NMR Restraints Grid
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NMR Restraints Grid |
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Result table
| image | mrblock_id | pdb_id | cing | stage | position | program | type |
|
|
11149 |
1r1f   |
cing | 1-original | 2 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 H THR 1 H THR 1 5.072 6.977 -0.776
2 HA THR 1 HA THR 1 2.537 8.266 -1.249
3 HB THR 1 HB THR 1 4.980 9.259 -2.731
4 HG1 THR 1 1HG THR 1 5.304 10.242 -0.842
5 1HG2 THR 1 1HG2 THR 1 3.401 10.029 -4.119
6 2HG2 THR 1 2HG2 THR 1 2.967 11.159 -2.836
7 3HG2 THR 1 3HG2 THR 1 2.108 9.626 -2.990
8 H PHE 2 H PHE 2 2.358 5.925 -1.605
9 HA PHE 2 HA PHE 2 1.814 4.304 -3.064
10 1HB PHE 2 2HB PHE 2 1.366 5.789 -4.851
11 2HB PHE 2 1HB PHE 2 3.066 6.170 -5.071
12 HD1 PHE 2 1HD PHE 2 3.627 5.561 -7.207
13 HD2 PHE 2 2HD PHE 2 1.305 2.883 -4.851
14 HE1 PHE 2 1HE PHE 2 3.778 3.872 -8.986
15 HE2 PHE 2 2HE PHE 2 1.457 1.188 -6.627
16 HZ PHE 2 HZ PHE 2 2.693 1.680 -8.698
17 H CYS 3 H CYS 3 3.103 2.873 -1.932
18 HA CYS 3 HA CYS 3 5.894 2.543 -2.144
19 1HB CYS 3 2HB CYS 3 4.109 1.438 -0.531
20 2HB CYS 3 1HB CYS 3 4.121 0.168 -1.727
21 H GLY 4 H GLY 4 3.352 0.486 -3.500
22 1HA GLY 4 2HA GLY 4 4.346 0.453 -6.106
23 2HA GLY 4 1HA GLY 4 5.035 -0.918 -5.255
24 H GLU 5 H GLU 5 2.975 -1.763 -3.690
25 HA GLU 5 HA GLU 5 1.240 -2.971 -5.656
26 1HB GLU 5 2HB GLU 5 1.172 -3.305 -2.660
27 2HB GLU 5 1HB GLU 5 0.483 -4.379 -3.863
28 1HG GLU 5 2HG GLU 5 2.646 -5.068 -4.586
29 2HG GLU 5 1HG GLU 5 3.425 -3.843 -3.580
30 H THR 6 H THR 6 -1.045 -3.372 -4.071
31 HA THR 6 HA THR 6 -2.145 -0.776 -3.388
32 HB THR 6 HB THR 6 -3.774 -2.348 -5.317
33 HG1 THR 6 1HG THR 6 -1.462 -0.864 -5.962
34 1HG2 THR 6 1HG2 THR 6 -4.585 -0.119 -5.926
35 2HG2 THR 6 2HG2 THR 6 -3.429 0.597 -4.802
36 3HG2 THR 6 3HG2 THR 6 -4.734 -0.423 -4.195
37 H CYS 7 H CYS 7 -3.872 -0.977 -1.969
38 HA CYS 7 HA CYS 7 -4.381 -3.705 -1.054
39 1HB CYS 7 2HB CYS 7 -5.179 -2.693 1.032
40 2HB CYS 7 1HB CYS 7 -3.532 -2.177 0.685
41 H ARG 8 H ARG 8 -6.084 -4.609 -2.023
42 HA ARG 8 HA ARG 8 -8.408 -3.010 -2.802
43 1HB ARG 8 2HB ARG 8 -8.155 -5.988 -3.155
44 2HB ARG 8 1HB ARG 8 -9.087 -4.842 -4.117
45 1HG ARG 8 2HG ARG 8 -6.138 -4.895 -3.935
46 2HG ARG 8 1HG ARG 8 -7.038 -5.721 -5.213
47 1HD ARG 8 2HD ARG 8 -8.069 -3.511 -5.779
48 2HD ARG 8 1HD ARG 8 -6.972 -2.759 -4.626
