Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | in_recoord | stage | position | program | type |
|
|
7413 | 1kgm RC | 5272 | cing | recoord | 1-original | 2 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 1H GLU 1 1HT GLU 1 7.859 -0.265 9.996
2 2H GLU 1 2HT GLU 1 7.651 0.957 8.833
3 3H GLU 1 3HT GLU 1 6.660 -0.424 8.806
4 HA GLU 1 HA GLU 1 5.878 0.280 11.112
5 1HB GLU 1 2HB GLU 1 7.404 2.685 10.073
6 2HB GLU 1 1HB GLU 1 6.252 2.781 11.405
7 1HG GLU 1 2HG GLU 1 7.604 0.895 12.502
8 2HG GLU 1 1HG GLU 1 8.844 1.233 11.295
9 H VAL 2 H VAL 2 4.108 -0.388 9.607
10 HA VAL 2 HA VAL 2 3.012 1.843 7.944
11 HB VAL 2 HB VAL 2 2.266 -1.095 8.050
12 1HG1 VAL 2 1HG1 VAL 2 0.620 0.539 7.052
13 2HG1 VAL 2 2HG1 VAL 2 1.209 -0.672 5.916
14 3HG1 VAL 2 3HG1 VAL 2 1.853 0.967 5.868
15 1HG2 VAL 2 1HG2 VAL 2 3.629 -0.999 5.807
16 2HG2 VAL 2 2HG2 VAL 2 4.494 -1.166 7.335
17 3HG2 VAL 2 3HG2 VAL 2 4.393 0.409 6.545
18 H THR 3 H THR 3 0.671 2.221 8.068
19 HA THR 3 HA THR 3 -0.601 1.366 10.642
20 HB THR 3 HB THR 3 0.293 3.581 10.986
21 HG1 THR 3 1HG THR 3 -1.748 4.825 10.936
22 1HG2 THR 3 1HG2 THR 3 0.812 4.271 8.767
23 2HG2 THR 3 2HG2 THR 3 -0.393 5.420 9.345
24 3HG2 THR 3 3HG2 THR 3 -0.867 4.123 8.250
25 H CYS 4 H CYS 4 -1.713 -0.150 9.085
26 HA CYS 4 HA CYS 4 -4.211 1.043 8.088
27 1HB CYS 4 2HB CYS 4 -3.739 0.265 5.749
28 2HB CYS 4 1HB CYS 4 -2.632 1.534 6.283
29 H GLU 5 H GLU 5 -5.593 -0.741 7.067
30 HA GLU 5 HA GLU 5 -5.212 -3.267 8.590
31 1HB GLU 5 2HB GLU 5 -7.379 -1.583 7.827
32 2HB GLU 5 1HB GLU 5 -7.611 -3.123 6.999
33 1HG GLU 5 2HG GLU 5 -7.855 -4.306 8.965
34 2HG GLU 5 1HG GLU 5 -6.818 -3.209 9.877
35 HA PRO 6 HA PRO 6 -3.964 -5.460 5.000
36 1HB PRO 6 2HB PRO 6 -5.021 -7.936 5.513
37 2HB PRO 6 1HB PRO 6 -3.607 -7.288 6.368
38 1HG PRO 6 2HG PRO 6 -6.441 -7.438 7.249
39 2HG PRO 6 1HG PRO 6 -4.955 -7.680 8.177
40 1HD PRO 6 2HD PRO 6 -6.433 -5.383 8.259
41 2HD PRO 6 1HD PRO 6 -4.684 -5.441 8.574
42 H GLY 7 H GLY 7 -4.943 -4.941 3.082
43 1HA GLY 7 2HA GLY 7 -6.502 -5.631 1.325
44 2HA GLY 7 1HA GLY 7 -7.682 -6.011 2.584
45 H THR 8 H THR 8 -5.687 -3.092 2.053
46 HA THR 8 HA THR 8 -8.111 -1.513 1.435
47 HB THR 8 HB THR 8 -6.415 -0.663 3.766
48 HG1 THR 8 1HG THR 8 -8.301 -1.794 4.913
49 1HG2 THR 8 1HG2 THR 8 -9.223 -0.253 4.072
50 2HG2 THR 8 2HG2 THR 8 -8.778 0.239 2.439
51 3HG2 THR 8 3HG2 THR 8 -7.965 0.959 3.827
52 H THR 9 H THR 9 -4.611 -1.620 1.960
53 HA THR 9 HA THR 9 -2.876 -0.219 1.166
54 HB THR 9 HB THR 9 -3.781 -1.609 -0.767
55 HG1 THR 9 1HG THR 9 -2.431 -0.593 -2.130
56 1HG2 THR 9 1HG2 THR 9 -5.244 0.985 -1.234
57 2HG2 THR 9 2HG2 THR 9 -5.883 -0.658 -1.248
58 3HG2 THR 9 3HG2 THR 9 -4.855 -0.100 -2.567
59 H PHE 10 H PHE 10 -2.689 1.936 -0.424
60 HA PHE 10 HA PHE 10 -4.713 3.938 -0.238
61 1HB PHE 10 2HB PHE 10 -3.590 5.186 1.727
62 2HB PHE 10 1HB PHE 10 -4.554 3.766 2.130
63 HD1 PHE 10 1HD PHE 10 -1.103 5.048 1.685
64 HD2 PHE 10 2HD PHE 10 -3.537 1.757 2.992
65 HE1 PHE 10 1HE PHE 10 0.883 3.988 2.726
66 HE2 PHE 10 2HE PHE 10 -1.552 0.701 4.024
67 HZ PHE 10 HZ PHE 10 0.658 1.811 3.898
68 H LYS 11 H LYS 11 -3.396 6.259 -0.053
69 HA LYS 11 HA LYS 11 -1.351 6.079 -2.203
70 1HB LYS 11 2HB LYS 11 -3.114 8.205 -0.989
71 2HB LYS 11 1HB LYS 11 -1.777 8.645 -2.051
72 1HG LYS 11 2HG LYS 11 -2.980 6.598 -3.450
73 2HG LYS 11 1HG LYS 11 -4.361 7.416 -2.716
74 1HD LYS 11 2HD LYS 11 -2.232 9.095 -3.982
75 2HD LYS 11 1HD LYS 11 -3.365 8.246 -5.036
76 1HE LYS 11 2HE LYS 11 -4.589 9.665 -2.727
77 2HE LYS 11 1HE LYS 11 -3.901 10.695 -4.000
78 1HZ LYS 11 1HZ LYS 11 -5.386 9.983 -5.503
79 2HZ LYS 11 2HZ LYS 11 -6.312 9.514 -4.159
80 3HZ LYS 11 3HZ LYS 11 -5.338 8.377 -4.960
81 H ASP 12 H ASP 12 0.796 6.255 -1.681
82 HA ASP 12 HA ASP 12 1.512 7.630 0.889
83 1HB ASP 12 2HB ASP 12 1.662 4.941 0.329
84 2HB ASP 12 1HB ASP 12 3.288 5.490 -0.093
85 H LYS 13 H LYS 13 3.347 8.934 0.812
86 HA LYS 13 HA LYS 13 4.612 10.584 -0.388
87 1HB LYS 13 2HB LYS 13 6.667 9.241 -1.210
88 2HB LYS 13 1HB LYS 13 6.210 9.093 0.489
89 1HG LYS 13 2HG LYS 13 5.319 6.956 0.202
90 2HG LYS 13 1HG LYS 13 5.050 7.200 -1.523
91 1HD LYS 13 2HD LYS 13 7.754 7.477 -1.408
92 2HD LYS 13 1HD LYS 13 7.491 6.316 -0.106
93 1HE LYS 13 2HE LYS 13 6.549 4.711 -1.553
94 2HE LYS 13 1HE LYS 13 6.181 5.920 -2.799
95 1HZ LYS 13 1HZ LYS 13 8.344 6.047 -3.461
96 2HZ LYS 13 2HZ LYS 13 8.322 4.423 -2.961
97 3HZ LYS 13 3HZ LYS 13 8.964 5.621 -1.941
98 H CYS 14 H CYS 14 5.788 8.432 -2.779
99 HA CYS 14 HA CYS 14 4.160 9.862 -4.851
100 1HB CYS 14 2HB CYS 14 6.909 8.589 -5.036
101 2HB CYS 14 1HB CYS 14 6.142 9.612 -6.253
102 H ASN 15 H ASN 15 3.760 7.143 -3.356
103 HA ASN 15 HA ASN 15 3.049 5.628 -5.805
104 1HB ASN 15 2HB ASN 15 5.018 4.738 -3.681
105 2HB ASN 15 1HB ASN 15 4.310 3.640 -4.864
106 1HD2 ASN 15 1HD2 ASN 15 6.373 6.549 -4.562
107 2HD2 ASN 15 2HD2 ASN 15 7.115 6.377 -6.088
108 H THR 16 H THR 16 2.034 3.422 -5.016
109 HA THR 16 HA THR 16 0.170 4.066 -2.765
110 HB THR 16 HB THR 16 0.082 2.435 -5.295
111 HG1 THR 16 1HG THR 16 -1.510 3.780 -5.735
112 1HG2 THR 16 1HG2 THR 16 -2.290 1.778 -4.221
113 2HG2 THR 16 2HG2 THR 16 -1.336 1.860 -2.741
114 3HG2 THR 16 3HG2 THR 16 -0.860 0.761 -4.035
115 H CYS 17 H CYS 17 0.214 2.821 -0.952
116 HA CYS 17 HA CYS 17 2.106 0.508 -0.907
117 1HB CYS 17 2HB CYS 17 1.875 2.814 0.597
118 2HB CYS 17 1HB CYS 17 1.089 1.606 1.614
119 H ARG 18 H ARG 18 0.992 -1.397 -1.145
120 HA ARG 18 HA ARG 18 -1.806 -1.697 -0.361
121 1HB ARG 18 2HB ARG 18 -1.148 -2.922 -2.253
122 2HB ARG 18 1HB ARG 18 0.395 -3.380 -1.537
123 1HG ARG 18 2HG ARG 18 -1.261 -5.270 -1.666
124 2HG ARG 18 1HG ARG 18 -0.692 -4.933 -0.030
125 1HD ARG 18 2HD ARG 18 -2.809 -4.520 0.652
126 2HD ARG 18 1HD ARG 18 -3.011 -3.299 -0.620
127 HE ARG 18 HE ARG 18 -4.293 -4.941 -1.725
128 1HH1 ARG 18 1HH2 ARG 18 -3.013 -6.644 0.781
129 2HH1 ARG 18 2HH2 ARG 18 -2.750 -8.123 -0.082
130 1HH2 ARG 18 1HH1 ARG 18 -3.388 -6.731 -3.192
131 2HH2 ARG 18 2HH1 ARG 18 -2.965 -8.171 -2.330
132 H CYS 19 H CYS 19 -2.273 -1.849 1.812
133 HA CYS 19 HA CYS 19 -0.520 -2.478 3.919
134 1HB CYS 19 2HB CYS 19 -3.010 -1.613 3.754
135 2HB CYS 19 1HB CYS 19 -3.407 -3.324 3.952
136 H GLY 20 H GLY 20 0.507 -4.367 4.428
137 1HA GLY 20 2HA GLY 20 0.192 -6.776 2.945
138 2HA GLY 20 1HA GLY 20 1.035 -6.650 4.492
139 H SER 21 H SER 21 0.114 -8.726 5.070
140 HA SER 21 HA SER 21 -2.833 -8.758 5.548
141 1HB SER 21 2HB SER 21 -0.899 -10.583 4.601
142 2HB SER 21 1HB SER 21 -1.391 -11.184 6.181
143 HG SER 21 HG SER 21 -2.791 -11.016 3.823
144 H ASP 22 H ASP 22 0.020 -8.055 7.187
145 HA ASP 22 HA ASP 22 -0.851 -9.175 9.793
146 1HB ASP 22 2HB ASP 22 1.474 -9.399 9.273
147 2HB ASP 22 1HB ASP 22 1.588 -7.715 8.748
148 H GLY 23 H GLY 23 -1.561 -6.473 7.997
149 1HA GLY 23 2HA GLY 23 -2.649 -4.478 8.586
150 2HA GLY 23 1HA GLY 23 -2.719 -5.088 10.241
151 H LYS 24 H LYS 24 0.454 -5.139 9.021
152 HA LYS 24 HA LYS 24 1.053 -2.388 10.005
153 1HB LYS 24 2HB LYS 24 1.098 -4.113 11.869
154 2HB LYS 24 1HB LYS 24 2.441 -4.883 11.023
155 1HG LYS 24 2HG LYS 24 3.375 -2.374 11.034
156 2HG LYS 24 1HG LYS 24 2.358 -2.277 12.472
157 1HD LYS 24 2HD LYS 24 4.622 -4.216 11.947
158 2HD LYS 24 1HD LYS 24 4.531 -2.987 13.209
159 1HE LYS 24 2HE LYS 24 2.290 -4.357 13.818
160 2HE LYS 24 1HE LYS 24 3.237 -5.671 13.092
161 1HZ LYS 24 1HZ LYS 24 3.557 -4.845 15.616
162 2HZ LYS 24 2HZ LYS 24 4.713 -3.880 14.832
163 3HZ LYS 24 3HZ LYS 24 4.786 -5.572 14.702
164 H SER 25 H SER 25 1.330 -4.400 7.522
165 HA SER 25 HA SER 25 4.128 -3.530 6.870
166 1HB SER 25 2HB SER 25 2.692 -6.157 6.619
167 2HB SER 25 1HB SER 25 3.968 -5.765 5.464
168 HG SER 25 HG SER 25 5.397 -5.548 7.161
169 H ALA 26 H ALA 26 4.469 -3.124 4.554
170 HA ALA 26 HA ALA 26 2.020 -2.977 2.870
171 1HB ALA 26 1HB ALA 26 2.522 -0.862 4.317
172 2HB ALA 26 2HB ALA 26 2.165 -0.640 2.605
173 3HB ALA 26 3HB ALA 26 3.833 -0.589 3.171
174 H ALA 27 H ALA 27 2.506 -2.937 0.620
175 HA ALA 27 HA ALA 27 5.191 -3.931 -0.087
176 1HB ALA 27 1HB ALA 27 2.523 -4.236 -0.960
177 2HB ALA 27 2HB ALA 27 3.957 -4.996 -1.650
178 3HB ALA 27 3HB ALA 27 3.381 -3.455 -2.289
179 H CYS 28 H CYS 28 3.054 -1.260 -1.076
180 HA CYS 28 HA CYS 28 3.576 0.850 -1.980
181 1HB CYS 28 2HB CYS 28 5.826 -0.002 -0.284
182 2HB CYS 28 1HB CYS 28 6.274 1.188 -1.500
183 H THR 29 H THR 29 3.447 0.657 -4.209
184 HA THR 29 HA THR 29 4.759 -1.017 -5.967
185 HB THR 29 HB THR 29 4.272 0.630 -7.649
186 HG1 THR 29 1HG THR 29 5.269 2.422 -6.927
187 1HG2 THR 29 1HG2 THR 29 2.362 -0.270 -6.114
188 2HG2 THR 29 2HG2 THR 29 2.015 1.065 -7.212
189 3HG2 THR 29 3HG2 THR 29 2.308 1.383 -5.503
190 H LEU 30 H LEU 30 6.031 2.060 -4.695
191 HA LEU 30 HA LEU 30 8.236 2.881 -4.583
192 1HB LEU 30 2HB LEU 30 8.522 -0.120 -4.673
193 2HB LEU 30 1HB LEU 30 9.944 0.917 -4.569
194 HG LEU 30 HG LEU 30 7.663 1.392 -2.687
195 1HD1 LEU 30 1HD1 LEU 30 8.549 -1.130 -2.844
196 2HD1 LEU 30 2HD1 LEU 30 8.172 -0.376 -1.295
197 3HD1 LEU 30 3HD1 LEU 30 9.843 -0.466 -1.849
198 1HD2 LEU 30 1HD2 LEU 30 10.197 2.489 -3.103
199 2HD2 LEU 30 2HD2 LEU 30 10.397 1.464 -1.682
200 3HD2 LEU 30 3HD2 LEU 30 9.177 2.737 -1.686
201 H LYS 31 H LYS 31 8.137 3.992 -6.626
202 HA LYS 31 HA LYS 31 9.632 2.607 -8.828
203 1HB LYS 31 2HB LYS 31 7.030 4.023 -8.733
204 2HB LYS 31 1HB LYS 31 8.062 4.449 -10.099
205 1HG LYS 31 2HG LYS 31 6.976 2.608 -10.984
206 2HG LYS 31 1HG LYS 31 8.369 1.814 -10.248
207 1HD LYS 31 2HD LYS 31 6.788 0.532 -9.222
208 2HD LYS 31 1HD LYS 31 6.658 1.910 -8.127
209 1HE LYS 31 2HE LYS 31 4.486 2.095 -8.747
210 2HE LYS 31 1HE LYS 31 5.047 2.546 -10.368
211 1HZ LYS 31 1HZ LYS 31 5.410 0.069 -10.701
212 2HZ LYS 31 2HZ LYS 31 3.799 0.608 -10.702
213 3HZ LYS 31 3HZ LYS 31 4.440 -0.160 -9.329
214 H ALA 32 H ALA 32 8.877 5.611 -7.128
215 HA ALA 32 HA ALA 32 11.484 6.708 -7.296
216 1HB ALA 32 1HB ALA 32 9.662 7.133 -9.621
217 2HB ALA 32 2HB ALA 32 11.419 7.002 -9.585
218 3HB ALA 32 3HB ALA 32 10.638 8.507 -9.101
219 H CYS 33 H CYS 33 11.562 8.768 -6.252
220 HA CYS 33 HA CYS 33 9.274 10.444 -5.768
221 1HB CYS 33 2HB CYS 33 8.675 8.299 -4.557
222 2HB CYS 33 1HB CYS 33 10.060 8.588 -3.501
223 HA PRO 34 HA PRO 34 13.283 12.320 -4.680
224 1HB PRO 34 2HB PRO 34 12.598 14.823 -5.552
225 2HB PRO 34 1HB PRO 34 13.212 13.556 -6.633
226 1HG PRO 34 2HG PRO 34 10.415 14.469 -6.183
227 2HG PRO 34 1HG PRO 34 11.214 13.975 -7.684
228 1HD PRO 34 2HD PRO 34 9.515 12.366 -6.279
229 2HD PRO 34 1HD PRO 34 10.825 11.750 -7.314
230 H GLN 35 H GLN 35 9.977 13.173 -3.896
231 HA GLN 35 HA GLN 35 10.729 13.898 -1.165
232 1HB GLN 35 2HB GLN 35 9.939 16.248 -1.383
233 2HB GLN 35 1HB GLN 35 11.329 15.932 -2.423
234 1HG GLN 35 2HG GLN 35 9.563 15.353 -4.239
235 2HG GLN 35 1HG GLN 35 8.430 16.215 -3.197
236 1HE2 GLN 35 1HE2 GLN 35 8.586 17.582 -5.417
237 2HE2 GLN 35 2HE2 GLN 35 9.693 18.869 -5.368
Start of MODEL 2
1 1H GLU 1 1HT GLU 1 8.126 2.672 10.137
2 2H GLU 1 2HT GLU 1 6.684 3.569 10.099
3 3H GLU 1 3HT GLU 1 7.328 2.931 8.663
4 HA GLU 1 HA GLU 1 6.815 0.716 9.284
5 1HB GLU 1 2HB GLU 1 7.581 1.426 11.684
6 2HB GLU 1 1HB GLU 1 5.870 1.764 11.947
7 1HG GLU 1 2HG GLU 1 5.764 -0.705 10.756
8 2HG GLU 1 1HG GLU 1 7.252 -0.826 11.694
9 H VAL 2 H VAL 2 5.127 0.894 7.769
10 HA VAL 2 HA VAL 2 2.846 2.602 8.014
11 HB VAL 2 HB VAL 2 3.367 1.701 5.877
12 1HG1 VAL 2 1HG1 VAL 2 4.725 -0.159 6.261
13 2HG1 VAL 2 2HG1 VAL 2 3.250 -0.915 5.660
14 3HG1 VAL 2 3HG1 VAL 2 3.582 -0.884 7.392
15 1HG2 VAL 2 1HG2 VAL 2 0.860 1.333 6.960
16 2HG2 VAL 2 2HG2 VAL 2 1.235 -0.276 6.342
17 3HG2 VAL 2 3HG2 VAL 2 1.260 1.113 5.257
18 H THR 3 H THR 3 0.928 2.324 9.118
19 HA THR 3 HA THR 3 0.469 -0.316 10.472
20 HB THR 3 HB THR 3 0.093 2.519 11.493
21 HG1 THR 3 1HG THR 3 2.229 1.700 11.523
22 1HG2 THR 3 1HG2 THR 3 -1.563 0.526 12.140
23 2HG2 THR 3 2HG2 THR 3 -1.015 1.700 13.338
24 3HG2 THR 3 3HG2 THR 3 -0.239 0.119 13.233
25 H CYS 4 H CYS 4 -0.918 -0.642 8.475
26 HA CYS 4 HA CYS 4 -3.553 0.775 8.754
27 1HB CYS 4 2HB CYS 4 -3.674 0.334 6.246
28 2HB CYS 4 1HB CYS 4 -2.432 1.485 6.748
29 H GLU 5 H GLU 5 -5.308 -0.629 7.551
30 HA GLU 5 HA GLU 5 -5.286 -3.301 8.794
31 1HB GLU 5 2HB GLU 5 -7.157 -1.303 7.958
32 2HB GLU 5 1HB GLU 5 -7.547 -2.797 7.108
33 1HG GLU 5 2HG GLU 5 -8.625 -3.395 9.010
34 2HG GLU 5 1HG GLU 5 -7.015 -3.689 9.669
35 HA PRO 6 HA PRO 6 -3.984 -5.359 5.114
36 1HB PRO 6 2HB PRO 6 -5.007 -7.846 5.626
37 2HB PRO 6 1HB PRO 6 -3.571 -7.202 6.448
38 1HG PRO 6 2HG PRO 6 -6.385 -7.366 7.407
39 2HG PRO 6 1HG PRO 6 -4.874 -7.638 8.289
40 1HD PRO 6 2HD PRO 6 -6.324 -5.338 8.475
41 2HD PRO 6 1HD PRO 6 -4.560 -5.405 8.704
42 H GLY 7 H GLY 7 -4.981 -5.036 3.163
43 1HA GLY 7 2HA GLY 7 -6.620 -5.659 1.489
44 2HA GLY 7 1HA GLY 7 -7.748 -6.060 2.790
45 H THR 8 H THR 8 -5.844 -3.144 1.954
46 HA THR 8 HA THR 8 -8.283 -1.582 1.496
47 HB THR 8 HB THR 8 -6.536 -1.023 3.913
48 HG1 THR 8 1HG THR 8 -9.185 -1.785 4.175
49 1HG2 THR 8 1HG2 THR 8 -8.604 0.410 4.467
50 2HG2 THR 8 2HG2 THR 8 -9.039 0.212 2.769
51 3HG2 THR 8 3HG2 THR 8 -7.525 1.007 3.205
52 H THR 9 H THR 9 -4.786 -1.642 2.022
53 HA THR 9 HA THR 9 -3.073 -0.209 1.232
54 HB THR 9 HB THR 9 -3.871 -1.683 -0.665
55 HG1 THR 9 1HG THR 9 -2.900 -0.241 -2.273
56 1HG2 THR 9 1HG2 THR 9 -6.037 -0.873 -1.158
57 2HG2 THR 9 2HG2 THR 9 -5.050 -0.320 -2.511
58 3HG2 THR 9 3HG2 THR 9 -5.487 0.802 -1.223
