.725 1.483
318 HB3 ALA 107 3HB ALA 107 11.909 -1.765 0.624
319 H TYR 108 H TYR 108 9.479 -0.999 0.617
320 HA TYR 108 HA TYR 108 9.502 1.546 -0.428
321 HB2 TYR 108 2HB TYR 108 8.451 -0.284 -1.580
322 HB3 TYR 108 1HB TYR 108 7.294 -0.504 -0.276
323 HD1 TYR 108 1HD TYR 108 5.197 0.507 -0.425
324 HD2 TYR 108 2HD TYR 108 8.359 1.942 -2.870
325 HE1 TYR 108 1HE TYR 108 3.604 1.935 -1.630
326 HE2 TYR 108 2HE TYR 108 6.806 3.361 -4.076
327 HH TYR 108 HH TYR 108 3.585 3.873 -2.957
328 H HIS 109 H HIS 109 7.204 0.227 1.962
329 HA HIS 109 HA HIS 109 6.014 2.775 2.313
330 HB2 HIS 109 2HB HIS 109 5.707 0.243 3.906
331 HB3 HIS 109 1HB HIS 109 4.852 1.726 4.312
332 HD1 HIS 109 1HD HIS 109 3.300 2.696 2.187
333 HD2 HIS 109 2HD HIS 109 4.419 -1.309 2.134
334 HE1 HIS 109 1HE HIS 109 1.711 1.556 0.632
335 H ALA 110 H ALA 110 8.664 1.179 3.836
336 HA ALA 110 HA ALA 110 8.802 2.856 6.122
337 HB1 ALA 110 1HB ALA 110 11.027 1.348 4.739
338 HB2 ALA 110 2HB ALA 110 9.976 0.680 5.978
339 HB3 ALA 110 3HB ALA 110 11.080 2.000 6.376
340 H ALA 111 H ALA 111 9.963 3.081 2.854
341 HA ALA 111 HA ALA 111 11.557 5.423 3.377
342 HB1 ALA 111 1HB ALA 111 12.141 5.321 1.035
343 HB2 ALA 111 2HB ALA 111 10.912 4.086 0.761
344 HB3 ALA 111 3HB ALA 111 12.308 3.729 1.773
345 H THR 112 H THR 112 8.542 4.741 1.548
346 HA THR 112 HA THR 112 8.252 7.620 1.421
347 HB THR 112 HB THR 112 8.432 6.587 -0.833
348 HG1 THR 112 1HG THR 112 5.893 7.345 -1.213
349 HG21 THR 112 1HG2 THR 112 7.395 4.413 -0.404
350 HG22 THR 112 2HG2 THR 112 6.597 5.227 -1.756
351 HG23 THR 112 3HG2 THR 112 5.833 5.193 -0.167
Start of MODEL 16
1 H MET 65 1HT MET 65 5.205 9.385 -14.623
2 HA MET 65 HA MET 65 5.288 11.236 -16.160
3 HB2 MET 65 2HB MET 65 3.542 9.445 -16.466
4 HB3 MET 65 1HB MET 65 2.428 10.429 -15.540
5 HG2 MET 65 2HG MET 65 1.966 10.668 -17.889
6 HG3 MET 65 1HG MET 65 2.584 12.187 -17.250
7 HE1 MET 65 1HE MET 65 5.083 9.265 -19.816
8 HE2 MET 65 2HE MET 65 3.407 8.971 -19.356
9 HE3 MET 65 3HE MET 65 4.681 8.931 -18.137
10 H SER 66 H SER 66 2.427 11.730 -14.080
11 HA SER 66 HA SER 66 3.408 14.273 -13.271
12 HB2 SER 66 2HB SER 66 2.173 14.710 -15.432
13 HB3 SER 66 1HB SER 66 0.735 14.008 -14.693
14 HG SER 66 HG SER 66 1.274 15.730 -12.985
15 H GLY 67 H GLY 67 3.510 13.223 -11.324
16 HA2 GLY 67 2HA GLY 67 1.245 11.775 -10.288
17 HA3 GLY 67 1HA GLY 67 2.812 11.980 -9.523
18 H SER 68 H SER 68 -0.226 13.508 -10.189
19 HA SER 68 HA SER 68 0.084 14.974 -7.692
20 HB2 SER 68 2HB SER 68 -1.397 16.753 -8.799
21 HB3 SER 68 1HB SER 68 0.278 16.671 -9.333
22 HG SER 68 HG SER 68 -2.052 16.192 -10.710
23 H GLY 69 H GLY 69 -2.541 14.410 -10.020
24 HA2 GLY 69 2HA GLY 69 -4.598 13.463 -9.765
25 HA3 GLY 69 1HA GLY 69 -3.947 12.591 -8.382
26 H ARG 70 H ARG 70 -6.038 12.938 -7.431
27 HA ARG 70 HA ARG 70 -6.283 15.637 -6.350
28 HB2 ARG 70 2HB ARG 70 -8.472 13.598 -6.826
29 HB3 ARG 70 1HB ARG 70 -8.704 15.056 -5.880
30 HG2 ARG 70 2HG ARG 70 -9.605 15.450 -8.035
31 HG3 ARG 70 1HG ARG 70 -8.100 16.365 -7.940
32 HD2 ARG 70 2HD ARG 70 -6.967 14.536 -9.149
33 HD3 ARG 70 1HD ARG 70 -8.508 13.710 -9.316
34 HE ARG 70 HE ARG 70 -8.676 16.340 -10.310
35 HH11 ARG 70 1HH1 ARG 70 -7.442 13.116 -11.148
36 HH12 ARG 70 2HH1 ARG 70 -7.413 13.408 -12.824
37 HH21 ARG 70 1HH2 ARG 70 -8.609 16.741 -12.613
38 HH22 ARG 70 2HH2 ARG 70 -8.050 15.542 -13.673
39 H GLY 71 H GLY 71 -5.166 15.531 -4.550
40 HA2 GLY 71 2HA GLY 71 -6.183 14.449 -2.275
41 HA3 GLY 71 1HA GLY 71 -5.021 13.266 -2.884
42 H ARG 72 H ARG 72 -4.554 14.464 -0.519
43 HA ARG 72 HA ARG 72 -3.052 16.891 -0.729
44 HB2 ARG 72 2HB ARG 72 -2.745 14.872 1.495
45 HB3 ARG 72 1HB ARG 72 -2.534 16.609 1.571
46 HG2 ARG 72 2HG ARG 72 -5.129 15.083 1.396
47 HG3 ARG 72 1HG ARG 72 -4.531 16.028 2.753
48 HD2 ARG 72 2HD ARG 72 -4.719 18.071 1.326
49 HD3 ARG 72 1HD ARG 72 -5.436 17.067 0.065
50 HE ARG 72 HE ARG 72 -6.585 17.560 2.714
51 HH11 ARG 72 1HH1 ARG 72 -7.072 16.774 -0.721
52 HH12 ARG 72 2HH1 ARG 72 -8.759 16.769 -0.640
53 HH21 ARG 72 1HH2 ARG 72 -8.940 17.584 2.821
54 HH22 ARG 72 2HH2 ARG 72 -9.845 17.209 1.436
55 H GLY 73 H GLY 73 -2.199 13.523 -0.188
56 HA2 GLY 73 2HA GLY 73 0.200 13.846 -1.805
57 HA3 GLY 73 1HA GLY 73 0.404 13.263 -0.150
58 H ALA 74 H ALA 74 -2.374 12.655 -2.008
59 HA ALA 74 HA ALA 74 -2.388 9.869 -1.521
60 HB1 ALA 74 1HB ALA 74 -4.439 11.162 -1.800
61 HB2 ALA 74 2HB ALA 74 -4.336 9.833 -2.961
62 HB3 ALA 74 3HB ALA 74 -4.004 11.481 -3.481
63 H ILE 75 H ILE 75 -2.423 8.229 -2.997
64 HA ILE 75 HA ILE 75 -0.357 8.537 -5.013
65 HB ILE 75 HB ILE 75 -1.654 6.055 -3.921
66 HG12 ILE 75 2HG1 ILE 75 1.044 7.200 -3.248
67 HG13 ILE 75 1HG1 ILE 75 -0.389 7.495 -2.279
68 HG21 ILE 75 1HG2 ILE 75 0.324 4.898 -4.908
69 HG22 ILE 75 2HG2 ILE 75 0.881 6.441 -5.557
70 HG23 ILE 75 3HG2 ILE 75 -0.623 5.731 -6.142
71 HD11 ILE 75 1HD1 ILE 75 0.988 5.754 -1.322
72 HD12 ILE 75 2HD1 ILE 75 0.840 4.794 -2.812
73 HD13 ILE 75 3HD1 ILE 75 -0.587 5.147 -1.817
74 H ASP 76 H ASP 76 -1.192 9.167 -6.732
75 HA ASP 76 HA ASP 76 -3.583 7.853 -7.818
76 HB2 ASP 76 2HB ASP 76 -3.838 10.283 -7.607
77 HB3 ASP 76 1HB ASP 76 -2.397 10.521 -8.599
78 H ARG 77 H ARG 77 -2.238 6.197 -8.164
79 HA ARG 77 HA ARG 77 -1.248 5.766 -10.781
80 HB2 ARG 77 2HB ARG 77 0.731 6.048 -8.495
81 HB3 ARG 77 1HB ARG 77 1.028 4.913 -9.791
82 HG2 ARG 77 2HG ARG 77 0.471 7.736 -10.516
83 HG3 ARG 77 1HG ARG 77 2.018 7.358 -9.767
84 HD2 ARG 77 2HD ARG 77 2.111 7.340 -12.250
85 HD3 ARG 77 1HD ARG 77 2.562 5.812 -11.518
86 HE ARG 77 HE ARG 77 0.326 4.978 -12.200
87 HH11 ARG 77 1HH1 ARG 77 1.414 7.944 -13.862
88 HH12 ARG 77 2HH1 ARG 77 0.667 7.480 -15.327
89 HH21 ARG 77 1HH2 ARG 77 -0.551 4.399 -14.141
90 HH22 ARG 77 2HH2 ARG 77 -0.478 5.425 -15.514
91 H GLU 78 H GLU 78 -0.622 3.439 -10.854
92 HA GLU 78 HA GLU 78 -2.145 1.846 -9.104
93 HB2 GLU 78 2HB GLU 78 0.154 0.906 -10.828
94 HB3 GLU 78 1HB GLU 78 -1.223 -0.026 -10.279
95 HG2 GLU 78 2HG GLU 78 -1.718 0.320 -12.508
96 HG3 GLU 78 1HG GLU 78 -2.606 1.627 -11.733
97 H GLN 79 H GLN 79 -1.547 1.259 -7.073
98 HA GLN 79 HA GLN 79 0.815 2.121 -5.883
99 HB2 GLN 79 2HB GLN 79 -1.072 -0.050 -4.993
100 HB3 GLN 79 1HB GLN 79 0.285 0.503 -4.025
101 HG2 GLN 79 2HG GLN 79 -0.697 2.794 -4.090
102 HG3 GLN 79 1HG GLN 79 -2.113 2.101 -4.884
103 HE21 GLN 79 1HE2 GLN 79 -3.531 0.809 -3.690
104 HE22 GLN 79 2HE2 GLN 79 -3.429 0.726 -1.970
105 H SER 80 H SER 80 0.089 -1.015 -7.296
106 HA SER 80 HA SER 80 2.422 -2.355 -6.538
107 HB2 SER 80 2HB SER 80 1.868 -3.559 -8.785
108 HB3 SER 80 1HB SER 80 0.740 -3.721 -7.414
109 HG SER 80 HG SER 80 -0.663 -2.909 -8.700
110 H ALA 81 H ALA 81 1.660 -0.425 -9.353
111 HA ALA 81 HA ALA 81 4.134 -0.756 -10.649
112 HB1 ALA 81 1HB ALA 81 3.365 1.003 -12.132
113 HB2 ALA 81 2HB ALA 81 2.125 1.448 -10.962
114 HB3 ALA 81 3HB ALA 81 2.055 -0.127 -11.759
115 H ALA 82 H ALA 82 2.883 1.596 -8.376
116 HA ALA 82 HA ALA 82 5.007 3.447 -8.514
117 HB1 ALA 82 1HB ALA 82 2.828 3.993 -7.518
118 HB2 ALA 82 2HB ALA 82 4.146 4.312 -6.392
119 HB3 ALA 82 3HB ALA 82 3.155 2.868 -6.201
120 H ILE 83 H ILE 83 4.399 0.671 -6.367
121 HA ILE 83 HA ILE 83 6.764 0.899 -4.859
122 HB ILE 83 HB ILE 83 5.214 -1.634 -5.540
123 HG12 ILE 83 2HG1 ILE 83 5.056 0.164 -3.102
124 HG13 ILE 83 1HG1 ILE 83 3.866 0.090 -4.396
125 HG21 ILE 83 1HG2 ILE 83 7.238 -1.118 -3.348
126 HG22 ILE 83 2HG2 ILE 83 7.472 -2.160 -4.753
127 HG23 ILE 83 3HG2 ILE 83 6.280 -2.587 -3.524
128 HD11 ILE 83 1HD1 ILE 83 4.579 -2.156 -2.524
129 HD12 ILE 83 2HD1 ILE 83 3.347 -2.216 -3.789
130 HD13 ILE 83 3HD1 ILE 83 3.151 -1.131 -2.411
131 H ARG 84 H ARG 84 6.041 -0.750 -7.874
132 HA ARG 84 HA ARG 84 8.530 -1.931 -8.269
133 HB2 ARG 84 2HB ARG 84 6.401 -1.064 -10.180
134 HB3 ARG 84 1HB ARG 84 7.894 -1.808 -10.741
135 HG2 ARG 84 2HG ARG 84 7.418 -3.796 -9.443
136 HG3 ARG 84 1HG ARG 84 5.963 -3.042 -8.785
137 HD2 ARG 84 2HD ARG 84 5.491 -4.602 -10.620
138 HD3 ARG 84 1HD ARG 84 4.980 -2.943 -10.968
139 HE ARG 84 HE ARG 84 7.595 -3.416 -11.902
140 HH11 ARG 84 1HH1 ARG 84 4.272 -4.303 -12.755
141 HH12 ARG 84 2HH1 ARG 84 4.535 -4.286 -14.431
142 HH21 ARG 84 1HH2 ARG 84 7.978 -3.423 -14.209
143 HH22 ARG 84 2HH2 ARG 84 6.723 -3.801 -15.286
144 H GLU 85 H GLU 85 7.327 1.256 -9.251
145 HA GLU 85 HA GLU 85 9.558 2.189 -10.646
146 HB2 GLU 85 2HB GLU 85 7.531 3.628 -8.954
147 HB3 GLU 85 1HB GLU 85 8.785 4.474 -9.845
148 HG2 GLU 85 2HG GLU 85 6.718 2.677 -11.074
149 HG3 GLU 85 1HG GLU 85 6.610 4.436 -10.990
150 H TRP 86 H TRP 86 8.789 2.346 -7.185
151 HA TRP 86 HA TRP 86 11.029 3.838 -6.403
152 HB2 TRP 86 2HB TRP 86 8.967 3.634 -5.099
153 HB3 TRP 86 1HB TRP 86 9.233 1.906 -4.938
154 HD1 TRP 86 HD TRP 86 10.222 5.242 -3.427
155 HE1 TRP 86 1HE TRP 86 11.589 4.832 -1.325
156 HE3 TRP 86 3HE TRP 86 10.838 0.250 -3.927
157 HZ2 TRP 86 2HZ TRP 86 12.810 2.619 -0.013
158 HZ3 TRP 86 3HZ TRP 86 12.130 -0.983 -2.191
159 HH2 TRP 86 HH TRP 86 13.088 0.196 -0.284
160 H ALA 87 H ALA 87 10.290 0.402 -6.563
161 HA ALA 87 HA ALA 87 12.614 -0.685 -5.505
162 HB1 ALA 87 1HB ALA 87 10.597 -1.975 -5.980
163 HB2 ALA 87 2HB ALA 87 12.002 -2.713 -6.759
164 HB3 ALA 87 3HB ALA 87 10.862 -1.770 -7.707
165 H ARG 88 H ARG 88 11.804 0.168 -8.816
166 HA ARG 88 HA ARG 88 14.196 -0.658 -10.006
167 HB2 ARG 88 2HB ARG 88 12.285 1.522 -10.880
168 HB3 ARG 88 1HB ARG 88 13.586 0.902 -11.875
169 HG2 ARG 88 2HG ARG 88 11.431 -0.906 -10.834
170 HG3 ARG 88 1HG ARG 88 11.181 0.071 -12.272
171 HD2 ARG 88 2HD ARG 88 11.856 -2.158 -12.910
172 HD3 ARG 88 1HD ARG 88 13.124 -1.023 -13.320
173 HE ARG 88 HE ARG 88 14.306 -1.832 -11.325
174 HH11 ARG 88 1HH1 ARG 88 11.759 -3.925 -12.630
175 HH12 ARG 88 2HH1 ARG 88 12.553 -5.377 -12.292
176 HH21 ARG 88 1HH2 ARG 88 15.415 -3.851 -10.849
177 HH22 ARG 88 2HH2 ARG 88 14.698 -5.337 -11.283
178 H ARG 89 H ARG 89 13.227 2.420 -8.578
179 HA ARG 89 HA ARG 89 15.466 3.998 -9.280
180 HB2 ARG 89 2HB ARG 89 13.762 4.168 -6.786
181 HB3 ARG 89 1HB ARG 89 14.888 5.396 -7.320
182 HG2 ARG 89 2HG ARG 89 12.473 4.506 -8.874
183 HG3 ARG 89 1HG ARG 89 12.514 5.899 -7.800
184 HD2 ARG 89 2HD ARG 89 14.302 6.872 -9.188
185 HD3 ARG 89 1HD ARG 89 14.183 5.492 -10.276
186 HE ARG 89 HE ARG 89 11.801 6.168 -10.548
187 HH11 ARG 89 1HH1 ARG 89 14.316 8.574 -9.877
188 HH12 ARG 89 2HH1 ARG 89 13.453 9.859 -10.600
189 HH21 ARG 89 1HH2 ARG 89 10.629 7.961 -11.490
190 HH22 ARG 89 2HH2 ARG 89 11.327 9.513 -11.512
191 H ASN 90 H ASN 90 14.823 1.976 -6.514
192 HA ASN 90 HA ASN 90 17.310 2.608 -5.219
193 HB2 ASN 90 2HB ASN 90 15.042 0.784 -4.608