49 HE ARG 8 HE ARG 8 -5.491 -4.256 -6.492
50 1HH1 ARG 8 1HH1 ARG 8 -7.361 -1.308 -6.180
51 2HH1 ARG 8 2HH1 ARG 8 -6.568 -0.518 -7.512
52 1HH2 ARG 8 1HH2 ARG 8 -4.415 -3.194 -8.234
53 2HH2 ARG 8 2HH2 ARG 8 -4.882 -1.586 -8.667
54 H VAL 9 H VAL 9 -9.713 -5.907 -2.417
55 HA VAL 9 HA VAL 9 -10.790 -5.168 0.125
56 HB VAL 9 HB VAL 9 -12.443 -7.011 -0.224
57 1HG1 VAL 9 1HG1 VAL 9 -13.460 -5.923 -2.349
58 2HG1 VAL 9 2HG1 VAL 9 -12.110 -4.797 -2.206
59 3HG1 VAL 9 3HG1 VAL 9 -13.271 -4.955 -0.887
60 1HG2 VAL 9 1HG2 VAL 9 -12.533 -8.238 -2.249
61 2HG2 VAL 9 2HG2 VAL 9 -10.867 -8.353 -1.680
62 3HG2 VAL 9 3HG2 VAL 9 -11.278 -7.245 -2.991
63 H ILE 10 H ILE 10 -8.179 -6.107 -0.230
64 HA ILE 10 HA ILE 10 -7.904 -7.889 1.981
65 HB ILE 10 HB ILE 10 -6.212 -9.314 0.584
66 1HG1 ILE 10 2HG1 ILE 10 -8.141 -8.488 -1.599
67 2HG1 ILE 10 1HG1 ILE 10 -6.452 -8.001 -1.494
68 1HG2 ILE 10 1HG2 ILE 10 -8.086 -10.313 1.687
69 2HG2 ILE 10 2HG2 ILE 10 -7.970 -10.981 0.059
70 3HG2 ILE 10 3HG2 ILE 10 -9.186 -9.756 0.425
71 1HD1 ILE 10 1HD1 ILE 10 -5.996 -9.756 -2.765
72 2HD1 ILE 10 2HD1 ILE 10 -7.620 -10.415 -2.559
73 3HD1 ILE 10 3HD1 ILE 10 -6.369 -10.764 -1.366
74 HA PRO 11 HA PRO 11 -5.074 -4.306 1.027
75 1HB PRO 11 2HB PRO 11 -5.584 -3.723 3.874
76 2HB PRO 11 1HB PRO 11 -5.642 -2.654 2.469
77 1HG PRO 11 2HG PRO 11 -7.855 -3.449 3.653
78 2HG PRO 11 1HG PRO 11 -7.779 -3.319 1.888
79 1HD PRO 11 2HD PRO 11 -7.591 -5.768 3.614
80 2HD PRO 11 1HD PRO 11 -8.484 -5.529 2.095
81 H VAL 12 H VAL 12 -3.582 -3.295 2.887
82 HA VAL 12 HA VAL 12 -1.592 -3.389 3.836
83 HB VAL 12 HB VAL 12 -2.223 -6.144 4.883
84 1HG1 VAL 12 1HG1 VAL 12 -1.020 -4.373 6.776
85 2HG1 VAL 12 2HG1 VAL 12 -0.097 -4.334 5.274
86 3HG1 VAL 12 3HG1 VAL 12 -0.385 -5.869 6.092
87 1HG2 VAL 12 1HG2 VAL 12 -3.614 -5.344 6.547
88 2HG2 VAL 12 2HG2 VAL 12 -4.094 -4.336 5.181
89 3HG2 VAL 12 3HG2 VAL 12 -3.005 -3.694 6.411
90 H CYS 13 H CYS 13 -0.952 -3.604 1.567
91 HA CYS 13 HA CYS 13 -0.209 -5.868 0.224
92 1HB CYS 13 2HB CYS 13 1.441 -3.339 0.367
93 2HB CYS 13 1HB CYS 13 1.390 -4.494 -0.961
94 H THR 14 H THR 14 0.868 -7.550 1.002
95 HA THR 14 HA THR 14 2.660 -7.368 3.202
96 HB THR 14 HB THR 14 2.248 -9.799 1.483
97 HG1 THR 14 1HG THR 14 0.417 -8.361 2.934
98 1HG2 THR 14 1HG2 THR 14 2.242 -10.671 4.014
99 2HG2 THR 14 2HG2 THR 14 3.229 -9.226 4.227
100 3HG2 THR 14 3HG2 THR 14 3.730 -10.474 3.086