59 H PHE 10 H PHE 10 -2.970 1.862 -0.518
60 HA PHE 10 HA PHE 10 -5.025 3.833 -0.387
61 1HB PHE 10 2HB PHE 10 -3.841 5.222 1.461
62 2HB PHE 10 1HB PHE 10 -4.819 3.847 1.972
63 HD1 PHE 10 1HD PHE 10 -3.830 1.924 3.000
64 HD2 PHE 10 2HD PHE 10 -1.347 5.009 1.340
65 HE1 PHE 10 1HE PHE 10 -1.849 0.916 4.092
66 HE2 PHE 10 2HE PHE 10 0.637 4.000 2.434
67 HZ PHE 10 HZ PHE 10 0.388 1.948 3.815
68 H LYS 11 H LYS 11 -3.665 6.190 -0.287
69 HA LYS 11 HA LYS 11 -1.501 5.837 -2.337
70 1HB LYS 11 2HB LYS 11 -3.910 7.493 -2.090
71 2HB LYS 11 1HB LYS 11 -2.476 8.429 -2.517
72 1HG LYS 11 2HG LYS 11 -2.034 6.583 -4.274
73 2HG LYS 11 1HG LYS 11 -3.711 6.111 -4.001
74 1HD LYS 11 2HD LYS 11 -2.776 8.875 -4.830
75 2HD LYS 11 1HD LYS 11 -3.537 7.688 -5.890
76 1HE LYS 11 2HE LYS 11 -5.561 7.714 -4.426
77 2HE LYS 11 1HE LYS 11 -4.804 8.993 -3.454
78 1HZ LYS 11 1HZ LYS 11 -4.440 10.158 -5.668
79 2HZ LYS 11 2HZ LYS 11 -6.028 10.138 -5.067
80 3HZ LYS 11 3HZ LYS 11 -5.574 9.074 -6.311
81 H ASP 12 H ASP 12 0.484 6.320 -1.494
82 HA ASP 12 HA ASP 12 0.680 8.591 0.452
83 1HB ASP 12 2HB ASP 12 0.787 6.061 1.254
84 2HB ASP 12 1HB ASP 12 2.445 6.173 0.651
85 H LYS 13 H LYS 13 3.082 9.256 0.642
86 HA LYS 13 HA LYS 13 4.766 10.399 -0.587
87 1HB LYS 13 2HB LYS 13 6.320 8.632 -1.493
88 2HB LYS 13 1HB LYS 13 5.772 8.353 0.162
89 1HG LYS 13 2HG LYS 13 4.145 6.748 -0.560
90 2HG LYS 13 1HG LYS 13 4.415 7.170 -2.251
91 1HD LYS 13 2HD LYS 13 5.615 5.110 -1.788
92 2HD LYS 13 1HD LYS 13 6.794 6.406 -1.998
93 1HE LYS 13 2HE LYS 13 6.135 6.467 0.739
94 2HE LYS 13 1HE LYS 13 6.337 4.750 0.338
95 1HZ LYS 13 1HZ LYS 13 8.420 6.205 0.843
96 2HZ LYS 13 2HZ LYS 13 8.220 6.722 -0.764
97 3HZ LYS 13 3HZ LYS 13 8.465 5.076 -0.423
98 H CYS 14 H CYS 14 5.444 8.432 -3.161
99 HA CYS 14 HA CYS 14 3.762 10.124 -4.971
100 1HB CYS 14 2HB CYS 14 5.640 10.174 -6.440
101 2HB CYS 14 1HB CYS 14 6.305 10.409 -4.822
102 H ASN 15 H ASN 15 2.887 7.505 -3.909
103 HA ASN 15 HA ASN 15 2.099 6.279 -6.429
104 1HB ASN 15 2HB ASN 15 4.469 5.349 -4.937
105 2HB ASN 15 1HB ASN 15 3.371 4.079 -5.470
106 1HD2 ASN 15 1HD2 ASN 15 5.941 6.068 -6.491
107 2HD2 ASN 15 2HD2 ASN 15 5.777 5.830 -8.172
108 H THR 16 H THR 16 2.779 4.204 -3.704
109 HA THR 16 HA THR 16 0.348 4.542 -2.216
110 HB THR 16 HB THR 16 0.324 2.977 -4.752
111 HG1 THR 16 1HG THR 16 -2.056 3.581 -4.073
112 1HG2 THR 16 1HG2 THR 16 0.094 1.230 -2.933
113 2HG2 THR 16 2HG2 THR 16 -1.295 1.358 -4.009
114 3HG2 THR 16 3HG2 THR 16 -1.360 2.075 -2.402
115 H CYS 17 H CYS 17 -0.160 2.397 -1.019
116 HA CYS 17 HA CYS 17 2.266 0.731 -0.603
117 1HB CYS 17 2HB CYS 17 1.285 2.976 0.975
118 2HB CYS 17 1HB CYS 17 1.388 1.507 1.932
119 H ARG 18 H ARG 18 0.804 -0.996 -1.406
120 HA ARG 18 HA ARG 18 -1.773 -1.600 -0.402
121 1HB ARG 18 2HB ARG 18 -0.807 -2.664 -2.356
122 2HB ARG 18 1HB ARG 18 0.496 -3.356 -1.385
123 1HG ARG 18 2HG ARG 18 -1.119 -5.104 -1.709
124 2HG ARG 18 1HG ARG 18 -1.296 -4.557 -0.042
125 1HD ARG 18 2HD ARG 18 -3.431 -3.880 -0.412
126 2HD ARG 18 1HD ARG 18 -2.961 -3.006 -1.885
127 HE ARG 18 HE ARG 18 -3.128 -5.978 -1.976
128 1HH1 ARG 18 1HH2 ARG 18 -5.224 -3.403 -2.218
129 2HH1 ARG 18 2HH2 ARG 18 -5.724 -3.720 -3.847
130 1HH2 ARG 18 1HH1 ARG 18 -3.322 -6.161 -4.389
131 2HH2 ARG 18 2HH1 ARG 18 -4.650 -5.284 -5.073
132 H CYS 19 H CYS 19 -2.257 -1.824 1.751
133 HA CYS 19 HA CYS 19 -0.496 -2.390 3.876
134 1HB CYS 19 2HB CYS 19 -3.036 -1.657 3.670
135 2HB CYS 19 1HB CYS 19 -3.328 -3.386 3.884
136 H GLY 20 H GLY 20 0.432 -4.269 4.628
137 1HA GLY 20 2HA GLY 20 0.539 -6.638 3.094
138 2HA GLY 20 1HA GLY 20 0.970 -6.545 4.805
139 H SER 21 H SER 21 -0.016 -8.770 4.809
140 HA SER 21 HA SER 21 -2.977 -8.846 4.634
141 1HB SER 21 2HB SER 21 -1.074 -11.066 5.392
142 2HB SER 21 1HB SER 21 -2.658 -11.203 4.635
143 HG SER 21 HG SER 21 -0.544 -11.304 3.333
144 H ASP 22 H ASP 22 -0.445 -8.648 7.021
145 HA ASP 22 HA ASP 22 -2.427 -9.238 9.192
146 1HB ASP 22 2HB ASP 22 -0.248 -9.498 10.526
147 2HB ASP 22 1HB ASP 22 -0.542 -10.710 9.273
148 H GLY 23 H GLY 23 -1.443 -6.639 7.569
149 1HA GLY 23 2HA GLY 23 -1.573 -4.352 8.139
150 2HA GLY 23 1HA GLY 23 -1.892 -4.829 9.809
151 H LYS 24 H LYS 24 -0.251 -2.790 9.746
152 HA LYS 24 HA LYS 24 1.911 -2.043 10.351
153 1HB LYS 24 2HB LYS 24 1.821 -4.958 11.134
154 2HB LYS 24 1HB LYS 24 3.258 -3.981 11.441
155 1HG LYS 24 2HG LYS 24 1.976 -3.790 13.427
156 2HG LYS 24 1HG LYS 24 1.657 -2.293 12.547
157 1HD LYS 24 2HD LYS 24 -0.523 -2.813 12.215
158 2HD LYS 24 1HD LYS 24 -0.154 -4.494 11.826
159 1HE LYS 24 2HE LYS 24 0.409 -4.058 14.613
160 2HE LYS 24 1HE LYS 24 -1.238 -3.501 14.257
161 1HZ LYS 24 1HZ LYS 24 -0.056 -6.128 13.529
162 2HZ LYS 24 2HZ LYS 24 -1.574 -5.581 12.996
163 3HZ LYS 24 3HZ LYS 24 -1.298 -5.856 14.651
164 H SER 25 H SER 25 1.385 -3.175 7.582
165 HA SER 25 HA SER 25 4.174 -3.164 6.692
166 1HB SER 25 2HB SER 25 2.481 -5.654 6.818
167 2HB SER 25 1HB SER 25 3.730 -5.494 5.582
168 HG SER 25 HG SER 25 5.050 -6.078 7.102
169 H ALA 26 H ALA 26 4.293 -2.745 4.438
170 HA ALA 26 HA ALA 26 1.756 -2.771 2.886
171 1HB ALA 26 1HB ALA 26 3.548 -0.350 3.241
172 2HB ALA 26 2HB ALA 26 2.009 -0.583 4.068
173 3HB ALA 26 3HB ALA 26 2.050 -0.410 2.314
174 H ALA 27 H ALA 27 2.150 -3.348 0.757
175 HA ALA 27 HA ALA 27 4.714 -4.256 -0.111
176 1HB ALA 27 1HB ALA 27 3.590 -4.582 -2.208
177 2HB ALA 27 2HB ALA 27 2.442 -3.290 -1.864
178 3HB ALA 27 3HB ALA 27 2.357 -4.805 -0.966
179 H CYS 28 H CYS 28 2.898 -1.459 -1.354
180 HA CYS 28 HA CYS 28 3.628 0.668 -2.051
181 1HB CYS 28 2HB CYS 28 6.163 -0.060 -0.569
182 2HB CYS 28 1HB CYS 28 5.492 1.549 -0.828
183 H THR 29 H THR 29 3.902 0.493 -4.261
184 HA THR 29 HA THR 29 6.136 -0.942 -5.482
185 HB THR 29 HB THR 29 4.232 -0.867 -6.843
186 HG1 THR 29 1HG THR 29 6.120 -0.075 -7.933
187 1HG2 THR 29 1HG2 THR 29 3.768 1.725 -5.540
188 2HG2 THR 29 2HG2 THR 29 2.608 0.575 -6.198
189 3HG2 THR 29 3HG2 THR 29 3.391 1.742 -7.262
190 H LEU 30 H LEU 30 5.315 2.473 -6.045
191 HA LEU 30 HA LEU 30 6.852 4.187 -6.704
192 1HB LEU 30 2HB LEU 30 7.892 4.873 -4.395
193 2HB LEU 30 1HB LEU 30 6.151 4.913 -4.618
194 HG LEU 30 HG LEU 30 7.291 2.335 -3.684
195 1HD1 LEU 30 1HD1 LEU 30 7.801 4.865 -2.339
196 2HD1 LEU 30 2HD1 LEU 30 8.432 3.258 -1.978
197 3HD1 LEU 30 3HD1 LEU 30 6.870 3.758 -1.331
198 1HD2 LEU 30 1HD2 LEU 30 5.216 2.898 -2.077
199 2HD2 LEU 30 2HD2 LEU 30 4.978 2.260 -3.704
200 3HD2 LEU 30 3HD2 LEU 30 4.820 3.989 -3.405
201 H LYS 31 H LYS 31 8.601 3.836 -7.979
202 HA LYS 31 HA LYS 31 10.920 2.280 -7.003
203 1HB LYS 31 2HB LYS 31 10.893 3.924 -9.523
204 2HB LYS 31 1HB LYS 31 11.575 2.328 -9.252
205 1HG LYS 31 2HG LYS 31 8.678 2.285 -8.933
206 2HG LYS 31 1HG LYS 31 9.143 2.901 -10.513
207 1HD LYS 31 2HD LYS 31 10.121 0.915 -11.145
208 2HD LYS 31 1HD LYS 31 10.550 0.477 -9.489
209 1HE LYS 31 2HE LYS 31 8.494 -0.475 -9.064
210 2HE LYS 31 1HE LYS 31 7.635 0.671 -10.113
211 1HZ LYS 31 1HZ LYS 31 7.694 -1.419 -11.236
212 2HZ LYS 31 2HZ LYS 31 9.361 -1.593 -10.965
213 3HZ LYS 31 3HZ LYS 31 8.791 -0.394 -12.025
214 H ALA 32 H ALA 32 10.587 4.206 -5.257
215 HA ALA 32 HA ALA 32 11.865 5.896 -4.182
216 1HB ALA 32 1HB ALA 32 13.153 6.802 -6.682
217 2HB ALA 32 2HB ALA 32 13.495 5.130 -6.233
218 3HB ALA 32 3HB ALA 32 13.873 6.440 -5.113
219 H CYS 33 H CYS 33 11.327 8.106 -3.932
220 HA CYS 33 HA CYS 33 9.472 9.173 -6.032
221 1HB CYS 33 2HB CYS 33 9.553 9.491 -3.016
222 2HB CYS 33 1HB CYS 33 8.453 10.393 -4.063
223 HA PRO 34 HA PRO 34 12.857 12.177 -6.081
224 1HB PRO 34 2HB PRO 34 12.368 13.017 -8.635
225 2HB PRO 34 1HB PRO 34 13.310 11.558 -8.264
226 1HG PRO 34 2HG PRO 34 10.490 11.813 -9.161
227 2HG PRO 34 1HG PRO 34 11.697 10.579 -9.556
228 1HD PRO 34 2HD PRO 34 9.664 10.239 -7.735
229 2HD PRO 34 1HD PRO 34 11.187 9.318 -7.730
230 H GLN 35 H GLN 35 9.577 12.658 -7.379
231 HA GLN 35 HA GLN 35 9.314 15.156 -5.809
232 1HB GLN 35 2HB GLN 35 10.201 15.155 -8.463
233 2HB GLN 35 1HB GLN 35 8.485 15.550 -8.581
234 1HG GLN 35 2HG GLN 35 8.704 17.471 -7.243
235 2HG GLN 35 1HG GLN 35 10.232 16.926 -6.549
236 1HE2 GLN 35 1HE2 GLN 35 9.395 19.413 -8.261
237 2HE2 GLN 35 2HE2 GLN 35 10.591 19.467 -9.467
Start of MODEL 3
1 1H GLU 1 1HT GLU 1 5.365 -0.836 11.086
2 2H GLU 1 2HT GLU 1 6.808 -0.391 11.866
3 3H GLU 1 3HT GLU 1 6.705 -0.341 10.171
4 HA GLU 1 HA GLU 1 5.585 1.522 12.156
5 1HB GLU 1 2HB GLU 1 7.721 1.963 11.059
6 2HB GLU 1 1HB GLU 1 7.001 1.665 9.476
7 1HG GLU 1 2HG GLU 1 7.043 4.037 9.716
8 2HG GLU 1 1HG GLU 1 5.371 3.562 10.023
9 H VAL 2 H VAL 2 4.880 -0.076 9.090
10 HA VAL 2 HA VAL 2 2.904 1.623 8.011
11 HB VAL 2 HB VAL 2 3.163 -1.401 8.103
12 1HG1 VAL 2 1HG1 VAL 2 1.663 0.144 5.997
13 2HG1 VAL 2 2HG1 VAL 2 0.852 -0.359 7.481
14 3HG1 VAL 2 3HG1 VAL 2 1.550 -1.568 6.405
15 1HG2 VAL 2 1HG2 VAL 2 4.071 0.748 6.169
16 2HG2 VAL 2 2HG2 VAL 2 4.050 -0.966 5.757
17 3HG2 VAL 2 3HG2 VAL 2 5.080 -0.386 7.066
18 H THR 3 H THR 3 1.014 2.322 8.927
19 HA THR 3 HA THR 3 -0.293 0.581 10.991
20 HB THR 3 HB THR 3 0.657 2.729 11.794
21 HG1 THR 3 1HG THR 3 -1.637 3.623 12.293
22 1HG2 THR 3 1HG2 THR 3 -0.339 3.669 9.321
23 2HG2 THR 3 2HG2 THR 3 0.501 4.600 10.561
24 3HG2 THR 3 3HG2 THR 3 -1.260 4.501 10.574
25 H CYS 4 H CYS 4 -1.420 -0.468 9.107
26 HA CYS 4 HA CYS 4 -3.896 1.037 8.436
27 1HB CYS 4 2HB CYS 4 -3.544 0.384 6.022
28 2HB CYS 4 1HB CYS 4 -2.348 1.536 6.627
29 H GLU 5 H GLU 5 -5.487 -0.512 7.328
30 HA GLU 5 HA GLU 5 -5.428 -3.107 8.739
31 1HB GLU 5 2HB GLU 5 -7.439 -1.638 7.007
32 2HB GLU 5 1HB GLU 5 -7.763 -3.199 7.761
33 1HG GLU 5 2HG GLU 5 -6.880 -0.760 9.323
34 2HG GLU 5 1HG GLU 5 -8.573 -1.196 9.086
35 HA PRO 6 HA PRO 6 -4.040 -5.351 5.221
36 1HB PRO 6 2HB PRO 6 -5.121 -7.801 5.801
37 2HB PRO 6 1HB PRO 6 -3.711 -7.137 6.649
38 1HG PRO 6 2HG PRO 6 -6.558 -7.230 7.505
39 2HG PRO 6 1HG PRO 6 -5.086 -7.467 8.456
40 1HD PRO 6 2HD PRO 6 -6.524 -5.151 8.468
41 2HD PRO 6 1HD PRO 6 -4.773 -5.222 8.780
42 H GLY 7 H GLY 7 -4.950 -5.062 3.228
43 1HA GLY 7 2HA GLY 7 -6.506 -5.689 1.489
44 2HA GLY 7 1HA GLY 7 -7.687 -6.110 2.738
45 H THR 8 H THR 8 -5.770 -3.144 2.264
46 HA THR 8 HA THR 8 -8.207 -1.607 1.600
47 HB THR 8 HB THR 8 -6.564 -0.936 4.050
48 HG1 THR 8 1HG THR 8 -7.855 -2.168 5.211
49 1HG2 THR 8 1HG2 THR 8 -9.276 -0.093 4.177
50 2HG2 THR 8 2HG2 THR 8 -8.663 0.351 2.584
51 3HG2 THR 8 3HG2 THR 8 -7.835 0.913 4.037
52 H THR 9 H THR 9 -4.725 -1.674 2.217
53 HA THR 9 HA THR 9 -3.003 -0.204 1.517
54 HB THR 9 HB THR 9 -3.766 -1.619 -0.450
55 HG1 THR 9 1HG THR 9 -2.060 0.225 -0.338
56 1HG2 THR 9 1HG2 THR 9 -5.918 -0.750 -0.947
57 2HG2 THR 9 2HG2 THR 9 -4.892 -0.213 -2.277
58 3HG2 THR 9 3HG2 THR 9 -5.323 0.910 -0.988
59 H PHE 10 H PHE 10 -2.966 1.923 -0.235
60 HA PHE 10 HA PHE 10 -5.064 3.844 0.038
61 1HB PHE 10 2HB PHE 10 -3.763 5.223 1.836
62 2HB PHE 10 1HB PHE 10 -4.735 3.854 2.374
63 HD1 PHE 10 1HD PHE 10 -3.734 1.911 3.338
64 HD2 PHE 10 2HD PHE 10 -1.278 4.964 1.581
65 HE1 PHE 10 1HE PHE 10 -1.718 0.848 4.312
66 HE2 PHE 10 2HE PHE 10 0.741 3.900 2.555
67 HZ PHE 10 HZ PHE 10 0.521 1.839 3.921
68 H LYS 11 H LYS 11 -3.833 6.220 0.005
69 HA LYS 11 HA LYS 11 -1.891 5.961 -2.245
70 1HB LYS 11 2HB LYS 11 -4.037 7.812 -1.389
71 2HB LYS 11 1HB LYS 11 -2.631 8.585 -2.124
72 1HG LYS 11 2HG LYS 11 -2.814 7.026 -4.054
73 2HG LYS 11 1HG LYS 11 -4.269 6.337 -3.334
74 1HD LYS 11 2HD LYS 11 -5.483 7.955 -4.313
75 2HD LYS 11 1HD LYS 11 -4.622 9.152 -3.345
76 1HE LYS 11 2HE LYS 11 -4.128 9.873 -5.526
77 2HE LYS 11 1HE LYS 11 -2.739 8.819 -5.192
78 1HZ LYS 11 1HZ LYS 11 -3.739 7.033 -6.302
79 2HZ LYS 11 2HZ LYS 11 -4.016 8.363 -7.321
80 3HZ LYS 11 3HZ LYS 11 -5.264 7.775 -6.330
81 H ASP 12 H ASP 12 0.142 5.817 -1.259
82 HA ASP 12 HA ASP 12 0.893 8.073 0.568
83 1HB ASP 12 2HB ASP 12 0.665 5.535 1.345
84 2HB ASP 12 1HB ASP 12 2.258 5.403 0.591
85 H LYS 13 H LYS 13 3.424 8.274 0.511
86 HA LYS 13 HA LYS 13 5.239 8.943 -0.851
87 1HB LYS 13 2HB LYS 13 4.744 6.437 -2.413
88 2HB LYS 13 1HB LYS 13 6.263 7.066 -1.765
89 1HG LYS 13 2HG LYS 13 4.843 6.675 0.531
90 2HG LYS 13 1HG LYS 13 4.218 5.385 -0.475
91 1HD LYS 13 2HD LYS 13 6.059 4.271 0.324
92 2HD LYS 13 1HD LYS 13 6.843 5.102 -1.019
93 1HE LYS 13 2HE LYS 13 7.389 6.996 0.565
94 2HE LYS 13 1HE LYS 13 6.790 5.975 1.889
95 1HZ LYS 13 1HZ LYS 13 9.306 5.884 0.909
96 2HZ LYS 13 2HZ LYS 13 8.559 4.620 0.055
97 3HZ LYS 13 3HZ LYS 13 8.553 4.622 1.755
98 H CYS 14 H CYS 14 5.448 7.919 -3.700
99 HA CYS 14 HA CYS 14 3.648 9.977 -4.902
100 1HB CYS 14 2HB CYS 14 5.719 8.573 -6.518
101 2HB CYS 14 1HB CYS 14 5.342 10.290 -6.437
102 H ASN 15 H ASN 15 3.147 6.934 -4.138
103 HA ASN 15 HA ASN 15 1.626 6.364 -6.632
104 1HB ASN 15 2HB ASN 15 3.926 4.817 -5.478
105 2HB ASN 15 1HB ASN 15 2.652 3.951 -6.335
106 1HD2 ASN 15 1HD2 ASN 15 5.469 4.363 -7.232
107 2HD2 ASN 15 2HD2 ASN 15 5.364 5.188 -8.722
108 H THR 16 H THR 16 2.406 3.947 -4.210
109 HA THR 16 HA THR 16 0.011 4.391 -2.581
110 HB THR 16 HB THR 16 0.095 2.546 -4.943
111 HG1 THR 16 1HG THR 16 -1.660 4.350 -3.718
112 1HG2 THR 16 1HG2 THR 16 -1.605 2.010 -2.492
113 2HG2 THR 16 2HG2 THR 16 -0.197 1.056 -2.958
114 3HG2 THR 16 3HG2 THR 16 -1.618 1.098 -4.003
115 H CYS 17 H CYS 17 -0.365 2.432 -1.157
116 HA CYS 17 HA CYS 17 2.119 0.874 -0.651
117 1HB CYS 17 2HB CYS 17 1.029 3.170 0.776
118 2HB CYS 17 1HB CYS 17 1.184 1.773 1.826