194 HB3 ASN 90 1HB ASN 90 16.516 0.712 -3.630
195 HD21 ASN 90 1HD2 ASN 90 13.751 2.645 -4.579
196 HD22 ASN 90 2HD2 ASN 90 13.871 3.796 -3.320
197 H GLY 91 H GLY 91 16.189 0.075 -7.306
198 HA2 GLY 91 2HA GLY 91 17.836 -1.113 -8.602
199 HA3 GLY 91 1HA GLY 91 18.921 -1.022 -7.221
200 H HIS 92 H HIS 92 15.616 -1.779 -6.681
201 HA HIS 92 HA HIS 92 16.353 -4.365 -5.665
202 HB2 HIS 92 2HB HIS 92 13.767 -2.852 -5.779
203 HB3 HIS 92 1HB HIS 92 13.854 -4.495 -5.151
204 HD1 HIS 92 1HD HIS 92 15.466 -4.712 -2.907
205 HD2 HIS 92 2HD HIS 92 14.246 -0.912 -4.031
206 HE1 HIS 92 1HE HIS 92 15.883 -3.235 -0.926
207 H ASN 93 H ASN 93 16.066 -6.211 -6.682
208 HA ASN 93 HA ASN 93 15.219 -6.022 -9.427
209 HB2 ASN 93 2HB ASN 93 16.530 -8.277 -7.919
210 HB3 ASN 93 1HB ASN 93 15.894 -8.498 -9.540
211 HD21 ASN 93 1HD2 ASN 93 17.474 -5.533 -8.409
212 HD22 ASN 93 2HD2 ASN 93 18.852 -5.689 -9.414
213 H VAL 94 H VAL 94 13.127 -5.691 -9.365
214 HA VAL 94 HA VAL 94 11.436 -7.810 -8.306
215 HB VAL 94 HB VAL 94 10.680 -5.073 -9.402
216 HG11 VAL 94 1HG1 VAL 94 8.879 -6.696 -9.759
217 HG12 VAL 94 2HG1 VAL 94 8.447 -5.526 -8.512
218 HG13 VAL 94 3HG1 VAL 94 8.949 -7.152 -8.053
219 HG21 VAL 94 1HG2 VAL 94 10.726 -6.113 -6.574
220 HG22 VAL 94 2HG2 VAL 94 10.155 -4.518 -7.076
221 HG23 VAL 94 3HG2 VAL 94 11.856 -4.957 -7.273
222 H SER 95 H SER 95 10.978 -9.359 -9.618
223 HA SER 95 HA SER 95 11.374 -9.123 -12.456
224 HB2 SER 95 2HB SER 95 12.133 -11.119 -11.169
225 HB3 SER 95 1HB SER 95 10.459 -11.464 -10.764
226 HG SER 95 HG SER 95 11.859 -12.031 -12.998
227 H THR 96 H THR 96 9.713 -9.826 -13.951
228 HA THR 96 HA THR 96 7.085 -8.877 -13.274
229 HB THR 96 HB THR 96 6.656 -9.582 -15.716
230 HG1 THR 96 1HG THR 96 8.215 -10.585 -16.682
231 HG21 THR 96 1HG2 THR 96 7.839 -7.606 -16.599
232 HG22 THR 96 2HG2 THR 96 8.797 -7.533 -15.119
233 HG23 THR 96 3HG2 THR 96 7.059 -7.247 -15.058
234 H ARG 97 H ARG 97 8.799 -11.783 -13.224
235 HA ARG 97 HA ARG 97 6.366 -13.378 -13.405
236 HB2 ARG 97 2HB ARG 97 9.257 -14.231 -13.455
237 HB3 ARG 97 1HB ARG 97 7.898 -15.349 -13.485
238 HG2 ARG 97 2HG ARG 97 8.463 -13.231 -15.540
239 HG3 ARG 97 1HG ARG 97 8.851 -14.948 -15.706
240 HD2 ARG 97 2HD ARG 97 6.521 -15.529 -15.597
241 HD3 ARG 97 1HD ARG 97 6.070 -13.862 -15.249
242 HE ARG 97 HE ARG 97 7.383 -13.674 -17.565
243 HH11 ARG 97 1HH1 ARG 97 4.699 -15.763 -16.544
244 HH12 ARG 97 2HH1 ARG 97 3.932 -15.696 -18.065
245 HH21 ARG 97 1HH2 ARG 97 6.314 -13.585 -19.593
246 HH22 ARG 97 2HH2 ARG 97 4.877 -14.455 -19.829
247 H GLY 98 H GLY 98 5.508 -12.777 -11.472
248 HA2 GLY 98 2HA GLY 98 5.490 -14.349 -9.422
249 HA3 GLY 98 1HA GLY 98 6.992 -13.490 -9.088
250 H ARG 99 H ARG 99 6.329 -12.445 -7.335
251 HA ARG 99 HA ARG 99 4.230 -10.435 -7.732
252 HB2 ARG 99 2HB ARG 99 3.617 -10.671 -5.367
253 HB3 ARG 99 1HB ARG 99 3.378 -12.172 -6.245
254 HG2 ARG 99 2HG ARG 99 5.427 -13.073 -5.293
255 HG3 ARG 99 1HG ARG 99 5.720 -11.544 -4.456
256 HD2 ARG 99 2HD ARG 99 3.637 -11.827 -3.220
257 HD3 ARG 99 1HD ARG 99 3.341 -13.351 -4.058
258 HE ARG 99 HE ARG 99 5.809 -13.614 -2.912
259 HH11 ARG 99 1HH1 ARG 99 2.553 -12.907 -1.692
260 HH12 ARG 99 2HH1 ARG 99 2.790 -13.679 -0.196
261 HH21 ARG 99 1HH2 ARG 99 6.145 -14.679 -0.873
262 HH22 ARG 99 2HH2 ARG 99 4.913 -14.716 0.290
263 H ILE 100 H ILE 100 4.513 -8.637 -6.085
264 HA ILE 100 HA ILE 100 7.244 -7.801 -6.146
265 HB ILE 100 HB ILE 100 4.848 -6.473 -4.818
266 HG12 ILE 100 2HG1 ILE 100 6.100 -5.978 -7.533
267 HG13 ILE 100 1HG1 ILE 100 4.546 -6.746 -7.246
268 HG21 ILE 100 1HG2 ILE 100 6.224 -4.430 -4.883
269 HG22 ILE 100 2HG2 ILE 100 7.565 -5.355 -5.554
270 HG23 ILE 100 3HG2 ILE 100 6.996 -5.690 -3.918
271 HD11 ILE 100 1HD1 ILE 100 4.279 -4.443 -7.936
272 HD12 ILE 100 2HD1 ILE 100 5.279 -3.914 -6.581
273 HD13 ILE 100 3HD1 ILE 100 3.708 -4.666 -6.278
274 HA PRO 101 HA PRO 101 8.084 -9.943 -2.333
275 HB2 PRO 101 2HB PRO 101 10.429 -8.151 -2.166
276 HB3 PRO 101 1HB PRO 101 10.383 -9.922 -2.247
277 HG2 PRO 101 2HG PRO 101 11.217 -8.482 -4.312
278 HG3 PRO 101 1HG PRO 101 10.304 -9.991 -4.515
279 HD2 PRO 101 2HD PRO 101 9.362 -7.182 -4.835
280 HD3 PRO 101 1HD PRO 101 8.937 -8.652 -5.736
281 H ALA 102 H ALA 102 7.452 -9.561 -0.349
282 HA ALA 102 HA ALA 102 6.363 -7.120 0.466
283 HB1 ALA 102 1HB ALA 102 7.191 -9.471 2.160
284 HB2 ALA 102 2HB ALA 102 5.628 -9.255 1.365
285 HB3 ALA 102 3HB ALA 102 6.116 -8.163 2.660
286 H ASP 103 H ASP 103 9.529 -8.425 0.738
287 HA ASP 103 HA ASP 103 10.662 -6.740 2.667
288 HB2 ASP 103 2HB ASP 103 11.867 -8.671 1.812
289 HB3 ASP 103 1HB ASP 103 11.854 -7.998 0.187
290 H VAL 104 H VAL 104 10.065 -6.286 -0.776
291 HA VAL 104 HA VAL 104 11.371 -3.726 -0.892
292 HB VAL 104 HB VAL 104 9.488 -5.081 -2.865
293 HG11 VAL 104 1HG1 VAL 104 9.507 -2.641 -3.162
294 HG12 VAL 104 2HG1 VAL 104 10.284 -3.475 -4.509
295 HG13 VAL 104 3HG1 VAL 104 11.269 -2.677 -3.282
296 HG21 VAL 104 1HG2 VAL 104 11.575 -6.299 -2.550
297 HG22 VAL 104 2HG2 VAL 104 12.482 -4.819 -2.884
298 HG23 VAL 104 3HG2 VAL 104 11.503 -5.557 -4.152
299 H ILE 105 H ILE 105 8.126 -4.987 -0.589
300 HA ILE 105 HA ILE 105 6.732 -2.533 -0.767
301 HB ILE 105 HB ILE 105 5.922 -5.027 0.761
302 HG12 ILE 105 2HG1 ILE 105 5.221 -4.171 -2.065
303 HG13 ILE 105 1HG1 ILE 105 6.406 -5.403 -1.654
304 HG21 ILE 105 1HG2 ILE 105 4.236 -2.721 -0.253
305 HG22 ILE 105 2HG2 ILE 105 4.645 -3.028 1.424
306 HG23 ILE 105 3HG2 ILE 105 3.624 -4.176 0.545
307 HD11 ILE 105 1HD1 ILE 105 3.448 -5.528 -1.090
308 HD12 ILE 105 2HD1 ILE 105 4.637 -6.770 -0.676
309 HD13 ILE 105 3HD1 ILE 105 4.314 -6.393 -2.361
310 H ASP 106 H ASP 106 8.096 -4.276 1.991
311 HA ASP 106 HA ASP 106 7.157 -2.491 3.972
312 HB2 ASP 106 2HB ASP 106 7.855 -4.719 4.620
313 HB3 ASP 106 1HB ASP 106 9.479 -4.430 4.001
314 H ALA 107 H ALA 107 10.239 -2.832 2.278
315 HA ALA 107 HA ALA 107 11.527 -0.663 3.434
316 HB1 ALA 107 1HB ALA 107 12.596 -2.395 2.063
317 HB2 ALA 107 2HB ALA 107 13.023 -0.774 1.517
318 HB3 ALA 107 3HB ALA 107 11.817 -1.729 0.632
319 H TYR 108 H TYR 108 9.460 -0.832 0.577
320 HA TYR 108 HA TYR 108 9.497 1.781 -0.307
321 HB2 TYR 108 2HB TYR 108 8.325 -0.034 -1.492
322 HB3 TYR 108 1HB TYR 108 7.153 -0.119 -0.186
323 HD1 TYR 108 1HD TYR 108 8.324 1.893 -3.017
324 HD2 TYR 108 2HD TYR 108 5.284 1.418 -0.108
325 HE1 TYR 108 1HE TYR 108 6.909 3.480 -4.250
326 HE2 TYR 108 2HE TYR 108 3.852 3.010 -1.326
327 HH TYR 108 HH TYR 108 4.166 4.918 -2.986
328 H HIS 109 H HIS 109 7.217 0.334 2.007
329 HA HIS 109 HA HIS 109 6.156 2.892 2.599
330 HB2 HIS 109 2HB HIS 109 5.647 0.213 3.844
331 HB3 HIS 109 1HB HIS 109 4.935 1.681 4.508
332 HD1 HIS 109 1HD HIS 109 3.027 2.793 3.146
333 HD2 HIS 109 2HD HIS 109 4.682 -0.554 1.330
334 HE1 HIS 109 1HE HIS 109 1.552 2.270 1.199
335 H ALA 110 H ALA 110 8.882 1.348 3.723
336 HA ALA 110 HA ALA 110 9.032 2.779 6.219
337 HB1 ALA 110 1HB ALA 110 10.130 0.582 5.938
338 HB2 ALA 110 2HB ALA 110 11.266 1.844 6.399
339 HB3 ALA 110 3HB ALA 110 11.188 1.297 4.726
340 H ALA 111 H ALA 111 10.020 3.273 2.889
341 HA ALA 111 HA ALA 111 11.827 5.453 3.642
342 HB1 ALA 111 1HB ALA 111 11.147 4.150 1.026
343 HB2 ALA 111 2HB ALA 111 12.582 3.805 1.994
344 HB3 ALA 111 3HB ALA 111 12.370 5.398 1.237
345 H THR 112 H THR 112 8.906 4.642 2.052
346 HA THR 112 HA THR 112 8.311 7.381 1.442
347 HB THR 112 HB THR 112 7.898 4.760 0.001
348 HG1 THR 112 1HG THR 112 9.475 7.027 -0.380
349 HG21 THR 112 1HG2 THR 112 6.807 5.969 -1.705
350 HG22 THR 112 2HG2 THR 112 6.918 7.477 -0.743
351 HG23 THR 112 3HG2 THR 112 5.939 6.092 -0.164
Start of MODEL 17
1 H MET 65 1HT MET 65 -19.231 -6.961 -10.281
2 HA MET 65 HA MET 65 -17.205 -5.967 -8.396
3 HB2 MET 65 2HB MET 65 -16.385 -5.881 -10.728
4 HB3 MET 65 1HB MET 65 -17.863 -5.070 -11.212
5 HG2 MET 65 2HG MET 65 -16.032 -3.496 -11.018
6 HG3 MET 65 1HG MET 65 -17.280 -3.153 -9.826
7 HE1 MET 65 1HE MET 65 -14.465 -5.969 -9.734
8 HE2 MET 65 2HE MET 65 -13.198 -5.094 -8.873
9 HE3 MET 65 3HE MET 65 -13.705 -4.561 -10.475
10 H SER 66 H SER 66 -18.447 -5.094 -6.817
11 HA SER 66 HA SER 66 -20.817 -3.634 -7.530
12 HB2 SER 66 2HB SER 66 -19.445 -4.040 -4.858
13 HB3 SER 66 1HB SER 66 -21.065 -3.382 -5.103
14 HG SER 66 HG SER 66 -21.733 -5.311 -5.905
15 H GLY 67 H GLY 67 -19.808 -2.063 -8.824
16 HA2 GLY 67 2HA GLY 67 -18.354 -0.061 -7.258
17 HA3 GLY 67 1HA GLY 67 -17.735 -0.583 -8.812
18 H SER 68 H SER 68 -21.085 -0.047 -7.969
19 HA SER 68 HA SER 68 -21.438 1.800 -10.126
20 HB2 SER 68 2HB SER 68 -23.275 1.172 -7.799
21 HB3 SER 68 1HB SER 68 -23.741 1.861 -9.358
22 HG SER 68 HG SER 68 -22.634 -0.188 -10.163
23 H GLY 69 H GLY 69 -20.879 1.837 -6.728
24 HA2 GLY 69 2HA GLY 69 -20.315 4.703 -6.848
25 HA3 GLY 69 1HA GLY 69 -21.191 4.009 -5.480
26 H ARG 70 H ARG 70 -18.162 4.009 -7.207
27 HA ARG 70 HA ARG 70 -16.867 2.315 -5.273
28 HB2 ARG 70 2HB ARG 70 -15.693 4.006 -7.460
29 HB3 ARG 70 1HB ARG 70 -14.780 2.905 -6.435
30 HG2 ARG 70 2HG ARG 70 -16.430 1.120 -7.255
31 HG3 ARG 70 1HG ARG 70 -16.822 2.281 -8.525
32 HD2 ARG 70 2HD ARG 70 -14.144 1.242 -7.819
33 HD3 ARG 70 1HD ARG 70 -15.088 0.685 -9.211
34 HE ARG 70 HE ARG 70 -14.580 3.522 -9.172
35 HH11 ARG 70 1HH1 ARG 70 -13.290 0.419 -10.288
36 HH12 ARG 70 2HH1 ARG 70 -12.264 1.102 -11.449
37 HH21 ARG 70 1HH2 ARG 70 -13.082 4.467 -10.695
38 HH22 ARG 70 2HH2 ARG 70 -12.076 3.478 -11.627
39 H GLY 71 H GLY 71 -15.257 2.949 -3.808
40 HA2 GLY 71 2HA GLY 71 -15.902 5.371 -2.471
41 HA3 GLY 71 1HA GLY 71 -14.638 4.232 -2.031
42 H ARG 72 H ARG 72 -14.573 7.105 -2.068
43 HA ARG 72 HA ARG 72 -12.981 7.974 -4.285
44 HB2 ARG 72 2HB ARG 72 -13.580 9.220 -1.607
45 HB3 ARG 72 1HB ARG 72 -12.660 10.015 -2.875
46 HG2 ARG 72 2HG ARG 72 -14.534 9.993 -4.349
47 HG3 ARG 72 1HG ARG 72 -15.478 9.026 -3.211
48 HD2 ARG 72 2HD ARG 72 -16.044 11.453 -3.210
49 HD3 ARG 72 1HD ARG 72 -15.537 10.830 -1.645
50 HE ARG 72 HE ARG 72 -13.443 11.884 -1.931
51 HH11 ARG 72 1HH1 ARG 72 -15.703 12.775 -4.493
52 HH12 ARG 72 2HH1 ARG 72 -15.106 14.358 -4.674
53 HH21 ARG 72 1HH2 ARG 72 -12.530 13.995 -2.242
54 HH22 ARG 72 2HH2 ARG 72 -13.216 15.061 -3.369
55 H GLY 73 H GLY 73 -12.382 6.111 -1.673
56 HA2 GLY 73 2HA GLY 73 -9.632 6.905 -1.209
57 HA3 GLY 73 1HA GLY 73 -10.486 5.553 -0.471
58 H ALA 74 H ALA 74 -11.153 5.274 -3.655
59 HA ALA 74 HA ALA 74 -9.441 3.072 -4.050
60 HB1 ALA 74 1HB ALA 74 -10.224 3.055 -6.332
61 HB2 ALA 74 2HB ALA 74 -10.946 4.657 -6.134
62 HB3 ALA 74 3HB ALA 74 -11.584 3.271 -5.229
63 H ILE 75 H ILE 75 -7.713 2.876 -5.516
64 HA ILE 75 HA ILE 75 -6.117 5.310 -5.450