101 H TYR 15 H TYR 15 3.232 -7.449 -0.269
102 HA TYR 15 HA TYR 15 5.897 -8.465 -0.074
103 1HB TYR 15 2HB TYR 15 4.639 -8.586 -2.177
104 2HB TYR 15 1HB TYR 15 4.595 -6.830 -2.265
105 HD1 TYR 15 1HD TYR 15 5.913 -6.087 -3.997
106 HD2 TYR 15 2HD TYR 15 7.333 -9.295 -1.590
107 HE1 TYR 15 1HE TYR 15 8.022 -6.096 -5.263
108 HE2 TYR 15 2HE TYR 15 9.447 -9.310 -2.847
109 HH TYR 15 HH TYR 15 10.740 -7.323 -4.301
110 H SER 16 H SER 16 4.497 -5.266 -0.415
111 HA SER 16 HA SER 16 7.036 -3.914 -0.123
112 1HB SER 16 2HB SER 16 5.586 -1.861 -0.158
113 2HB SER 16 1HB SER 16 5.377 -2.907 -1.541
114 HG SER 16 HG SER 16 3.494 -3.724 -0.628
115 H ALA 17 H ALA 17 4.854 -5.325 1.990
116 HA ALA 17 HA ALA 17 4.839 -3.588 4.188
117 1HB ALA 17 1HB ALA 17 4.329 -5.605 5.536
118 2HB ALA 17 2HB ALA 17 4.649 -6.595 4.111
119 3HB ALA 17 3HB ALA 17 3.315 -5.442 4.101
120 H ALA 18 H ALA 18 7.348 -5.595 2.927
121 HA ALA 18 HA ALA 18 8.894 -6.100 5.199
122 1HB ALA 18 1HB ALA 18 10.602 -5.491 2.984
123 2HB ALA 18 2HB ALA 18 9.190 -6.380 2.410
124 3HB ALA 18 3HB ALA 18 10.204 -7.061 3.682
125 H LEU 19 H LEU 19 8.625 -3.259 3.171
126 HA LEU 19 HA LEU 19 10.727 -1.785 4.465
127 1HB LEU 19 2HB LEU 19 8.735 -1.289 2.332
128 2HB LEU 19 1HB LEU 19 9.295 0.116 3.207
129 HG LEU 19 HG LEU 19 11.583 -0.354 2.577
130 1HD1 LEU 19 1HD1 LEU 19 11.076 -2.365 0.561
131 2HD1 LEU 19 2HD1 LEU 19 10.688 -2.961 2.174
132 3HD1 LEU 19 3HD1 LEU 19 12.299 -2.331 1.832
133 1HD2 LEU 19 1HD2 LEU 19 11.417 0.136 0.221
134 2HD2 LEU 19 2HD2 LEU 19 10.143 0.988 1.094
135 3HD2 LEU 19 3HD2 LEU 19 9.761 -0.470 0.180
136 H GLY 20 H GLY 20 7.422 -2.385 5.027
137 1HA GLY 20 2HA GLY 20 6.352 -1.863 7.090
138 2HA GLY 20 1HA GLY 20 7.430 -0.475 7.258
139 H CYS 21 H CYS 21 6.264 -1.035 4.167
140 HA CYS 21 HA CYS 21 5.016 1.428 3.841
141 1HB CYS 21 2HB CYS 21 5.230 -1.102 2.309
142 2HB CYS 21 1HB CYS 21 4.003 0.038 1.774
143 H THR 22 H THR 22 2.937 2.124 4.008
144 HA THR 22 HA THR 22 0.961 0.157 4.914
145 HB THR 22 HB THR 22 0.049 2.163 6.298
146 HG1 THR 22 1HG THR 22 2.817 2.833 6.257
147 1HG2 THR 22 1HG2 THR 22 0.654 0.392 7.616
148 2HG2 THR 22 2HG2 THR 22 1.894 1.547 8.103
149 3HG2 THR 22 3HG2 THR 22 2.274 0.289 6.926
150 H CYS 23 H CYS 23 -0.994 0.316 4.112
151 HA CYS 23 HA CYS 23 -1.421 2.217 1.954
152 1HB CYS 23 2HB CYS 23 -1.859 -0.378 1.923
153 2HB CYS 23 1HB CYS 23 -3.344 0.034 2.769