119 H ARG 18 H ARG 18 0.874 -1.012 -1.252
120 HA ARG 18 HA ARG 18 -1.723 -1.682 -0.307
121 1HB ARG 18 2HB ARG 18 -0.858 -2.910 -2.105
122 2HB ARG 18 1HB ARG 18 0.698 -3.152 -1.317
123 1HG ARG 18 2HG ARG 18 -0.500 -5.258 -1.280
124 2HG ARG 18 1HG ARG 18 -0.454 -4.624 0.365
125 1HD ARG 18 2HD ARG 18 -2.736 -3.864 0.228
126 2HD ARG 18 1HD ARG 18 -2.794 -4.180 -1.518
127 HE ARG 18 HE ARG 18 -2.059 -6.525 0.074
128 1HH1 ARG 18 1HH2 ARG 18 -3.695 -6.139 -2.575
129 2HH1 ARG 18 2HH2 ARG 18 -5.225 -6.768 -2.061
130 1HH2 ARG 18 1HH1 ARG 18 -4.422 -6.690 1.313
131 2HH2 ARG 18 2HH1 ARG 18 -5.638 -7.080 0.143
132 H CYS 19 H CYS 19 -2.404 -2.213 1.720
133 HA CYS 19 HA CYS 19 -0.500 -2.531 3.919
134 1HB CYS 19 2HB CYS 19 -2.838 -1.407 3.844
135 2HB CYS 19 1HB CYS 19 -3.478 -3.048 3.964
136 H GLY 20 H GLY 20 0.512 -4.472 4.205
137 1HA GLY 20 2HA GLY 20 -0.138 -6.922 3.001
138 2HA GLY 20 1HA GLY 20 0.796 -6.784 4.494
139 H SER 21 H SER 21 -0.682 -8.958 4.470
140 HA SER 21 HA SER 21 -3.429 -8.619 5.363
141 1HB SER 21 2HB SER 21 -1.959 -10.619 4.297
142 2HB SER 21 1HB SER 21 -1.843 -11.060 5.999
143 HG SER 21 HG SER 21 -3.942 -11.443 6.054
144 H ASP 22 H ASP 22 -0.433 -8.146 6.878
145 HA ASP 22 HA ASP 22 -1.489 -8.815 9.589
146 1HB ASP 22 2HB ASP 22 1.147 -8.578 8.242
147 2HB ASP 22 1HB ASP 22 1.100 -8.042 9.926
148 H GLY 23 H GLY 23 -1.637 -6.256 7.558
149 1HA GLY 23 2HA GLY 23 -2.148 -3.994 7.955
150 2HA GLY 23 1HA GLY 23 -2.131 -4.356 9.684
151 H LYS 24 H LYS 24 0.287 -4.957 10.412
152 HA LYS 24 HA LYS 24 1.853 -2.532 9.942
153 1HB LYS 24 2HB LYS 24 1.499 -4.404 11.955
154 2HB LYS 24 1HB LYS 24 3.113 -4.781 11.352
155 1HG LYS 24 2HG LYS 24 3.880 -2.548 11.741
156 2HG LYS 24 1HG LYS 24 2.240 -1.967 12.037
157 1HD LYS 24 2HD LYS 24 3.386 -4.157 13.750
158 2HD LYS 24 1HD LYS 24 3.795 -2.473 14.083
159 1HE LYS 24 2HE LYS 24 0.905 -3.116 13.652
160 2HE LYS 24 1HE LYS 24 1.640 -3.601 15.193
161 1HZ LYS 24 1HZ LYS 24 1.952 -0.903 13.995
162 2HZ LYS 24 2HZ LYS 24 2.430 -1.401 15.547
163 3HZ LYS 24 3HZ LYS 24 0.781 -1.274 15.163
164 H SER 25 H SER 25 1.647 -3.799 7.475
165 HA SER 25 HA SER 25 4.443 -4.256 6.795
166 1HB SER 25 2HB SER 25 2.446 -6.531 6.929
167 2HB SER 25 1HB SER 25 3.932 -6.633 5.983
168 HG SER 25 HG SER 25 5.089 -6.240 7.903
169 H ALA 26 H ALA 26 4.156 -2.746 5.103
170 HA ALA 26 HA ALA 26 2.044 -3.397 3.079
171 1HB ALA 26 1HB ALA 26 3.416 -0.858 3.977
172 2HB ALA 26 2HB ALA 26 1.693 -1.233 4.002
173 3HB ALA 26 3HB ALA 26 2.508 -0.930 2.468
174 H ALA 27 H ALA 27 2.703 -2.904 0.795
175 HA ALA 27 HA ALA 27 5.547 -3.698 0.342
176 1HB ALA 27 1HB ALA 27 4.494 -5.180 -1.009
177 2HB ALA 27 2HB ALA 27 4.038 -3.822 -2.036
178 3HB ALA 27 3HB ALA 27 2.949 -4.367 -0.760
179 H CYS 28 H CYS 28 3.036 -1.671 -1.167
180 HA CYS 28 HA CYS 28 3.172 0.471 -2.138
181 1HB CYS 28 2HB CYS 28 5.935 0.570 -0.906
182 2HB CYS 28 1HB CYS 28 4.859 1.919 -1.248
183 H THR 29 H THR 29 3.791 1.168 -4.177
184 HA THR 29 HA THR 29 6.011 -0.359 -5.499
185 HB THR 29 HB THR 29 3.691 -0.781 -6.298
186 HG1 THR 29 1HG THR 29 4.996 0.777 -8.244
187 1HG2 THR 29 1HG2 THR 29 2.217 0.893 -6.627
188 2HG2 THR 29 2HG2 THR 29 3.363 1.793 -7.621
189 3HG2 THR 29 3HG2 THR 29 3.395 1.961 -5.865
190 H LEU 30 H LEU 30 7.583 1.288 -4.821
191 HA LEU 30 HA LEU 30 7.341 3.833 -6.391
192 1HB LEU 30 2HB LEU 30 8.719 4.752 -4.395
193 2HB LEU 30 1HB LEU 30 7.008 4.423 -4.117
194 HG LEU 30 HG LEU 30 8.872 2.156 -3.651
195 1HD1 LEU 30 1HD1 LEU 30 8.982 4.743 -2.171
196 2HD1 LEU 30 2HD1 LEU 30 10.252 3.552 -2.447
197 3HD1 LEU 30 3HD1 LEU 30 9.026 3.262 -1.213
198 1HD2 LEU 30 1HD2 LEU 30 7.302 1.717 -1.839
199 2HD2 LEU 30 2HD2 LEU 30 6.389 2.085 -3.303
200 3HD2 LEU 30 3HD2 LEU 30 6.570 3.308 -2.045
201 H LYS 31 H LYS 31 9.215 4.430 -7.509
202 HA LYS 31 HA LYS 31 11.599 2.632 -7.188
203 1HB LYS 31 2HB LYS 31 9.852 2.780 -9.309
204 2HB LYS 31 1HB LYS 31 11.121 3.897 -9.809
205 1HG LYS 31 2HG LYS 31 11.783 1.742 -10.613
206 2HG LYS 31 1HG LYS 31 12.792 2.072 -9.205
207 1HD LYS 31 2HD LYS 31 12.006 -0.177 -8.952
208 2HD LYS 31 1HD LYS 31 11.071 0.806 -7.824
209 1HE LYS 31 2HE LYS 31 9.441 -0.547 -8.920
210 2HE LYS 31 1HE LYS 31 9.344 1.011 -9.763
211 1HZ LYS 31 1HZ LYS 31 10.763 -1.445 -10.611
212 2HZ LYS 31 2HZ LYS 31 11.154 0.077 -11.257
213 3HZ LYS 31 3HZ LYS 31 9.594 -0.561 -11.463
214 H ALA 32 H ALA 32 10.515 5.839 -8.366
215 HA ALA 32 HA ALA 32 13.262 6.895 -7.830
216 1HB ALA 32 1HB ALA 32 11.618 8.778 -9.166
217 2HB ALA 32 2HB ALA 32 11.256 7.207 -9.882
218 3HB ALA 32 3HB ALA 32 12.913 7.809 -9.866
219 H CYS 33 H CYS 33 10.180 8.628 -7.934
220 HA CYS 33 HA CYS 33 9.163 10.065 -6.359
221 1HB CYS 33 2HB CYS 33 10.402 7.829 -4.797
222 2HB CYS 33 1HB CYS 33 9.749 9.215 -3.918
223 HA PRO 34 HA PRO 34 12.155 13.042 -5.140
224 1HB PRO 34 2HB PRO 34 10.844 14.338 -3.128
225 2HB PRO 34 1HB PRO 34 10.367 14.484 -4.832
226 1HG PRO 34 2HG PRO 34 9.150 12.875 -2.657
227 2HG PRO 34 1HG PRO 34 8.379 13.715 -4.010
228 1HD PRO 34 2HD PRO 34 8.845 11.000 -3.899
229 2HD PRO 34 1HD PRO 34 8.599 11.928 -5.396
230 H GLN 35 H GLN 35 13.096 10.754 -4.122
231 HA GLN 35 HA GLN 35 14.413 9.861 -2.372
232 1HB GLN 35 2HB GLN 35 15.290 12.186 -2.447
233 2HB GLN 35 1HB GLN 35 14.036 12.683 -1.312
234 1HG GLN 35 2HG GLN 35 15.670 10.350 -0.484
235 2HG GLN 35 1HG GLN 35 16.508 11.902 -0.527
236 1HE2 GLN 35 1HE2 GLN 35 16.505 12.698 1.590
237 2HE2 GLN 35 2HE2 GLN 35 15.148 12.730 2.610
Start of MODEL 4
1 1H GLU 1 1HT GLU 1 7.982 0.178 9.817
2 2H GLU 1 2HT GLU 1 6.985 0.073 8.446
3 3H GLU 1 3HT GLU 1 6.469 -0.580 9.928
4 HA GLU 1 HA GLU 1 6.293 1.600 10.905
5 1HB GLU 1 2HB GLU 1 7.747 2.210 8.349
6 2HB GLU 1 1HB GLU 1 6.781 3.476 9.110
7 1HG GLU 1 2HG GLU 1 8.487 3.869 10.522
8 2HG GLU 1 1HG GLU 1 8.253 2.253 11.190
9 H VAL 2 H VAL 2 4.412 -0.142 9.881
10 HA VAL 2 HA VAL 2 2.708 1.596 8.127
11 HB VAL 2 HB VAL 2 2.651 -1.416 8.494
12 1HG1 VAL 2 1HG1 VAL 2 1.101 0.568 6.924
13 2HG1 VAL 2 2HG1 VAL 2 0.612 -1.010 7.544
14 3HG1 VAL 2 3HG1 VAL 2 1.569 -0.901 6.067
15 1HG2 VAL 2 1HG2 VAL 2 3.719 0.031 6.075
16 2HG2 VAL 2 2HG2 VAL 2 3.987 -1.641 6.568
17 3HG2 VAL 2 3HG2 VAL 2 4.774 -0.327 7.443
18 H THR 3 H THR 3 0.308 1.160 8.504
19 HA THR 3 HA THR 3 -0.577 0.100 11.066
20 HB THR 3 HB THR 3 0.512 2.150 11.832
21 HG1 THR 3 1HG THR 3 -1.155 2.785 12.979
22 1HG2 THR 3 1HG2 THR 3 0.292 3.201 9.483
23 2HG2 THR 3 2HG2 THR 3 0.146 4.276 10.873
24 3HG2 THR 3 3HG2 THR 3 -1.300 3.737 10.021
25 H CYS 4 H CYS 4 -1.794 -0.847 9.096
26 HA CYS 4 HA CYS 4 -4.303 0.705 8.703
27 1HB CYS 4 2HB CYS 4 -4.053 0.186 6.211
28 2HB CYS 4 1HB CYS 4 -2.923 1.384 6.851
29 H GLU 5 H GLU 5 -5.835 -0.787 7.284
30 HA GLU 5 HA GLU 5 -5.885 -3.437 8.592
31 1HB GLU 5 2HB GLU 5 -7.716 -1.529 7.351
32 2HB GLU 5 1HB GLU 5 -8.027 -3.181 6.817
33 1HG GLU 5 2HG GLU 5 -9.298 -2.607 8.878
34 2HG GLU 5 1HG GLU 5 -8.170 -3.938 9.140
35 HA PRO 6 HA PRO 6 -4.218 -5.528 5.101
36 1HB PRO 6 2HB PRO 6 -5.423 -7.971 5.388
37 2HB PRO 6 1HB PRO 6 -4.096 -7.416 6.428
38 1HG PRO 6 2HG PRO 6 -7.024 -7.457 6.959
39 2HG PRO 6 1HG PRO 6 -5.677 -7.817 8.048
40 1HD PRO 6 2HD PRO 6 -7.032 -5.455 8.075
41 2HD PRO 6 1HD PRO 6 -5.325 -5.608 8.558
42 H GLY 7 H GLY 7 -5.094 -4.571 3.243
43 1HA GLY 7 2HA GLY 7 -6.390 -5.261 1.223
44 2HA GLY 7 1HA GLY 7 -7.718 -5.671 2.313
45 H THR 8 H THR 8 -5.618 -2.784 2.163
46 HA THR 8 HA THR 8 -7.980 -1.124 1.442
47 HB THR 8 HB THR 8 -6.292 -0.864 3.947
48 HG1 THR 8 1HG THR 8 -7.876 -1.970 4.721
49 1HG2 THR 8 1HG2 THR 8 -8.430 0.961 2.815
50 2HG2 THR 8 2HG2 THR 8 -6.724 1.353 3.033
51 3HG2 THR 8 3HG2 THR 8 -7.756 1.095 4.440
52 H THR 9 H THR 9 -4.495 -1.347 2.024
53 HA THR 9 HA THR 9 -2.704 -0.004 1.261
54 HB THR 9 HB THR 9 -3.574 -1.395 -0.674
55 HG1 THR 9 1HG THR 9 -1.783 0.389 -0.615
56 1HG2 THR 9 1HG2 THR 9 -5.053 1.179 -1.170
57 2HG2 THR 9 2HG2 THR 9 -5.663 -0.474 -1.221
58 3HG2 THR 9 3HG2 THR 9 -4.615 0.120 -2.510
59 H PHE 10 H PHE 10 -2.425 2.122 -0.356
60 HA PHE 10 HA PHE 10 -4.370 4.189 -0.284
61 1HB PHE 10 2HB PHE 10 -3.274 5.422 1.741
62 2HB PHE 10 1HB PHE 10 -4.411 4.117 2.070
63 HD1 PHE 10 1HD PHE 10 -0.775 4.900 1.748
64 HD2 PHE 10 2HD PHE 10 -3.738 2.172 3.242
65 HE1 PHE 10 1HE PHE 10 0.981 3.680 3.008
66 HE2 PHE 10 2HE PHE 10 -1.984 0.955 4.495
67 HZ PHE 10 HZ PHE 10 0.374 1.705 4.384
68 H LYS 11 H LYS 11 -2.910 6.468 0.078
69 HA LYS 11 HA LYS 11 -0.734 6.152 -1.945
70 1HB LYS 11 2HB LYS 11 -2.906 7.984 -1.445
71 2HB LYS 11 1HB LYS 11 -1.380 8.869 -1.457
72 1HG LYS 11 2HG LYS 11 -1.012 8.468 -3.672
73 2HG LYS 11 1HG LYS 11 -1.682 6.838 -3.591
74 1HD LYS 11 2HD LYS 11 -3.966 8.068 -3.252
75 2HD LYS 11 1HD LYS 11 -3.123 9.456 -3.940
76 1HE LYS 11 2HE LYS 11 -2.769 6.891 -5.403
77 2HE LYS 11 1HE LYS 11 -4.386 7.619 -5.482
78 1HZ LYS 11 1HZ LYS 11 -2.961 8.551 -7.196
79 2HZ LYS 11 2HZ LYS 11 -1.817 9.015 -6.029
80 3HZ LYS 11 3HZ LYS 11 -3.353 9.740 -6.052
81 H ASP 12 H ASP 12 1.261 6.011 -1.004
82 HA ASP 12 HA ASP 12 1.856 7.811 1.325
83 1HB ASP 12 2HB ASP 12 1.839 5.028 1.172
84 2HB ASP 12 1HB ASP 12 3.548 5.442 0.992
85 H LYS 13 H LYS 13 3.832 8.946 1.202
86 HA LYS 13 HA LYS 13 5.458 10.153 -0.049
87 1HB LYS 13 2HB LYS 13 7.303 8.630 -0.597
88 2HB LYS 13 1HB LYS 13 6.554 8.155 0.932
89 1HG LYS 13 2HG LYS 13 5.361 6.365 -0.102
90 2HG LYS 13 1HG LYS 13 5.743 6.962 -1.716
91 1HD LYS 13 2HD LYS 13 8.233 6.651 -0.958
92 2HD LYS 13 1HD LYS 13 7.540 5.579 0.259
93 1HE LYS 13 2HE LYS 13 6.240 4.607 -1.875
94 2HE LYS 13 1HE LYS 13 7.682 5.228 -2.705
95 1HZ LYS 13 1HZ LYS 13 9.033 4.122 -0.965
96 2HZ LYS 13 2HZ LYS 13 8.160 3.028 -1.929
97 3HZ LYS 13 3HZ LYS 13 7.621 3.402 -0.362
98 H CYS 14 H CYS 14 6.830 8.953 -2.435
99 HA CYS 14 HA CYS 14 4.941 9.945 -4.443
100 1HB CYS 14 2HB CYS 14 6.844 9.833 -5.876
101 2HB CYS 14 1HB CYS 14 7.482 10.272 -4.288
102 H ASN 15 H ASN 15 3.975 7.520 -3.156
103 HA ASN 15 HA ASN 15 3.355 5.945 -5.502
104 1HB ASN 15 2HB ASN 15 5.671 5.264 -3.787
105 2HB ASN 15 1HB ASN 15 4.597 3.915 -4.157
106 1HD2 ASN 15 1HD2 ASN 15 7.375 5.187 -5.268
107 2HD2 ASN 15 2HD2 ASN 15 7.197 4.925 -6.944
108 H THR 16 H THR 16 2.727 3.516 -4.311
109 HA THR 16 HA THR 16 0.814 4.314 -2.139
110 HB THR 16 HB THR 16 0.564 2.904 -4.733
111 HG1 THR 16 1HG THR 16 -1.718 3.620 -4.049
112 1HG2 THR 16 1HG2 THR 16 -0.971 1.911 -2.312
113 2HG2 THR 16 2HG2 THR 16 0.258 0.997 -3.186
114 3HG2 THR 16 3HG2 THR 16 -1.254 1.428 -3.985
115 H CYS 17 H CYS 17 0.129 2.321 -0.831
116 HA CYS 17 HA CYS 17 2.299 0.289 -0.614
117 1HB CYS 17 2HB CYS 17 2.135 2.559 0.948
118 2HB CYS 17 1HB CYS 17 1.312 1.354 1.940
119 H ARG 18 H ARG 18 1.062 -1.548 -0.996
120 HA ARG 18 HA ARG 18 -1.718 -1.809 -0.242
121 1HB ARG 18 2HB ARG 18 -0.796 -3.024 -2.113
122 2HB ARG 18 1HB ARG 18 0.456 -3.742 -1.098
123 1HG ARG 18 2HG ARG 18 -1.259 -5.410 -1.419
124 2HG ARG 18 1HG ARG 18 -1.379 -4.840 0.245
125 1HD ARG 18 2HD ARG 18 -3.567 -4.408 -0.185
126 2HD ARG 18 1HD ARG 18 -3.010 -3.086 -1.230
127 HE ARG 18 HE ARG 18 -4.050 -5.617 -2.162
128 1HH1 ARG 18 1HH2 ARG 18 -3.267 -2.675 -3.292
129 2HH1 ARG 18 2HH2 ARG 18 -2.465 -3.190 -4.739
130 1HH2 ARG 18 1HH1 ARG 18 -2.331 -6.523 -3.793
131 2HH2 ARG 18 2HH1 ARG 18 -1.934 -5.370 -5.021
132 H CYS 19 H CYS 19 -2.313 -1.928 1.896
133 HA CYS 19 HA CYS 19 -0.686 -2.582 4.105
134 1HB CYS 19 2HB CYS 19 -3.110 -1.606 3.838
135 2HB CYS 19 1HB CYS 19 -3.609 -3.296 3.962
136 H GLY 20 H GLY 20 0.227 -4.507 4.700
137 1HA GLY 20 2HA GLY 20 -0.119 -6.922 3.229
138 2HA GLY 20 1HA GLY 20 0.642 -6.813 4.820
139 H SER 21 H SER 21 -0.741 -9.039 4.560
140 HA SER 21 HA SER 21 -3.581 -8.818 5.158
141 1HB SER 21 2HB SER 21 -1.773 -10.753 4.314
142 2HB SER 21 1HB SER 21 -2.191 -11.277 5.943
143 HG SER 21 HG SER 21 -4.131 -10.479 4.041
144 H ASP 22 H ASP 22 -0.804 -8.274 6.998
145 HA ASP 22 HA ASP 22 -2.020 -9.185 9.552
146 1HB ASP 22 2HB ASP 22 0.429 -9.507 8.712
147 2HB ASP 22 1HB ASP 22 0.639 -7.814 9.174
148 H GLY 23 H GLY 23 -2.153 -6.480 7.617
149 1HA GLY 23 2HA GLY 23 -3.212 -4.418 8.144
150 2HA GLY 23 1HA GLY 23 -3.086 -4.825 9.857
151 H LYS 24 H LYS 24 -0.101 -5.475 9.165
152 HA LYS 24 HA LYS 24 0.805 -2.646 9.511
153 1HB LYS 24 2HB LYS 24 1.526 -5.300 10.605
154 2HB LYS 24 1HB LYS 24 2.893 -4.241 10.260
155 1HG LYS 24 2HG LYS 24 2.076 -2.535 11.701
156 2HG LYS 24 1HG LYS 24 0.481 -3.282 11.805
157 1HD LYS 24 2HD LYS 24 2.996 -4.644 12.794
158 2HD LYS 24 1HD LYS 24 1.982 -3.639 13.831
159 1HE LYS 24 2HE LYS 24 0.523 -5.689 12.253
160 2HE LYS 24 1HE LYS 24 1.589 -6.318 13.524
161 1HZ LYS 24 1HZ LYS 24 0.322 -4.051 14.543
162 2HZ LYS 24 2HZ LYS 24 0.104 -5.666 15.023
163 3HZ LYS 24 3HZ LYS 24 -0.886 -4.995 13.818
164 H SER 25 H SER 25 3.010 -5.222 8.695
165 HA SER 25 HA SER 25 4.575 -4.116 6.804
166 1HB SER 25 2HB SER 25 3.270 -6.852 6.723
167 2HB SER 25 1HB SER 25 4.682 -6.410 5.764
168 HG SER 25 HG SER 25 5.703 -7.032 7.507
169 H ALA 26 H ALA 26 4.085 -2.829 5.096
170 HA ALA 26 HA ALA 26 1.735 -3.562 3.379
171 1HB ALA 26 1HB ALA 26 2.840 -1.034 4.514
172 2HB ALA 26 2HB ALA 26 1.160 -1.508 4.265
173 3HB ALA 26 3HB ALA 26 2.127 -0.940 2.904
174 H ALA 27 H ALA 27 2.075 -3.525 1.118
175 HA ALA 27 HA ALA 27 4.882 -3.732 0.230
176 1HB ALA 27 1HB ALA 27 2.498 -3.804 -1.580
177 2HB ALA 27 2HB ALA 27 2.685 -5.093 -0.390