65 HB ILE 75 HB ILE 75 -5.138 2.455 -5.764
66 HG12 ILE 75 2HG1 ILE 75 -5.256 4.092 -3.248
67 HG13 ILE 75 1HG1 ILE 75 -6.497 2.925 -3.686
68 HG21 ILE 75 1HG2 ILE 75 -3.605 4.300 -6.423
69 HG22 ILE 75 2HG2 ILE 75 -3.032 3.425 -5.009
70 HG23 ILE 75 3HG2 ILE 75 -3.799 5.008 -4.817
71 HD11 ILE 75 1HD1 ILE 75 -4.838 1.159 -3.658
72 HD12 ILE 75 2HD1 ILE 75 -4.923 1.994 -2.105
73 HD13 ILE 75 3HD1 ILE 75 -3.582 2.322 -3.214
74 H ASP 76 H ASP 76 -5.324 6.131 -7.233
75 HA ASP 76 HA ASP 76 -6.476 5.344 -9.759
76 HB2 ASP 76 2HB ASP 76 -6.244 7.716 -9.132
77 HB3 ASP 76 1HB ASP 76 -4.495 7.536 -9.114
78 H ARG 77 H ARG 77 -3.192 5.779 -8.552
79 HA ARG 77 HA ARG 77 -2.093 4.254 -10.777
80 HB2 ARG 77 2HB ARG 77 -0.840 5.547 -8.351
81 HB3 ARG 77 1HB ARG 77 0.058 4.459 -9.375
82 HG2 ARG 77 2HG ARG 77 0.624 6.707 -9.926
83 HG3 ARG 77 1HG ARG 77 -0.283 6.018 -11.262
84 HD2 ARG 77 2HD ARG 77 -2.226 7.276 -10.694
85 HD3 ARG 77 1HD ARG 77 -1.541 7.744 -9.137
86 HE ARG 77 HE ARG 77 0.249 8.795 -10.682
87 HH11 ARG 77 1HH1 ARG 77 -3.237 8.792 -11.459
88 HH12 ARG 77 2HH1 ARG 77 -3.228 10.391 -12.033
89 HH21 ARG 77 1HH2 ARG 77 0.212 10.994 -11.561
90 HH22 ARG 77 2HH2 ARG 77 -1.247 11.641 -12.132
91 H GLU 78 H GLU 78 -1.147 2.203 -10.502
92 HA GLU 78 HA GLU 78 -2.296 0.668 -8.366
93 HB2 GLU 78 2HB GLU 78 -0.221 -0.066 -10.427
94 HB3 GLU 78 1HB GLU 78 -0.878 -1.185 -9.249
95 HG2 GLU 78 2HG GLU 78 -3.111 -0.830 -10.244
96 HG3 GLU 78 1HG GLU 78 -2.349 0.183 -11.475
97 H GLN 79 H GLN 79 -1.391 0.249 -6.462
98 HA GLN 79 HA GLN 79 0.962 1.584 -5.678
99 HB2 GLN 79 2HB GLN 79 -0.571 -0.632 -4.348
100 HB3 GLN 79 1HB GLN 79 0.852 0.108 -3.631
101 HG2 GLN 79 2HG GLN 79 -1.729 1.488 -4.324
102 HG3 GLN 79 1HG GLN 79 -1.137 1.068 -2.717
103 HE21 GLN 79 1HE2 GLN 79 -1.840 3.663 -3.743
104 HE22 GLN 79 2HE2 GLN 79 -0.430 4.651 -3.630
105 H SER 80 H SER 80 0.255 -1.641 -6.778
106 HA SER 80 HA SER 80 2.696 -2.868 -6.316
107 HB2 SER 80 2HB SER 80 1.003 -3.255 -8.767
108 HB3 SER 80 1HB SER 80 1.973 -4.463 -7.912
109 HG SER 80 HG SER 80 0.532 -4.058 -6.101
110 H ALA 81 H ALA 81 1.591 -0.919 -9.064
111 HA ALA 81 HA ALA 81 3.970 -1.191 -10.564
112 HB1 ALA 81 1HB ALA 81 1.854 -0.559 -11.601
113 HB2 ALA 81 2HB ALA 81 3.090 0.661 -11.909
114 HB3 ALA 81 3HB ALA 81 1.849 0.949 -10.689
115 H ALA 82 H ALA 82 2.738 1.217 -8.325
116 HA ALA 82 HA ALA 82 4.785 3.101 -8.519
117 HB1 ALA 82 1HB ALA 82 3.066 2.428 -6.138
118 HB2 ALA 82 2HB ALA 82 2.632 3.537 -7.443
119 HB3 ALA 82 3HB ALA 82 3.977 3.918 -6.367
120 H ILE 83 H ILE 83 4.444 0.332 -6.306
121 HA ILE 83 HA ILE 83 6.860 0.841 -4.931
122 HB ILE 83 HB ILE 83 5.306 -1.746 -5.204
123 HG12 ILE 83 2HG1 ILE 83 5.293 0.288 -2.965
124 HG13 ILE 83 1HG1 ILE 83 4.034 0.110 -4.180
125 HG21 ILE 83 1HG2 ILE 83 7.587 -2.223 -4.486
126 HG22 ILE 83 2HG2 ILE 83 6.503 -2.415 -3.102
127 HG23 ILE 83 3HG2 ILE 83 7.490 -0.966 -3.255
128 HD11 ILE 83 1HD1 ILE 83 3.402 -0.920 -2.069
129 HD12 ILE 83 2HD1 ILE 83 4.822 -1.967 -2.144
130 HD13 ILE 83 3HD1 ILE 83 3.542 -2.126 -3.348
131 H ARG 84 H ARG 84 6.054 -1.062 -7.786
132 HA ARG 84 HA ARG 84 8.598 -2.258 -8.043
133 HB2 ARG 84 2HB ARG 84 6.349 -1.828 -9.969
134 HB3 ARG 84 1HB ARG 84 7.860 -2.573 -10.473
135 HG2 ARG 84 2HG ARG 84 7.588 -4.360 -8.944
136 HG3 ARG 84 1HG ARG 84 6.230 -3.563 -8.156
137 HD2 ARG 84 2HD ARG 84 5.479 -5.364 -9.591
138 HD3 ARG 84 1HD ARG 84 4.929 -3.801 -10.203
139 HE ARG 84 HE ARG 84 7.274 -4.262 -11.466
140 HH11 ARG 84 1HH1 ARG 84 4.159 -5.939 -11.303
141 HH12 ARG 84 2HH1 ARG 84 4.313 -6.707 -12.809
142 HH21 ARG 84 1HH2 ARG 84 7.447 -5.234 -13.581
143 HH22 ARG 84 2HH2 ARG 84 6.208 -6.251 -14.175
144 H GLU 85 H GLU 85 7.254 0.728 -9.312
145 HA GLU 85 HA GLU 85 9.481 1.479 -10.848
146 HB2 GLU 85 2HB GLU 85 7.461 3.186 -9.387
147 HB3 GLU 85 1HB GLU 85 8.646 3.823 -10.514
148 HG2 GLU 85 2HG GLU 85 7.668 2.521 -12.313
149 HG3 GLU 85 1HG GLU 85 6.505 1.819 -11.190
150 H TRP 86 H TRP 86 8.666 2.009 -7.430
151 HA TRP 86 HA TRP 86 10.884 3.557 -6.736
152 HB2 TRP 86 2HB TRP 86 8.869 3.420 -5.359
153 HB3 TRP 86 1HB TRP 86 9.095 1.692 -5.146
154 HD1 TRP 86 HD TRP 86 10.184 5.051 -3.747
155 HE1 TRP 86 1HE TRP 86 11.611 4.681 -1.686
156 HE3 TRP 86 3HE TRP 86 10.682 0.023 -4.088
157 HZ2 TRP 86 2HZ TRP 86 12.824 2.484 -0.325
158 HZ3 TRP 86 3HZ TRP 86 12.004 -1.175 -2.346
159 HH2 TRP 86 HH TRP 86 13.044 0.047 -0.516
160 H ALA 87 H ALA 87 10.241 0.090 -6.668
161 HA ALA 87 HA ALA 87 12.570 -0.868 -5.546
162 HB1 ALA 87 1HB ALA 87 10.592 -2.256 -5.972
163 HB2 ALA 87 2HB ALA 87 12.026 -2.991 -6.688
164 HB3 ALA 87 3HB ALA 87 10.875 -2.137 -7.699
165 H ARG 88 H ARG 88 11.853 -0.214 -8.935
166 HA ARG 88 HA ARG 88 14.433 -1.026 -9.815
167 HB2 ARG 88 2HB ARG 88 12.328 0.617 -11.221
168 HB3 ARG 88 1HB ARG 88 13.835 0.110 -11.973
169 HG2 ARG 88 2HG ARG 88 11.657 -1.705 -10.935
170 HG3 ARG 88 1HG ARG 88 12.038 -1.382 -12.629
171 HD2 ARG 88 2HD ARG 88 14.317 -2.334 -12.226
172 HD3 ARG 88 1HD ARG 88 13.798 -2.760 -10.598
173 HE ARG 88 HE ARG 88 12.002 -3.833 -12.465
174 HH11 ARG 88 1HH1 ARG 88 15.232 -4.392 -11.120
175 HH12 ARG 88 2HH1 ARG 88 15.358 -5.974 -11.714
176 HH21 ARG 88 1HH2 ARG 88 12.151 -5.981 -13.234
177 HH22 ARG 88 2HH2 ARG 88 13.551 -6.928 -12.968
178 H ARG 89 H ARG 89 13.115 2.040 -8.838
179 HA ARG 89 HA ARG 89 15.273 3.715 -9.573
180 HB2 ARG 89 2HB ARG 89 13.319 3.890 -7.284
181 HB3 ARG 89 1HB ARG 89 14.486 5.146 -7.637
182 HG2 ARG 89 2HG ARG 89 12.368 4.198 -9.545
183 HG3 ARG 89 1HG ARG 89 12.224 5.606 -8.493
184 HD2 ARG 89 2HD ARG 89 14.355 5.204 -10.568
185 HD3 ARG 89 1HD ARG 89 12.910 6.190 -10.782
186 HE ARG 89 HE ARG 89 14.908 6.742 -8.690
187 HH11 ARG 89 1HH1 ARG 89 12.858 7.896 -11.337
188 HH12 ARG 89 2HH1 ARG 89 13.331 9.521 -11.178
189 HH21 ARG 89 1HH2 ARG 89 15.528 8.945 -8.447
190 HH22 ARG 89 2HH2 ARG 89 14.878 10.145 -9.455
191 H ASN 90 H ASN 90 14.702 1.740 -6.781
192 HA ASN 90 HA ASN 90 17.099 2.712 -5.496
193 HB2 ASN 90 2HB ASN 90 14.832 0.989 -4.635
194 HB3 ASN 90 1HB ASN 90 16.296 1.092 -3.635
195 HD21 ASN 90 1HD2 ASN 90 13.575 2.847 -4.969
196 HD22 ASN 90 2HD2 ASN 90 13.636 4.196 -3.922
197 H GLY 91 H GLY 91 16.102 -0.115 -7.219
198 HA2 GLY 91 2HA GLY 91 17.903 -1.260 -8.376
199 HA3 GLY 91 1HA GLY 91 18.879 -1.055 -6.929
200 H HIS 92 H HIS 92 15.530 -2.060 -6.786
201 HA HIS 92 HA HIS 92 16.395 -4.602 -5.671
202 HB2 HIS 92 2HB HIS 92 13.735 -3.178 -5.650
203 HB3 HIS 92 1HB HIS 92 13.995 -4.773 -4.972
204 HD1 HIS 92 1HD HIS 92 14.894 -4.834 -2.561
205 HD2 HIS 92 2HD HIS 92 14.995 -1.065 -4.290
206 HE1 HIS 92 1HE HIS 92 15.476 -3.244 -0.718
207 H ASN 93 H ASN 93 15.760 -6.528 -6.577
208 HA ASN 93 HA ASN 93 14.666 -6.317 -9.254
209 HB2 ASN 93 2HB ASN 93 16.810 -7.729 -8.474
210 HB3 ASN 93 1HB ASN 93 15.560 -8.952 -8.259
211 HD21 ASN 93 1HD2 ASN 93 17.221 -6.932 -10.549
212 HD22 ASN 93 2HD2 ASN 93 16.683 -7.768 -11.958
213 H VAL 94 H VAL 94 12.570 -6.191 -9.103
214 HA VAL 94 HA VAL 94 11.139 -8.137 -7.461
215 HB VAL 94 HB VAL 94 10.169 -5.638 -8.909
216 HG11 VAL 94 1HG1 VAL 94 8.097 -5.916 -7.661
217 HG12 VAL 94 2HG1 VAL 94 8.648 -7.502 -7.097
218 HG13 VAL 94 3HG1 VAL 94 8.345 -7.227 -8.816
219 HG21 VAL 94 1HG2 VAL 94 9.890 -4.724 -6.670
220 HG22 VAL 94 2HG2 VAL 94 11.566 -5.192 -6.972
221 HG23 VAL 94 3HG2 VAL 94 10.530 -6.216 -5.982
222 H SER 95 H SER 95 12.132 -7.539 -10.607
223 HA SER 95 HA SER 95 11.904 -8.549 -12.584
224 HB2 SER 95 2HB SER 95 12.236 -10.661 -11.331
225 HB3 SER 95 1HB SER 95 10.514 -10.736 -10.975
226 HG SER 95 HG SER 95 11.823 -11.715 -13.056
227 H THR 96 H THR 96 10.121 -9.618 -14.030
228 HA THR 96 HA THR 96 7.705 -7.985 -13.820
229 HB THR 96 HB THR 96 7.505 -8.646 -16.289
230 HG1 THR 96 1HG THR 96 10.271 -9.056 -16.177
231 HG21 THR 96 1HG2 THR 96 9.115 -6.921 -17.008
232 HG22 THR 96 2HG2 THR 96 9.897 -6.996 -15.429
233 HG23 THR 96 3HG2 THR 96 8.244 -6.403 -15.563
234 H ARG 97 H ARG 97 8.955 -11.165 -13.691
235 HA ARG 97 HA ARG 97 6.604 -12.586 -14.554
236 HB2 ARG 97 2HB ARG 97 8.780 -13.657 -12.769
237 HB3 ARG 97 1HB ARG 97 7.678 -14.573 -13.773
238 HG2 ARG 97 2HG ARG 97 8.800 -13.629 -15.768
239 HG3 ARG 97 1HG ARG 97 9.958 -12.840 -14.684
240 HD2 ARG 97 2HD ARG 97 10.355 -15.126 -13.679
241 HD3 ARG 97 1HD ARG 97 9.476 -15.782 -15.055
242 HE ARG 97 HE ARG 97 11.770 -14.054 -15.501
243 HH11 ARG 97 1HH1 ARG 97 10.234 -17.208 -15.948
244 HH12 ARG 97 2HH1 ARG 97 11.587 -17.955 -16.636
245 HH21 ARG 97 1HH2 ARG 97 13.650 -15.053 -16.475
246 HH22 ARG 97 2HH2 ARG 97 13.584 -16.675 -16.989
247 H GLY 98 H GLY 98 8.167 -11.926 -11.478
248 HA2 GLY 98 2HA GLY 98 5.991 -13.141 -10.021
249 HA3 GLY 98 1HA GLY 98 7.489 -12.508 -9.351
250 H ARG 99 H ARG 99 6.212 -11.605 -7.745
251 HA ARG 99 HA ARG 99 5.057 -9.069 -8.522
252 HB2 ARG 99 2HB ARG 99 3.276 -10.802 -8.160
253 HB3 ARG 99 1HB ARG 99 3.838 -10.987 -6.507
254 HG2 ARG 99 2HG ARG 99 3.099 -8.800 -5.951
255 HG3 ARG 99 1HG ARG 99 2.806 -8.402 -7.650
256 HD2 ARG 99 2HD ARG 99 1.053 -10.089 -7.745
257 HD3 ARG 99 1HD ARG 99 1.366 -10.519 -6.066
258 HE ARG 99 HE ARG 99 0.589 -8.384 -5.409
259 HH11 ARG 99 1HH1 ARG 99 -0.110 -9.144 -8.823
260 HH12 ARG 99 2HH1 ARG 99 -1.415 -8.076 -8.922
261 HH21 ARG 99 1HH2 ARG 99 -1.213 -6.937 -5.568
262 HH22 ARG 99 2HH2 ARG 99 -2.093 -6.786 -7.009
263 H ILE 100 H ILE 100 4.687 -7.936 -6.137
264 HA ILE 100 HA ILE 100 7.399 -7.488 -5.454
265 HB ILE 100 HB ILE 100 4.980 -6.271 -4.151
266 HG12 ILE 100 2HG1 ILE 100 6.403 -5.472 -6.692
267 HG13 ILE 100 1HG1 ILE 100 4.776 -6.134 -6.593
268 HG21 ILE 100 1HG2 ILE 100 7.806 -5.287 -4.635
269 HG22 ILE 100 2HG2 ILE 100 7.161 -5.855 -3.091
270 HG23 ILE 100 3HG2 ILE 100 6.515 -4.386 -3.831
271 HD11 ILE 100 1HD1 ILE 100 5.763 -3.567 -5.497
272 HD12 ILE 100 2HD1 ILE 100 4.116 -4.182 -5.282
273 HD13 ILE 100 3HD1 ILE 100 4.716 -3.772 -6.904
274 HA PRO 101 HA PRO 101 7.428 -10.104 -1.815
275 HB2 PRO 101 2HB PRO 101 10.053 -8.894 -1.319
276 HB3 PRO 101 1HB PRO 101 9.668 -10.589 -1.678
277 HG2 PRO 101 2HG PRO 101 10.970 -9.011 -3.408
278 HG3 PRO 101 1HG PRO 101 9.893 -10.334 -3.911
279 HD2 PRO 101 2HD PRO 101 9.380 -7.400 -3.901
280 HD3 PRO 101 1HD PRO 101 8.889 -8.658 -5.057
281 H ALA 102 H ALA 102 7.086 -9.662 0.316
282 HA ALA 102 HA ALA 102 6.137 -7.204 1.184
283 HB1 ALA 102 1HB ALA 102 7.236 -9.455 2.865
284 HB2 ALA 102 2HB ALA 102 5.585 -9.340 2.251
285 HB3 ALA 102 3HB ALA 102 6.177 -8.163 3.426
286 H ASP 103 H ASP 103 9.322 -8.517 1.243
287 HA ASP 103 HA ASP 103 10.616 -6.787 3.025