154 H ASP 24 H ASP 24 -3.668 3.152 1.794
155 HA ASP 24 HA ASP 24 -4.410 4.319 4.357
156 1HB ASP 24 2HB ASP 24 -4.151 5.860 2.510
157 2HB ASP 24 1HB ASP 24 -5.257 4.922 1.513
158 H ASP 25 H ASP 25 -5.781 2.415 1.753
159 HA ASP 25 HA ASP 25 -7.540 1.029 1.533
160 1HB ASP 25 2HB ASP 25 -6.493 -0.170 3.404
161 2HB ASP 25 1HB ASP 25 -7.386 0.827 4.547
162 H ARG 26 H ARG 26 -9.316 1.371 0.896
163 HA ARG 26 HA ARG 26 -11.418 2.552 2.495
164 1HB ARG 26 2HB ARG 26 -10.353 3.800 -0.048
165 2HB ARG 26 1HB ARG 26 -11.924 4.142 0.608
166 1HG ARG 26 2HG ARG 26 -9.328 4.697 1.996
167 2HG ARG 26 1HG ARG 26 -10.287 5.887 1.118
168 1HD ARG 26 2HD ARG 26 -12.164 5.453 2.691
169 2HD ARG 26 1HD ARG 26 -11.099 4.386 3.607
170 HE ARG 26 HE ARG 26 -11.147 7.233 3.684
171 1HH1 ARG 26 1HH1 ARG 26 -9.104 4.430 4.164
172 2HH1 ARG 26 2HH1 ARG 26 -7.818 5.343 4.894
173 1HH2 ARG 26 1HH2 ARG 26 -9.454 8.414 4.711
174 2HH2 ARG 26 2HH2 ARG 26 -8.018 7.579 5.206
175 H SER 27 H SER 27 -10.913 0.030 1.688
176 HA SER 27 HA SER 27 -12.090 -1.735 0.823
177 1HB SER 27 2HB SER 27 -13.599 0.259 -0.895
178 2HB SER 27 1HB SER 27 -13.987 -1.439 -0.668
179 HG SER 27 HG SER 27 -13.766 -0.066 1.678
180 H ASP 28 H ASP 28 -10.561 0.765 -0.771
181 HA ASP 28 HA ASP 28 -8.755 -0.735 -2.171
182 1HB ASP 28 2HB ASP 28 -10.608 -1.274 -3.729
183 2HB ASP 28 1HB ASP 28 -10.879 0.448 -3.989
184 H GLY 29 H GLY 29 -7.121 0.591 -3.035
185 1HA GLY 29 2HA GLY 29 -7.437 3.402 -3.350
186 2HA GLY 29 1HA GLY 29 -6.748 3.033 -1.777
187 H LEU 30 H LEU 30 -4.631 2.716 -1.620
188 HA LEU 30 HA LEU 30 -2.994 1.609 -3.640
189 1HB LEU 30 2HB LEU 30 -3.583 3.879 -4.600
190 2HB LEU 30 1HB LEU 30 -2.692 4.584 -3.269
191 HG LEU 30 HG LEU 30 -0.640 3.487 -4.061
192 1HD1 LEU 30 1HD1 LEU 30 -2.256 1.713 -5.296
193 2HD1 LEU 30 2HD1 LEU 30 -0.564 1.964 -5.724
194 3HD1 LEU 30 3HD1 LEU 30 -1.834 2.759 -6.653
195 1HD2 LEU 30 1HD2 LEU 30 -1.874 4.893 -6.400
196 2HD2 LEU 30 2HD2 LEU 30 -0.216 4.973 -5.804
197 3HD2 LEU 30 3HD2 LEU 30 -1.515 5.753 -4.900
198 H CYS 31 H CYS 31 -1.295 0.756 -2.568
199 HA CYS 31 HA CYS 31 -0.861 1.357 0.173
200 1HB CYS 31 2HB CYS 31 0.382 -0.481 -1.811
201 2HB CYS 31 1HB CYS 31 1.313 -0.096 -0.368
202 H LYS 32 H LYS 32 0.652 2.599 1.178
203 HA LYS 32 HA LYS 32 2.098 4.405 -0.596
204 1HB LYS 32 2HB LYS 32 0.663 4.681 1.866
205 2HB LYS 32 1HB LYS 32 2.277 5.312 2.049