178 3HB ALA 27 3HB ALA 27 3.941 -4.817 -1.597
179 H CYS 28 H CYS 28 5.859 -1.730 -0.105
180 HA CYS 28 HA CYS 28 4.224 0.434 -1.315
181 1HB CYS 28 2HB CYS 28 6.529 0.172 0.475
182 2HB CYS 28 1HB CYS 28 6.785 1.388 -0.775
183 H THR 29 H THR 29 4.257 0.458 -3.539
184 HA THR 29 HA THR 29 6.295 -0.843 -5.122
185 HB THR 29 HB THR 29 4.045 -0.571 -5.951
186 HG1 THR 29 1HG THR 29 4.939 -0.279 -7.809
187 1HG2 THR 29 1HG2 THR 29 3.630 2.103 -6.473
188 2HG2 THR 29 2HG2 THR 29 4.424 2.143 -4.899
189 3HG2 THR 29 3HG2 THR 29 2.940 1.217 -5.114
190 H LEU 30 H LEU 30 8.375 -0.007 -4.824
191 HA LEU 30 HA LEU 30 8.811 2.914 -4.750
192 1HB LEU 30 2HB LEU 30 10.822 0.649 -4.769
193 2HB LEU 30 1HB LEU 30 11.038 2.274 -4.115
194 HG LEU 30 HG LEU 30 8.734 1.205 -2.864
195 1HD1 LEU 30 1HD1 LEU 30 10.980 -0.762 -3.216
196 2HD1 LEU 30 2HD1 LEU 30 9.239 -1.043 -3.265
197 3HD1 LEU 30 3HD1 LEU 30 10.044 -0.762 -1.721
198 1HD2 LEU 30 1HD2 LEU 30 10.353 1.234 -0.859
199 2HD2 LEU 30 2HD2 LEU 30 10.130 2.754 -1.725
200 3HD2 LEU 30 3HD2 LEU 30 11.575 1.783 -2.008
201 H LYS 31 H LYS 31 9.046 4.018 -6.646
202 HA LYS 31 HA LYS 31 10.488 2.682 -8.901
203 1HB LYS 31 2HB LYS 31 7.903 2.693 -8.996
204 2HB LYS 31 1HB LYS 31 8.049 4.431 -9.255
205 1HG LYS 31 2HG LYS 31 7.917 3.112 -11.388
206 2HG LYS 31 1HG LYS 31 9.385 4.078 -11.250
207 1HD LYS 31 2HD LYS 31 9.699 1.664 -12.040
208 2HD LYS 31 1HD LYS 31 10.706 2.173 -10.685
209 1HE LYS 31 2HE LYS 31 9.671 -0.066 -10.284
210 2HE LYS 31 1HE LYS 31 9.108 1.131 -9.102
211 1HZ LYS 31 1HZ LYS 31 7.723 0.396 -11.628
212 2HZ LYS 31 2HZ LYS 31 7.200 1.580 -10.528
213 3HZ LYS 31 3HZ LYS 31 7.234 -0.056 -10.068
214 H ALA 32 H ALA 32 9.181 5.771 -7.650
215 HA ALA 32 HA ALA 32 11.638 7.197 -7.777
216 1HB ALA 32 1HB ALA 32 9.888 7.250 -10.247
217 2HB ALA 32 2HB ALA 32 11.604 6.853 -10.147
218 3HB ALA 32 3HB ALA 32 11.068 8.514 -9.905
219 H CYS 33 H CYS 33 11.340 9.417 -7.150
220 HA CYS 33 HA CYS 33 8.497 10.202 -6.604
221 1HB CYS 33 2HB CYS 33 10.898 10.812 -4.859
222 2HB CYS 33 1HB CYS 33 9.194 10.989 -4.442
223 HA PRO 34 HA PRO 34 9.580 13.885 -8.746
224 1HB PRO 34 2HB PRO 34 7.632 15.537 -7.757
225 2HB PRO 34 1HB PRO 34 7.307 14.267 -8.954
226 1HG PRO 34 2HG PRO 34 6.839 14.263 -6.015
227 2HG PRO 34 1HG PRO 34 5.850 13.584 -7.317
228 1HD PRO 34 2HD PRO 34 7.485 12.087 -5.724
229 2HD PRO 34 1HD PRO 34 7.047 11.635 -7.388
230 H GLN 35 H GLN 35 8.251 15.473 -5.915
231 HA GLN 35 HA GLN 35 10.240 17.336 -5.467
232 1HB GLN 35 2HB GLN 35 8.075 16.079 -4.015
233 2HB GLN 35 1HB GLN 35 9.408 16.438 -2.917
234 1HG GLN 35 2HG GLN 35 9.417 18.755 -4.196
235 2HG GLN 35 1HG GLN 35 7.747 18.317 -4.556
236 1HE2 GLN 35 1HE2 GLN 35 9.948 19.289 -1.992
237 2HE2 GLN 35 2HE2 GLN 35 8.771 19.425 -0.777
Start of MODEL 5
1 1H GLU 1 1HT GLU 1 6.176 -1.694 12.103
2 2H GLU 1 2HT GLU 1 4.660 -1.715 11.336
3 3H GLU 1 3HT GLU 1 4.814 -1.081 12.904
4 HA GLU 1 HA GLU 1 5.812 0.859 12.198
5 1HB GLU 1 2HB GLU 1 6.649 0.717 9.641
6 2HB GLU 1 1HB GLU 1 7.660 0.204 10.987
7 1HG GLU 1 2HG GLU 1 7.450 -2.023 10.474
8 2HG GLU 1 1HG GLU 1 5.804 -1.841 9.875
9 H VAL 2 H VAL 2 4.288 -0.888 9.445
10 HA VAL 2 HA VAL 2 2.839 1.381 8.468
11 HB VAL 2 HB VAL 2 2.387 -1.615 8.269
12 1HG1 VAL 2 1HG1 VAL 2 0.813 -1.242 6.591
13 2HG1 VAL 2 2HG1 VAL 2 1.401 0.387 6.260
14 3HG1 VAL 2 3HG1 VAL 2 0.443 0.073 7.707
15 1HG2 VAL 2 1HG2 VAL 2 4.143 -1.570 6.860
16 2HG2 VAL 2 2HG2 VAL 2 4.357 0.151 7.179
17 3HG2 VAL 2 3HG2 VAL 2 3.311 -0.379 5.861
18 H THR 3 H THR 3 0.571 1.887 8.739
19 HA THR 3 HA THR 3 -0.775 0.571 11.070
20 HB THR 3 HB THR 3 0.409 2.738 11.624
21 HG1 THR 3 1HG THR 3 -2.134 3.526 12.008
22 1HG2 THR 3 1HG2 THR 3 -1.636 4.429 10.446
23 2HG2 THR 3 2HG2 THR 3 -0.748 3.548 9.202
24 3HG2 THR 3 3HG2 THR 3 0.120 4.570 10.347
25 H CYS 4 H CYS 4 -1.693 -0.396 8.859
26 HA CYS 4 HA CYS 4 -4.153 1.182 8.211
27 1HB CYS 4 2HB CYS 4 -3.769 0.409 5.824
28 2HB CYS 4 1HB CYS 4 -2.565 1.556 6.421
29 H GLU 5 H GLU 5 -5.555 -0.472 6.708
30 HA GLU 5 HA GLU 5 -5.886 -2.906 8.382
31 1HB GLU 5 2HB GLU 5 -7.705 -1.198 7.726
32 2HB GLU 5 1HB GLU 5 -7.626 -1.916 6.115
33 1HG GLU 5 2HG GLU 5 -8.294 -4.057 6.930
34 2HG GLU 5 1HG GLU 5 -8.041 -3.576 8.608
35 HA PRO 6 HA PRO 6 -3.977 -5.411 5.303
36 1HB PRO 6 2HB PRO 6 -5.052 -7.825 6.037
37 2HB PRO 6 1HB PRO 6 -3.747 -7.029 6.937
38 1HG PRO 6 2HG PRO 6 -6.667 -7.102 7.513
39 2HG PRO 6 1HG PRO 6 -5.296 -7.222 8.626
40 1HD PRO 6 2HD PRO 6 -6.730 -4.941 8.297
41 2HD PRO 6 1HD PRO 6 -5.001 -4.943 8.720
42 H GLY 7 H GLY 7 -4.794 -5.051 3.265
43 1HA GLY 7 2HA GLY 7 -6.083 -5.986 1.411
44 2HA GLY 7 1HA GLY 7 -7.366 -6.387 2.560
45 H THR 8 H THR 8 -5.565 -3.353 2.072
46 HA THR 8 HA THR 8 -8.031 -2.020 1.099
47 HB THR 8 HB THR 8 -6.590 -0.959 3.526
48 HG1 THR 8 1HG THR 8 -8.925 -2.490 3.730
49 1HG2 THR 8 1HG2 THR 8 -9.020 -0.352 1.981
50 2HG2 THR 8 2HG2 THR 8 -8.066 0.691 3.036
51 3HG2 THR 8 3HG2 THR 8 -9.271 -0.397 3.725
52 H THR 9 H THR 9 -4.559 -1.951 1.674
53 HA THR 9 HA THR 9 -2.863 -0.522 0.891
54 HB THR 9 HB THR 9 -3.840 -1.777 -1.114
55 HG1 THR 9 1HG THR 9 -2.804 -0.173 -2.582
56 1HG2 THR 9 1HG2 THR 9 -5.279 0.856 -1.340
57 2HG2 THR 9 2HG2 THR 9 -5.912 -0.775 -1.553
58 3HG2 THR 9 3HG2 THR 9 -4.872 -0.064 -2.786
59 H PHE 10 H PHE 10 -2.575 1.753 -0.325
60 HA PHE 10 HA PHE 10 -4.604 3.757 -0.106
61 1HB PHE 10 2HB PHE 10 -3.732 4.782 2.054
62 2HB PHE 10 1HB PHE 10 -4.583 3.252 2.255
63 HD1 PHE 10 1HD PHE 10 -1.286 4.904 2.246
64 HD2 PHE 10 2HD PHE 10 -3.392 1.211 2.858
65 HE1 PHE 10 1HE PHE 10 0.740 3.919 3.285
66 HE2 PHE 10 2HE PHE 10 -1.366 0.227 3.891
67 HZ PHE 10 HZ PHE 10 0.698 1.581 4.108
68 H LYS 11 H LYS 11 -3.141 5.987 0.627
69 HA LYS 11 HA LYS 11 -0.890 5.952 -1.354
70 1HB LYS 11 2HB LYS 11 -3.194 7.613 -0.882
71 2HB LYS 11 1HB LYS 11 -1.735 8.585 -0.682
72 1HG LYS 11 2HG LYS 11 -1.105 8.346 -2.881
73 2HG LYS 11 1HG LYS 11 -1.817 6.737 -3.019
74 1HD LYS 11 2HD LYS 11 -3.278 8.035 -4.311
75 2HD LYS 11 1HD LYS 11 -4.092 7.999 -2.747
76 1HE LYS 11 2HE LYS 11 -4.081 10.305 -3.508
77 2HE LYS 11 1HE LYS 11 -2.890 10.182 -2.198
78 1HZ LYS 11 1HZ LYS 11 -1.935 9.502 -4.855
79 2HZ LYS 11 2HZ LYS 11 -1.166 10.371 -3.615
80 3HZ LYS 11 3HZ LYS 11 -2.302 11.141 -4.617
81 H ASP 12 H ASP 12 1.003 7.289 -0.795
82 HA ASP 12 HA ASP 12 1.272 8.126 2.037
83 1HB ASP 12 2HB ASP 12 1.850 5.594 1.489
84 2HB ASP 12 1HB ASP 12 3.359 6.301 0.901
85 H LYS 13 H LYS 13 2.930 7.677 -1.082
86 HA LYS 13 HA LYS 13 4.071 10.423 -0.800
87 1HB LYS 13 2HB LYS 13 5.653 7.981 -1.655
88 2HB LYS 13 1HB LYS 13 6.281 9.591 -1.291
89 1HG LYS 13 2HG LYS 13 5.078 9.131 1.044
90 2HG LYS 13 1HG LYS 13 5.350 7.453 0.574
91 1HD LYS 13 2HD LYS 13 7.720 7.813 0.363
92 2HD LYS 13 1HD LYS 13 7.528 9.556 0.550
93 1HE LYS 13 2HE LYS 13 6.626 9.159 2.863
94 2HE LYS 13 1HE LYS 13 7.017 7.439 2.667
95 1HZ LYS 13 1HZ LYS 13 9.021 8.099 3.434
96 2HZ LYS 13 2HZ LYS 13 8.801 9.717 2.964
97 3HZ LYS 13 3HZ LYS 13 9.274 8.555 1.819
98 H CYS 14 H CYS 14 5.757 9.543 -3.254
99 HA CYS 14 HA CYS 14 3.881 10.463 -5.261
100 1HB CYS 14 2HB CYS 14 5.812 10.747 -6.464
101 2HB CYS 14 1HB CYS 14 6.590 10.444 -4.914
102 H ASN 15 H ASN 15 4.399 7.440 -3.834
103 HA ASN 15 HA ASN 15 3.131 6.043 -6.172
104 1HB ASN 15 2HB ASN 15 5.403 5.368 -4.336
105 2HB ASN 15 1HB ASN 15 4.427 4.055 -4.995
106 1HD2 ASN 15 1HD2 ASN 15 3.852 4.981 -7.571
107 2HD2 ASN 15 2HD2 ASN 15 5.299 5.176 -8.452
108 H THR 16 H THR 16 2.514 3.672 -4.985
109 HA THR 16 HA THR 16 0.649 4.445 -2.766
110 HB THR 16 HB THR 16 0.465 2.685 -5.201
111 HG1 THR 16 1HG THR 16 -0.519 4.562 -5.513
112 1HG2 THR 16 1HG2 THR 16 -0.139 1.234 -3.288
113 2HG2 THR 16 2HG2 THR 16 -1.543 1.610 -4.286
114 3HG2 THR 16 3HG2 THR 16 -1.305 2.445 -2.751
115 H CYS 17 H CYS 17 0.045 2.456 -1.412
116 HA CYS 17 HA CYS 17 2.223 0.452 -1.183
117 1HB CYS 17 2HB CYS 17 2.154 2.835 0.271
118 2HB CYS 17 1HB CYS 17 1.510 1.630 1.386
119 H ARG 18 H ARG 18 0.995 -1.394 -1.268
120 HA ARG 18 HA ARG 18 -1.744 -1.573 -0.385
121 1HB ARG 18 2HB ARG 18 0.346 -3.182 -1.636
122 2HB ARG 18 1HB ARG 18 -0.646 -4.137 -0.532
123 1HG ARG 18 2HG ARG 18 -2.140 -2.272 -2.277
124 2HG ARG 18 1HG ARG 18 -1.347 -3.611 -3.107
125 1HD ARG 18 2HD ARG 18 -2.755 -4.369 -0.617
126 2HD ARG 18 1HD ARG 18 -3.803 -3.823 -1.943
127 HE ARG 18 HE ARG 18 -1.766 -5.593 -2.950
128 1HH1 ARG 18 1HH1 ARG 18 -5.003 -5.321 -2.879
129 2HH1 ARG 18 2HH1 ARG 18 -5.366 -6.985 -2.569
130 1HH2 ARG 18 1HH2 ARG 18 -2.091 -7.831 -1.801
131 2HH2 ARG 18 2HH2 ARG 18 -3.716 -8.407 -1.958
132 H CYS 19 H CYS 19 -2.550 -2.311 1.583
133 HA CYS 19 HA CYS 19 -0.708 -2.377 3.864
134 1HB CYS 19 2HB CYS 19 -3.094 -1.420 3.708
135 2HB CYS 19 1HB CYS 19 -3.648 -3.095 3.802
136 H GLY 20 H GLY 20 0.472 -4.221 4.186
137 1HA GLY 20 2HA GLY 20 0.005 -6.766 3.110
138 2HA GLY 20 1HA GLY 20 0.915 -6.491 4.599
139 H SER 21 H SER 21 -0.713 -8.758 4.268
140 HA SER 21 HA SER 21 -3.343 -8.401 5.437
141 1HB SER 21 2HB SER 21 -1.592 -10.490 4.417
142 2HB SER 21 1HB SER 21 -2.448 -11.023 5.861
143 HG SER 21 HG SER 21 -3.611 -9.828 3.557
144 H ASP 22 H ASP 22 -0.273 -8.121 6.761
145 HA ASP 22 HA ASP 22 -0.932 -9.284 9.399
146 1HB ASP 22 2HB ASP 22 1.350 -8.990 7.894
147 2HB ASP 22 1HB ASP 22 1.497 -7.643 9.026
148 H GLY 23 H GLY 23 -1.686 -6.463 7.824
149 1HA GLY 23 2HA GLY 23 -2.659 -4.497 8.693
150 2HA GLY 23 1HA GLY 23 -2.337 -5.114 10.314
151 H LYS 24 H LYS 24 0.256 -5.294 10.641
152 HA LYS 24 HA LYS 24 1.219 -2.515 10.332
153 1HB LYS 24 2HB LYS 24 2.599 -4.859 11.654
154 2HB LYS 24 1HB LYS 24 2.762 -3.145 12.036
155 1HG LYS 24 2HG LYS 24 0.365 -4.924 12.537
156 2HG LYS 24 1HG LYS 24 1.356 -4.092 13.736
157 1HD LYS 24 2HD LYS 24 0.502 -2.063 12.010
158 2HD LYS 24 1HD LYS 24 -0.915 -3.092 12.218
159 1HE LYS 24 2HE LYS 24 -0.329 -3.013 14.759
160 2HE LYS 24 1HE LYS 24 0.645 -1.595 14.322
161 1HZ LYS 24 1HZ LYS 24 -2.249 -2.024 13.833
162 2HZ LYS 24 2HZ LYS 24 -1.356 -0.796 13.070
163 3HZ LYS 24 3HZ LYS 24 -1.527 -0.800 14.760
164 H SER 25 H SER 25 1.177 -3.567 7.818
165 HA SER 25 HA SER 25 4.005 -3.586 7.074
166 1HB SER 25 2HB SER 25 2.284 -6.064 6.723
167 2HB SER 25 1HB SER 25 3.926 -5.867 6.107
168 HG SER 25 HG SER 25 4.665 -5.732 8.207
169 H ALA 26 H ALA 26 4.240 -3.225 4.782
170 HA ALA 26 HA ALA 26 1.907 -3.391 3.019
171 1HB ALA 26 1HB ALA 26 2.069 -1.190 4.635
172 2HB ALA 26 2HB ALA 26 1.272 -1.196 3.062
173 3HB ALA 26 3HB ALA 26 2.934 -0.624 3.207
174 H ALA 27 H ALA 27 2.488 -3.084 0.816
175 HA ALA 27 HA ALA 27 5.440 -2.964 0.304
176 1HB ALA 27 1HB ALA 27 4.282 -3.929 -1.965
177 2HB ALA 27 2HB ALA 27 3.112 -4.460 -0.757
178 3HB ALA 27 3HB ALA 27 4.800 -4.957 -0.630
179 H CYS 28 H CYS 28 6.136 -1.132 -0.764
180 HA CYS 28 HA CYS 28 4.064 0.631 -1.950
181 1HB CYS 28 2HB CYS 28 6.734 0.885 -0.703
182 2HB CYS 28 1HB CYS 28 6.453 1.976 -2.060
183 H THR 29 H THR 29 3.911 0.901 -4.163
184 HA THR 29 HA THR 29 4.975 -0.777 -6.090
185 HB THR 29 HB THR 29 4.399 0.961 -7.667
186 HG1 THR 29 1HG THR 29 4.051 3.125 -6.731
187 1HG2 THR 29 1HG2 THR 29 2.528 1.943 -5.662
188 2HG2 THR 29 2HG2 THR 29 2.712 0.191 -5.586
189 3HG2 THR 29 3HG2 THR 29 2.221 0.961 -7.094
190 H LEU 30 H LEU 30 6.590 1.865 -4.449
191 HA LEU 30 HA LEU 30 8.796 2.696 -4.617
192 1HB LEU 30 2HB LEU 30 8.791 -0.275 -4.911
193 2HB LEU 30 1HB LEU 30 10.318 0.560 -5.206
194 HG LEU 30 HG LEU 30 8.743 1.307 -2.773
195 1HD1 LEU 30 1HD1 LEU 30 9.589 -1.376 -3.332
196 2HD1 LEU 30 2HD1 LEU 30 8.862 -0.744 -1.856
197 3HD1 LEU 30 3HD1 LEU 30 10.614 -0.719 -2.056
198 1HD2 LEU 30 1HD2 LEU 30 11.074 2.191 -3.777
199 2HD2 LEU 30 2HD2 LEU 30 11.687 0.831 -2.838
200 3HD2 LEU 30 3HD2 LEU 30 10.775 2.114 -2.041
201 H LYS 31 H LYS 31 7.980 3.848 -6.683
202 HA LYS 31 HA LYS 31 9.134 2.680 -9.174
203 1HB LYS 31 2HB LYS 31 6.736 3.846 -8.630
204 2HB LYS 31 1HB LYS 31 7.649 5.250 -9.185
205 1HG LYS 31 2HG LYS 31 7.043 4.530 -11.259
206 2HG LYS 31 1HG LYS 31 8.378 3.395 -11.050
207 1HD LYS 31 2HD LYS 31 5.454 2.885 -10.438
208 2HD LYS 31 1HD LYS 31 6.409 2.144 -11.723
209 1HE LYS 31 2HE LYS 31 7.888 1.108 -10.008
210 2HE LYS 31 1HE LYS 31 6.862 1.803 -8.736
211 1HZ LYS 31 1HZ LYS 31 6.182 -0.469 -9.347
212 2HZ LYS 31 2HZ LYS 31 5.887 0.057 -10.934
213 3HZ LYS 31 3HZ LYS 31 4.962 0.670 -9.648
214 H ALA 32 H ALA 32 9.233 5.644 -7.176
215 HA ALA 32 HA ALA 32 12.014 6.131 -7.688
216 1HB ALA 32 1HB ALA 32 11.825 6.931 -9.796
217 2HB ALA 32 2HB ALA 32 11.000 8.323 -9.098
218 3HB ALA 32 3HB ALA 32 10.065 6.951 -9.692
219 H CYS 33 H CYS 33 9.274 8.410 -7.705
220 HA CYS 33 HA CYS 33 8.690 10.118 -6.177
221 1HB CYS 33 2HB CYS 33 10.057 8.144 -4.314
222 2HB CYS 33 1HB CYS 33 9.021 9.476 -3.793
223 HA PRO 34 HA PRO 34 12.303 12.610 -5.915
224 1HB PRO 34 2HB PRO 34 11.341 14.619 -4.329
225 2HB PRO 34 1HB PRO 34 10.874 14.425 -6.030
226 1HG PRO 34 2HG PRO 34 9.386 13.695 -3.565
227 2HG PRO 34 1HG PRO 34 8.784 14.327 -5.104
228 1HD PRO 34 2HD PRO 34 8.639 11.690 -4.351
229 2HD PRO 34 1HD PRO 34 8.627 12.255 -6.037
230 H GLN 35 H GLN 35 12.606 10.439 -4.238
231 HA GLN 35 HA GLN 35 13.556 9.729 -2.186
232 1HB GLN 35 2HB GLN 35 14.657 12.553 -2.369
233 2HB GLN 35 1HB GLN 35 15.403 11.190 -1.535
234 1HG GLN 35 2HG GLN 35 16.039 10.150 -3.507