288 HB2 ASP 103 2HB ASP 103 11.552 -8.872 2.019
289 HB3 ASP 103 1HB ASP 103 11.742 -8.015 0.500
290 H VAL 104 H VAL 104 9.906 -6.444 -0.424
291 HA VAL 104 HA VAL 104 11.292 -3.931 -0.639
292 HB VAL 104 HB VAL 104 9.440 -5.356 -2.605
293 HG11 VAL 104 1HG1 VAL 104 11.155 -2.913 -3.075
294 HG12 VAL 104 2HG1 VAL 104 9.399 -2.910 -2.957
295 HG13 VAL 104 3HG1 VAL 104 10.193 -3.760 -4.288
296 HG21 VAL 104 1HG2 VAL 104 11.471 -5.805 -3.846
297 HG22 VAL 104 2HG2 VAL 104 11.606 -6.463 -2.206
298 HG23 VAL 104 3HG2 VAL 104 12.409 -4.940 -2.637
299 H ILE 105 H ILE 105 8.015 -5.077 -0.248
300 HA ILE 105 HA ILE 105 6.688 -2.586 -0.492
301 HB ILE 105 HB ILE 105 5.871 -4.989 1.182
302 HG12 ILE 105 2HG1 ILE 105 5.123 -4.257 -1.658
303 HG13 ILE 105 1HG1 ILE 105 6.289 -5.491 -1.204
304 HG21 ILE 105 1HG2 ILE 105 4.637 -2.957 1.790
305 HG22 ILE 105 2HG2 ILE 105 3.587 -4.104 0.955
306 HG23 ILE 105 3HG2 ILE 105 4.216 -2.698 0.096
307 HD11 ILE 105 1HD1 ILE 105 4.161 -6.440 -1.831
308 HD12 ILE 105 2HD1 ILE 105 3.353 -5.529 -0.549
309 HD13 ILE 105 3HD1 ILE 105 4.531 -6.779 -0.143
310 H ASP 106 H ASP 106 8.204 -4.224 2.217
311 HA ASP 106 HA ASP 106 7.387 -2.466 4.268
312 HB2 ASP 106 2HB ASP 106 8.260 -4.705 4.755
313 HB3 ASP 106 1HB ASP 106 9.818 -4.261 4.072
314 H ALA 107 H ALA 107 10.385 -2.774 2.439
315 HA ALA 107 HA ALA 107 11.662 -0.517 3.458
316 HB1 ALA 107 1HB ALA 107 12.773 -2.252 2.197
317 HB2 ALA 107 2HB ALA 107 13.084 -0.670 1.468
318 HB3 ALA 107 3HB ALA 107 11.896 -1.780 0.747
319 H TYR 108 H TYR 108 9.490 -0.879 0.690
320 HA TYR 108 HA TYR 108 9.575 1.682 -0.342
321 HB2 TYR 108 2HB TYR 108 8.396 -0.088 -1.509
322 HB3 TYR 108 1HB TYR 108 7.243 -0.230 -0.189
323 HD1 TYR 108 1HD TYR 108 5.374 1.278 -0.005
324 HD2 TYR 108 2HD TYR 108 8.321 1.894 -3.003
325 HE1 TYR 108 1HE TYR 108 3.918 2.931 -1.082
326 HE2 TYR 108 2HE TYR 108 6.904 3.525 -4.091
327 HH TYR 108 HH TYR 108 4.093 4.773 -2.512
328 H HIS 109 H HIS 109 7.255 0.402 2.068
329 HA HIS 109 HA HIS 109 6.240 3.015 2.448
330 HB2 HIS 109 2HB HIS 109 5.710 0.459 3.927
331 HB3 HIS 109 1HB HIS 109 5.031 1.992 4.478
332 HD1 HIS 109 1HD HIS 109 3.311 3.164 2.805
333 HD2 HIS 109 2HD HIS 109 4.476 -0.684 1.770
334 HE1 HIS 109 1HE HIS 109 1.695 2.409 1.046
335 H ALA 110 H ALA 110 8.922 1.469 3.728
336 HA ALA 110 HA ALA 110 9.121 3.150 6.051
337 HB1 ALA 110 1HB ALA 110 10.162 0.934 6.028
338 HB2 ALA 110 2HB ALA 110 11.373 2.198 6.289
339 HB3 ALA 110 3HB ALA 110 11.215 1.441 4.708
340 H ALA 111 H ALA 111 10.065 3.374 2.657
341 HA ALA 111 HA ALA 111 11.912 5.591 3.222
342 HB1 ALA 111 1HB ALA 111 12.658 3.779 1.730
343 HB2 ALA 111 2HB ALA 111 12.506 5.328 0.874
344 HB3 ALA 111 3HB ALA 111 11.251 4.103 0.709
345 H THR 112 H THR 112 8.875 4.739 1.967
346 HA THR 112 HA THR 112 8.426 7.404 1.032
347 HB THR 112 HB THR 112 7.860 4.732 -0.273
348 HG1 THR 112 1HG THR 112 9.698 6.745 -0.560
349 HG21 THR 112 1HG2 THR 112 7.104 7.486 -1.120
350 HG22 THR 112 2HG2 THR 112 6.013 6.208 -0.502
351 HG23 THR 112 3HG2 THR 112 6.884 5.972 -2.042
Start of MODEL 18
1 H MET 65 1HT MET 65 -2.079 3.497 -20.911
2 HA MET 65 HA MET 65 -4.212 4.483 -20.585
3 HB2 MET 65 2HB MET 65 -4.049 2.039 -20.916
4 HB3 MET 65 1HB MET 65 -3.912 1.822 -19.182
5 HG2 MET 65 2HG MET 65 -6.164 2.721 -18.879
6 HG3 MET 65 1HG MET 65 -6.306 2.964 -20.619
7 HE1 MET 65 1HE MET 65 -8.457 1.356 -18.883
8 HE2 MET 65 2HE MET 65 -8.775 -0.009 -19.954
9 HE3 MET 65 3HE MET 65 -8.586 1.613 -20.621
10 H SER 66 H SER 66 -4.919 6.014 -19.369
11 HA SER 66 HA SER 66 -5.491 5.516 -16.588
12 HB2 SER 66 2HB SER 66 -3.917 7.973 -17.470
13 HB3 SER 66 1HB SER 66 -4.487 7.640 -15.836
14 HG SER 66 HG SER 66 -3.235 5.538 -16.410
15 H GLY 67 H GLY 67 -5.440 8.175 -18.974
16 HA2 GLY 67 2HA GLY 67 -7.711 8.450 -20.055
17 HA3 GLY 67 1HA GLY 67 -8.287 8.572 -18.392
18 H SER 68 H SER 68 -8.555 10.565 -17.692
19 HA SER 68 HA SER 68 -7.271 12.720 -19.100
20 HB2 SER 68 2HB SER 68 -8.775 14.116 -17.698
21 HB3 SER 68 1HB SER 68 -9.647 12.884 -18.607
22 HG SER 68 HG SER 68 -10.356 12.173 -16.762
23 H GLY 69 H GLY 69 -6.704 10.828 -16.341
24 HA2 GLY 69 2HA GLY 69 -4.481 11.144 -15.324
25 HA3 GLY 69 1HA GLY 69 -4.857 12.867 -15.279
26 H ARG 70 H ARG 70 -4.392 12.692 -12.998
27 HA ARG 70 HA ARG 70 -5.065 12.896 -10.903
28 HB2 ARG 70 2HB ARG 70 -7.762 12.218 -11.959
29 HB3 ARG 70 1HB ARG 70 -7.450 12.485 -10.247
30 HG2 ARG 70 2HG ARG 70 -6.466 14.684 -10.831
31 HG3 ARG 70 1HG ARG 70 -6.979 14.400 -12.497
32 HD2 ARG 70 2HD ARG 70 -8.718 14.314 -10.133
33 HD3 ARG 70 1HD ARG 70 -8.505 15.772 -11.124
34 HE ARG 70 HE ARG 70 -9.208 13.744 -12.854
35 HH11 ARG 70 1HH1 ARG 70 -10.754 15.388 -10.143
36 HH12 ARG 70 2HH1 ARG 70 -12.344 15.074 -10.682
37 HH21 ARG 70 1HH2 ARG 70 -11.429 13.344 -13.612
38 HH22 ARG 70 2HH2 ARG 70 -12.722 13.965 -12.698
39 H GLY 71 H GLY 71 -3.987 11.619 -9.725
40 HA2 GLY 71 2HA GLY 71 -5.057 8.935 -9.229
41 HA3 GLY 71 1HA GLY 71 -3.373 9.098 -9.695
42 H ARG 72 H ARG 72 -4.808 11.555 -7.713
43 HA ARG 72 HA ARG 72 -3.263 10.555 -5.431
44 HB2 ARG 72 2HB ARG 72 -4.224 13.333 -6.123
45 HB3 ARG 72 1HB ARG 72 -3.842 12.904 -4.472
46 HG2 ARG 72 2HG ARG 72 -1.982 14.049 -5.446
47 HG3 ARG 72 1HG ARG 72 -1.539 12.374 -5.173
48 HD2 ARG 72 2HD ARG 72 -1.815 11.894 -7.534
49 HD3 ARG 72 1HD ARG 72 -2.403 13.535 -7.815
50 HE ARG 72 HE ARG 72 0.072 13.692 -6.570
51 HH11 ARG 72 1HH1 ARG 72 -1.183 12.661 -9.693
52 HH12 ARG 72 2HH1 ARG 72 0.184 13.118 -10.582
53 HH21 ARG 72 1HH2 ARG 72 2.008 14.293 -7.783
54 HH22 ARG 72 2HH2 ARG 72 2.059 14.044 -9.455
55 H GLY 73 H GLY 73 -4.238 10.071 -3.549
56 HA2 GLY 73 2HA GLY 73 -6.066 9.923 -2.057
57 HA3 GLY 73 1HA GLY 73 -7.150 10.395 -3.376
58 H ALA 74 H ALA 74 -7.523 8.952 -5.047
59 HA ALA 74 HA ALA 74 -6.977 6.174 -4.360
60 HB1 ALA 74 1HB ALA 74 -8.956 7.310 -6.342
61 HB2 ALA 74 2HB ALA 74 -9.335 6.653 -4.737
62 HB3 ALA 74 3HB ALA 74 -8.668 5.599 -5.995
63 H ILE 75 H ILE 75 -5.615 5.121 -5.521
64 HA ILE 75 HA ILE 75 -3.939 6.627 -7.293
65 HB ILE 75 HB ILE 75 -3.751 3.738 -6.376
66 HG12 ILE 75 2HG1 ILE 75 -2.371 6.133 -5.209
67 HG13 ILE 75 1HG1 ILE 75 -3.942 5.600 -4.633
68 HG21 ILE 75 1HG2 ILE 75 -2.315 4.334 -8.325
69 HG22 ILE 75 2HG2 ILE 75 -1.365 4.012 -6.876
70 HG23 ILE 75 3HG2 ILE 75 -1.646 5.673 -7.389
71 HD11 ILE 75 1HD1 ILE 75 -2.164 4.775 -3.236
72 HD12 ILE 75 2HD1 ILE 75 -1.426 3.956 -4.631
73 HD13 ILE 75 3HD1 ILE 75 -3.031 3.473 -4.046
74 H ASP 76 H ASP 76 -3.955 6.505 -9.430
75 HA ASP 76 HA ASP 76 -6.122 5.126 -10.754
76 HB2 ASP 76 2HB ASP 76 -5.320 7.405 -11.437
77 HB3 ASP 76 1HB ASP 76 -3.832 6.655 -11.998
78 H ARG 77 H ARG 77 -2.668 4.958 -10.703
79 HA ARG 77 HA ARG 77 -2.709 2.613 -12.412
80 HB2 ARG 77 2HB ARG 77 -0.413 4.293 -11.386
81 HB3 ARG 77 1HB ARG 77 -0.263 2.957 -12.534
82 HG2 ARG 77 2HG ARG 77 -1.619 4.085 -14.144
83 HG3 ARG 77 1HG ARG 77 -2.007 5.355 -12.997
84 HD2 ARG 77 2HD ARG 77 0.356 6.048 -13.020
85 HD3 ARG 77 1HD ARG 77 0.682 4.790 -14.223
86 HE ARG 77 HE ARG 77 -1.364 6.098 -15.320
87 HH11 ARG 77 1HH1 ARG 77 1.721 7.339 -14.070
88 HH12 ARG 77 2HH1 ARG 77 1.734 8.654 -15.156
89 HH21 ARG 77 1HH2 ARG 77 -1.313 7.845 -16.727
90 HH22 ARG 77 2HH2 ARG 77 -0.009 8.968 -16.693
91 H GLU 78 H GLU 78 -0.954 0.948 -11.698
92 HA GLU 78 HA GLU 78 -2.115 -0.225 -9.385
93 HB2 GLU 78 2HB GLU 78 0.101 -1.103 -11.225
94 HB3 GLU 78 1HB GLU 78 -0.377 -2.038 -9.824
95 HG2 GLU 78 2HG GLU 78 -1.365 -2.885 -11.896
96 HG3 GLU 78 1HG GLU 78 -2.587 -2.370 -10.746
97 H GLN 79 H GLN 79 -1.407 -0.356 -7.344
98 HA GLN 79 HA GLN 79 0.731 1.221 -6.384
99 HB2 GLN 79 2HB GLN 79 -0.527 -1.195 -5.039
100 HB3 GLN 79 1HB GLN 79 0.521 -0.029 -4.253
101 HG2 GLN 79 2HG GLN 79 -1.212 1.715 -4.777
102 HG3 GLN 79 1HG GLN 79 -2.260 0.394 -5.297
103 HE21 GLN 79 1HE2 GLN 79 -3.755 0.767 -3.671
104 HE22 GLN 79 2HE2 GLN 79 -3.457 0.403 -2.015
105 H SER 80 H SER 80 0.428 -2.118 -7.348
106 HA SER 80 HA SER 80 2.928 -3.107 -6.626
107 HB2 SER 80 2HB SER 80 1.279 -3.754 -9.065
108 HB3 SER 80 1HB SER 80 2.529 -4.773 -8.336
109 HG SER 80 HG SER 80 0.419 -5.347 -7.712
110 H ALA 81 H ALA 81 1.969 -1.281 -9.507
111 HA ALA 81 HA ALA 81 4.491 -1.496 -10.753
112 HB1 ALA 81 1HB ALA 81 2.354 0.613 -11.118
113 HB2 ALA 81 2HB ALA 81 2.466 -0.903 -12.011
114 HB3 ALA 81 3HB ALA 81 3.715 0.328 -12.203
115 H ALA 82 H ALA 82 2.968 0.948 -8.735
116 HA ALA 82 HA ALA 82 5.027 2.838 -8.719
117 HB1 ALA 82 1HB ALA 82 2.780 3.267 -7.821
118 HB2 ALA 82 2HB ALA 82 4.034 3.683 -6.650
119 HB3 ALA 82 3HB ALA 82 3.120 2.185 -6.472
120 H ILE 83 H ILE 83 4.531 0.073 -6.565
121 HA ILE 83 HA ILE 83 6.814 0.543 -4.968
122 HB ILE 83 HB ILE 83 5.380 -2.091 -5.473
123 HG12 ILE 83 2HG1 ILE 83 5.062 -0.097 -3.213
124 HG13 ILE 83 1HG1 ILE 83 3.930 -0.324 -4.539
125 HG21 ILE 83 1HG2 ILE 83 6.393 -2.817 -3.335
126 HG22 ILE 83 2HG2 ILE 83 7.294 -1.304 -3.262
127 HG23 ILE 83 3HG2 ILE 83 7.618 -2.459 -4.554
128 HD11 ILE 83 1HD1 ILE 83 3.156 -1.409 -2.504
129 HD12 ILE 83 2HD1 ILE 83 4.633 -2.372 -2.445
130 HD13 ILE 83 3HD1 ILE 83 3.486 -2.597 -3.767
131 H ARG 84 H ARG 84 6.329 -1.319 -7.949
132 HA ARG 84 HA ARG 84 8.909 -2.473 -7.940
133 HB2 ARG 84 2HB ARG 84 6.984 -2.022 -10.196
134 HB3 ARG 84 1HB ARG 84 8.477 -2.933 -10.336
135 HG2 ARG 84 2HG ARG 84 7.642 -4.502 -8.631
136 HG3 ARG 84 1HG ARG 84 6.133 -3.592 -8.566
137 HD2 ARG 84 2HD ARG 84 7.230 -5.158 -10.913
138 HD3 ARG 84 1HD ARG 84 5.801 -5.473 -9.919
139 HE ARG 84 HE ARG 84 4.645 -3.763 -10.966
140 HH11 ARG 84 1HH1 ARG 84 7.914 -4.096 -12.359
141 HH12 ARG 84 2HH1 ARG 84 7.519 -3.251 -13.779
142 HH21 ARG 84 1HH2 ARG 84 4.139 -2.640 -12.941
143 HH22 ARG 84 2HH2 ARG 84 5.368 -2.374 -14.098
144 H GLU 85 H GLU 85 7.593 0.425 -9.563
145 HA GLU 85 HA GLU 85 9.968 1.134 -10.760
146 HB2 GLU 85 2HB GLU 85 7.517 2.629 -9.975
147 HB3 GLU 85 1HB GLU 85 8.945 3.534 -10.451
148 HG2 GLU 85 2HG GLU 85 7.466 3.238 -12.324
149 HG3 GLU 85 1HG GLU 85 8.990 2.390 -12.576
150 H TRP 86 H TRP 86 8.793 1.856 -7.476
151 HA TRP 86 HA TRP 86 10.927 3.528 -6.760
152 HB2 TRP 86 2HB TRP 86 8.891 3.445 -5.442
153 HB3 TRP 86 1HB TRP 86 9.112 1.729 -5.142
154 HD1 TRP 86 HD TRP 86 10.194 5.143 -3.893
155 HE1 TRP 86 1HE TRP 86 11.536 4.853 -1.724
156 HE3 TRP 86 3HE TRP 86 10.665 0.097 -3.949
157 HZ2 TRP 86 2HZ TRP 86 12.670 2.723 -0.226
158 HZ3 TRP 86 3HZ TRP 86 11.901 -1.022 -2.107
159 HH2 TRP 86 HH TRP 86 12.876 0.281 -0.294
160 H ALA 87 H ALA 87 10.378 0.073 -6.573
161 HA ALA 87 HA ALA 87 12.647 -0.775 -5.245
162 HB1 ALA 87 1HB ALA 87 10.767 -2.221 -5.774