206 1HG LYS 32 2HG LYS 32 0.658 7.018 1.312
207 2HG LYS 32 1HG LYS 32 1.957 6.774 0.139
208 1HD LYS 32 2HD LYS 32 0.337 5.070 -0.939
209 2HD LYS 32 1HD LYS 32 -0.909 5.899 -0.004
210 1HE LYS 32 2HE LYS 32 0.946 7.125 -2.035
211 2HE LYS 32 1HE LYS 32 -0.765 6.791 -2.256
212 1HZ LYS 32 1HZ LYS 32 -1.165 8.340 -0.332
213 2HZ LYS 32 2HZ LYS 32 -0.582 9.079 -1.738
214 3HZ LYS 32 3HZ LYS 32 0.463 8.793 -0.439
215 H ARG 33 H ARG 33 4.264 5.012 -0.168
216 HA ARG 33 HA ARG 33 5.896 2.746 0.464
217 1HB ARG 33 2HB ARG 33 6.202 4.492 -1.402
218 2HB ARG 33 1HB ARG 33 6.891 5.519 -0.156
219 1HG ARG 33 2HG ARG 33 8.778 4.229 0.058
220 2HG ARG 33 1HG ARG 33 7.976 2.769 -0.522
221 1HD ARG 33 2HD ARG 33 9.630 3.721 -2.120
222 2HD ARG 33 1HD ARG 33 8.002 3.567 -2.775
223 HE ARG 33 HE ARG 33 9.050 6.148 -1.759
224 1HH1 ARG 33 1HH1 ARG 33 7.456 4.215 -4.222
225 2HH1 ARG 33 2HH1 ARG 33 7.147 5.561 -5.264
226 1HH2 ARG 33 1HH2 ARG 33 8.664 7.927 -3.140
227 2HH2 ARG 33 2HH2 ARG 33 7.835 7.671 -4.653
228 H ASN 34 H ASN 34 8.162 4.391 1.398
229 HA ASN 34 HA ASN 34 7.453 5.236 4.097
230 1HB ASN 34 2HB ASN 34 8.996 2.833 3.403
231 2HB ASN 34 1HB ASN 34 9.645 3.797 4.706
232 1HD2 ASN 34 1HD2 ASN 34 9.234 2.617 6.437
233 2HD2 ASN 34 2HD2 ASN 34 7.696 1.979 6.875
234 H GLY 35 H GLY 35 9.002 6.678 4.953
235 1HA GLY 35 2HA GLY 35 10.912 8.052 4.917
236 2HA GLY 35 1HA GLY 35 11.400 7.286 3.401
237 H ASP 36 H ASP 36 9.160 7.460 1.989
238 HA ASP 36 HA ASP 36 8.220 10.199 1.845
239 1HB ASP 36 2HB ASP 36 8.843 10.524 -0.448
240 2HB ASP 36 1HB ASP 36 10.298 9.998 0.385
241 HA PRO 37 HA PRO 37 5.404 6.290 1.264
242 1HB PRO 37 2HB PRO 37 4.081 7.986 3.380
243 2HB PRO 37 1HB PRO 37 4.010 6.223 3.154
244 1HG PRO 37 2HG PRO 37 5.752 6.979 4.896
245 2HG PRO 37 1HG PRO 37 6.372 6.018 3.554
246 1HD PRO 37 2HD PRO 37 6.368 9.023 3.775
247 2HD PRO 37 1HD PRO 37 7.759 7.938 3.528
Start of MODEL 2
1 H THR 1 H THR 1 5.767 6.353 -0.691
2 HA THR 1 HA THR 1 3.644 7.927 -1.837
3 HB THR 1 HB THR 1 6.151 7.267 -3.419
4 HG1 THR 1 1HG THR 1 6.715 8.861 -1.900
5 1HG2 THR 1 1HG2 THR 1 4.154 9.377 -4.134
6 2HG2 THR 1 2HG2 THR 1 3.789 7.684 -4.469
7 3HG2 THR 1 3HG2 THR 1 5.216 8.437 -5.183
8 H PHE 2 H PHE 2 2.786 6.640 -3.692
9 HA PHE 2 HA PHE 2 2.033 4.142 -3.012
10 1HB PHE 2 2HB PHE 2 0.873 5.170 -4.746
11 2HB PHE 2 1HB PHE 2 2.328 5.504 -5.662