235 2HG GLN 35 1HG GLN 35 14.738 10.890 -4.439
236 1HE2 GLN 35 1HE2 GLN 35 17.991 10.945 -4.309
237 2HE2 GLN 35 2HE2 GLN 35 18.295 12.570 -4.695
Start of MODEL 6
1 1H GLU 1 1HT GLU 1 3.655 0.690 13.279
2 2H GLU 1 2HT GLU 1 4.974 -0.046 12.500
3 3H GLU 1 3HT GLU 1 3.394 -0.607 12.219
4 HA GLU 1 HA GLU 1 3.604 2.180 11.630
5 1HB GLU 1 2HB GLU 1 5.481 0.181 10.329
6 2HB GLU 1 1HB GLU 1 5.131 1.773 9.653
7 1HG GLU 1 2HG GLU 1 6.174 2.900 11.431
8 2HG GLU 1 1HG GLU 1 6.064 1.504 12.503
9 H VAL 2 H VAL 2 3.245 2.055 8.934
10 HA VAL 2 HA VAL 2 1.575 1.561 7.333
11 HB VAL 2 HB VAL 2 2.029 -1.167 8.580
12 1HG1 VAL 2 1HG1 VAL 2 0.253 -1.576 7.167
13 2HG1 VAL 2 2HG1 VAL 2 1.562 -1.659 5.987
14 3HG1 VAL 2 3HG1 VAL 2 0.611 -0.182 6.146
15 1HG2 VAL 2 1HG2 VAL 2 3.830 -1.412 7.035
16 2HG2 VAL 2 2HG2 VAL 2 4.053 0.173 7.775
17 3HG2 VAL 2 3HG2 VAL 2 3.365 0.046 6.156
18 H THR 3 H THR 3 0.700 2.336 10.054
19 HA THR 3 HA THR 3 -1.410 0.860 11.152
20 HB THR 3 HB THR 3 -1.222 3.851 10.654
21 HG1 THR 3 1HG THR 3 0.256 3.803 12.122
22 1HG2 THR 3 1HG2 THR 3 -2.775 4.139 12.418
23 2HG2 THR 3 2HG2 THR 3 -2.624 2.460 12.934
24 3HG2 THR 3 3HG2 THR 3 -3.461 2.848 11.431
25 H CYS 4 H CYS 4 -2.523 -0.262 9.414
26 HA CYS 4 HA CYS 4 -4.748 1.246 8.255
27 1HB CYS 4 2HB CYS 4 -3.396 1.918 6.523
28 2HB CYS 4 1HB CYS 4 -2.225 0.634 6.814
29 H GLU 5 H GLU 5 -6.094 -0.301 6.837
30 HA GLU 5 HA GLU 5 -6.242 -2.929 8.171
31 1HB GLU 5 2HB GLU 5 -7.941 -1.689 5.982
32 2HB GLU 5 1HB GLU 5 -8.398 -3.023 7.043
33 1HG GLU 5 2HG GLU 5 -8.203 -1.517 9.001
34 2HG GLU 5 1HG GLU 5 -7.796 -0.183 7.922
35 HA PRO 6 HA PRO 6 -3.965 -4.930 4.953
36 1HB PRO 6 2HB PRO 6 -4.744 -7.501 5.512
37 2HB PRO 6 1HB PRO 6 -3.541 -6.617 6.473
38 1HG PRO 6 2HG PRO 6 -6.442 -7.053 7.015
39 2HG PRO 6 1HG PRO 6 -5.063 -7.123 8.127
40 1HD PRO 6 2HD PRO 6 -6.704 -4.982 7.999
41 2HD PRO 6 1HD PRO 6 -4.970 -4.831 8.370
42 H GLY 7 H GLY 7 -4.566 -5.031 2.837
43 1HA GLY 7 2HA GLY 7 -5.808 -6.001 1.003
44 2HA GLY 7 1HA GLY 7 -7.133 -6.343 2.121
45 H THR 8 H THR 8 -5.483 -3.227 1.957
46 HA THR 8 HA THR 8 -7.764 -2.048 0.454
47 HB THR 8 HB THR 8 -6.956 -1.217 3.256
48 HG1 THR 8 1HG THR 8 -8.341 -2.646 3.863
49 1HG2 THR 8 1HG2 THR 8 -8.186 0.636 2.917
50 2HG2 THR 8 2HG2 THR 8 -9.538 -0.319 2.311
51 3HG2 THR 8 3HG2 THR 8 -8.265 0.204 1.209
52 H THR 9 H THR 9 -4.442 -2.053 1.158
53 HA THR 9 HA THR 9 -2.693 -0.507 0.784
54 HB THR 9 HB THR 9 -3.453 -1.355 -1.433
55 HG1 THR 9 1HG THR 9 -2.579 0.459 -2.609
56 1HG2 THR 9 1HG2 THR 9 -5.190 1.114 -1.300
57 2HG2 THR 9 2HG2 THR 9 -5.695 -0.553 -1.574
58 3HG2 THR 9 3HG2 THR 9 -4.796 0.310 -2.820
59 H PHE 10 H PHE 10 -2.471 1.958 -0.250
60 HA PHE 10 HA PHE 10 -4.409 3.936 0.328
61 1HB PHE 10 2HB PHE 10 -3.453 4.648 2.603
62 2HB PHE 10 1HB PHE 10 -4.430 3.183 2.602
63 HD1 PHE 10 1HD PHE 10 -0.966 4.503 2.675
64 HD2 PHE 10 2HD PHE 10 -3.462 1.032 3.088
65 HE1 PHE 10 1HE PHE 10 0.951 3.234 3.604
66 HE2 PHE 10 2HE PHE 10 -1.544 -0.237 4.016
67 HZ PHE 10 HZ PHE 10 0.662 0.865 4.273
68 H LYS 11 H LYS 11 -3.180 6.139 0.920
69 HA LYS 11 HA LYS 11 -0.957 6.367 -0.996
70 1HB LYS 11 2HB LYS 11 -2.406 8.356 0.782
71 2HB LYS 11 1HB LYS 11 -1.294 8.779 -0.518
72 1HG LYS 11 2HG LYS 11 -3.811 7.142 -0.916
73 2HG LYS 11 1HG LYS 11 -3.710 8.880 -1.198
74 1HD LYS 11 2HD LYS 11 -1.562 7.342 -2.493
75 2HD LYS 11 1HD LYS 11 -3.177 6.955 -3.089
76 1HE LYS 11 2HE LYS 11 -2.402 9.842 -2.746
77 2HE LYS 11 1HE LYS 11 -1.865 8.953 -4.186
78 1HZ LYS 11 1HZ LYS 11 -4.608 8.460 -3.429
79 2HZ LYS 11 2HZ LYS 11 -3.946 8.777 -4.961
80 3HZ LYS 11 3HZ LYS 11 -4.309 10.059 -3.908
81 H ASP 12 H ASP 12 1.193 6.809 -0.426
82 HA ASP 12 HA ASP 12 1.824 7.192 2.465
83 1HB ASP 12 2HB ASP 12 1.908 4.775 1.823
84 2HB ASP 12 1HB ASP 12 3.131 5.178 0.613
85 H LYS 13 H LYS 13 3.269 6.975 -0.800
86 HA LYS 13 HA LYS 13 4.833 9.448 -0.160
87 1HB LYS 13 2HB LYS 13 5.913 7.020 -1.619
88 2HB LYS 13 1HB LYS 13 6.828 8.401 -1.003
89 1HG LYS 13 2HG LYS 13 5.731 7.661 1.302
90 2HG LYS 13 1HG LYS 13 5.639 6.097 0.491
91 1HD LYS 13 2HD LYS 13 8.218 7.592 0.309
92 2HD LYS 13 1HD LYS 13 7.817 6.840 1.854
93 1HE LYS 13 2HE LYS 13 7.567 4.659 0.795
94 2HE LYS 13 1HE LYS 13 7.802 5.378 -0.810
95 1HZ LYS 13 1HZ LYS 13 9.920 4.651 -0.201
96 2HZ LYS 13 2HZ LYS 13 9.745 5.162 1.410
97 3HZ LYS 13 3HZ LYS 13 9.947 6.305 0.170
98 H CYS 14 H CYS 14 6.213 8.969 -2.820
99 HA CYS 14 HA CYS 14 4.460 10.549 -4.462
100 1HB CYS 14 2HB CYS 14 6.275 10.458 -5.989
101 2HB CYS 14 1HB CYS 14 7.034 10.301 -4.403
102 H ASN 15 H ASN 15 4.354 7.233 -3.763
103 HA ASN 15 HA ASN 15 2.821 6.727 -6.293
104 1HB ASN 15 2HB ASN 15 5.095 5.357 -5.016
105 2HB ASN 15 1HB ASN 15 3.784 4.276 -5.488
106 1HD2 ASN 15 1HD2 ASN 15 4.904 7.305 -7.081
107 2HD2 ASN 15 2HD2 ASN 15 5.257 6.562 -8.575
108 H THR 16 H THR 16 3.267 4.410 -3.703
109 HA THR 16 HA THR 16 0.897 4.986 -2.180
110 HB THR 16 HB THR 16 0.702 3.440 -4.732
111 HG1 THR 16 1HG THR 16 -0.362 5.302 -4.769
112 1HG2 THR 16 1HG2 THR 16 -1.180 2.116 -3.965
113 2HG2 THR 16 2HG2 THR 16 -1.067 2.819 -2.352
114 3HG2 THR 16 3HG2 THR 16 0.210 1.756 -2.942
115 H CYS 17 H CYS 17 0.194 2.857 -0.977
116 HA CYS 17 HA CYS 17 2.428 0.907 -0.746
117 1HB CYS 17 2HB CYS 17 2.262 3.141 0.844
118 2HB CYS 17 1HB CYS 17 1.399 1.944 1.813
119 H ARG 18 H ARG 18 1.247 -0.937 -1.161
120 HA ARG 18 HA ARG 18 -1.515 -1.353 -0.514
121 1HB ARG 18 2HB ARG 18 -0.424 -2.656 -2.209
122 2HB ARG 18 1HB ARG 18 0.848 -3.159 -1.094
123 1HG ARG 18 2HG ARG 18 -0.662 -5.015 -1.288
124 2HG ARG 18 1HG ARG 18 -0.964 -4.282 0.289
125 1HD ARG 18 2HD ARG 18 -2.984 -3.281 -0.427
126 2HD ARG 18 1HD ARG 18 -2.561 -3.451 -2.142
127 HE ARG 18 HE ARG 18 -3.800 -5.499 -0.537
128 1HH1 ARG 18 1HH1 ARG 18 -1.265 -6.890 -0.948
129 2HH1 ARG 18 2HH1 ARG 18 -1.445 -7.605 -2.516
130 1HH2 ARG 18 1HH2 ARG 18 -4.101 -5.576 -3.433
131 2HH2 ARG 18 2HH2 ARG 18 -3.048 -6.862 -3.921
132 H CYS 19 H CYS 19 -2.469 -2.288 1.284
133 HA CYS 19 HA CYS 19 -0.927 -2.254 3.773
134 1HB CYS 19 2HB CYS 19 -3.470 -1.674 3.042
135 2HB CYS 19 1HB CYS 19 -3.695 -3.323 3.632
136 H GLY 20 H GLY 20 0.362 -4.012 4.185
137 1HA GLY 20 2HA GLY 20 0.346 -6.529 3.049
138 2HA GLY 20 1HA GLY 20 0.846 -6.258 4.722
139 H SER 21 H SER 21 -0.366 -8.651 4.101
140 HA SER 21 HA SER 21 -3.253 -8.483 4.670
141 1HB SER 21 2HB SER 21 -1.350 -10.324 3.549
142 2HB SER 21 1HB SER 21 -2.218 -11.131 4.852
143 HG SER 21 HG SER 21 -4.084 -10.847 3.802
144 H ASP 22 H ASP 22 -0.360 -8.612 6.502
145 HA ASP 22 HA ASP 22 -1.726 -9.883 8.834
146 1HB ASP 22 2HB ASP 22 0.467 -10.745 8.125
147 2HB ASP 22 1HB ASP 22 1.164 -9.127 8.279
148 H GLY 23 H GLY 23 -1.478 -6.858 7.584
149 1HA GLY 23 2HA GLY 23 -1.822 -4.740 8.541
150 2HA GLY 23 1HA GLY 23 -2.125 -5.563 10.076
151 H LYS 24 H LYS 24 -0.614 -3.149 9.853
152 HA LYS 24 HA LYS 24 1.396 -2.252 10.714
153 1HB LYS 24 2HB LYS 24 2.029 -5.101 11.510
154 2HB LYS 24 1HB LYS 24 2.474 -3.613 12.345
155 1HG LYS 24 2HG LYS 24 -0.285 -4.841 12.112
156 2HG LYS 24 1HG LYS 24 0.653 -4.574 13.582
157 1HD LYS 24 2HD LYS 24 -0.204 -2.300 11.782
158 2HD LYS 24 1HD LYS 24 -1.203 -2.877 13.114
159 1HE LYS 24 2HE LYS 24 1.660 -1.887 13.384
160 2HE LYS 24 1HE LYS 24 0.206 -0.986 13.860
161 1HZ LYS 24 1HZ LYS 24 1.411 -3.342 15.089
162 2HZ LYS 24 2HZ LYS 24 -0.287 -3.305 15.030
163 3HZ LYS 24 3HZ LYS 24 0.567 -2.059 15.808
164 H SER 25 H SER 25 1.192 -3.822 7.999
165 HA SER 25 HA SER 25 4.060 -3.527 7.346
166 1HB SER 25 2HB SER 25 2.535 -6.147 7.195
167 2HB SER 25 1HB SER 25 4.124 -5.883 6.473
168 HG SER 25 HG SER 25 4.189 -6.805 8.605
169 H ALA 26 H ALA 26 4.174 -2.671 5.299
170 HA ALA 26 HA ALA 26 1.806 -3.050 3.491
171 1HB ALA 26 1HB ALA 26 3.671 -0.715 3.988
172 2HB ALA 26 2HB ALA 26 1.934 -0.783 4.290
173 3HB ALA 26 3HB ALA 26 2.543 -0.765 2.633
174 H ALA 27 H ALA 27 2.727 -2.229 1.130
175 HA ALA 27 HA ALA 27 5.158 -3.908 0.599
176 1HB ALA 27 1HB ALA 27 4.076 -4.527 -1.461
177 2HB ALA 27 2HB ALA 27 2.845 -3.283 -1.251
178 3HB ALA 27 3HB ALA 27 2.867 -4.689 -0.188
179 H CYS 28 H CYS 28 3.254 -1.202 -0.721
180 HA CYS 28 HA CYS 28 3.948 0.799 -1.752
181 1HB CYS 28 2HB CYS 28 6.056 -0.030 0.123
182 2HB CYS 28 1HB CYS 28 6.639 1.022 -1.168
183 H THR 29 H THR 29 3.999 0.622 -3.957
184 HA THR 29 HA THR 29 5.461 -1.331 -5.437
185 HB THR 29 HB THR 29 3.451 0.186 -6.044
186 HG1 THR 29 1HG THR 29 3.892 -0.158 -8.140
187 1HG2 THR 29 1HG2 THR 29 5.633 2.023 -7.033
188 2HG2 THR 29 2HG2 THR 29 4.827 2.281 -5.485
189 3HG2 THR 29 3HG2 THR 29 3.896 2.320 -6.982
190 H LEU 30 H LEU 30 6.428 1.724 -4.071
191 HA LEU 30 HA LEU 30 8.443 2.961 -4.248
192 1HB LEU 30 2HB LEU 30 9.172 0.030 -4.342
193 2HB LEU 30 1HB LEU 30 10.410 1.284 -4.262
194 HG LEU 30 HG LEU 30 8.161 0.863 -2.271
195 1HD1 LEU 30 1HD1 LEU 30 10.217 0.537 -0.748
196 2HD1 LEU 30 2HD1 LEU 30 11.138 0.348 -2.240
197 3HD1 LEU 30 3HD1 LEU 30 9.832 -0.774 -1.862
198 1HD2 LEU 30 1HD2 LEU 30 8.460 3.043 -1.768
199 2HD2 LEU 30 2HD2 LEU 30 9.794 3.176 -2.913
200 3HD2 LEU 30 3HD2 LEU 30 10.101 2.635 -1.263
201 H LYS 31 H LYS 31 7.603 3.666 -6.507
202 HA LYS 31 HA LYS 31 9.347 2.536 -8.668
203 1HB LYS 31 2HB LYS 31 6.592 2.892 -8.486
204 2HB LYS 31 1HB LYS 31 7.119 4.269 -9.453
205 1HG LYS 31 2HG LYS 31 6.633 2.383 -10.927
206 2HG LYS 31 1HG LYS 31 8.366 2.708 -10.942
207 1HD LYS 31 2HD LYS 31 8.131 0.333 -10.724
208 2HD LYS 31 1HD LYS 31 8.592 0.928 -9.131
209 1HE LYS 31 2HE LYS 31 6.644 0.217 -8.212
210 2HE LYS 31 1HE LYS 31 5.686 0.936 -9.522
211 1HZ LYS 31 1HZ LYS 31 6.175 -0.889 -10.936
212 2HZ LYS 31 2HZ LYS 31 5.657 -1.553 -9.460
213 3HZ LYS 31 3HZ LYS 31 7.310 -1.525 -9.850
214 H ALA 32 H ALA 32 10.638 4.289 -7.019
215 HA ALA 32 HA ALA 32 11.952 6.248 -7.147
216 1HB ALA 32 1HB ALA 32 12.593 6.367 -9.306
217 2HB ALA 32 2HB ALA 32 11.122 7.269 -9.673
218 3HB ALA 32 3HB ALA 32 11.132 5.509 -9.798
219 H CYS 33 H CYS 33 11.681 8.512 -6.795
220 HA CYS 33 HA CYS 33 8.901 9.595 -7.002
221 1HB CYS 33 2HB CYS 33 10.717 9.535 -4.567
222 2HB CYS 33 1HB CYS 33 9.209 10.450 -4.656
223 HA PRO 34 HA PRO 34 10.958 13.268 -8.267
224 1HB PRO 34 2HB PRO 34 9.370 15.220 -7.186
225 2HB PRO 34 1HB PRO 34 8.876 14.228 -8.574
226 1HG PRO 34 2HG PRO 34 8.123 13.976 -5.707
227 2HG PRO 34 1HG PRO 34 7.138 13.738 -7.158
228 1HD PRO 34 2HD PRO 34 8.190 11.688 -5.697
229 2HD PRO 34 1HD PRO 34 7.835 11.577 -7.436
230 H GLN 35 H GLN 35 9.772 14.836 -5.371
231 HA GLN 35 HA GLN 35 10.909 15.691 -3.482
232 1HB GLN 35 2HB GLN 35 11.551 13.061 -3.746
233 2HB GLN 35 1HB GLN 35 13.155 13.787 -3.863
234 1HG GLN 35 2HG GLN 35 13.081 14.635 -1.710
235 2HG GLN 35 1HG GLN 35 11.321 14.739 -1.699
236 1HE2 GLN 35 1HE2 GLN 35 11.269 13.520 0.358
237 2HE2 GLN 35 2HE2 GLN 35 11.533 11.844 0.370
Start of MODEL 7
1 1H GLU 1 1HT GLU 1 6.896 1.022 6.323
2 2H GLU 1 2HT GLU 1 8.363 1.085 7.179
3 3H GLU 1 3HT GLU 1 7.642 2.516 6.613
4 HA GLU 1 HA GLU 1 6.819 0.806 8.880
5 1HB GLU 1 2HB GLU 1 7.249 3.772 8.385
6 2HB GLU 1 1HB GLU 1 6.848 3.051 9.945
7 1HG GLU 1 2HG GLU 1 8.973 1.533 9.351
8 2HG GLU 1 1HG GLU 1 9.411 2.966 8.420
9 H VAL 2 H VAL 2 4.655 0.343 8.992
10 HA VAL 2 HA VAL 2 2.667 2.389 8.246
11 HB VAL 2 HB VAL 2 3.017 1.438 6.096
12 1HG1 VAL 2 1HG1 VAL 2 4.369 -0.498 6.999
13 2HG1 VAL 2 2HG1 VAL 2 3.287 -0.920 5.675
14 3HG1 VAL 2 3HG1 VAL 2 2.846 -1.321 7.334
15 1HG2 VAL 2 1HG2 VAL 2 0.804 -0.318 7.163
16 2HG2 VAL 2 2HG2 VAL 2 0.915 0.471 5.589
17 3HG2 VAL 2 3HG2 VAL 2 0.604 1.430 7.038
18 H THR 3 H THR 3 0.494 1.765 8.972
19 HA THR 3 HA THR 3 0.252 -0.702 10.599
20 HB THR 3 HB THR 3 -0.026 2.115 11.700
21 HG1 THR 3 1HG THR 3 1.920 0.096 11.895
22 1HG2 THR 3 1HG2 THR 3 0.020 0.292 13.798
23 2HG2 THR 3 2HG2 THR 3 -1.005 -0.487 12.593
24 3HG2 THR 3 3HG2 THR 3 -1.408 1.125 13.186
25 H CYS 4 H CYS 4 -1.082 0.026 8.205
26 HA CYS 4 HA CYS 4 -3.738 1.067 9.006
27 1HB CYS 4 2HB CYS 4 -3.580 1.915 6.917
28 2HB CYS 4 1HB CYS 4 -2.027 1.111 6.725
29 H GLU 5 H GLU 5 -5.565 -0.267 7.651
30 HA GLU 5 HA GLU 5 -5.674 -2.900 8.912
31 1HB GLU 5 2HB GLU 5 -7.434 -1.297 7.039
32 2HB GLU 5 1HB GLU 5 -7.890 -2.897 7.626
33 1HG GLU 5 2HG GLU 5 -8.182 -2.168 9.801
34 2HG GLU 5 1HG GLU 5 -7.010 -0.860 9.632
35 HA PRO 6 HA PRO 6 -3.987 -5.115 5.492
36 1HB PRO 6 2HB PRO 6 -4.975 -7.597 6.085
37 2HB PRO 6 1HB PRO 6 -3.630 -6.855 6.974
38 1HG PRO 6 2HG PRO 6 -6.498 -7.080 7.725
39 2HG PRO 6 1HG PRO 6 -5.052 -7.199 8.738
40 1HD PRO 6 2HD PRO 6 -6.642 -4.973 8.599
41 2HD PRO 6 1HD PRO 6 -4.918 -4.938 9.035
42 H GLY 7 H GLY 7 -4.932 -4.671 3.522
43 1HA GLY 7 2HA GLY 7 -6.369 -5.605 1.747
44 2HA GLY 7 1HA GLY 7 -7.598 -5.907 2.981
45 H THR 8 H THR 8 -5.693 -2.942 2.665
46 HA THR 8 HA THR 8 -8.172 -1.506 1.788
47 HB THR 8 HB THR 8 -6.329 -1.012 4.129
48 HG1 THR 8 1HG THR 8 -8.614 -0.643 4.953
49 1HG2 THR 8 1HG2 THR 8 -6.421 1.148 3.165
50 2HG2 THR 8 2HG2 THR 8 -7.713 1.151 4.366
51 3HG2 THR 8 3HG2 THR 8 -8.097 0.941 2.658
52 H THR 9 H THR 9 -4.647 -1.569 1.996
53 HA THR 9 HA THR 9 -2.987 -0.337 0.862
54 HB THR 9 HB THR 9 -4.151 -1.886 -0.811
55 HG1 THR 9 1HG THR 9 -3.221 -0.506 -2.611
56 1HG2 THR 9 1HG2 THR 9 -5.275 -0.473 -2.677
57 2HG2 THR 9 2HG2 THR 9 -5.526 0.726 -1.411
58 3HG2 THR 9 3HG2 THR 9 -6.227 -0.884 -1.253
59 H PHE 10 H PHE 10 -2.720 1.675 -0.713
60 HA PHE 10 HA PHE 10 -4.639 3.764 -0.810