163 HB2 ALA 87 2HB ALA 87 12.260 -2.936 -6.398
164 HB3 ALA 87 3HB ALA 87 11.147 -2.121 -7.485
165 H ARG 88 H ARG 88 12.099 -0.404 -8.676
166 HA ARG 88 HA ARG 88 14.722 -1.078 -9.436
167 HB2 ARG 88 2HB ARG 88 12.555 0.324 -10.951
168 HB3 ARG 88 1HB ARG 88 14.102 -0.139 -11.662
169 HG2 ARG 88 2HG ARG 88 13.664 -2.476 -10.912
170 HG3 ARG 88 1HG ARG 88 12.046 -1.962 -10.450
171 HD2 ARG 88 2HD ARG 88 13.221 -1.630 -13.143
172 HD3 ARG 88 1HD ARG 88 12.274 -3.045 -12.681
173 HE ARG 88 HE ARG 88 10.583 -1.039 -12.108
174 HH11 ARG 88 1HH1 ARG 88 12.564 -1.524 -15.003
175 HH12 ARG 88 2HH1 ARG 88 11.364 -0.960 -16.076
176 HH21 ARG 88 1HH2 ARG 88 8.932 -0.294 -13.594
177 HH22 ARG 88 2HH2 ARG 88 9.280 -0.244 -15.265
178 H ARG 89 H ARG 89 13.266 1.974 -8.608
179 HA ARG 89 HA ARG 89 15.341 3.753 -9.330
180 HB2 ARG 89 2HB ARG 89 13.370 3.737 -7.050
181 HB3 ARG 89 1HB ARG 89 14.558 5.006 -7.206
182 HG2 ARG 89 2HG ARG 89 12.541 4.370 -9.340
183 HG3 ARG 89 1HG ARG 89 12.226 5.496 -8.024
184 HD2 ARG 89 2HD ARG 89 14.342 6.698 -8.751
185 HD3 ARG 89 1HD ARG 89 14.282 5.710 -10.208
186 HE ARG 89 HE ARG 89 12.345 6.799 -10.880
187 HH11 ARG 89 1HH1 ARG 89 13.542 8.107 -7.775
188 HH12 ARG 89 2HH1 ARG 89 12.619 9.519 -7.856
189 HH21 ARG 89 1HH2 ARG 89 11.097 8.816 -10.978
190 HH22 ARG 89 2HH2 ARG 89 11.223 9.942 -9.711
191 H ASN 90 H ASN 90 14.771 1.784 -6.491
192 HA ASN 90 HA ASN 90 17.203 2.703 -5.214
193 HB2 ASN 90 2HB ASN 90 14.874 1.107 -4.312
194 HB3 ASN 90 1HB ASN 90 16.334 1.200 -3.307
195 HD21 ASN 90 1HD2 ASN 90 13.586 2.871 -4.569
196 HD22 ASN 90 2HD2 ASN 90 13.745 4.290 -3.604
197 H GLY 91 H GLY 91 16.441 0.124 -7.207
198 HA2 GLY 91 2HA GLY 91 18.297 -1.160 -8.046
199 HA3 GLY 91 1HA GLY 91 19.027 -1.071 -6.452
200 H HIS 92 H HIS 92 15.779 -1.743 -6.111
201 HA HIS 92 HA HIS 92 16.359 -4.492 -5.464
202 HB2 HIS 92 2HB HIS 92 13.812 -2.863 -5.304
203 HB3 HIS 92 1HB HIS 92 13.951 -4.530 -4.749
204 HD1 HIS 92 1HD HIS 92 14.929 -4.825 -2.349
205 HD2 HIS 92 2HD HIS 92 15.075 -0.940 -3.805
206 HE1 HIS 92 1HE HIS 92 15.556 -3.385 -0.396
207 H ASN 93 H ASN 93 16.169 -6.027 -6.937
208 HA ASN 93 HA ASN 93 15.012 -5.353 -9.499
209 HB2 ASN 93 2HB ASN 93 16.468 -7.846 -8.580
210 HB3 ASN 93 1HB ASN 93 15.769 -7.681 -10.176
211 HD21 ASN 93 1HD2 ASN 93 17.482 -5.075 -8.442
212 HD22 ASN 93 2HD2 ASN 93 18.824 -5.040 -9.508
213 H VAL 94 H VAL 94 12.877 -5.318 -9.433
214 HA VAL 94 HA VAL 94 11.513 -7.796 -8.644
215 HB VAL 94 HB VAL 94 10.395 -4.975 -8.415
216 HG11 VAL 94 1HG1 VAL 94 8.527 -6.039 -7.241
217 HG12 VAL 94 2HG1 VAL 94 9.239 -7.623 -7.553
218 HG13 VAL 94 3HG1 VAL 94 8.679 -6.625 -8.897
219 HG21 VAL 94 1HG2 VAL 94 12.084 -5.345 -6.695
220 HG22 VAL 94 2HG2 VAL 94 11.305 -6.855 -6.233
221 HG23 VAL 94 3HG2 VAL 94 10.472 -5.321 -5.976
222 H SER 95 H SER 95 10.435 -8.693 -10.279
223 HA SER 95 HA SER 95 10.270 -7.173 -12.763
224 HB2 SER 95 2HB SER 95 11.568 -9.307 -12.719
225 HB3 SER 95 1HB SER 95 10.102 -10.158 -12.256
226 HG SER 95 HG SER 95 10.844 -9.038 -14.693
227 H THR 96 H THR 96 8.356 -8.118 -14.144
228 HA THR 96 HA THR 96 5.882 -7.718 -12.731
229 HB THR 96 HB THR 96 5.014 -8.197 -15.118
230 HG1 THR 96 1HG THR 96 6.502 -8.850 -16.445
231 HG21 THR 96 1HG2 THR 96 6.867 -5.845 -14.640
232 HG22 THR 96 2HG2 THR 96 5.160 -5.923 -14.196
233 HG23 THR 96 3HG2 THR 96 5.633 -5.930 -15.897
234 H ARG 97 H ARG 97 7.961 -10.180 -13.605
235 HA ARG 97 HA ARG 97 5.967 -12.286 -13.725
236 HB2 ARG 97 2HB ARG 97 8.988 -12.495 -13.854
237 HB3 ARG 97 1HB ARG 97 7.822 -13.732 -14.311
238 HG2 ARG 97 2HG ARG 97 7.040 -12.373 -16.150
239 HG3 ARG 97 1HG ARG 97 8.130 -11.069 -15.682
240 HD2 ARG 97 2HD ARG 97 9.107 -12.255 -17.514
241 HD3 ARG 97 1HD ARG 97 10.030 -12.631 -16.063
242 HE ARG 97 HE ARG 97 8.102 -14.583 -16.309
243 HH11 ARG 97 1HH1 ARG 97 10.891 -13.462 -18.183
244 HH12 ARG 97 2HH1 ARG 97 11.169 -14.966 -18.910
245 HH21 ARG 97 1HH2 ARG 97 8.501 -16.651 -17.311
246 HH22 ARG 97 2HH2 ARG 97 9.785 -16.819 -18.412
247 H GLY 98 H GLY 98 5.166 -12.493 -11.722
248 HA2 GLY 98 2HA GLY 98 5.379 -13.790 -9.707
249 HA3 GLY 98 1HA GLY 98 7.022 -13.163 -9.546
250 H ARG 99 H ARG 99 5.326 -12.867 -7.451
251 HA ARG 99 HA ARG 99 4.108 -10.255 -7.521
252 HB2 ARG 99 2HB ARG 99 4.526 -12.261 -5.326
253 HB3 ARG 99 1HB ARG 99 3.921 -10.650 -4.991
254 HG2 ARG 99 2HG ARG 99 2.009 -11.060 -6.442
255 HG3 ARG 99 1HG ARG 99 2.631 -12.670 -6.811
256 HD2 ARG 99 2HD ARG 99 2.437 -13.325 -4.495
257 HD3 ARG 99 1HD ARG 99 1.976 -11.686 -4.049
258 HE ARG 99 HE ARG 99 -0.065 -11.975 -5.220
259 HH11 ARG 99 1HH1 ARG 99 1.732 -14.995 -4.622
260 HH12 ARG 99 2HH1 ARG 99 0.343 -15.962 -4.664
261 HH21 ARG 99 1HH2 ARG 99 -1.977 -13.388 -5.245
262 HH22 ARG 99 2HH2 ARG 99 -1.759 -15.068 -5.018
263 H ILE 100 H ILE 100 4.680 -8.860 -5.426
264 HA ILE 100 HA ILE 100 7.453 -8.111 -5.850
265 HB ILE 100 HB ILE 100 5.276 -6.718 -4.263
266 HG12 ILE 100 2HG1 ILE 100 6.298 -6.160 -7.058
267 HG13 ILE 100 1HG1 ILE 100 4.744 -6.877 -6.657
268 HG21 ILE 100 1HG2 ILE 100 6.753 -4.748 -4.380
269 HG22 ILE 100 2HG2 ILE 100 7.990 -5.720 -5.180
270 HG23 ILE 100 3HG2 ILE 100 7.514 -6.086 -3.521
271 HD11 ILE 100 1HD1 ILE 100 4.557 -4.517 -7.220
272 HD12 ILE 100 2HD1 ILE 100 5.653 -4.125 -5.896
273 HD13 ILE 100 3HD1 ILE 100 4.071 -4.828 -5.552
274 HA PRO 101 HA PRO 101 8.777 -10.154 -2.082
275 HB2 PRO 101 2HB PRO 101 10.810 -7.988 -2.130
276 HB3 PRO 101 1HB PRO 101 11.062 -9.738 -2.021
277 HG2 PRO 101 2HG PRO 101 11.592 -8.470 -4.255
278 HG3 PRO 101 1HG PRO 101 10.842 -10.081 -4.263
279 HD2 PRO 101 2HD PRO 101 9.597 -7.441 -4.815
280 HD3 PRO 101 1HD PRO 101 9.266 -9.039 -5.523
281 H ALA 102 H ALA 102 8.128 -9.816 -0.066
282 HA ALA 102 HA ALA 102 6.730 -7.517 0.767
283 HB1 ALA 102 1HB ALA 102 6.704 -8.569 2.967
284 HB2 ALA 102 2HB ALA 102 7.945 -9.711 2.450
285 HB3 ALA 102 3HB ALA 102 6.344 -9.749 1.709
286 H ASP 103 H ASP 103 10.067 -8.461 1.050
287 HA ASP 103 HA ASP 103 10.939 -6.561 2.924
288 HB2 ASP 103 2HB ASP 103 12.409 -7.723 0.537
289 HB3 ASP 103 1HB ASP 103 13.171 -6.704 1.739
290 H VAL 104 H VAL 104 10.389 -6.340 -0.550
291 HA VAL 104 HA VAL 104 11.482 -3.708 -0.784
292 HB VAL 104 HB VAL 104 9.694 -5.292 -2.663
293 HG11 VAL 104 1HG1 VAL 104 10.350 -3.707 -4.386
294 HG12 VAL 104 2HG1 VAL 104 11.287 -2.790 -3.210
295 HG13 VAL 104 3HG1 VAL 104 9.526 -2.866 -3.068
296 HG21 VAL 104 1HG2 VAL 104 11.724 -5.694 -3.925
297 HG22 VAL 104 2HG2 VAL 104 11.905 -6.291 -2.264
298 HG23 VAL 104 3HG2 VAL 104 12.648 -4.768 -2.746
299 H ILE 105 H ILE 105 8.322 -5.149 -0.480
300 HA ILE 105 HA ILE 105 6.761 -2.831 -0.788
301 HB ILE 105 HB ILE 105 6.164 -5.293 0.878
302 HG12 ILE 105 2HG1 ILE 105 5.361 -4.635 -1.970
303 HG13 ILE 105 1HG1 ILE 105 6.678 -5.708 -1.523
304 HG21 ILE 105 1HG2 ILE 105 3.814 -4.653 0.623
305 HG22 ILE 105 2HG2 ILE 105 4.304 -3.158 -0.210
306 HG23 ILE 105 3HG2 ILE 105 4.724 -3.402 1.477
307 HD11 ILE 105 1HD1 ILE 105 3.772 -6.134 -0.879
308 HD12 ILE 105 2HD1 ILE 105 5.098 -7.236 -0.490
309 HD13 ILE 105 3HD1 ILE 105 4.679 -6.927 -2.167
310 H ASP 106 H ASP 106 8.167 -4.340 2.106
311 HA ASP 106 HA ASP 106 7.023 -2.513 3.941
312 HB2 ASP 106 2HB ASP 106 7.797 -4.736 4.621
313 HB3 ASP 106 1HB ASP 106 9.453 -4.291 4.222
314 H ALA 107 H ALA 107 10.169 -2.775 2.381
315 HA ALA 107 HA ALA 107 11.368 -0.542 3.520
316 HB1 ALA 107 1HB ALA 107 12.561 -2.245 2.240
317 HB2 ALA 107 2HB ALA 107 12.899 -0.624 1.632
318 HB3 ALA 107 3HB ALA 107 11.775 -1.687 0.767
319 H TYR 108 H TYR 108 9.372 -0.864 0.615
320 HA TYR 108 HA TYR 108 9.462 1.738 -0.355
321 HB2 TYR 108 2HB TYR 108 8.454 -0.051 -1.640
322 HB3 TYR 108 1HB TYR 108 7.230 -0.299 -0.405
323 HD1 TYR 108 1HD TYR 108 8.374 2.006 -3.060
324 HD2 TYR 108 2HD TYR 108 5.203 0.993 -0.425
325 HE1 TYR 108 1HE TYR 108 6.898 3.524 -4.267
326 HE2 TYR 108 2HE TYR 108 3.708 2.501 -1.618
327 HH TYR 108 HH TYR 108 3.896 4.505 -3.049
328 H HIS 109 H HIS 109 7.048 0.297 1.821
329 HA HIS 109 HA HIS 109 5.776 2.762 2.170
330 HB2 HIS 109 2HB HIS 109 5.400 0.133 3.543
331 HB3 HIS 109 1HB HIS 109 4.532 1.567 4.088
332 HD1 HIS 109 1HD HIS 109 2.899 2.689 2.257
333 HD2 HIS 109 2HD HIS 109 4.360 -1.088 1.324
334 HE1 HIS 109 1HE HIS 109 1.502 1.858 0.351
335 H ALA 110 H ALA 110 8.484 1.435 3.726
336 HA ALA 110 HA ALA 110 8.275 3.226 5.993
337 HB1 ALA 110 1HB ALA 110 10.567 1.486 5.111
338 HB2 ALA 110 2HB ALA 110 9.312 1.028 6.257
339 HB3 ALA 110 3HB ALA 110 10.440 2.328 6.654
340 H ALA 111 H ALA 111 9.956 3.109 2.916
341 HA ALA 111 HA ALA 111 11.754 5.255 3.588
342 HB1 ALA 111 1HB ALA 111 12.627 5.005 1.360
343 HB2 ALA 111 2HB ALA 111 11.249 3.994 0.916
344 HB3 ALA 111 3HB ALA 111 12.415 3.413 2.097
345 H THR 112 H THR 112 8.981 4.948 1.378
346 HA THR 112 HA THR 112 9.283 7.785 0.953
347 HB THR 112 HB THR 112 9.242 6.315 -1.077
348 HG1 THR 112 1HG THR 112 6.938 7.738 -1.510
349 HG21 THR 112 1HG2 THR 112 6.345 5.815 -0.353
350 HG22 THR 112 2HG2 THR 112 7.632 4.614 -0.357
351 HG23 THR 112 3HG2 THR 112 7.114 5.355 -1.871
Start of MODEL 19
1 H MET 65 1HT MET 65 -19.548 21.254 7.084
2 HA MET 65 HA MET 65 -21.151 21.317 4.602
3 HB2 MET 65 2HB MET 65 -18.604 22.829 5.264
4 HB3 MET 65 1HB MET 65 -19.404 22.792 3.710
5 HG2 MET 65 2HG MET 65 -19.886 24.871 4.778
6 HG3 MET 65 1HG MET 65 -21.360 23.905 4.738
7 HE1 MET 65 1HE MET 65 -21.681 25.964 8.068
8 HE2 MET 65 2HE MET 65 -22.432 25.580 6.523
9 HE3 MET 65 3HE MET 65 -20.933 26.510 6.568
10 H SER 66 H SER 66 -17.700 21.088 5.379
11 HA SER 66 HA SER 66 -17.672 18.716 3.708
12 HB2 SER 66 2HB SER 66 -15.223 19.354 3.518
13 HB3 SER 66 1HB SER 66 -16.399 20.503 2.842
14 HG SER 66 HG SER 66 -14.695 21.445 4.186
15 H GLY 67 H GLY 67 -15.914 20.092 6.455
16 HA2 GLY 67 2HA GLY 67 -16.334 18.815 8.575
17 HA3 GLY 67 1HA GLY 67 -15.831 17.408 7.647
18 H SER 68 H SER 68 -13.749 16.900 7.649
19 HA SER 68 HA SER 68 -11.808 18.943 8.374
20 HB2 SER 68 2HB SER 68 -12.030 16.332 9.885
21 HB3 SER 68 1HB SER 68 -10.880 17.627 10.189
22 HG SER 68 HG SER 68 -13.611 17.475 10.720
23 H GLY 69 H GLY 69 -10.670 18.776 6.477
24 HA2 GLY 69 2HA GLY 69 -8.732 17.900 5.507
25 HA3 GLY 69 1HA GLY 69 -9.080 16.356 6.251
26 H ARG 70 H ARG 70 -10.029 14.821 5.134
27 HA ARG 70 HA ARG 70 -10.706 13.593 3.406
28 HB2 ARG 70 2HB ARG 70 -11.825 16.191 2.307
29 HB3 ARG 70 1HB ARG 70 -12.072 14.622 1.555
30 HG2 ARG 70 2HG ARG 70 -12.935 15.313 4.350
31 HG3 ARG 70 1HG ARG 70 -13.987 15.386 2.937
32 HD2 ARG 70 2HD ARG 70 -13.638 12.994 2.554