12 HD1 PHE 2 1HD PHE 2 2.169 4.491 -7.706
13 HD2 PHE 2 2HD PHE 2 0.905 2.346 -4.258
14 HE1 PHE 2 1HE PHE 2 1.723 2.519 -9.104
15 HE2 PHE 2 2HE PHE 2 0.459 0.369 -5.650
16 HZ PHE 2 HZ PHE 2 0.867 0.453 -8.075
17 H CYS 3 H CYS 3 3.327 2.603 -2.351
18 HA CYS 3 HA CYS 3 5.938 2.055 -3.051
19 1HB CYS 3 2HB CYS 3 4.109 -0.195 -2.299
20 2HB CYS 3 1HB CYS 3 5.754 0.124 -1.781
21 H GLY 4 H GLY 4 3.181 0.025 -4.026
22 1HA GLY 4 2HA GLY 4 3.703 -0.140 -6.745
23 2HA GLY 4 1HA GLY 4 4.649 -1.412 -5.975
24 H GLU 5 H GLU 5 2.971 -2.076 -3.894
25 HA GLU 5 HA GLU 5 1.036 -3.717 -5.230
26 1HB GLU 5 2HB GLU 5 1.993 -3.374 -2.433
27 2HB GLU 5 1HB GLU 5 0.399 -4.075 -2.666
28 1HG GLU 5 2HG GLU 5 1.893 -5.520 -4.416
29 2HG GLU 5 1HG GLU 5 3.047 -5.223 -3.109
30 H THR 6 H THR 6 -1.239 -3.810 -4.210
31 HA THR 6 HA THR 6 -2.202 -1.119 -3.581
32 HB THR 6 HB THR 6 -4.262 -1.702 -5.005
33 HG1 THR 6 1HG THR 6 -2.505 -3.147 -6.640
34 1HG2 THR 6 1HG2 THR 6 -2.636 -1.137 -7.142
35 2HG2 THR 6 2HG2 THR 6 -1.667 -0.591 -5.773
36 3HG2 THR 6 3HG2 THR 6 -3.291 0.053 -6.016
37 H CYS 7 H CYS 7 -3.089 -1.256 -1.685
38 HA CYS 7 HA CYS 7 -4.194 -3.698 -0.634
39 1HB CYS 7 2HB CYS 7 -4.799 -1.883 1.254
40 2HB CYS 7 1HB CYS 7 -3.183 -2.588 1.122
41 H ARG 8 H ARG 8 -5.636 -3.535 -2.635
42 HA ARG 8 HA ARG 8 -7.878 -1.792 -2.649
43 1HB ARG 8 2HB ARG 8 -8.705 -3.449 -4.407
44 2HB ARG 8 1HB ARG 8 -7.205 -2.638 -4.724
45 1HG ARG 8 2HG ARG 8 -6.049 -4.695 -3.760
46 2HG ARG 8 1HG ARG 8 -7.621 -5.481 -3.920
47 1HD ARG 8 2HD ARG 8 -7.620 -4.870 -6.327
48 2HD ARG 8 1HD ARG 8 -5.992 -4.227 -6.128
49 HE ARG 8 HE ARG 8 -6.718 -6.945 -6.473
50 1HH1 ARG 8 1HH1 ARG 8 -4.356 -4.907 -4.855
51 2HH1 ARG 8 2HH1 ARG 8 -3.189 -6.179 -4.702
52 1HH2 ARG 8 1HH2 ARG 8 -5.148 -8.603 -6.292
53 2HH2 ARG 8 2HH2 ARG 8 -3.632 -8.268 -5.523
54 H VAL 9 H VAL 9 -9.212 -4.647 -3.391
55 HA VAL 9 HA VAL 9 -10.868 -4.675 -0.994
56 HB VAL 9 HB VAL 9 -12.212 -6.382 -2.212
57 1HG1 VAL 9 1HG1 VAL 9 -13.020 -4.230 -2.526
58 2HG1 VAL 9 2HG1 VAL 9 -12.810 -4.813 -4.177
59 3HG1 VAL 9 3HG1 VAL 9 -11.613 -3.732 -3.466
60 1HG2 VAL 9 1HG2 VAL 9 -10.078 -7.102 -3.548
61 2HG2 VAL 9 2HG2 VAL 9 -10.614 -5.859 -4.679
62 3HG2 VAL 9 3HG2 VAL 9 -11.673 -7.215 -4.291
63 H ILE 10 H ILE 10 -8.127 -5.463 -1.033
64 HA ILE 10 HA ILE 10 -8.135 -7.654 0.735
65 HB ILE 10 HB ILE 10 -6.304 -8.871 -0.731