61 1HB PHE 10 2HB PHE 10 -3.652 5.093 1.177
62 2HB PHE 10 1HB PHE 10 -4.722 3.750 1.570
63 HD1 PHE 10 1HD PHE 10 -1.151 4.760 1.283
64 HD2 PHE 10 2HD PHE 10 -3.934 1.841 2.764
65 HE1 PHE 10 1HE PHE 10 0.665 3.691 2.591
66 HE2 PHE 10 2HE PHE 10 -2.117 0.774 4.070
67 HZ PHE 10 HZ PHE 10 0.182 1.698 3.985
68 H LYS 11 H LYS 11 -3.032 6.013 -0.327
69 HA LYS 11 HA LYS 11 -0.761 5.557 -2.235
70 1HB LYS 11 2HB LYS 11 -3.017 7.138 -2.457
71 2HB LYS 11 1HB LYS 11 -1.806 8.286 -1.883
72 1HG LYS 11 2HG LYS 11 -0.790 8.317 -3.892
73 2HG LYS 11 1HG LYS 11 -0.684 6.557 -3.919
74 1HD LYS 11 2HD LYS 11 -2.319 6.477 -5.458
75 2HD LYS 11 1HD LYS 11 -3.418 7.278 -4.333
76 1HE LYS 11 2HE LYS 11 -1.396 8.853 -5.946
77 2HE LYS 11 1HE LYS 11 -3.014 8.484 -6.575
78 1HZ LYS 11 1HZ LYS 11 -2.559 10.589 -5.053
79 2HZ LYS 11 2HZ LYS 11 -2.832 9.448 -3.824
80 3HZ LYS 11 3HZ LYS 11 -4.026 9.739 -4.997
81 H ASP 12 H ASP 12 1.256 6.006 -1.417
82 HA ASP 12 HA ASP 12 1.507 7.934 0.838
83 1HB ASP 12 2HB ASP 12 1.307 5.491 1.564
84 2HB ASP 12 1HB ASP 12 2.842 5.214 0.733
85 H LYS 13 H LYS 13 3.201 9.312 0.417
86 HA LYS 13 HA LYS 13 5.221 10.118 -0.507
87 1HB LYS 13 2HB LYS 13 5.876 7.367 -1.480
88 2HB LYS 13 1HB LYS 13 6.928 8.561 -0.713
89 1HG LYS 13 2HG LYS 13 5.121 8.084 1.280
90 2HG LYS 13 1HG LYS 13 5.200 6.518 0.501
91 1HD LYS 13 2HD LYS 13 7.756 7.961 1.097
92 2HD LYS 13 1HD LYS 13 6.928 7.108 2.400
93 1HE LYS 13 2HE LYS 13 7.169 5.006 1.346
94 2HE LYS 13 1HE LYS 13 7.471 5.739 -0.242
95 1HZ LYS 13 1HZ LYS 13 9.467 6.808 0.804
96 2HZ LYS 13 2HZ LYS 13 9.574 5.124 0.613
97 3HZ LYS 13 3HZ LYS 13 9.239 5.788 2.140
98 H CYS 14 H CYS 14 6.405 8.672 -2.910
99 HA CYS 14 HA CYS 14 4.608 9.876 -4.945
100 1HB CYS 14 2HB CYS 14 7.424 8.739 -4.955
101 2HB CYS 14 1HB CYS 14 6.633 9.387 -6.395
102 H ASN 15 H ASN 15 4.128 7.243 -3.456
103 HA ASN 15 HA ASN 15 3.447 5.639 -5.856
104 1HB ASN 15 2HB ASN 15 5.450 4.935 -3.722
105 2HB ASN 15 1HB ASN 15 4.595 3.667 -4.593
106 1HD2 ASN 15 1HD2 ASN 15 4.482 4.554 -7.185
107 2HD2 ASN 15 2HD2 ASN 15 6.046 4.843 -7.803
108 H THR 16 H THR 16 2.456 3.449 -4.913
109 HA THR 16 HA THR 16 0.487 4.251 -2.806
110 HB THR 16 HB THR 16 0.502 2.604 -5.293
111 HG1 THR 16 1HG THR 16 -1.071 4.477 -3.975
112 1HG2 THR 16 1HG2 THR 16 -1.478 1.302 -4.546
113 2HG2 THR 16 2HG2 THR 16 -1.247 1.921 -2.912
114 3HG2 THR 16 3HG2 THR 16 -0.025 0.879 -3.639
115 H CYS 17 H CYS 17 -0.221 2.336 -1.403
116 HA CYS 17 HA CYS 17 1.973 0.366 -0.956
117 1HB CYS 17 2HB CYS 17 1.678 2.736 0.450
118 2HB CYS 17 1HB CYS 17 0.871 1.556 1.484
119 H ARG 18 H ARG 18 0.853 -1.545 -1.168
120 HA ARG 18 HA ARG 18 -1.972 -1.793 -0.427
121 1HB ARG 18 2HB ARG 18 -1.191 -3.011 -2.326
122 2HB ARG 18 1HB ARG 18 0.207 -3.628 -1.445
123 1HG ARG 18 2HG ARG 18 -1.464 -5.395 -1.637
124 2HG ARG 18 1HG ARG 18 -1.341 -4.893 0.050
125 1HD ARG 18 2HD ARG 18 -3.404 -3.774 0.004
126 2HD ARG 18 1HD ARG 18 -3.377 -3.600 -1.762
127 HE ARG 18 HE ARG 18 -3.352 -6.328 -1.429
128 1HH1 ARG 18 1HH2 ARG 18 -5.512 -3.736 -1.098
129 2HH1 ARG 18 2HH2 ARG 18 -6.836 -4.702 -0.535
130 1HH2 ARG 18 1HH1 ARG 18 -4.961 -7.608 -0.295
131 2HH2 ARG 18 2HH1 ARG 18 -6.523 -6.892 -0.081
132 H CYS 19 H CYS 19 -2.477 -1.895 1.698
133 HA CYS 19 HA CYS 19 -0.786 -2.539 3.862
134 1HB CYS 19 2HB CYS 19 -3.402 -1.745 3.374
135 2HB CYS 19 1HB CYS 19 -3.600 -3.313 4.156
136 H GLY 20 H GLY 20 0.250 -4.478 4.180
137 1HA GLY 20 2HA GLY 20 -0.200 -6.897 2.871
138 2HA GLY 20 1HA GLY 20 0.512 -6.798 4.485
139 H SER 21 H SER 21 -0.917 -8.994 4.196
140 HA SER 21 HA SER 21 -3.756 -8.556 4.885
141 1HB SER 21 2HB SER 21 -2.701 -10.363 3.363
142 2HB SER 21 1HB SER 21 -2.207 -11.149 4.859
143 HG SER 21 HG SER 21 -4.230 -11.642 5.273
144 H ASP 22 H ASP 22 -0.768 -8.880 6.541
145 HA ASP 22 HA ASP 22 -2.042 -9.944 9.010
146 1HB ASP 22 2HB ASP 22 0.617 -9.816 7.778
147 2HB ASP 22 1HB ASP 22 0.641 -9.421 9.501
148 H GLY 23 H GLY 23 -1.494 -6.964 7.551
149 1HA GLY 23 2HA GLY 23 -1.896 -4.804 8.423
150 2HA GLY 23 1HA GLY 23 -2.115 -5.533 10.018
151 H LYS 24 H LYS 24 -0.710 -3.267 10.074
152 HA LYS 24 HA LYS 24 1.377 -2.325 10.665
153 1HB LYS 24 2HB LYS 24 1.134 -5.062 11.691
154 2HB LYS 24 1HB LYS 24 2.810 -4.528 11.555
155 1HG LYS 24 2HG LYS 24 2.560 -3.302 13.422
156 2HG LYS 24 1HG LYS 24 1.311 -2.352 12.616
157 1HD LYS 24 2HD LYS 24 -0.202 -4.450 13.188
158 2HD LYS 24 1HD LYS 24 1.015 -4.710 14.440
159 1HE LYS 24 2HE LYS 24 0.223 -1.905 14.318
160 2HE LYS 24 1HE LYS 24 -1.167 -2.968 14.625
161 1HZ LYS 24 1HZ LYS 24 0.475 -2.243 16.554
162 2HZ LYS 24 2HZ LYS 24 1.337 -3.596 15.994
163 3HZ LYS 24 3HZ LYS 24 -0.265 -3.768 16.533
164 H SER 25 H SER 25 0.989 -3.756 7.919
165 HA SER 25 HA SER 25 3.790 -3.426 7.060
166 1HB SER 25 2HB SER 25 2.333 -6.051 7.261
167 2HB SER 25 1HB SER 25 3.541 -5.821 5.995
168 HG SER 25 HG SER 25 4.084 -5.147 8.680
169 H ALA 26 H ALA 26 3.839 -2.772 4.909
170 HA ALA 26 HA ALA 26 1.473 -3.287 3.184
171 1HB ALA 26 1HB ALA 26 1.696 -1.002 4.705
172 2HB ALA 26 2HB ALA 26 0.767 -1.118 3.211
173 3HB ALA 26 3HB ALA 26 2.417 -0.492 3.178
174 H ALA 27 H ALA 27 2.023 -3.307 0.985
175 HA ALA 27 HA ALA 27 4.921 -3.262 0.357
176 1HB ALA 27 1HB ALA 27 4.280 -4.544 -1.495
177 2HB ALA 27 2HB ALA 27 2.680 -3.807 -1.569
178 3HB ALA 27 3HB ALA 27 3.051 -4.986 -0.311
179 H CYS 28 H CYS 28 5.674 -1.196 -0.110
180 HA CYS 28 HA CYS 28 3.862 0.689 -1.476
181 1HB CYS 28 2HB CYS 28 6.285 0.753 0.190
182 2HB CYS 28 1HB CYS 28 6.301 1.936 -1.118
183 H THR 29 H THR 29 4.135 1.333 -3.622
184 HA THR 29 HA THR 29 5.853 -0.318 -5.321
185 HB THR 29 HB THR 29 4.621 0.623 -7.063
186 HG1 THR 29 1HG THR 29 3.981 2.737 -7.093
187 1HG2 THR 29 1HG2 THR 29 2.597 1.611 -5.165
188 2HG2 THR 29 2HG2 THR 29 3.179 -0.017 -4.825
189 3HG2 THR 29 3HG2 THR 29 2.469 0.354 -6.395
190 H LEU 30 H LEU 30 7.650 0.801 -3.671
191 HA LEU 30 HA LEU 30 8.706 3.335 -3.989
192 1HB LEU 30 2HB LEU 30 10.072 0.628 -3.919
193 2HB LEU 30 1HB LEU 30 10.933 2.151 -3.699
194 HG LEU 30 HG LEU 30 8.505 1.808 -2.034
195 1HD1 LEU 30 1HD1 LEU 30 10.351 0.539 -0.460
196 2HD1 LEU 30 2HD1 LEU 30 10.733 -0.134 -2.044
197 3HD1 LEU 30 3HD1 LEU 30 9.103 -0.294 -1.387
198 1HD2 LEU 30 1HD2 LEU 30 10.534 3.593 -2.119
199 2HD2 LEU 30 2HD2 LEU 30 11.197 2.457 -0.944
200 3HD2 LEU 30 3HD2 LEU 30 9.644 3.234 -0.639
201 H LYS 31 H LYS 31 8.341 4.184 -6.122
202 HA LYS 31 HA LYS 31 10.186 3.074 -8.208
203 1HB LYS 31 2HB LYS 31 7.270 3.428 -8.156
204 2HB LYS 31 1HB LYS 31 8.030 4.147 -9.575
205 1HG LYS 31 2HG LYS 31 7.430 1.800 -10.013
206 2HG LYS 31 1HG LYS 31 9.181 2.007 -10.037
207 1HD LYS 31 2HD LYS 31 9.484 0.722 -8.184
208 2HD LYS 31 1HD LYS 31 8.058 1.379 -7.381
209 1HE LYS 31 2HE LYS 31 7.432 -0.860 -7.796
210 2HE LYS 31 1HE LYS 31 6.734 -0.004 -9.186
211 1HZ LYS 31 1HZ LYS 31 9.075 -0.368 -10.193
212 2HZ LYS 31 2HZ LYS 31 7.958 -1.647 -10.213
213 3HZ LYS 31 3HZ LYS 31 9.196 -1.615 -9.050
214 H ALA 32 H ALA 32 11.444 4.976 -7.079
215 HA ALA 32 HA ALA 32 12.378 7.126 -7.395
216 1HB ALA 32 1HB ALA 32 12.462 7.342 -9.640
217 2HB ALA 32 2HB ALA 32 10.860 8.076 -9.593
218 3HB ALA 32 3HB ALA 32 11.026 6.337 -9.820
219 H CYS 33 H CYS 33 11.837 9.340 -6.897
220 HA CYS 33 HA CYS 33 9.034 10.170 -6.640
221 1HB CYS 33 2HB CYS 33 9.278 8.707 -4.705
222 2HB CYS 33 1HB CYS 33 10.776 9.519 -4.239
223 HA PRO 34 HA PRO 34 11.915 13.635 -7.256
224 1HB PRO 34 2HB PRO 34 10.143 15.147 -8.691
225 2HB PRO 34 1HB PRO 34 11.126 13.858 -9.416
226 1HG PRO 34 2HG PRO 34 8.269 13.824 -8.594
227 2HG PRO 34 1HG PRO 34 9.051 13.072 -9.992
228 1HD PRO 34 2HD PRO 34 8.337 11.711 -7.729
229 2HD PRO 34 1HD PRO 34 9.654 11.208 -8.815
230 H GLN 35 H GLN 35 8.767 13.407 -5.806
231 HA GLN 35 HA GLN 35 9.012 16.151 -4.648
232 1HB GLN 35 2HB GLN 35 6.911 14.543 -5.675
233 2HB GLN 35 1HB GLN 35 6.614 14.710 -3.945
234 1HG GLN 35 2HG GLN 35 6.081 16.898 -4.146
235 2HG GLN 35 1HG GLN 35 7.478 17.219 -5.175
236 1HE2 GLN 35 1HE2 GLN 35 6.779 18.031 -7.149
237 2HE2 GLN 35 2HE2 GLN 35 5.418 17.485 -8.003
Start of MODEL 8
1 1H GLU 1 1HT GLU 1 4.320 3.839 11.186
2 2H GLU 1 2HT GLU 1 6.006 4.022 11.265
3 3H GLU 1 3HT GLU 1 5.244 2.771 12.124
4 HA GLU 1 HA GLU 1 6.283 2.679 9.525
5 1HB GLU 1 2HB GLU 1 5.788 1.062 11.667
6 2HB GLU 1 1HB GLU 1 4.514 0.536 10.567
7 1HG GLU 1 2HG GLU 1 6.917 0.842 9.051
8 2HG GLU 1 1HG GLU 1 7.292 -0.118 10.482
9 H VAL 2 H VAL 2 4.271 0.656 8.604
10 HA VAL 2 HA VAL 2 2.783 2.254 6.784
11 HB VAL 2 HB VAL 2 2.283 -0.541 7.858
12 1HG1 VAL 2 1HG1 VAL 2 0.781 -0.882 6.138
13 2HG1 VAL 2 2HG1 VAL 2 1.543 0.318 5.093
14 3HG1 VAL 2 3HG1 VAL 2 0.500 0.835 6.419
15 1HG2 VAL 2 1HG2 VAL 2 3.641 0.147 5.261
16 2HG2 VAL 2 2HG2 VAL 2 3.764 -1.328 6.220
17 3HG2 VAL 2 3HG2 VAL 2 4.566 0.147 6.763
18 H THR 3 H THR 3 1.894 0.889 9.939
19 HA THR 3 HA THR 3 -0.092 1.167 11.222
20 HB THR 3 HB THR 3 0.219 3.970 10.118
21 HG1 THR 3 1HG THR 3 2.082 4.057 11.055
22 1HG2 THR 3 1HG2 THR 3 -0.468 4.601 12.401
23 2HG2 THR 3 2HG2 THR 3 -0.593 2.894 12.833
24 3HG2 THR 3 3HG2 THR 3 -1.686 3.583 11.631
25 H CYS 4 H CYS 4 -1.251 -0.130 9.418
26 HA CYS 4 HA CYS 4 -3.596 1.424 8.521
27 1HB CYS 4 2HB CYS 4 -2.417 1.876 6.596
28 2HB CYS 4 1HB CYS 4 -1.332 0.505 6.822
29 H GLU 5 H GLU 5 -5.215 -0.123 7.457
30 HA GLU 5 HA GLU 5 -5.311 -2.638 8.999
31 1HB GLU 5 2HB GLU 5 -7.167 -1.075 7.194
32 2HB GLU 5 1HB GLU 5 -7.602 -2.674 7.799
33 1HG GLU 5 2HG GLU 5 -7.022 -1.740 10.138
34 2HG GLU 5 1HG GLU 5 -7.098 -0.151 9.375
35 HA PRO 6 HA PRO 6 -3.931 -5.187 5.687
36 1HB PRO 6 2HB PRO 6 -5.249 -7.505 6.314
37 2HB PRO 6 1HB PRO 6 -3.840 -6.915 7.219
38 1HG PRO 6 2HG PRO 6 -6.737 -6.708 7.883
39 2HG PRO 6 1HG PRO 6 -5.357 -7.039 8.944
40 1HD PRO 6 2HD PRO 6 -6.551 -4.603 8.780
41 2HD PRO 6 1HD PRO 6 -4.827 -4.816 9.170
42 H GLY 7 H GLY 7 -4.631 -5.645 3.601
43 1HA GLY 7 2HA GLY 7 -6.091 -5.890 1.777
44 2HA GLY 7 1HA GLY 7 -7.339 -6.371 2.932
45 H THR 8 H THR 8 -5.582 -3.425 1.903
46 HA THR 8 HA THR 8 -8.105 -1.989 1.521
47 HB THR 8 HB THR 8 -6.306 -0.873 3.649
48 HG1 THR 8 1HG THR 8 -7.333 -2.084 5.180
49 1HG2 THR 8 1HG2 THR 8 -7.952 0.663 3.515
50 2HG2 THR 8 2HG2 THR 8 -8.986 -0.529 4.303
51 3HG2 THR 8 3HG2 THR 8 -8.965 -0.406 2.544
52 H THR 9 H THR 9 -4.584 -1.915 1.769
53 HA THR 9 HA THR 9 -2.970 -0.548 0.746
54 HB THR 9 HB THR 9 -4.142 -1.946 -1.068
55 HG1 THR 9 1HG THR 9 -3.221 -0.184 -2.665
56 1HG2 THR 9 1HG2 THR 9 -5.216 -0.315 -2.805
57 2HG2 THR 9 2HG2 THR 9 -5.517 0.710 -1.405
58 3HG2 THR 9 3HG2 THR 9 -6.200 -0.914 -1.473
59 H PHE 10 H PHE 10 -2.748 1.631 -0.584
60 HA PHE 10 HA PHE 10 -4.742 3.666 -0.441
61 1HB PHE 10 2HB PHE 10 -3.813 4.812 1.640
62 2HB PHE 10 1HB PHE 10 -4.706 3.323 1.944
63 HD1 PHE 10 1HD PHE 10 -3.595 1.327 2.734
64 HD2 PHE 10 2HD PHE 10 -1.337 4.839 1.727
65 HE1 PHE 10 1HE PHE 10 -1.590 0.350 3.821
66 HE2 PHE 10 2HE PHE 10 0.666 3.864 2.814
67 HZ PHE 10 HZ PHE 10 0.541 1.619 3.861
68 H LYS 11 H LYS 11 -3.332 5.933 0.035
69 HA LYS 11 HA LYS 11 -0.943 5.707 -1.765
70 1HB LYS 11 2HB LYS 11 -3.225 7.640 -1.475
71 2HB LYS 11 1HB LYS 11 -1.693 8.217 -2.125
72 1HG LYS 11 2HG LYS 11 -1.884 6.982 -4.052
73 2HG LYS 11 1HG LYS 11 -2.743 5.669 -3.247
74 1HD LYS 11 2HD LYS 11 -4.784 7.004 -3.161
75 2HD LYS 11 1HD LYS 11 -3.941 8.388 -3.859
76 1HE LYS 11 2HE LYS 11 -3.608 7.219 -5.955
77 2HE LYS 11 1HE LYS 11 -4.223 5.706 -5.260
78 1HZ LYS 11 1HZ LYS 11 -6.183 7.413 -4.634
79 2HZ LYS 11 2HZ LYS 11 -6.188 6.450 -6.033
80 3HZ LYS 11 3HZ LYS 11 -5.677 8.067 -6.114
81 H ASP 12 H ASP 12 0.931 6.898 -1.121
82 HA ASP 12 HA ASP 12 0.765 8.422 1.437
83 1HB ASP 12 2HB ASP 12 1.463 5.825 1.424
84 2HB ASP 12 1HB ASP 12 3.038 6.535 1.047
85 H LYS 13 H LYS 13 3.159 7.280 -0.965
86 HA LYS 13 HA LYS 13 4.242 10.075 -1.047
87 1HB LYS 13 2HB LYS 13 5.605 7.404 -1.517
88 2HB LYS 13 1HB LYS 13 6.399 8.984 -1.519
89 1HG LYS 13 2HG LYS 13 5.031 9.002 0.879
90 2HG LYS 13 1HG LYS 13 5.555 7.324 0.747
91 1HD LYS 13 2HD LYS 13 7.414 8.306 1.761
92 2HD LYS 13 1HD LYS 13 7.857 8.394 0.056
93 1HE LYS 13 2HE LYS 13 8.279 10.590 0.864
94 2HE LYS 13 1HE LYS 13 6.680 10.728 0.109
95 1HZ LYS 13 1HZ LYS 13 6.650 9.769 2.836
96 2HZ LYS 13 2HZ LYS 13 5.665 10.931 2.082
97 3HZ LYS 13 3HZ LYS 13 7.198 11.365 2.671
98 H CYS 14 H CYS 14 5.944 8.762 -3.353
99 HA CYS 14 HA CYS 14 4.391 9.836 -5.527
100 1HB CYS 14 2HB CYS 14 6.944 8.328 -5.111
101 2HB CYS 14 1HB CYS 14 6.306 8.446 -6.755
102 H ASN 15 H ASN 15 3.952 6.946 -3.866
103 HA ASN 15 HA ASN 15 2.417 5.823 -6.155
104 1HB ASN 15 2HB ASN 15 4.861 4.695 -4.855
105 2HB ASN 15 1HB ASN 15 3.600 3.568 -5.357
106 1HD2 ASN 15 1HD2 ASN 15 3.741 2.897 -7.496
107 2HD2 ASN 15 2HD2 ASN 15 4.539 3.750 -8.739
108 H THR 16 H THR 16 1.557 3.506 -5.173
109 HA THR 16 HA THR 16 0.108 4.262 -2.677
110 HB THR 16 HB THR 16 -0.406 2.745 -5.163
111 HG1 THR 16 1HG THR 16 -2.432 3.579 -4.795
112 1HG2 THR 16 1HG2 THR 16 -2.038 1.204 -4.152
113 2HG2 THR 16 2HG2 THR 16 -1.558 1.740 -2.541
114 3HG2 THR 16 3HG2 THR 16 -0.413 0.864 -3.556
115 H CYS 17 H CYS 17 -0.226 2.452 -1.082
116 HA CYS 17 HA CYS 17 2.065 0.518 -1.073
117 1HB CYS 17 2HB CYS 17 1.897 2.750 0.456
118 2HB CYS 17 1HB CYS 17 1.035 1.609 1.492
119 H ARG 18 H ARG 18 0.729 -1.261 -1.671
120 HA ARG 18 HA ARG 18 -1.849 -1.885 -0.692