33 HD3 ARG 70 1HD ARG 70 -12.566 12.926 3.948
34 HE ARG 70 HE ARG 70 -14.580 13.747 5.213
35 HH11 ARG 70 1HH1 ARG 70 -14.880 11.641 2.357
36 HH12 ARG 70 2HH1 ARG 70 -16.264 10.846 2.916
37 HH21 ARG 70 1HH2 ARG 70 -16.515 12.602 5.978
38 HH22 ARG 70 2HH2 ARG 70 -17.240 11.442 4.988
39 H GLY 71 H GLY 71 -9.486 12.639 1.987
40 HA2 GLY 71 2HA GLY 71 -8.051 12.411 0.165
41 HA3 GLY 71 1HA GLY 71 -7.921 14.167 0.074
42 H ARG 72 H ARG 72 -6.766 15.226 1.753
43 HA ARG 72 HA ARG 72 -5.078 15.676 3.183
44 HB2 ARG 72 2HB ARG 72 -4.911 12.701 3.714
45 HB3 ARG 72 1HB ARG 72 -4.106 13.949 4.639
46 HG2 ARG 72 2HG ARG 72 -6.280 14.793 5.382
47 HG3 ARG 72 1HG ARG 72 -7.082 13.535 4.432
48 HD2 ARG 72 2HD ARG 72 -5.865 11.828 5.733
49 HD3 ARG 72 1HD ARG 72 -5.168 13.110 6.718
50 HE ARG 72 HE ARG 72 -8.044 13.068 6.614
51 HH11 ARG 72 1HH1 ARG 72 -5.160 12.022 8.387
52 HH12 ARG 72 2HH1 ARG 72 -6.009 11.660 9.808
53 HH21 ARG 72 1HH2 ARG 72 -9.203 12.526 8.569
54 HH22 ARG 72 2HH2 ARG 72 -8.363 11.943 9.919
55 H GLY 73 H GLY 73 -4.168 12.617 1.702
56 HA2 GLY 73 2HA GLY 73 -2.292 13.496 -0.099
57 HA3 GLY 73 1HA GLY 73 -1.434 13.357 1.432
58 H ALA 74 H ALA 74 -3.711 11.571 -0.529
59 HA ALA 74 HA ALA 74 -2.556 9.011 0.407
60 HB1 ALA 74 1HB ALA 74 -5.000 9.284 0.675
61 HB2 ALA 74 2HB ALA 74 -4.599 8.014 -0.481
62 HB3 ALA 74 3HB ALA 74 -5.137 9.592 -1.053
63 H ILE 75 H ILE 75 -2.738 7.346 -1.370
64 HA ILE 75 HA ILE 75 -1.084 8.383 -3.504
65 HB ILE 75 HB ILE 75 -1.785 5.518 -2.813
66 HG12 ILE 75 2HG1 ILE 75 0.723 7.059 -2.147
67 HG13 ILE 75 1HG1 ILE 75 -0.623 6.899 -1.033
68 HG21 ILE 75 1HG2 ILE 75 0.412 6.716 -4.530
69 HG22 ILE 75 2HG2 ILE 75 -0.992 5.842 -5.137
70 HG23 ILE 75 3HG2 ILE 75 0.225 5.001 -4.175
71 HD11 ILE 75 1HD1 ILE 75 -0.331 4.497 -1.039
72 HD12 ILE 75 2HD1 ILE 75 1.103 5.359 -0.496
73 HD13 ILE 75 3HD1 ILE 75 1.061 4.657 -2.126
74 H ASP 76 H ASP 76 -1.894 8.863 -5.309
75 HA ASP 76 HA ASP 76 -4.649 8.101 -6.008
76 HB2 ASP 76 2HB ASP 76 -3.998 10.505 -6.011
77 HB3 ASP 76 1HB ASP 76 -2.826 10.160 -7.272
78 H ARG 77 H ARG 77 -1.382 7.733 -6.967
79 HA ARG 77 HA ARG 77 -2.019 6.643 -9.567
80 HB2 ARG 77 2HB ARG 77 0.625 6.877 -8.120
81 HB3 ARG 77 1HB ARG 77 0.423 6.441 -9.812
82 HG2 ARG 77 2HG ARG 77 -0.438 8.587 -10.350
83 HG3 ARG 77 1HG ARG 77 -0.547 9.035 -8.651
84 HD2 ARG 77 2HD ARG 77 1.940 8.781 -8.559
85 HD3 ARG 77 1HD ARG 77 1.921 8.629 -10.319
86 HE ARG 77 HE ARG 77 0.831 10.821 -10.358
87 HH11 ARG 77 1HH1 ARG 77 2.938 9.965 -7.646
88 HH12 ARG 77 2HH1 ARG 77 3.110 11.555 -7.074
89 HH21 ARG 77 1HH2 ARG 77 1.053 13.029 -9.571
90 HH22 ARG 77 2HH2 ARG 77 1.970 13.345 -8.185
91 H GLU 78 H GLU 78 -0.785 4.497 -10.102
92 HA GLU 78 HA GLU 78 -2.010 2.468 -8.594
93 HB2 GLU 78 2HB GLU 78 0.155 2.345 -10.671
94 HB3 GLU 78 1HB GLU 78 -0.605 0.931 -9.959
95 HG2 GLU 78 2HG GLU 78 -2.749 1.679 -10.827
96 HG3 GLU 78 1HG GLU 78 -1.957 3.065 -11.580
97 H GLN 79 H GLN 79 -1.459 1.915 -6.663
98 HA GLN 79 HA GLN 79 0.945 2.492 -5.392
99 HB2 GLN 79 2HB GLN 79 -1.316 0.665 -4.724
100 HB3 GLN 79 1HB GLN 79 0.108 0.745 -3.696
101 HG2 GLN 79 2HG GLN 79 -0.244 3.060 -3.279
102 HG3 GLN 79 1HG GLN 79 -1.542 3.133 -4.469
103 HE21 GLN 79 1HE2 GLN 79 -3.524 2.452 -3.908
104 HE22 GLN 79 2HE2 GLN 79 -3.980 2.026 -2.286
105 H SER 80 H SER 80 -0.126 -0.665 -6.653
106 HA SER 80 HA SER 80 2.221 -1.991 -5.852
107 HB2 SER 80 2HB SER 80 0.306 -2.723 -8.087
108 HB3 SER 80 1HB SER 80 1.468 -3.814 -7.323
109 HG SER 80 HG SER 80 -0.953 -2.804 -6.332
110 H ALA 81 H ALA 81 1.352 -0.528 -8.977
111 HA ALA 81 HA ALA 81 3.735 -1.117 -10.300
112 HB1 ALA 81 1HB ALA 81 1.961 1.289 -10.695
113 HB2 ALA 81 2HB ALA 81 1.721 -0.290 -11.446
114 HB3 ALA 81 3HB ALA 81 3.145 0.672 -11.845
115 H ALA 82 H ALA 82 2.847 1.623 -8.222
116 HA ALA 82 HA ALA 82 5.176 3.142 -8.613
117 HB1 ALA 82 1HB ALA 82 3.422 3.067 -6.158
118 HB2 ALA 82 2HB ALA 82 3.133 4.060 -7.581
119 HB3 ALA 82 3HB ALA 82 4.563 4.345 -6.583
120 H ILE 83 H ILE 83 4.404 0.641 -6.232
121 HA ILE 83 HA ILE 83 6.802 0.808 -4.766
122 HB ILE 83 HB ILE 83 5.159 -1.703 -5.294
123 HG12 ILE 83 2HG1 ILE 83 5.024 0.244 -2.977
124 HG13 ILE 83 1HG1 ILE 83 3.839 0.125 -4.268
125 HG21 ILE 83 1HG2 ILE 83 6.173 -2.549 -3.204
126 HG22 ILE 83 2HG2 ILE 83 7.171 -1.096 -3.116
127 HG23 ILE 83 3HG2 ILE 83 7.385 -2.233 -4.449
128 HD11 ILE 83 1HD1 ILE 83 3.055 -0.966 -2.251
129 HD12 ILE 83 2HD1 ILE 83 4.474 -2.013 -2.244
130 HD13 ILE 83 3HD1 ILE 83 3.287 -2.145 -3.541
131 H ARG 84 H ARG 84 5.934 -1.034 -7.633
132 HA ARG 84 HA ARG 84 8.357 -2.430 -7.933
133 HB2 ARG 84 2HB ARG 84 6.254 -1.652 -9.923
134 HB3 ARG 84 1HB ARG 84 7.635 -2.673 -10.312
135 HG2 ARG 84 2HG ARG 84 6.934 -4.325 -8.735
136 HG3 ARG 84 1HG ARG 84 5.647 -3.268 -8.154
137 HD2 ARG 84 2HD ARG 84 4.819 -4.996 -9.661
138 HD3 ARG 84 1HD ARG 84 4.566 -3.367 -10.286
139 HE ARG 84 HE ARG 84 6.905 -4.081 -11.400
140 HH11 ARG 84 1HH1 ARG 84 3.712 -5.618 -11.351
141 HH12 ARG 84 2HH1 ARG 84 3.888 -6.379 -12.859
142 HH21 ARG 84 1HH2 ARG 84 7.134 -5.072 -13.482
143 HH22 ARG 84 2HH2 ARG 84 5.882 -6.073 -14.104
144 H GLU 85 H GLU 85 7.251 0.646 -9.278
145 HA GLU 85 HA GLU 85 9.538 1.154 -10.845
146 HB2 GLU 85 2HB GLU 85 7.538 3.019 -9.622
147 HB3 GLU 85 1HB GLU 85 8.740 3.522 -10.814
148 HG2 GLU 85 2HG GLU 85 7.721 1.895 -12.393
149 HG3 GLU 85 1HG GLU 85 6.478 1.571 -11.183
150 H TRP 86 H TRP 86 8.692 1.956 -7.501
151 HA TRP 86 HA TRP 86 10.866 3.603 -6.914
152 HB2 TRP 86 2HB TRP 86 8.849 3.493 -5.550
153 HB3 TRP 86 1HB TRP 86 9.126 1.793 -5.226
154 HD1 TRP 86 HD TRP 86 10.169 5.260 -4.091
155 HE1 TRP 86 1HE TRP 86 11.513 5.049 -1.936
156 HE3 TRP 86 3HE TRP 86 10.679 0.235 -4.026
157 HZ2 TRP 86 2HZ TRP 86 12.699 2.974 -0.391
158 HZ3 TRP 86 3HZ TRP 86 11.948 -0.828 -2.167
159 HH2 TRP 86 HH TRP 86 12.926 0.531 -0.398
160 H ALA 87 H ALA 87 10.272 0.150 -6.629
161 HA ALA 87 HA ALA 87 12.651 -0.711 -5.508
162 HB1 ALA 87 1HB ALA 87 10.958 -2.096 -7.574
163 HB2 ALA 87 2HB ALA 87 10.684 -2.121 -5.836
164 HB3 ALA 87 3HB ALA 87 12.126 -2.880 -6.515
165 H ARG 88 H ARG 88 11.788 -0.275 -8.892
166 HA ARG 88 HA ARG 88 14.197 -1.127 -10.001
167 HB2 ARG 88 2HB ARG 88 12.277 0.955 -11.068
168 HB3 ARG 88 1HB ARG 88 13.599 0.269 -11.987
169 HG2 ARG 88 2HG ARG 88 11.235 -1.251 -10.909
170 HG3 ARG 88 1HG ARG 88 11.448 -0.721 -12.575
171 HD2 ARG 88 2HD ARG 88 13.557 -2.074 -12.625
172 HD3 ARG 88 1HD ARG 88 13.089 -2.733 -11.054
173 HE ARG 88 HE ARG 88 11.022 -2.961 -12.957
174 HH11 ARG 88 1HH1 ARG 88 14.029 -4.508 -11.881
175 HH12 ARG 88 2HH1 ARG 88 13.713 -5.987 -12.628
176 HH21 ARG 88 1HH2 ARG 88 10.617 -4.999 -14.049
177 HH22 ARG 88 2HH2 ARG 88 11.737 -6.277 -13.890
178 H ARG 89 H ARG 89 13.148 2.074 -8.985
179 HA ARG 89 HA ARG 89 15.385 3.602 -9.777
180 HB2 ARG 89 2HB ARG 89 13.467 4.015 -7.526
181 HB3 ARG 89 1HB ARG 89 14.623 5.211 -8.093
182 HG2 ARG 89 2HG ARG 89 13.563 5.102 -10.311
183 HG3 ARG 89 1HG ARG 89 12.345 4.019 -9.625
184 HD2 ARG 89 2HD ARG 89 11.848 5.722 -7.950
185 HD3 ARG 89 1HD ARG 89 13.025 6.761 -8.770
186 HE ARG 89 HE ARG 89 11.231 5.914 -10.676
187 HH11 ARG 89 1HH1 ARG 89 11.089 7.974 -7.762
188 HH12 ARG 89 2HH1 ARG 89 9.838 8.948 -8.380
189 HH21 ARG 89 1HH2 ARG 89 9.479 7.283 -11.457
190 HH22 ARG 89 2HH2 ARG 89 8.909 8.543 -10.483
191 H ASN 90 H ASN 90 14.671 1.826 -6.877
192 HA ASN 90 HA ASN 90 17.054 2.809 -5.566
193 HB2 ASN 90 2HB ASN 90 14.700 1.236 -4.670
194 HB3 ASN 90 1HB ASN 90 16.138 1.343 -3.637
195 HD21 ASN 90 1HD2 ASN 90 13.462 3.019 -5.064
196 HD22 ASN 90 2HD2 ASN 90 13.568 4.436 -4.099
197 H GLY 91 H GLY 91 16.244 0.163 -7.467
198 HA2 GLY 91 2HA GLY 91 17.887 -1.293 -8.312
199 HA3 GLY 91 1HA GLY 91 18.930 -0.878 -6.958
200 H HIS 92 H HIS 92 15.603 -1.871 -6.707
201 HA HIS 92 HA HIS 92 16.429 -4.183 -5.159
202 HB2 HIS 92 2HB HIS 92 13.851 -2.721 -5.477
203 HB3 HIS 92 1HB HIS 92 13.909 -4.296 -4.693
204 HD1 HIS 92 1HD HIS 92 15.026 -4.348 -2.276
205 HD2 HIS 92 2HD HIS 92 14.838 -0.604 -4.053
206 HE1 HIS 92 1HE HIS 92 15.546 -2.699 -0.467
207 H ASN 93 H ASN 93 15.868 -6.208 -5.720
208 HA ASN 93 HA ASN 93 15.315 -6.532 -8.519
209 HB2 ASN 93 2HB ASN 93 16.176 -8.498 -6.420
210 HB3 ASN 93 1HB ASN 93 15.717 -8.991 -8.047
211 HD21 ASN 93 1HD2 ASN 93 16.987 -8.350 -9.782
212 HD22 ASN 93 2HD2 ASN 93 18.606 -7.832 -9.575
213 H VAL 94 H VAL 94 13.316 -6.189 -8.950
214 HA VAL 94 HA VAL 94 11.368 -8.069 -7.838
215 HB VAL 94 HB VAL 94 10.837 -5.335 -9.078
216 HG11 VAL 94 1HG1 VAL 94 9.039 -6.913 -9.546
217 HG12 VAL 94 2HG1 VAL 94 8.504 -5.690 -8.388
218 HG13 VAL 94 3HG1 VAL 94 8.922 -7.311 -7.831
219 HG21 VAL 94 1HG2 VAL 94 10.583 -6.245 -6.218
220 HG22 VAL 94 2HG2 VAL 94 10.085 -4.670 -6.835
221 HG23 VAL 94 3HG2 VAL 94 11.789 -5.128 -6.847
222 H SER 95 H SER 95 11.035 -9.607 -9.270
223 HA SER 95 HA SER 95 11.897 -9.247 -11.978
224 HB2 SER 95 2HB SER 95 12.356 -11.320 -10.698
225 HB3 SER 95 1HB SER 95 10.623 -11.630 -10.629
226 HG SER 95 HG SER 95 12.298 -12.323 -12.483
227 H THR 96 H THR 96 10.533 -9.625 -13.820
228 HA THR 96 HA THR 96 7.938 -8.480 -13.575
229 HB THR 96 HB THR 96 8.119 -9.052 -16.124
230 HG1 THR 96 1HG THR 96 10.093 -9.605 -16.769
231 HG21 THR 96 1HG2 THR 96 9.930 -7.054 -14.761
232 HG22 THR 96 2HG2 THR 96 8.228 -6.797 -15.156
233 HG23 THR 96 3HG2 THR 96 9.415 -6.988 -16.448
234 H ARG 97 H ARG 97 9.039 -11.445 -12.974
235 HA ARG 97 HA ARG 97 7.276 -13.125 -14.373
236 HB2 ARG 97 2HB ARG 97 8.497 -13.536 -11.635
237 HB3 ARG 97 1HB ARG 97 7.693 -14.786 -12.559
238 HG2 ARG 97 2HG ARG 97 10.276 -13.391 -13.228
239 HG3 ARG 97 1HG ARG 97 10.058 -15.068 -12.733
240 HD2 ARG 97 2HD ARG 97 9.150 -13.788 -15.311
241 HD3 ARG 97 1HD ARG 97 10.427 -14.978 -15.115
242 HE ARG 97 HE ARG 97 7.969 -15.983 -14.137
243 HH11 ARG 97 1HH1 ARG 97 9.793 -15.479 -17.146
244 HH12 ARG 97 2HH1 ARG 97 8.828 -16.526 -18.061
245 HH21 ARG 97 1HH2 ARG 97 6.652 -17.426 -15.393
246 HH22 ARG 97 2HH2 ARG 97 6.972 -17.638 -17.049
247 H GLY 98 H GLY 98 7.059 -11.438 -11.283
248 HA2 GLY 98 2HA GLY 98 4.629 -10.604 -11.111
249 HA3 GLY 98 1HA GLY 98 4.295 -12.328 -11.000
250 H ARG 99 H ARG 99 3.984 -10.056 -9.168
251 HA ARG 99 HA ARG 99 3.738 -9.816 -7.025
252 HB2 ARG 99 2HB ARG 99 5.044 -12.487 -6.789
253 HB3 ARG 99 1HB ARG 99 4.687 -11.529 -5.357
254 HG2 ARG 99 2HG ARG 99 2.698 -12.485 -7.408
255 HG3 ARG 99 1HG ARG 99 2.918 -13.138 -5.782
256 HD2 ARG 99 2HD ARG 99 2.359 -10.872 -4.873
257 HD3 ARG 99 1HD ARG 99 1.983 -10.368 -6.516
258 HE ARG 99 HE ARG 99 0.562 -12.679 -5.913