121 1HB ARG 18 2HB ARG 18 0.106 -3.002 -2.327
122 2HB ARG 18 1HB ARG 18 -0.052 -4.179 -1.022
123 1HG ARG 18 2HG ARG 18 -2.404 -3.039 -2.557
124 2HG ARG 18 1HG ARG 18 -1.631 -4.576 -2.944
125 1HD ARG 18 2HD ARG 18 -2.440 -4.167 -0.099
126 2HD ARG 18 1HD ARG 18 -3.736 -4.449 -1.280
127 HE ARG 18 HE ARG 18 -1.359 -6.260 -1.207
128 1HH1 ARG 18 1HH1 ARG 18 -4.563 -5.807 -0.181
129 2HH1 ARG 18 2HH1 ARG 18 -5.099 -7.392 -0.626
130 1HH2 ARG 18 1HH2 ARG 18 -2.115 -8.255 -2.172
131 2HH2 ARG 18 2HH2 ARG 18 -3.712 -8.779 -1.754
132 H CYS 19 H CYS 19 -2.495 -2.254 1.364
133 HA CYS 19 HA CYS 19 -0.611 -2.621 3.544
134 1HB CYS 19 2HB CYS 19 -3.131 -1.636 3.210
135 2HB CYS 19 1HB CYS 19 -3.492 -3.221 3.900
136 H GLY 20 H GLY 20 0.254 -4.563 4.144
137 1HA GLY 20 2HA GLY 20 -0.431 -7.050 2.929
138 2HA GLY 20 1HA GLY 20 0.526 -6.879 4.405
139 H SER 21 H SER 21 -1.466 -8.921 3.945
140 HA SER 21 HA SER 21 -3.979 -8.313 5.202
141 1HB SER 21 2HB SER 21 -3.101 -10.325 3.759
142 2HB SER 21 1HB SER 21 -2.604 -10.990 5.312
143 HG SER 21 HG SER 21 -4.723 -10.909 5.995
144 H ASP 22 H ASP 22 -0.836 -8.520 6.477
145 HA ASP 22 HA ASP 22 -1.786 -9.300 9.195
146 1HB ASP 22 2HB ASP 22 0.994 -8.848 8.055
147 2HB ASP 22 1HB ASP 22 0.619 -9.572 9.623
148 H GLY 23 H GLY 23 -1.754 -6.552 7.487
149 1HA GLY 23 2HA GLY 23 -1.579 -4.275 8.021
150 2HA GLY 23 1HA GLY 23 -1.908 -4.788 9.679
151 H LYS 24 H LYS 24 -0.308 -2.808 9.855
152 HA LYS 24 HA LYS 24 1.889 -2.027 10.302
153 1HB LYS 24 2HB LYS 24 1.271 -4.574 11.575
154 2HB LYS 24 1HB LYS 24 3.010 -4.373 11.357
155 1HG LYS 24 2HG LYS 24 2.113 -3.431 13.527
156 2HG LYS 24 1HG LYS 24 2.990 -2.268 12.532
157 1HD LYS 24 2HD LYS 24 1.171 -0.949 12.447
158 2HD LYS 24 1HD LYS 24 0.245 -2.260 11.715
159 1HE LYS 24 2HE LYS 24 -0.724 -1.408 13.899
160 2HE LYS 24 1HE LYS 24 -0.341 -3.140 13.918
161 1HZ LYS 24 1HZ LYS 24 1.366 -2.839 15.322
162 2HZ LYS 24 2HZ LYS 24 0.607 -1.368 15.706
163 3HZ LYS 24 3HZ LYS 24 1.874 -1.404 14.576
164 H SER 25 H SER 25 1.418 -3.378 7.624
165 HA SER 25 HA SER 25 4.208 -3.502 6.787
166 1HB SER 25 2HB SER 25 2.547 -5.969 7.245
167 2HB SER 25 1HB SER 25 3.774 -5.967 5.977
168 HG SER 25 HG SER 25 5.315 -5.468 7.526
169 H ALA 26 H ALA 26 4.335 -3.212 4.539
170 HA ALA 26 HA ALA 26 1.863 -3.586 2.917
171 1HB ALA 26 1HB ALA 26 1.957 -1.283 2.157
172 2HB ALA 26 2HB ALA 26 3.469 -1.014 3.025
173 3HB ALA 26 3HB ALA 26 1.971 -1.270 3.920
174 H ALA 27 H ALA 27 2.611 -2.659 0.539
175 HA ALA 27 HA ALA 27 5.179 -4.083 -0.074
176 1HB ALA 27 1HB ALA 27 2.530 -4.343 -1.004
177 2HB ALA 27 2HB ALA 27 3.964 -5.113 -1.685
178 3HB ALA 27 3HB ALA 27 3.414 -3.560 -2.314
179 H CYS 28 H CYS 28 3.120 -1.370 -1.077
180 HA CYS 28 HA CYS 28 3.668 0.721 -1.990
181 1HB CYS 28 2HB CYS 28 5.870 -0.110 -0.218
182 2HB CYS 28 1HB CYS 28 6.340 1.083 -1.420
183 H THR 29 H THR 29 3.494 0.148 -4.221
184 HA THR 29 HA THR 29 5.776 -1.090 -5.616
185 HB THR 29 HB THR 29 3.261 -1.386 -6.072
186 HG1 THR 29 1HG THR 29 5.263 -0.829 -7.927
187 1HG2 THR 29 1HG2 THR 29 3.211 0.881 -7.901
188 2HG2 THR 29 2HG2 THR 29 3.366 1.398 -6.223
189 3HG2 THR 29 3HG2 THR 29 2.012 0.380 -6.710
190 H LEU 30 H LEU 30 6.510 1.300 -4.318
191 HA LEU 30 HA LEU 30 6.440 3.530 -6.199
192 1HB LEU 30 2HB LEU 30 7.266 4.722 -4.357
193 2HB LEU 30 1HB LEU 30 6.346 3.430 -3.594
194 HG LEU 30 HG LEU 30 9.347 3.502 -4.009
195 1HD1 LEU 30 1HD1 LEU 30 8.463 3.038 -1.317
196 2HD1 LEU 30 2HD1 LEU 30 7.644 4.467 -1.945
197 3HD1 LEU 30 3HD1 LEU 30 9.407 4.391 -1.941
198 1HD2 LEU 30 1HD2 LEU 30 8.358 1.203 -4.264
199 2HD2 LEU 30 2HD2 LEU 30 7.681 1.369 -2.650
200 3HD2 LEU 30 3HD2 LEU 30 9.428 1.357 -2.874
201 H LYS 31 H LYS 31 8.401 4.571 -6.970
202 HA LYS 31 HA LYS 31 10.823 2.835 -7.176
203 1HB LYS 31 2HB LYS 31 8.932 3.801 -9.263
204 2HB LYS 31 1HB LYS 31 10.644 3.916 -9.659
205 1HG LYS 31 2HG LYS 31 10.809 1.686 -9.958
206 2HG LYS 31 1HG LYS 31 10.016 1.363 -8.415
207 1HD LYS 31 2HD LYS 31 8.635 2.017 -11.035
208 2HD LYS 31 1HD LYS 31 8.664 0.445 -10.236
209 1HE LYS 31 2HE LYS 31 7.627 1.697 -8.199
210 2HE LYS 31 1HE LYS 31 7.229 2.959 -9.382
211 1HZ LYS 31 1HZ LYS 31 6.691 0.128 -9.993
212 2HZ LYS 31 2HZ LYS 31 5.954 1.518 -10.632
213 3HZ LYS 31 3HZ LYS 31 5.588 1.009 -9.053
214 H ALA 32 H ALA 32 11.282 4.633 -5.467
215 HA ALA 32 HA ALA 32 12.588 6.553 -4.986
216 1HB ALA 32 1HB ALA 32 13.945 7.350 -6.729
217 2HB ALA 32 2HB ALA 32 12.690 7.107 -7.944
218 3HB ALA 32 3HB ALA 32 13.564 5.722 -7.289
219 H CYS 33 H CYS 33 12.096 8.835 -4.779
220 HA CYS 33 HA CYS 33 9.818 9.905 -6.346
221 1HB CYS 33 2HB CYS 33 8.810 8.598 -4.534
222 2HB CYS 33 1HB CYS 33 9.789 9.463 -3.344
223 HA PRO 34 HA PRO 34 12.596 13.326 -5.491
224 1HB PRO 34 2HB PRO 34 11.522 14.996 -7.372
225 2HB PRO 34 1HB PRO 34 12.666 13.700 -7.774
226 1HG PRO 34 2HG PRO 34 9.715 13.780 -8.086
227 2HG PRO 34 1HG PRO 34 10.943 13.035 -9.120
228 1HD PRO 34 2HD PRO 34 9.359 11.654 -7.346
229 2HD PRO 34 1HD PRO 34 10.943 11.091 -7.932
230 H GLN 35 H GLN 35 9.237 12.984 -5.095
231 HA GLN 35 HA GLN 35 9.062 14.949 -3.006
232 1HB GLN 35 2HB GLN 35 9.287 16.383 -5.065
233 2HB GLN 35 1HB GLN 35 7.773 15.695 -5.650
234 1HG GLN 35 2HG GLN 35 7.088 17.681 -4.586
235 2HG GLN 35 1HG GLN 35 6.799 16.443 -3.363
236 1HE2 GLN 35 1HE2 GLN 35 7.041 18.536 -1.940
237 2HE2 GLN 35 2HE2 GLN 35 8.612 18.906 -1.414
Start of MODEL 9
1 1H GLU 1 1HT GLU 1 5.587 0.924 12.673
2 2H GLU 1 2HT GLU 1 4.366 -0.058 12.018
3 3H GLU 1 3HT GLU 1 3.993 1.066 13.237
4 HA GLU 1 HA GLU 1 4.053 2.859 11.825
5 1HB GLU 1 2HB GLU 1 5.431 2.586 9.658
6 2HB GLU 1 1HB GLU 1 6.332 2.605 11.175
7 1HG GLU 1 2HG GLU 1 6.492 0.194 11.190
8 2HG GLU 1 1HG GLU 1 5.407 0.066 9.806
9 H VAL 2 H VAL 2 3.299 3.093 9.343
10 HA VAL 2 HA VAL 2 1.601 2.616 7.780
11 HB VAL 2 HB VAL 2 2.359 -0.203 8.615
12 1HG1 VAL 2 1HG1 VAL 2 1.143 -0.984 6.849
13 2HG1 VAL 2 2HG1 VAL 2 1.523 0.413 5.843
14 3HG1 VAL 2 3HG1 VAL 2 0.244 0.519 7.053
15 1HG2 VAL 2 1HG2 VAL 2 4.174 1.476 7.785
16 2HG2 VAL 2 2HG2 VAL 2 3.392 1.298 6.213
17 3HG2 VAL 2 3HG2 VAL 2 4.086 -0.110 7.018
18 H THR 3 H THR 3 1.020 -0.173 9.899
19 HA THR 3 HA THR 3 -0.949 -0.814 11.050
20 HB THR 3 HB THR 3 -0.777 2.175 11.551
21 HG1 THR 3 1HG THR 3 0.965 1.341 12.451
22 1HG2 THR 3 1HG2 THR 3 -2.672 2.015 12.744
23 2HG2 THR 3 2HG2 THR 3 -1.972 0.708 13.700
24 3HG2 THR 3 3HG2 THR 3 -2.851 0.342 12.216
25 H CYS 4 H CYS 4 -2.212 -1.370 9.161
26 HA CYS 4 HA CYS 4 -4.487 0.473 8.697
27 1HB CYS 4 2HB CYS 4 -4.073 0.201 6.193
28 2HB CYS 4 1HB CYS 4 -2.886 1.192 7.047
29 H GLU 5 H GLU 5 -5.659 -0.894 6.574
30 HA GLU 5 HA GLU 5 -6.271 -3.526 7.838
31 1HB GLU 5 2HB GLU 5 -7.683 -1.431 6.334
32 2HB GLU 5 1HB GLU 5 -8.083 -3.064 5.799
33 1HG GLU 5 2HG GLU 5 -9.599 -2.849 7.529
34 2HG GLU 5 1HG GLU 5 -8.225 -3.505 8.420
35 HA PRO 6 HA PRO 6 -4.064 -5.524 4.560
36 1HB PRO 6 2HB PRO 6 -5.064 -8.046 4.952
37 2HB PRO 6 1HB PRO 6 -3.826 -7.322 5.998
38 1HG PRO 6 2HG PRO 6 -6.759 -7.579 6.439
39 2HG PRO 6 1HG PRO 6 -5.425 -7.774 7.586
40 1HD PRO 6 2HD PRO 6 -6.958 -5.533 7.459
41 2HD PRO 6 1HD PRO 6 -5.254 -5.519 7.974
42 H GLY 7 H GLY 7 -4.930 -4.793 2.616
43 1HA GLY 7 2HA GLY 7 -6.107 -5.735 0.616
44 2HA GLY 7 1HA GLY 7 -7.455 -6.111 1.697
45 H THR 8 H THR 8 -5.654 -3.129 2.002
46 HA THR 8 HA THR 8 -7.933 -1.632 0.760
47 HB THR 8 HB THR 8 -6.556 -1.157 3.421
48 HG1 THR 8 1HG THR 8 -8.807 -1.530 4.096
49 1HG2 THR 8 1HG2 THR 8 -8.392 0.487 1.746
50 2HG2 THR 8 2HG2 THR 8 -7.121 0.998 2.856
51 3HG2 THR 8 3HG2 THR 8 -8.683 0.471 3.486
52 H THR 9 H THR 9 -4.524 -1.730 1.644
53 HA THR 9 HA THR 9 -2.710 -0.338 1.053
54 HB THR 9 HB THR 9 -3.435 -1.686 -0.986
55 HG1 THR 9 1HG THR 9 -1.984 -0.609 -2.244
56 1HG2 THR 9 1HG2 THR 9 -5.464 -0.678 -1.656
57 2HG2 THR 9 2HG2 THR 9 -4.297 -0.139 -2.862
58 3HG2 THR 9 3HG2 THR 9 -4.788 0.948 -1.564
59 H PHE 10 H PHE 10 -2.324 1.831 -0.450
60 HA PHE 10 HA PHE 10 -4.292 3.877 -0.509
61 1HB PHE 10 2HB PHE 10 -3.473 5.067 1.630
62 2HB PHE 10 1HB PHE 10 -4.509 3.659 1.855
63 HD1 PHE 10 1HD PHE 10 -3.687 1.651 2.886
64 HD2 PHE 10 2HD PHE 10 -0.992 4.851 1.910
65 HE1 PHE 10 1HE PHE 10 -1.901 0.552 4.210
66 HE2 PHE 10 2HE PHE 10 0.794 3.750 3.233
67 HZ PHE 10 HZ PHE 10 0.339 1.601 4.383
68 H LYS 11 H LYS 11 -2.816 6.133 0.167
69 HA LYS 11 HA LYS 11 -0.296 5.825 -1.438
70 1HB LYS 11 2HB LYS 11 -2.594 7.084 -2.207
71 2HB LYS 11 1HB LYS 11 -1.729 8.419 -1.443
72 1HG LYS 11 2HG LYS 11 -0.266 8.558 -3.153
73 2HG LYS 11 1HG LYS 11 0.040 6.820 -3.114
74 1HD LYS 11 2HD LYS 11 -1.894 6.373 -4.480
75 2HD LYS 11 1HD LYS 11 -2.433 8.048 -4.358
76 1HE LYS 11 2HE LYS 11 -1.001 8.746 -5.994
77 2HE LYS 11 1HE LYS 11 0.319 7.718 -5.400
78 1HZ LYS 11 1HZ LYS 11 -1.035 7.144 -7.599
79 2HZ LYS 11 2HZ LYS 11 -2.034 6.366 -6.465
80 3HZ LYS 11 3HZ LYS 11 -0.394 5.943 -6.587
81 H ASP 12 H ASP 12 1.425 6.260 -0.121
82 HA ASP 12 HA ASP 12 1.046 8.117 2.189
83 1HB ASP 12 2HB ASP 12 1.853 5.714 2.432
84 2HB ASP 12 1HB ASP 12 3.319 6.209 1.579
85 H LYS 13 H LYS 13 3.074 7.491 -0.642
86 HA LYS 13 HA LYS 13 4.094 10.296 -0.453
87 1HB LYS 13 2HB LYS 13 5.798 7.910 -1.214
88 2HB LYS 13 1HB LYS 13 6.336 9.527 -0.751
89 1HG LYS 13 2HG LYS 13 5.227 9.081 1.517
90 2HG LYS 13 1HG LYS 13 5.123 7.394 1.014
91 1HD LYS 13 2HD LYS 13 7.384 7.060 1.179
92 2HD LYS 13 1HD LYS 13 7.768 8.705 0.670
93 1HE LYS 13 2HE LYS 13 6.482 9.121 3.087
94 2HE LYS 13 1HE LYS 13 7.418 7.644 3.386
95 1HZ LYS 13 1HZ LYS 13 9.204 8.985 2.016
96 2HZ LYS 13 2HZ LYS 13 9.051 9.181 3.697
97 3HZ LYS 13 3HZ LYS 13 8.357 10.316 2.640
98 H CYS 14 H CYS 14 5.841 8.981 -2.841
99 HA CYS 14 HA CYS 14 3.979 9.904 -4.931
100 1HB CYS 14 2HB CYS 14 6.760 8.727 -5.200
101 2HB CYS 14 1HB CYS 14 5.943 9.830 -6.313
102 H ASN 15 H ASN 15 4.034 7.122 -3.305
103 HA ASN 15 HA ASN 15 3.254 5.518 -5.705
104 1HB ASN 15 2HB ASN 15 5.190 4.735 -3.503
105 2HB ASN 15 1HB ASN 15 4.584 3.630 -4.734
106 1HD2 ASN 15 1HD2 ASN 15 7.226 5.506 -4.047
107 2HD2 ASN 15 2HD2 ASN 15 7.761 5.838 -5.632
108 H THR 16 H THR 16 2.255 3.350 -4.842
109 HA THR 16 HA THR 16 0.409 4.049 -2.591
110 HB THR 16 HB THR 16 0.286 2.359 -5.080
111 HG1 THR 16 1HG THR 16 -0.456 4.580 -4.911
112 1HG2 THR 16 1HG2 THR 16 -1.558 2.108 -2.687
113 2HG2 THR 16 2HG2 THR 16 -0.465 0.861 -3.287
114 3HG2 THR 16 3HG2 THR 16 -1.836 1.375 -4.268
115 H CYS 17 H CYS 17 0.581 2.951 -0.734
116 HA CYS 17 HA CYS 17 2.421 0.615 -0.607
117 1HB CYS 17 2HB CYS 17 2.046 2.970 0.852
118 2HB CYS 17 1HB CYS 17 1.403 1.697 1.886
119 H ARG 18 H ARG 18 1.362 -1.294 -0.827
120 HA ARG 18 HA ARG 18 -1.453 -1.662 -0.239
121 1HB ARG 18 2HB ARG 18 -0.528 -2.992 -1.949
122 2HB ARG 18 1HB ARG 18 0.911 -3.368 -1.003
123 1HG ARG 18 2HG ARG 18 -0.548 -5.330 -1.099
124 2HG ARG 18 1HG ARG 18 -0.491 -4.711 0.551
125 1HD ARG 18 2HD ARG 18 -2.683 -3.958 0.490
126 2HD ARG 18 1HD ARG 18 -2.647 -3.680 -1.263
127 HE ARG 18 HE ARG 18 -2.361 -6.492 -0.428
128 1HH1 ARG 18 1HH1 ARG 18 -4.723 -4.057 -0.745
129 2HH1 ARG 18 2HH1 ARG 18 -5.823 -5.032 -1.659
130 1HH2 ARG 18 1HH2 ARG 18 -3.642 -7.714 -1.925
131 2HH2 ARG 18 2HH2 ARG 18 -5.213 -7.104 -2.324
132 H CYS 19 H CYS 19 -2.324 -2.103 1.742
133 HA CYS 19 HA CYS 19 -0.791 -2.275 4.146
134 1HB CYS 19 2HB CYS 19 -3.249 -1.643 3.717
135 2HB CYS 19 1HB CYS 19 -3.569 -3.379 3.698
136 H GLY 20 H GLY 20 0.453 -3.985 4.794
137 1HA GLY 20 2HA GLY 20 0.673 -6.482 3.575
138 2HA GLY 20 1HA GLY 20 1.042 -6.212 5.282
139 H SER 21 H SER 21 0.045 -8.641 4.761
140 HA SER 21 HA SER 21 -2.854 -8.800 4.788
141 1HB SER 21 2HB SER 21 -0.734 -10.471 4.312
142 2HB SER 21 1HB SER 21 -1.240 -11.010 5.910
143 HG SER 21 HG SER 21 -2.301 -11.772 3.741
144 H ASP 22 H ASP 22 -0.583 -7.917 7.154
145 HA ASP 22 HA ASP 22 -2.601 -8.408 9.312
146 1HB ASP 22 2HB ASP 22 -0.630 -8.988 10.769
147 2HB ASP 22 1HB ASP 22 -0.887 -10.130 9.446
148 H GLY 23 H GLY 23 -2.255 -5.948 7.917
149 1HA GLY 23 2HA GLY 23 -1.729 -3.678 8.257
150 2HA GLY 23 1HA GLY 23 -2.084 -4.051 9.946
151 H LYS 24 H LYS 24 -0.298 -2.266 10.053
152 HA LYS 24 HA LYS 24 1.976 -1.680 10.432
153 1HB LYS 24 2HB LYS 24 1.235 -4.240 11.724
154 2HB LYS 24 1HB LYS 24 2.971 -3.939 11.628
155 1HG LYS 24 2HG LYS 24 2.795 -1.904 12.839
156 2HG LYS 24 1HG LYS 24 1.044 -1.837 12.626
157 1HD LYS 24 2HD LYS 24 1.664 -4.323 13.877
158 2HD LYS 24 1HD LYS 24 2.522 -3.055 14.754
159 1HE LYS 24 2HE LYS 24 0.030 -1.913 14.315
160 2HE LYS 24 1HE LYS 24 -0.355 -3.611 14.657
161 1HZ LYS 24 1HZ LYS 24 0.071 -1.950 16.611
162 2HZ LYS 24 2HZ LYS 24 1.703 -2.267 16.263
163 3HZ LYS 24 3HZ LYS 24 0.661 -3.539 16.693
164 H SER 25 H SER 25 1.525 -2.665 7.766
165 HA SER 25 HA SER 25 4.244 -3.450 7.053
166 1HB SER 25 2HB SER 25 1.930 -5.396 7.013
167 2HB SER 25 1HB SER 25 3.339 -5.619 5.973
168 HG SER 25 HG SER 25 3.173 -5.591 8.794
169 H ALA 26 H ALA 26 4.614 -2.710 4.966
170 HA ALA 26 HA ALA 26 2.322 -2.465 3.090
171 1HB ALA 26 1HB ALA 26 2.445 -0.129 2.974
172 2HB ALA 26 2HB ALA 26 4.095 -0.089 3.595
173 3HB ALA 26 3HB ALA 26 2.750 -0.418 4.687
174 H ALA 27 H ALA 27 2.983 -2.883 1.017
175 HA ALA 27 HA ALA 27 5.792 -3.537 0.489
176 1HB ALA 27 1HB ALA 27 4.833 -4.758 -1.177
177 2HB ALA 27 2HB ALA 27 3.866 -3.392 -1.733
178 3HB ALA 27 3HB ALA 27 3.313 -4.369 -0.372
179 H CYS 28 H CYS 28 3.441 -1.159 -0.699