259 HH11 ARG 99 1HH1 ARG 99 0.601 -9.203 -5.220
260 HH12 ARG 99 2HH1 ARG 99 -1.027 -9.138 -4.738
261 HH21 ARG 99 1HH2 ARG 99 -1.695 -12.582 -5.280
262 HH22 ARG 99 2HH2 ARG 99 -2.370 -11.094 -4.798
263 H ILE 100 H ILE 100 4.443 -8.420 -5.818
264 HA ILE 100 HA ILE 100 7.185 -7.597 -6.038
265 HB ILE 100 HB ILE 100 4.957 -6.469 -4.325
266 HG12 ILE 100 2HG1 ILE 100 5.817 -5.619 -7.099
267 HG13 ILE 100 1HG1 ILE 100 4.351 -6.518 -6.730
268 HG21 ILE 100 1HG2 ILE 100 7.548 -5.247 -5.307
269 HG22 ILE 100 2HG2 ILE 100 7.192 -5.759 -3.655
270 HG23 ILE 100 3HG2 ILE 100 6.302 -4.415 -4.372
271 HD11 ILE 100 1HD1 ILE 100 3.898 -4.170 -7.071
272 HD12 ILE 100 2HD1 ILE 100 5.036 -3.770 -5.780
273 HD13 ILE 100 3HD1 ILE 100 3.547 -4.640 -5.401
274 HA PRO 101 HA PRO 101 8.250 -9.997 -2.402
275 HB2 PRO 101 2HB PRO 101 10.583 -8.184 -2.248
276 HB3 PRO 101 1HB PRO 101 10.551 -9.951 -2.437
277 HG2 PRO 101 2HG PRO 101 11.265 -8.380 -4.451
278 HG3 PRO 101 1HG PRO 101 10.334 -9.873 -4.706
279 HD2 PRO 101 2HD PRO 101 9.367 -7.045 -4.722
280 HD3 PRO 101 1HD PRO 101 8.924 -8.416 -5.761
281 H ALA 102 H ALA 102 7.827 -9.721 -0.316
282 HA ALA 102 HA ALA 102 6.547 -7.447 0.699
283 HB1 ALA 102 1HB ALA 102 6.650 -8.605 2.841
284 HB2 ALA 102 2HB ALA 102 7.857 -9.713 2.194
285 HB3 ALA 102 3HB ALA 102 6.217 -9.725 1.549
286 H ASP 103 H ASP 103 9.846 -8.465 0.733
287 HA ASP 103 HA ASP 103 10.989 -6.768 2.652
288 HB2 ASP 103 2HB ASP 103 12.175 -7.628 0.001
289 HB3 ASP 103 1HB ASP 103 13.076 -7.006 1.372
290 H VAL 104 H VAL 104 10.237 -6.297 -0.742
291 HA VAL 104 HA VAL 104 11.447 -3.713 -0.898
292 HB VAL 104 HB VAL 104 9.552 -5.147 -2.793
293 HG11 VAL 104 1HG1 VAL 104 9.449 -2.706 -3.095
294 HG12 VAL 104 2HG1 VAL 104 10.205 -3.522 -4.464
295 HG13 VAL 104 3HG1 VAL 104 11.207 -2.667 -3.286
296 HG21 VAL 104 1HG2 VAL 104 11.703 -6.262 -2.533
297 HG22 VAL 104 2HG2 VAL 104 12.530 -4.742 -2.900
298 HG23 VAL 104 3HG2 VAL 104 11.554 -5.534 -4.134
299 H ILE 105 H ILE 105 8.231 -5.038 -0.571
300 HA ILE 105 HA ILE 105 6.761 -2.644 -0.646
301 HB ILE 105 HB ILE 105 6.151 -5.174 0.923
302 HG12 ILE 105 2HG1 ILE 105 5.266 -4.340 -1.848
303 HG13 ILE 105 1HG1 ILE 105 6.506 -5.534 -1.498
304 HG21 ILE 105 1HG2 ILE 105 4.308 -2.949 0.038
305 HG22 ILE 105 2HG2 ILE 105 4.810 -3.300 1.695
306 HG23 ILE 105 3HG2 ILE 105 3.817 -4.465 0.806
307 HD11 ILE 105 1HD1 ILE 105 3.584 -5.755 -0.797
308 HD12 ILE 105 2HD1 ILE 105 4.827 -6.958 -0.433
309 HD13 ILE 105 3HD1 ILE 105 4.425 -6.588 -2.107
310 H ASP 106 H ASP 106 8.399 -4.291 2.012
311 HA ASP 106 HA ASP 106 7.487 -2.645 4.127
312 HB2 ASP 106 2HB ASP 106 8.427 -4.863 4.532
313 HB3 ASP 106 1HB ASP 106 9.965 -4.356 3.852
314 H ALA 107 H ALA 107 10.449 -2.718 2.242
315 HA ALA 107 HA ALA 107 11.695 -0.483 3.383
316 HB1 ALA 107 1HB ALA 107 13.124 -0.534 1.413
317 HB2 ALA 107 2HB ALA 107 11.949 -1.578 0.595
318 HB3 ALA 107 3HB ALA 107 12.817 -2.171 2.008
319 H TYR 108 H TYR 108 9.579 -0.806 0.577
320 HA TYR 108 HA TYR 108 9.597 1.806 -0.328
321 HB2 TYR 108 2HB TYR 108 8.566 0.038 -1.634
322 HB3 TYR 108 1HB TYR 108 7.389 -0.234 -0.353
323 HD1 TYR 108 1HD TYR 108 5.431 1.123 -0.155
324 HD2 TYR 108 2HD TYR 108 8.380 2.092 -3.061
325 HE1 TYR 108 1HE TYR 108 3.887 2.708 -1.186
326 HE2 TYR 108 2HE TYR 108 6.858 3.669 -4.098
327 HH TYR 108 HH TYR 108 3.946 4.610 -2.512
328 H HIS 109 H HIS 109 7.329 0.265 1.969
329 HA HIS 109 HA HIS 109 6.112 2.770 2.375
330 HB2 HIS 109 2HB HIS 109 5.684 0.133 3.720
331 HB3 HIS 109 1HB HIS 109 4.903 1.595 4.330
332 HD1 HIS 109 1HD HIS 109 3.512 2.945 2.365
333 HD2 HIS 109 2HD HIS 109 4.302 -1.081 1.737
334 HE1 HIS 109 1HE HIS 109 2.001 2.239 0.497
335 H ALA 110 H ALA 110 8.796 1.324 3.839
336 HA ALA 110 HA ALA 110 8.736 3.039 6.134
337 HB1 ALA 110 1HB ALA 110 9.860 0.859 6.203
338 HB2 ALA 110 2HB ALA 110 10.959 2.173 6.615
339 HB3 ALA 110 3HB ALA 110 11.032 1.430 5.015
340 H ALA 111 H ALA 111 9.889 3.359 2.811
341 HA ALA 111 HA ALA 111 11.610 5.604 3.594
342 HB1 ALA 111 1HB ALA 111 11.280 4.111 1.017
343 HB2 ALA 111 2HB ALA 111 12.582 3.858 2.180
344 HB3 ALA 111 3HB ALA 111 12.454 5.392 1.299
345 H THR 112 H THR 112 8.749 4.691 1.908
346 HA THR 112 HA THR 112 8.359 7.387 0.978
347 HB THR 112 HB THR 112 8.248 4.752 -0.453
348 HG1 THR 112 1HG THR 112 9.763 7.117 -0.755
349 HG21 THR 112 1HG2 THR 112 7.573 6.018 -2.408
350 HG22 THR 112 2HG2 THR 112 7.330 7.452 -1.346
351 HG23 THR 112 3HG2 THR 112 6.393 5.946 -1.093
Start of MODEL 20
1 H MET 65 1HT MET 65 -16.948 24.479 -21.008
2 HA MET 65 HA MET 65 -16.290 22.094 -22.628
3 HB2 MET 65 2HB MET 65 -14.528 23.944 -20.998
4 HB3 MET 65 1HB MET 65 -14.004 22.391 -21.599
5 HG2 MET 65 2HG MET 65 -14.352 23.220 -23.900
6 HG3 MET 65 1HG MET 65 -14.777 24.793 -23.221
7 HE1 MET 65 1HE MET 65 -12.500 24.478 -25.379
8 HE2 MET 65 2HE MET 65 -11.237 25.495 -24.684
9 HE3 MET 65 3HE MET 65 -12.919 26.018 -24.625
10 H SER 66 H SER 66 -14.922 20.647 -20.979
11 HA SER 66 HA SER 66 -16.317 20.692 -18.423
12 HB2 SER 66 2HB SER 66 -17.163 18.801 -19.722
13 HB3 SER 66 1HB SER 66 -15.519 18.267 -20.071
14 HG SER 66 HG SER 66 -16.808 18.350 -17.539
15 H GLY 67 H GLY 67 -14.791 21.609 -17.199
16 HA2 GLY 67 2HA GLY 67 -12.069 20.621 -17.422
17 HA3 GLY 67 1HA GLY 67 -12.588 22.039 -16.502
18 H SER 68 H SER 68 -12.023 18.671 -16.420
19 HA SER 68 HA SER 68 -12.599 18.685 -13.579
20 HB2 SER 68 2HB SER 68 -13.731 16.619 -15.487
21 HB3 SER 68 1HB SER 68 -13.868 16.586 -13.725
22 HG SER 68 HG SER 68 -14.627 18.951 -14.538
23 H GLY 69 H GLY 69 -11.426 17.145 -12.447
24 HA2 GLY 69 2HA GLY 69 -9.532 15.511 -13.960
25 HA3 GLY 69 1HA GLY 69 -8.928 16.609 -12.721
26 H ARG 70 H ARG 70 -11.127 13.935 -13.271
27 HA ARG 70 HA ARG 70 -11.663 13.406 -10.550
28 HB2 ARG 70 2HB ARG 70 -11.834 11.522 -12.906
29 HB3 ARG 70 1HB ARG 70 -12.488 11.198 -11.310
30 HG2 ARG 70 2HG ARG 70 -13.364 13.386 -13.192
31 HG3 ARG 70 1HG ARG 70 -14.247 11.910 -12.798
32 HD2 ARG 70 2HD ARG 70 -14.424 12.649 -10.470
33 HD3 ARG 70 1HD ARG 70 -13.508 14.099 -10.874
34 HE ARG 70 HE ARG 70 -15.959 13.608 -12.328
35 HH11 ARG 70 1HH1 ARG 70 -14.255 15.454 -9.844
36 HH12 ARG 70 2HH1 ARG 70 -15.468 16.657 -9.715
37 HH21 ARG 70 1HH2 ARG 70 -17.627 15.286 -12.107
38 HH22 ARG 70 2HH2 ARG 70 -17.385 16.557 -10.996
39 H GLY 71 H GLY 71 -10.861 12.051 -9.107
40 HA2 GLY 71 2HA GLY 71 -9.174 10.085 -9.007
41 HA3 GLY 71 1HA GLY 71 -8.064 11.362 -9.496
42 H ARG 72 H ARG 72 -8.504 13.448 -8.190
43 HA ARG 72 HA ARG 72 -8.301 14.609 -6.273
44 HB2 ARG 72 2HB ARG 72 -9.991 12.418 -5.036
45 HB3 ARG 72 1HB ARG 72 -9.598 13.943 -4.260
46 HG2 ARG 72 2HG ARG 72 -10.896 15.139 -5.919
47 HG3 ARG 72 1HG ARG 72 -11.211 13.629 -6.784
48 HD2 ARG 72 2HD ARG 72 -12.322 12.735 -4.791
49 HD3 ARG 72 1HD ARG 72 -12.043 14.259 -3.955
50 HE ARG 72 HE ARG 72 -13.425 15.093 -6.053
51 HH11 ARG 72 1HH1 ARG 72 -14.005 12.319 -3.932
52 HH12 ARG 72 2HH1 ARG 72 -15.697 12.349 -4.154
53 HH21 ARG 72 1HH2 ARG 72 -15.781 15.134 -6.312
54 HH22 ARG 72 2HH2 ARG 72 -16.718 13.969 -5.517
55 H GLY 73 H GLY 73 -8.439 11.671 -4.377
56 HA2 GLY 73 2HA GLY 73 -5.522 11.805 -4.060
57 HA3 GLY 73 1HA GLY 73 -6.600 11.606 -2.682
58 H ALA 74 H ALA 74 -7.767 10.106 -5.437
59 HA ALA 74 HA ALA 74 -7.354 7.493 -4.316
60 HB1 ALA 74 1HB ALA 74 -9.471 8.089 -5.434
61 HB2 ALA 74 2HB ALA 74 -8.688 6.708 -6.208
62 HB3 ALA 74 3HB ALA 74 -8.596 8.304 -6.949
63 H ILE 75 H ILE 75 -6.713 5.752 -5.935
64 HA ILE 75 HA ILE 75 -4.024 6.525 -6.734
65 HB ILE 75 HB ILE 75 -5.223 3.821 -6.251
66 HG12 ILE 75 2HG1 ILE 75 -3.421 5.465 -4.482
67 HG13 ILE 75 1HG1 ILE 75 -5.157 5.328 -4.274
68 HG21 ILE 75 1HG2 ILE 75 -2.858 3.053 -6.169
69 HG22 ILE 75 2HG2 ILE 75 -2.333 4.689 -6.567
70 HG23 ILE 75 3HG2 ILE 75 -3.260 3.754 -7.738
71 HD11 ILE 75 1HD1 ILE 75 -3.974 3.910 -2.723
72 HD12 ILE 75 2HD1 ILE 75 -3.168 3.084 -4.064
73 HD13 ILE 75 3HD1 ILE 75 -4.921 2.950 -3.859
74 H ASP 76 H ASP 76 -4.057 7.108 -8.658
75 HA ASP 76 HA ASP 76 -5.652 5.874 -10.763
76 HB2 ASP 76 2HB ASP 76 -5.363 8.262 -10.970
77 HB3 ASP 76 1HB ASP 76 -3.613 8.119 -10.892
78 H ARG 77 H ARG 77 -2.159 6.380 -10.293
79 HA ARG 77 HA ARG 77 -1.717 3.979 -11.862
80 HB2 ARG 77 2HB ARG 77 0.226 6.031 -10.787
81 HB3 ARG 77 1HB ARG 77 0.690 4.592 -11.692
82 HG2 ARG 77 2HG ARG 77 -0.571 5.347 -13.601
83 HG3 ARG 77 1HG ARG 77 -1.110 6.761 -12.699
84 HD2 ARG 77 2HD ARG 77 1.252 7.478 -12.512
85 HD3 ARG 77 1HD ARG 77 1.725 6.080 -13.478
86 HE ARG 77 HE ARG 77 -0.260 7.735 -14.700
87 HH11 ARG 77 1HH1 ARG 77 3.225 7.184 -14.352
88 HH12 ARG 77 2HH1 ARG 77 3.629 8.082 -15.736
89 HH21 ARG 77 1HH2 ARG 77 0.321 8.960 -16.613
90 HH22 ARG 77 2HH2 ARG 77 1.955 9.092 -17.041
91 H GLU 78 H GLU 78 -1.390 2.182 -10.982
92 HA GLU 78 HA GLU 78 -2.080 1.578 -8.414
93 HB2 GLU 78 2HB GLU 78 -0.445 0.010 -10.362
94 HB3 GLU 78 1HB GLU 78 -1.073 -0.658 -8.865
95 HG2 GLU 78 2HG GLU 78 -3.314 -0.177 -9.559
96 HG3 GLU 78 1HG GLU 78 -2.733 0.565 -11.045
97 H GLN 79 H GLN 79 -1.113 0.867 -6.604
98 HA GLN 79 HA GLN 79 1.226 2.098 -5.734
99 HB2 GLN 79 2HB GLN 79 -0.233 -0.291 -4.635
100 HB3 GLN 79 1HB GLN 79 1.056 0.564 -3.805
101 HG2 GLN 79 2HG GLN 79 -1.559 1.787 -4.640
102 HG3 GLN 79 1HG GLN 79 -1.163 1.156 -3.045
103 HE21 GLN 79 1HE2 GLN 79 -1.508 3.123 -2.067
104 HE22 GLN 79 2HE2 GLN 79 -0.438 4.469 -2.223
105 H SER 80 H SER 80 0.467 -1.108 -6.960
106 HA SER 80 HA SER 80 2.884 -2.428 -6.628
107 HB2 SER 80 2HB SER 80 1.059 -2.643 -9.025
108 HB3 SER 80 1HB SER 80 2.058 -3.910 -8.305
109 HG SER 80 HG SER 80 0.748 -3.875 -6.483
110 H ALA 81 H ALA 81 1.797 -0.329 -9.280
111 HA ALA 81 HA ALA 81 4.104 -0.538 -10.869
112 HB1 ALA 81 1HB ALA 81 1.948 0.309 -11.709
113 HB2 ALA 81 2HB ALA 81 3.264 1.449 -12.001
114 HB3 ALA 81 3HB ALA 81 2.123 1.727 -10.680
115 H ALA 82 H ALA 82 3.100 1.723 -8.373
116 HA ALA 82 HA ALA 82 5.306 3.459 -8.532
117 HB1 ALA 82 1HB ALA 82 3.529 2.911 -6.158
118 HB2 ALA 82 2HB ALA 82 3.192 4.059 -7.453
119 HB3 ALA 82 3HB ALA 82 4.570 4.317 -6.380
120 H ILE 83 H ILE 83 4.718 0.602 -6.494
121 HA ILE 83 HA ILE 83 7.103 0.752 -4.991
122 HB ILE 83 HB ILE 83 5.605 -1.784 -5.785
123 HG12 ILE 83 2HG1 ILE 83 5.370 -0.115 -3.268
124 HG13 ILE 83 1HG1 ILE 83 4.192 -0.130 -4.572
125 HG21 ILE 83 1HG2 ILE 83 6.681 -2.774 -3.791
126 HG22 ILE 83 2HG2 ILE 83 7.563 -1.269 -3.543
127 HG23 ILE 83 3HG2 ILE 83 7.876 -2.242 -4.981
128 HD11 ILE 83 1HD1 ILE 83 3.747 -2.502 -4.121
129 HD12 ILE 83 2HD1 ILE 83 3.450 -1.488 -2.711
130 HD13 ILE 83 3HD1 ILE 83 4.920 -2.455 -2.802