180 HA CYS 28 HA CYS 28 3.770 0.929 -1.723
181 1HB CYS 28 2HB CYS 28 6.171 0.362 -0.131
182 2HB CYS 28 1HB CYS 28 6.460 1.485 -1.459
183 H THR 29 H THR 29 3.720 1.089 -3.896
184 HA THR 29 HA THR 29 4.988 -0.767 -5.673
185 HB THR 29 HB THR 29 4.002 0.594 -7.364
186 HG1 THR 29 1HG THR 29 4.621 2.597 -7.153
187 1HG2 THR 29 1HG2 THR 29 1.874 0.378 -6.642
188 2HG2 THR 29 2HG2 THR 29 2.112 1.557 -5.354
189 3HG2 THR 29 3HG2 THR 29 2.565 -0.128 -5.101
190 H LEU 30 H LEU 30 5.988 2.386 -4.430
191 HA LEU 30 HA LEU 30 8.053 3.522 -4.617
192 1HB LEU 30 2HB LEU 30 8.983 0.799 -5.587
193 2HB LEU 30 1HB LEU 30 9.978 2.052 -4.847
194 HG LEU 30 HG LEU 30 7.605 0.869 -3.406
195 1HD1 LEU 30 1HD1 LEU 30 8.935 -0.834 -2.482
196 2HD1 LEU 30 2HD1 LEU 30 10.440 -0.050 -2.964
197 3HD1 LEU 30 3HD1 LEU 30 9.425 -0.835 -4.175
198 1HD2 LEU 30 1HD2 LEU 30 8.897 1.655 -1.431
199 2HD2 LEU 30 2HD2 LEU 30 8.526 2.976 -2.540
200 3HD2 LEU 30 3HD2 LEU 30 10.144 2.274 -2.513
201 H LYS 31 H LYS 31 10.044 2.557 -6.734
202 HA LYS 31 HA LYS 31 10.542 3.108 -8.972
203 1HB LYS 31 2HB LYS 31 9.216 1.613 -10.031
204 2HB LYS 31 1HB LYS 31 8.001 1.739 -8.766
205 1HG LYS 31 2HG LYS 31 7.229 3.894 -9.940
206 2HG LYS 31 1HG LYS 31 8.235 3.381 -11.296
207 1HD LYS 31 2HD LYS 31 6.213 2.407 -11.885
208 2HD LYS 31 1HD LYS 31 6.939 1.092 -10.959
209 1HE LYS 31 2HE LYS 31 4.983 1.165 -9.767
210 2HE LYS 31 1HE LYS 31 5.719 2.572 -8.976
211 1HZ LYS 31 1HZ LYS 31 4.848 3.926 -10.861
212 2HZ LYS 31 2HZ LYS 31 3.640 3.274 -9.861
213 3HZ LYS 31 3HZ LYS 31 3.966 2.571 -11.372
214 H ALA 32 H ALA 32 9.112 5.134 -6.973
215 HA ALA 32 HA ALA 32 8.928 7.303 -9.000
216 1HB ALA 32 1HB ALA 32 6.798 6.942 -6.894
217 2HB ALA 32 2HB ALA 32 6.678 6.121 -8.450
218 3HB ALA 32 3HB ALA 32 6.719 7.883 -8.383
219 H CYS 33 H CYS 33 8.145 9.363 -7.399
220 HA CYS 33 HA CYS 33 8.884 10.832 -5.702
221 1HB CYS 33 2HB CYS 33 8.569 8.238 -4.626
222 2HB CYS 33 1HB CYS 33 10.100 8.842 -3.987
223 HA PRO 34 HA PRO 34 13.111 11.221 -7.008
224 1HB PRO 34 2HB PRO 34 13.611 13.605 -5.763
225 2HB PRO 34 1HB PRO 34 12.676 13.478 -7.266
226 1HG PRO 34 2HG PRO 34 11.720 13.798 -4.464
227 2HG PRO 34 1HG PRO 34 11.107 14.529 -5.956
228 1HD PRO 34 2HD PRO 34 9.921 12.405 -4.731
229 2HD PRO 34 1HD PRO 34 9.832 12.701 -6.484
230 H GLN 35 H GLN 35 12.087 11.597 -3.642
231 HA GLN 35 HA GLN 35 14.692 10.376 -2.796
232 1HB GLN 35 2HB GLN 35 14.649 11.945 -0.879
233 2HB GLN 35 1HB GLN 35 14.658 12.817 -2.413
234 1HG GLN 35 2HG GLN 35 12.970 13.906 -1.183
235 2HG GLN 35 1HG GLN 35 12.070 12.782 -2.201
236 1HE2 GLN 35 1HE2 GLN 35 10.429 11.837 -0.986
237 2HE2 GLN 35 2HE2 GLN 35 10.580 11.322 0.624
Start of MODEL 10
1 1H GLU 1 1HT GLU 1 4.255 3.522 11.568
2 2H GLU 1 2HT GLU 1 2.780 4.299 11.243
3 3H GLU 1 3HT GLU 1 4.182 5.216 11.528
4 HA GLU 1 HA GLU 1 4.202 5.326 9.267
5 1HB GLU 1 2HB GLU 1 5.882 3.460 10.521
6 2HB GLU 1 1HB GLU 1 5.329 2.651 9.053
7 1HG GLU 1 2HG GLU 1 6.098 5.489 8.713
8 2HG GLU 1 1HG GLU 1 7.421 4.394 9.114
9 H VAL 2 H VAL 2 3.663 1.801 9.594
10 HA VAL 2 HA VAL 2 1.715 1.933 7.371
11 HB VAL 2 HB VAL 2 2.859 -0.382 8.968
12 1HG1 VAL 2 1HG1 VAL 2 2.210 -1.468 6.624
13 2HG1 VAL 2 2HG1 VAL 2 1.032 -0.156 6.608
14 3HG1 VAL 2 3HG1 VAL 2 1.024 -1.333 7.922
15 1HG2 VAL 2 1HG2 VAL 2 4.755 0.091 7.840
16 2HG2 VAL 2 2HG2 VAL 2 3.944 1.323 6.871
17 3HG2 VAL 2 3HG2 VAL 2 3.894 -0.368 6.371
18 H THR 3 H THR 3 1.499 -0.220 10.174
19 HA THR 3 HA THR 3 -0.440 -0.849 11.379
20 HB THR 3 HB THR 3 -0.584 0.701 13.034
21 HG1 THR 3 1HG THR 3 -1.674 2.444 12.676
22 1HG2 THR 3 1HG2 THR 3 1.800 0.848 12.323
23 2HG2 THR 3 2HG2 THR 3 1.217 2.330 13.080
24 3HG2 THR 3 3HG2 THR 3 1.381 2.242 11.326
25 H CYS 4 H CYS 4 -1.013 -0.550 8.607
26 HA CYS 4 HA CYS 4 -3.575 0.959 8.490
27 1HB CYS 4 2HB CYS 4 -3.294 0.496 6.042
28 2HB CYS 4 1HB CYS 4 -1.901 1.319 6.751
29 H GLU 5 H GLU 5 -5.273 -0.263 7.038
30 HA GLU 5 HA GLU 5 -5.860 -2.843 8.354
31 1HB GLU 5 2HB GLU 5 -7.500 -0.955 8.000
32 2HB GLU 5 1HB GLU 5 -7.392 -1.256 6.265
33 1HG GLU 5 2HG GLU 5 -7.903 -3.766 7.104
34 2HG GLU 5 1HG GLU 5 -8.711 -2.868 8.390
35 HA PRO 6 HA PRO 6 -4.142 -5.166 5.007
36 1HB PRO 6 2HB PRO 6 -5.415 -7.545 5.524
37 2HB PRO 6 1HB PRO 6 -4.026 -6.958 6.461
38 1HG PRO 6 2HG PRO 6 -6.939 -6.804 7.098
39 2HG PRO 6 1HG PRO 6 -5.572 -7.200 8.156
40 1HD PRO 6 2HD PRO 6 -6.725 -4.761 8.158
41 2HD PRO 6 1HD PRO 6 -4.983 -4.985 8.449
42 H GLY 7 H GLY 7 -4.783 -5.388 2.890
43 1HA GLY 7 2HA GLY 7 -6.218 -5.713 1.039
44 2HA GLY 7 1HA GLY 7 -7.516 -6.121 2.168
45 H THR 8 H THR 8 -5.511 -3.204 1.573
46 HA THR 8 HA THR 8 -7.895 -1.641 0.863
47 HB THR 8 HB THR 8 -6.425 -1.292 3.491
48 HG1 THR 8 1HG THR 8 -8.003 -2.487 4.138
49 1HG2 THR 8 1HG2 THR 8 -8.321 0.484 1.980
50 2HG2 THR 8 2HG2 THR 8 -6.846 0.915 2.849
51 3HG2 THR 8 3HG2 THR 8 -8.310 0.505 3.744
52 H THR 9 H THR 9 -4.452 -1.708 1.681
53 HA THR 9 HA THR 9 -2.679 -0.279 1.052
54 HB THR 9 HB THR 9 -3.433 -1.635 -0.983
55 HG1 THR 9 1HG THR 9 -1.798 -0.756 -1.965
56 1HG2 THR 9 1HG2 THR 9 -4.315 -0.070 -2.839
57 2HG2 THR 9 2HG2 THR 9 -4.808 0.996 -1.525
58 3HG2 THR 9 3HG2 THR 9 -5.470 -0.636 -1.635
59 H PHE 10 H PHE 10 -2.386 1.938 -0.431
60 HA PHE 10 HA PHE 10 -4.429 3.913 -0.417
61 1HB PHE 10 2HB PHE 10 -3.647 5.076 1.744
62 2HB PHE 10 1HB PHE 10 -4.606 3.613 1.951
63 HD1 PHE 10 1HD PHE 10 -3.734 1.760 3.133
64 HD2 PHE 10 2HD PHE 10 -1.084 4.845 1.751
65 HE1 PHE 10 1HE PHE 10 -1.865 0.714 4.382
66 HE2 PHE 10 2HE PHE 10 0.786 3.798 3.002
67 HZ PHE 10 HZ PHE 10 0.396 1.732 4.318
68 H LYS 11 H LYS 11 -3.335 6.225 -0.157
69 HA LYS 11 HA LYS 11 -0.848 6.175 -1.779
70 1HB LYS 11 2HB LYS 11 -3.183 7.887 -1.352
71 2HB LYS 11 1HB LYS 11 -1.678 8.807 -1.340
72 1HG LYS 11 2HG LYS 11 -1.035 7.741 -3.491
73 2HG LYS 11 1HG LYS 11 -2.584 6.898 -3.515
74 1HD LYS 11 2HD LYS 11 -3.080 8.770 -4.807
75 2HD LYS 11 1HD LYS 11 -3.569 9.326 -3.206
76 1HE LYS 11 2HE LYS 11 -2.093 11.032 -3.386
77 2HE LYS 11 1HE LYS 11 -0.772 9.850 -3.473
78 1HZ LYS 11 1HZ LYS 11 -1.134 9.599 -5.815
79 2HZ LYS 11 2HZ LYS 11 -0.946 11.255 -5.487
80 3HZ LYS 11 3HZ LYS 11 -2.491 10.613 -5.772
81 H ASP 12 H ASP 12 1.134 6.811 -0.910
82 HA ASP 12 HA ASP 12 1.107 8.033 1.824
83 1HB ASP 12 2HB ASP 12 1.491 5.504 1.689
84 2HB ASP 12 1HB ASP 12 3.021 5.887 0.891
85 H LYS 13 H LYS 13 3.192 7.254 -0.972
86 HA LYS 13 HA LYS 13 4.571 9.874 -0.503
87 1HB LYS 13 2HB LYS 13 5.700 7.210 -1.416
88 2HB LYS 13 1HB LYS 13 6.631 8.701 -1.230
89 1HG LYS 13 2HG LYS 13 5.305 8.486 1.194
90 2HG LYS 13 1HG LYS 13 5.713 6.814 0.815
91 1HD LYS 13 2HD LYS 13 8.020 8.202 0.138
92 2HD LYS 13 1HD LYS 13 7.466 9.019 1.600
93 1HE LYS 13 2HE LYS 13 7.638 7.081 2.909
94 2HE LYS 13 1HE LYS 13 7.533 6.006 1.500
95 1HZ LYS 13 1HZ LYS 13 9.729 7.961 1.744
96 2HZ LYS 13 2HZ LYS 13 9.670 6.533 0.825
97 3HZ LYS 13 3HZ LYS 13 9.840 6.454 2.513
98 H CYS 14 H CYS 14 5.827 8.186 -3.152
99 HA CYS 14 HA CYS 14 4.366 9.988 -5.011
100 1HB CYS 14 2HB CYS 14 6.258 9.471 -6.484
101 2HB CYS 14 1HB CYS 14 6.857 9.906 -4.880
102 H ASN 15 H ASN 15 3.244 7.362 -3.885
103 HA ASN 15 HA ASN 15 2.112 6.395 -6.387
104 1HB ASN 15 2HB ASN 15 4.536 5.212 -5.247
105 2HB ASN 15 1HB ASN 15 3.255 4.025 -5.493
106 1HD2 ASN 15 1HD2 ASN 15 5.238 3.505 -7.158
107 2HD2 ASN 15 2HD2 ASN 15 4.978 4.117 -8.730
108 H THR 16 H THR 16 2.818 4.234 -3.711
109 HA THR 16 HA THR 16 0.576 4.735 -2.039
110 HB THR 16 HB THR 16 0.092 3.396 -4.633
111 HG1 THR 16 1HG THR 16 -1.819 4.384 -4.374
112 1HG2 THR 16 1HG2 THR 16 -1.562 1.816 -3.810
113 2HG2 THR 16 2HG2 THR 16 -1.250 2.301 -2.143
114 3HG2 THR 16 3HG2 THR 16 -0.007 1.449 -3.061
115 H CYS 17 H CYS 17 -0.012 2.632 -0.786
116 HA CYS 17 HA CYS 17 2.278 0.709 -0.752
117 1HB CYS 17 2HB CYS 17 2.053 2.833 0.952
118 2HB CYS 17 1HB CYS 17 1.175 1.594 1.854
119 H ARG 18 H ARG 18 1.427 -1.334 -0.829
120 HA ARG 18 HA ARG 18 -1.422 -1.811 -0.384
121 1HB ARG 18 2HB ARG 18 -0.383 -3.035 -2.125
122 2HB ARG 18 1HB ARG 18 1.012 -3.437 -1.124
123 1HG ARG 18 2HG ARG 18 -0.428 -5.404 -1.368
124 2HG ARG 18 1HG ARG 18 -0.449 -4.852 0.306
125 1HD ARG 18 2HD ARG 18 -2.576 -3.613 -0.167
126 2HD ARG 18 1HD ARG 18 -2.575 -4.311 -1.799
127 HE ARG 18 HE ARG 18 -3.196 -5.751 0.660
128 1HH1 ARG 18 1HH2 ARG 18 -3.601 -5.947 -2.567
129 2HH1 ARG 18 2HH2 ARG 18 -3.189 -7.620 -2.745
130 1HH2 ARG 18 1HH1 ARG 18 -1.925 -7.927 0.467
131 2HH2 ARG 18 2HH1 ARG 18 -2.244 -8.741 -1.028
132 H CYS 19 H CYS 19 -2.291 -2.258 1.598
133 HA CYS 19 HA CYS 19 -0.626 -2.683 3.947
134 1HB CYS 19 2HB CYS 19 -2.954 -1.548 3.637
135 2HB CYS 19 1HB CYS 19 -3.593 -3.193 3.728
136 H GLY 20 H GLY 20 0.360 -4.646 4.264
137 1HA GLY 20 2HA GLY 20 -0.267 -7.079 3.000
138 2HA GLY 20 1HA GLY 20 0.594 -6.966 4.538
139 H SER 21 H SER 21 -0.798 -9.089 4.671
140 HA SER 21 HA SER 21 -3.632 -8.727 5.309
141 1HB SER 21 2HB SER 21 -2.026 -10.763 4.443
142 2HB SER 21 1HB SER 21 -2.181 -11.165 6.150
143 HG SER 21 HG SER 21 -3.929 -12.071 5.207
144 H ASP 22 H ASP 22 -0.735 -8.223 7.006
145 HA ASP 22 HA ASP 22 -1.964 -8.830 9.655
146 1HB ASP 22 2HB ASP 22 0.765 -8.555 8.490
147 2HB ASP 22 1HB ASP 22 0.574 -8.072 10.180
148 H GLY 23 H GLY 23 -1.982 -6.309 7.567
149 1HA GLY 23 2HA GLY 23 -2.544 -4.047 7.896
150 2HA GLY 23 1HA GLY 23 -2.610 -4.375 9.631
151 H LYS 24 H LYS 24 -0.198 -4.993 10.449
152 HA LYS 24 HA LYS 24 1.371 -2.556 10.024
153 1HB LYS 24 2HB LYS 24 1.604 -5.069 11.691
154 2HB LYS 24 1HB LYS 24 2.866 -3.837 11.696
155 1HG LYS 24 2HG LYS 24 1.654 -2.502 13.045
156 2HG LYS 24 1HG LYS 24 0.250 -2.623 11.984
157 1HD LYS 24 2HD LYS 24 -0.328 -3.521 14.176
158 2HD LYS 24 1HD LYS 24 -0.283 -4.838 13.004
159 1HE LYS 24 2HE LYS 24 2.288 -4.925 13.814
160 2HE LYS 24 1HE LYS 24 1.543 -4.291 15.296
161 1HZ LYS 24 1HZ LYS 24 1.542 -6.823 14.929
162 2HZ LYS 24 2HZ LYS 24 0.297 -6.518 13.814
163 3HZ LYS 24 3HZ LYS 24 0.104 -6.084 15.446
164 H SER 25 H SER 25 1.310 -3.697 7.570
165 HA SER 25 HA SER 25 4.120 -4.322 7.056
166 1HB SER 25 2HB SER 25 1.921 -6.396 6.863
167 2HB SER 25 1HB SER 25 3.449 -6.561 5.996
168 HG SER 25 HG SER 25 4.075 -7.405 7.827
169 H ALA 26 H ALA 26 4.144 -2.702 5.466
170 HA ALA 26 HA ALA 26 2.095 -2.894 3.294
171 1HB ALA 26 1HB ALA 26 2.627 -0.806 4.851
172 2HB ALA 26 2HB ALA 26 2.270 -0.576 3.138
173 3HB ALA 26 3HB ALA 26 3.942 -0.565 3.701
174 H ALA 27 H ALA 27 2.977 -2.360 1.083
175 HA ALA 27 HA ALA 27 5.692 -3.571 0.734
176 1HB ALA 27 1HB ALA 27 4.427 -4.897 -0.613
177 2HB ALA 27 2HB ALA 27 4.376 -3.518 -1.713
178 3HB ALA 27 3HB ALA 27 3.069 -3.773 -0.556
179 H CYS 28 H CYS 28 3.531 -1.046 -0.484
180 HA CYS 28 HA CYS 28 3.986 1.033 -1.456
181 1HB CYS 28 2HB CYS 28 6.321 0.352 0.252
182 2HB CYS 28 1HB CYS 28 6.551 1.671 -0.896
183 H THR 29 H THR 29 3.920 0.723 -3.672
184 HA THR 29 HA THR 29 5.977 -0.772 -5.111
185 HB THR 29 HB THR 29 3.574 -0.649 -5.746
186 HG1 THR 29 1HG THR 29 5.104 0.650 -7.727
187 1HG2 THR 29 1HG2 THR 29 3.505 1.868 -7.047
188 2HG2 THR 29 2HG2 THR 29 4.083 2.160 -5.406
189 3HG2 THR 29 3HG2 THR 29 2.541 1.343 -5.666
190 H LEU 30 H LEU 30 7.712 0.765 -4.077
191 HA LEU 30 HA LEU 30 7.979 3.482 -4.920
192 1HB LEU 30 2HB LEU 30 10.175 1.479 -4.331
193 2HB LEU 30 1HB LEU 30 10.221 3.224 -4.071
194 HG LEU 30 HG LEU 30 7.925 2.198 -2.719
195 1HD1 LEU 30 1HD1 LEU 30 8.708 0.457 -1.388
196 2HD1 LEU 30 2HD1 LEU 30 10.398 0.890 -1.637
197 3HD1 LEU 30 3HD1 LEU 30 9.498 0.084 -2.920
198 1HD2 LEU 30 1HD2 LEU 30 10.124 3.953 -2.313
199 2HD2 LEU 30 2HD2 LEU 30 10.101 2.835 -0.949
200 3HD2 LEU 30 3HD2 LEU 30 8.673 3.800 -1.323
201 H LYS 31 H LYS 31 8.952 4.384 -6.736
202 HA LYS 31 HA LYS 31 10.214 2.583 -8.744
203 1HB LYS 31 2HB LYS 31 7.547 3.343 -8.839
204 2HB LYS 31 1HB LYS 31 8.333 4.525 -9.888
205 1HG LYS 31 2HG LYS 31 7.813 2.700 -11.319
206 2HG LYS 31 1HG LYS 31 9.532 2.520 -10.965
207 1HD LYS 31 2HD LYS 31 8.270 0.373 -10.748
208 2HD LYS 31 1HD LYS 31 9.047 0.865 -9.242
209 1HE LYS 31 2HE LYS 31 7.048 1.203 -8.180
210 2HE LYS 31 1HE LYS 31 6.294 1.903 -9.625
211 1HZ LYS 31 1HZ LYS 31 6.560 -0.907 -8.846
212 2HZ LYS 31 2HZ LYS 31 6.666 -0.539 -10.502
213 3HZ LYS 31 3HZ LYS 31 5.274 -0.120 -9.623
214 H ALA 32 H ALA 32 9.317 5.919 -7.844
215 HA ALA 32 HA ALA 32 12.000 6.824 -8.772
216 1HB ALA 32 1HB ALA 32 10.089 8.795 -9.501
217 2HB ALA 32 2HB ALA 32 9.468 7.246 -10.069
218 3HB ALA 32 3HB ALA 32 11.063 7.798 -10.580
219 H CYS 33 H CYS 33 8.941 8.105 -7.444
220 HA CYS 33 HA CYS 33 8.571 9.619 -5.665
221 1HB CYS 33 2HB CYS 33 10.515 7.539 -4.885
222 2HB CYS 33 1HB CYS 33 10.504 8.960 -3.835
223 HA PRO 34 HA PRO 34 11.747 12.591 -6.950
224 1HB PRO 34 2HB PRO 34 10.055 14.739 -6.932
225 2HB PRO 34 1HB PRO 34 10.174 13.618 -8.303
226 1HG PRO 34 2HG PRO 34 8.120 13.778 -6.162
227 2HG PRO 34 1HG PRO 34 7.936 13.388 -7.878
228 1HD PRO 34 2HD PRO 34 7.951 11.524 -5.865
229 2HD PRO 34 1HD PRO 34 8.392 11.178 -7.554
230 H GLN 35 H GLN 35 9.988 12.048 -4.135
231 HA GLN 35 HA GLN 35 11.579 14.116 -2.662
232 1HB GLN 35 2HB GLN 35 9.481 14.285 -1.202
233 2HB GLN 35 1HB GLN 35 9.332 14.948 -2.831
234 1HG GLN 35 2HG GLN 35 8.164 13.012 -3.614
235 2HG GLN 35 1HG GLN 35 8.547 12.108 -2.148
236 1HE2 GLN 35 1HE2 GLN 35 6.999 12.183 -0.501
237 2HE2 GLN 35 2HE2 GLN 35 5.728 13.305 -0.421