131 H ARG 84 H ARG 84 6.358 -0.766 -8.083
132 HA ARG 84 HA ARG 84 8.882 -1.916 -8.509
133 HB2 ARG 84 2HB ARG 84 6.730 -1.045 -10.401
134 HB3 ARG 84 1HB ARG 84 8.222 -1.793 -10.951
135 HG2 ARG 84 2HG ARG 84 7.741 -3.775 -9.651
136 HG3 ARG 84 1HG ARG 84 6.286 -3.010 -9.011
137 HD2 ARG 84 2HD ARG 84 5.816 -4.572 -10.817
138 HD3 ARG 84 1HD ARG 84 5.326 -2.916 -11.194
139 HE ARG 84 HE ARG 84 7.817 -3.097 -12.248
140 HH11 ARG 84 1HH1 ARG 84 4.990 -5.183 -12.596
141 HH12 ARG 84 2HH1 ARG 84 5.252 -5.536 -14.232
142 HH21 ARG 84 1HH2 ARG 84 8.224 -3.598 -14.503
143 HH22 ARG 84 2HH2 ARG 84 7.159 -4.627 -15.334
144 H GLU 85 H GLU 85 7.536 1.228 -9.501
145 HA GLU 85 HA GLU 85 9.817 2.176 -10.803
146 HB2 GLU 85 2HB GLU 85 7.684 3.657 -9.301
147 HB3 GLU 85 1HB GLU 85 8.945 4.469 -10.218
148 HG2 GLU 85 2HG GLU 85 8.124 3.215 -12.232
149 HG3 GLU 85 1HG GLU 85 6.763 2.678 -11.240
150 H TRP 86 H TRP 86 8.887 2.407 -7.376
151 HA TRP 86 HA TRP 86 11.035 3.992 -6.555
152 HB2 TRP 86 2HB TRP 86 9.033 3.723 -5.209
153 HB3 TRP 86 1HB TRP 86 9.302 1.991 -5.092
154 HD1 TRP 86 HD TRP 86 10.428 5.310 -3.584
155 HE1 TRP 86 1HE TRP 86 11.812 4.832 -1.481
156 HE3 TRP 86 3HE TRP 86 10.811 0.275 -4.060
157 HZ2 TRP 86 2HZ TRP 86 12.938 2.572 -0.180
158 HZ3 TRP 86 3HZ TRP 86 12.075 -1.000 -2.327
159 HH2 TRP 86 HH TRP 86 13.103 0.138 -0.447
160 H ALA 87 H ALA 87 10.529 0.524 -6.748
161 HA ALA 87 HA ALA 87 12.927 -0.340 -5.650
162 HB1 ALA 87 1HB ALA 87 11.058 -1.820 -6.086
163 HB2 ALA 87 2HB ALA 87 12.514 -2.417 -6.892
164 HB3 ALA 87 3HB ALA 87 11.265 -1.598 -7.820
165 H ARG 88 H ARG 88 12.079 0.349 -9.000
166 HA ARG 88 HA ARG 88 14.672 -0.229 -9.970
167 HB2 ARG 88 2HB ARG 88 12.379 1.264 -11.253
168 HB3 ARG 88 1HB ARG 88 13.900 0.960 -12.072
169 HG2 ARG 88 2HG ARG 88 12.040 -1.177 -11.021
170 HG3 ARG 88 1HG ARG 88 12.163 -0.665 -12.706
171 HD2 ARG 88 2HD ARG 88 14.558 -1.328 -12.681
172 HD3 ARG 88 1HD ARG 88 14.342 -1.917 -11.037
173 HE ARG 88 HE ARG 88 12.465 -3.269 -12.444
174 HH11 ARG 88 1HH1 ARG 88 15.971 -2.844 -12.867
175 HH12 ARG 88 2HH1 ARG 88 16.190 -4.393 -13.553
176 HH21 ARG 88 1HH2 ARG 88 12.847 -5.409 -13.401
177 HH22 ARG 88 2HH2 ARG 88 14.431 -5.855 -13.857
178 H ARG 89 H ARG 89 13.250 2.657 -8.697
179 HA ARG 89 HA ARG 89 15.332 4.448 -9.465
180 HB2 ARG 89 2HB ARG 89 13.301 4.556 -7.237
181 HB3 ARG 89 1HB ARG 89 14.484 5.822 -7.496
182 HG2 ARG 89 2HG ARG 89 12.394 4.959 -9.488
183 HG3 ARG 89 1HG ARG 89 12.282 6.369 -8.430
184 HD2 ARG 89 2HD ARG 89 14.412 7.183 -9.447
185 HD3 ARG 89 1HD ARG 89 14.292 5.873 -10.614
186 HE ARG 89 HE ARG 89 11.958 6.985 -10.979
187 HH11 ARG 89 1HH1 ARG 89 15.117 8.555 -10.554
188 HH12 ARG 89 2HH1 ARG 89 14.714 9.941 -11.437
189 HH21 ARG 89 1HH2 ARG 89 11.414 8.907 -12.225
190 HH22 ARG 89 2HH2 ARG 89 12.559 10.146 -12.432
191 H ASN 90 H ASN 90 14.838 2.325 -6.760
192 HA ASN 90 HA ASN 90 17.199 3.332 -5.392
193 HB2 ASN 90 2HB ASN 90 15.025 1.438 -4.648
194 HB3 ASN 90 1HB ASN 90 16.496 1.510 -3.664
195 HD21 ASN 90 1HD2 ASN 90 13.653 3.188 -4.737
196 HD22 ASN 90 2HD2 ASN 90 13.684 4.441 -3.563
197 H GLY 91 H GLY 91 16.393 0.761 -7.454
198 HA2 GLY 91 2HA GLY 91 18.096 -0.416 -8.602
199 HA3 GLY 91 1HA GLY 91 19.141 -0.218 -7.207
200 H HIS 92 H HIS 92 15.820 -1.259 -6.934
201 HA HIS 92 HA HIS 92 16.707 -3.876 -5.995
202 HB2 HIS 92 2HB HIS 92 14.107 -2.376 -5.744
203 HB3 HIS 92 1HB HIS 92 14.292 -4.050 -5.242
204 HD1 HIS 92 1HD HIS 92 15.363 -4.404 -2.880
205 HD2 HIS 92 2HD HIS 92 15.336 -0.479 -4.206
206 HE1 HIS 92 1HE HIS 92 15.962 -3.020 -0.889
207 H ASN 93 H ASN 93 16.618 -5.431 -7.486
208 HA ASN 93 HA ASN 93 14.923 -5.036 -9.805
209 HB2 ASN 93 2HB ASN 93 16.902 -7.257 -9.202
210 HB3 ASN 93 1HB ASN 93 15.943 -7.145 -10.672
211 HD21 ASN 93 1HD2 ASN 93 18.814 -7.161 -10.408
212 HD22 ASN 93 2HD2 ASN 93 19.371 -5.700 -11.119
213 H VAL 94 H VAL 94 12.921 -5.174 -8.913
214 HA VAL 94 HA VAL 94 12.070 -7.274 -7.298
215 HB VAL 94 HB VAL 94 9.768 -6.401 -7.805
216 HG11 VAL 94 1HG1 VAL 94 10.102 -4.334 -6.571
217 HG12 VAL 94 2HG1 VAL 94 11.850 -4.502 -6.805
218 HG13 VAL 94 3HG1 VAL 94 10.955 -5.708 -5.875
219 HG21 VAL 94 1HG2 VAL 94 11.313 -4.339 -9.369
220 HG22 VAL 94 2HG2 VAL 94 9.638 -4.185 -8.855
221 HG23 VAL 94 3HG2 VAL 94 10.091 -5.461 -9.987
222 H SER 95 H SER 95 10.785 -8.974 -7.648
223 HA SER 95 HA SER 95 11.032 -10.285 -10.131
224 HB2 SER 95 2HB SER 95 11.027 -11.519 -7.975
225 HB3 SER 95 1HB SER 95 9.367 -10.994 -7.703
226 HG SER 95 HG SER 95 9.552 -13.103 -8.574
227 H THR 96 H THR 96 9.759 -10.089 -11.797
228 HA THR 96 HA THR 96 7.080 -9.020 -11.485
229 HB THR 96 HB THR 96 7.287 -8.974 -14.049
230 HG1 THR 96 1HG THR 96 9.403 -9.063 -14.814
231 HG21 THR 96 1HG2 THR 96 9.168 -7.343 -12.351
232 HG22 THR 96 2HG2 THR 96 7.463 -6.994 -12.632
233 HG23 THR 96 3HG2 THR 96 8.614 -6.895 -13.965
234 H ARG 97 H ARG 97 8.356 -11.760 -10.992
235 HA ARG 97 HA ARG 97 6.611 -13.364 -12.666
236 HB2 ARG 97 2HB ARG 97 9.037 -14.130 -11.004
237 HB3 ARG 97 1HB ARG 97 7.985 -15.304 -11.766
238 HG2 ARG 97 2HG ARG 97 9.965 -15.042 -13.098
239 HG3 ARG 97 1HG ARG 97 8.603 -14.365 -13.979
240 HD2 ARG 97 2HD ARG 97 10.555 -12.941 -14.225
241 HD3 ARG 97 1HD ARG 97 9.322 -12.104 -13.286
242 HE ARG 97 HE ARG 97 11.070 -13.413 -11.522
243 HH11 ARG 97 1HH1 ARG 97 10.983 -10.559 -13.647
244 HH12 ARG 97 2HH1 ARG 97 12.316 -9.812 -12.912
245 HH21 ARG 97 1HH2 ARG 97 12.799 -12.369 -10.481
246 HH22 ARG 97 2HH2 ARG 97 13.366 -10.855 -11.007
247 H GLY 98 H GLY 98 4.711 -13.134 -11.605
248 HA2 GLY 98 2HA GLY 98 3.287 -14.111 -9.965
249 HA3 GLY 98 1HA GLY 98 4.648 -14.101 -8.842
250 H ARG 99 H ARG 99 4.994 -12.378 -7.580
251 HA ARG 99 HA ARG 99 3.704 -9.858 -8.236
252 HB2 ARG 99 2HB ARG 99 3.360 -11.271 -5.589
253 HB3 ARG 99 1HB ARG 99 2.983 -9.581 -5.842
254 HG2 ARG 99 2HG ARG 99 1.314 -10.299 -7.564
255 HG3 ARG 99 1HG ARG 99 1.629 -11.967 -7.082
256 HD2 ARG 99 2HD ARG 99 -0.335 -11.103 -5.940
257 HD3 ARG 99 1HD ARG 99 0.964 -11.415 -4.785
258 HE ARG 99 HE ARG 99 1.057 -8.748 -5.693
259 HH11 ARG 99 1HH1 ARG 99 -0.777 -10.832 -3.496
260 HH12 ARG 99 2HH1 ARG 99 -1.274 -9.579 -2.470
261 HH21 ARG 99 1HH2 ARG 99 0.329 -6.991 -4.290
262 HH22 ARG 99 2HH2 ARG 99 -0.656 -7.348 -2.945
263 H ILE 100 H ILE 100 4.397 -8.213 -6.499
264 HA ILE 100 HA ILE 100 7.212 -8.009 -6.650
265 HB ILE 100 HB ILE 100 5.191 -6.351 -5.096
266 HG12 ILE 100 2HG1 ILE 100 6.380 -5.891 -7.835
267 HG13 ILE 100 1HG1 ILE 100 4.756 -6.488 -7.528
268 HG21 ILE 100 1HG2 ILE 100 8.022 -5.670 -5.906
269 HG22 ILE 100 2HG2 ILE 100 7.442 -5.963 -4.261
270 HG23 ILE 100 3HG2 ILE 100 6.871 -4.559 -5.162
271 HD11 ILE 100 1HD1 ILE 100 4.749 -4.138 -8.075
272 HD12 ILE 100 2HD1 ILE 100 5.846 -3.806 -6.736
273 HD13 ILE 100 3HD1 ILE 100 4.209 -4.383 -6.415
274 HA PRO 101 HA PRO 101 8.306 -10.272 -2.943
275 HB2 PRO 101 2HB PRO 101 10.585 -8.398 -2.768
276 HB3 PRO 101 1HB PRO 101 10.597 -10.166 -2.911
277 HG2 PRO 101 2HG PRO 101 11.298 -8.593 -4.937
278 HG3 PRO 101 1HG PRO 101 10.477 -10.147 -5.179
279 HD2 PRO 101 2HD PRO 101 9.404 -7.397 -5.407
280 HD3 PRO 101 1HD PRO 101 8.980 -8.875 -6.297
281 H ALA 102 H ALA 102 7.628 -9.997 -0.940
282 HA ALA 102 HA ALA 102 6.488 -7.714 0.122
283 HB1 ALA 102 1HB ALA 102 6.482 -8.883 2.264
284 HB2 ALA 102 2HB ALA 102 7.661 -10.039 1.643
285 HB3 ALA 102 3HB ALA 102 6.040 -9.977 0.952
286 H ASP 103 H ASP 103 9.768 -8.846 0.337
287 HA ASP 103 HA ASP 103 10.845 -7.166 2.283
288 HB2 ASP 103 2HB ASP 103 12.088 -9.017 1.157
289 HB3 ASP 103 1HB ASP 103 12.153 -8.047 -0.304
290 H VAL 104 H VAL 104 10.327 -6.547 -1.152
291 HA VAL 104 HA VAL 104 11.505 -3.937 -0.944
292 HB VAL 104 HB VAL 104 10.036 -5.281 -3.247
293 HG11 VAL 104 1HG1 VAL 104 11.557 -2.666 -3.243
294 HG12 VAL 104 2HG1 VAL 104 9.801 -2.810 -3.335
295 HG13 VAL 104 3HG1 VAL 104 10.807 -3.432 -4.644
296 HG21 VAL 104 1HG2 VAL 104 12.259 -5.412 -4.242
297 HG22 VAL 104 2HG2 VAL 104 12.236 -6.228 -2.669
298 HG23 VAL 104 3HG2 VAL 104 12.931 -4.612 -2.832
299 H ILE 105 H ILE 105 8.341 -5.363 -0.940
300 HA ILE 105 HA ILE 105 6.864 -2.975 -1.154
301 HB ILE 105 HB ILE 105 6.093 -5.542 0.276
302 HG12 ILE 105 2HG1 ILE 105 5.486 -4.580 -2.533
303 HG13 ILE 105 1HG1 ILE 105 6.656 -5.822 -2.110
304 HG21 ILE 105 1HG2 ILE 105 3.767 -4.758 -0.022
305 HG22 ILE 105 2HG2 ILE 105 4.381 -3.224 -0.655
306 HG23 ILE 105 3HG2 ILE 105 4.705 -3.678 1.010
307 HD11 ILE 105 1HD1 ILE 105 4.614 -6.776 -2.958
308 HD12 ILE 105 2HD1 ILE 105 3.684 -5.974 -1.684
309 HD13 ILE 105 3HD1 ILE 105 4.852 -7.232 -1.270
310 H ASP 106 H ASP 106 8.160 -4.704 1.703
311 HA ASP 106 HA ASP 106 7.053 -2.837 3.535
312 HB2 ASP 106 2HB ASP 106 9.185 -4.943 3.828
313 HB3 ASP 106 1HB ASP 106 8.819 -3.824 5.134
314 H ALA 107 H ALA 107 10.138 -3.186 1.938
315 HA ALA 107 HA ALA 107 11.464 -1.080 3.233
316 HB1 ALA 107 1HB ALA 107 12.993 -1.102 1.327
317 HB2 ALA 107 2HB ALA 107 11.819 -2.042 0.400
318 HB3 ALA 107 3HB ALA 107 12.588 -2.752 1.816
319 H TYR 108 H TYR 108 9.406 -1.151 0.390
320 HA TYR 108 HA TYR 108 9.582 1.518 -0.390
321 HB2 TYR 108 2HB TYR 108 8.551 -0.110 -1.834
322 HB3 TYR 108 1HB TYR 108 7.321 -0.476 -0.632
323 HD1 TYR 108 1HD TYR 108 8.521 2.121 -2.971
324 HD2 TYR 108 2HD TYR 108 5.309 0.789 -0.538
325 HE1 TYR 108 1HE TYR 108 7.071 3.771 -4.014
326 HE2 TYR 108 2HE TYR 108 3.829 2.453 -1.565
327 HH TYR 108 HH TYR 108 4.674 4.199 -4.375
328 H HIS 109 H HIS 109 7.141 -0.054 1.678
329 HA HIS 109 HA HIS 109 5.871 2.386 2.218
330 HB2 HIS 109 2HB HIS 109 5.574 -0.279 3.603
331 HB3 HIS 109 1HB HIS 109 4.630 1.141 4.041
332 HD1 HIS 109 1HD HIS 109 3.391 2.208 1.631
333 HD2 HIS 109 2HD HIS 109 4.199 -1.852 1.939
334 HE1 HIS 109 1HE HIS 109 1.867 1.072 -0.013
335 H ALA 110 H ALA 110 8.565 0.873 3.697
336 HA ALA 110 HA ALA 110 8.486 2.450 6.084
337 HB1 ALA 110 1HB ALA 110 10.740 1.600 6.489
338 HB2 ALA 110 2HB ALA 110 10.800 0.956 4.850
339 HB3 ALA 110 3HB ALA 110 9.659 0.286 6.016
340 H ALA 111 H ALA 111 10.231 2.611 3.003
341 HA ALA 111 HA ALA 111 11.773 4.873 3.715
342 HB1 ALA 111 1HB ALA 111 11.161 3.805 0.971
343 HB2 ALA 111 2HB ALA 111 12.479 3.272 2.011
344 HB3 ALA 111 3HB ALA 111 12.452 4.928 1.394
345 H THR 112 H THR 112 8.855 4.567 1.660
346 HA THR 112 HA THR 112 8.803 7.463 1.759
347 HB THR 112 HB THR 112 8.899 6.605 -0.542
348 HG1 THR 112 1HG THR 112 7.822 8.310 -0.897
349 HG21 THR 112 1HG2 THR 112 7.812 4.441 -0.280
350 HG22 THR 112 2HG2 THR 112 7.024 5.365 -1.559
351 HG23 THR 112 3HG2 THR 112 6.271 5.237 0.029