66 1HG1 ILE 10 2HG1 ILE 10 -8.113 -7.718 -2.866
67 2HG1 ILE 10 1HG1 ILE 10 -6.419 -7.306 -2.621
68 1HG2 ILE 10 1HG2 ILE 10 -7.886 -10.353 -0.163
69 2HG2 ILE 10 2HG2 ILE 10 -8.411 -10.146 -1.835
70 3HG2 ILE 10 3HG2 ILE 10 -9.209 -9.249 -0.542
71 1HD1 ILE 10 1HD1 ILE 10 -6.466 -8.811 -4.418
72 2HD1 ILE 10 2HD1 ILE 10 -7.580 -9.897 -3.585
73 3HD1 ILE 10 3HD1 ILE 10 -5.912 -9.749 -3.030
74 HA PRO 11 HA PRO 11 -5.039 -4.187 0.791
75 1HB PRO 11 2HB PRO 11 -5.771 -4.110 3.641
76 2HB PRO 11 1HB PRO 11 -5.703 -2.803 2.455
77 1HG PRO 11 2HG PRO 11 -8.024 -3.748 3.354
78 2HG PRO 11 1HG PRO 11 -7.831 -3.224 1.672
79 1HD PRO 11 2HD PRO 11 -7.851 -6.001 2.801
80 2HD PRO 11 1HD PRO 11 -8.604 -5.385 1.314
81 H VAL 12 H VAL 12 -3.732 -3.766 3.124
82 HA VAL 12 HA VAL 12 -1.922 -4.328 4.282
83 HB VAL 12 HB VAL 12 -2.783 -7.219 4.160
84 1HG1 VAL 12 1HG1 VAL 12 -1.116 -7.617 5.573
85 2HG1 VAL 12 2HG1 VAL 12 -1.652 -6.330 6.652
86 3HG1 VAL 12 3HG1 VAL 12 -0.569 -5.961 5.311
87 1HG2 VAL 12 1HG2 VAL 12 -4.572 -5.522 4.951
88 2HG2 VAL 12 2HG2 VAL 12 -3.564 -5.372 6.390
89 3HG2 VAL 12 3HG2 VAL 12 -4.246 -6.938 5.950
90 H CYS 13 H CYS 13 -1.011 -3.715 2.203
91 HA CYS 13 HA CYS 13 -0.088 -5.374 0.206
92 1HB CYS 13 2HB CYS 13 1.706 -3.205 1.200
93 2HB CYS 13 1HB CYS 13 1.167 -3.547 -0.443
94 H THR 14 H THR 14 0.916 -7.289 0.656
95 HA THR 14 HA THR 14 2.666 -7.605 2.903
96 HB THR 14 HB THR 14 2.146 -9.541 0.645
97 HG1 THR 14 1HG THR 14 0.376 -8.589 2.245
98 1HG2 THR 14 1HG2 THR 14 4.099 -9.833 2.378
99 2HG2 THR 14 2HG2 THR 14 3.068 -11.200 1.959
100 3HG2 THR 14 3HG2 THR 14 2.790 -10.314 3.459
101 H TYR 15 H TYR 15 3.160 -7.300 -0.592
102 HA TYR 15 HA TYR 15 5.936 -7.976 -0.519
103 1HB TYR 15 2HB TYR 15 4.586 -8.141 -2.579
104 2HB TYR 15 1HB TYR 15 4.366 -6.395 -2.574
105 HD1 TYR 15 1HD TYR 15 7.353 -8.589 -2.115
106 HD2 TYR 15 2HD TYR 15 5.531 -5.451 -4.327
107 HE1 TYR 15 1HE TYR 15 9.410 -8.343 -3.441
108 HE2 TYR 15 2HE TYR 15 7.580 -5.193 -5.661
109 HH TYR 15 HH TYR 15 10.522 -6.523 -4.789
110 H SER 16 H SER 16 4.102 -4.994 -0.529
111 HA SER 16 HA SER 16 6.453 -3.322 -0.367
112 1HB SER 16 2HB SER 16 3.537 -2.592 0.007
113 2HB SER 16 1HB SER 16 4.871 -1.480 -0.298
114 HG SER 16 HG SER 16 4.834 -3.403 -2.176
115 H ALA 17 H ALA 17 4.773 -5.193 1.834
116 HA ALA 17 HA ALA 17 4.681 -3.543 4.106
117 1HB ALA 17 1HB ALA 17 4.869 -6.531 3.813
118 2HB ALA 17 2HB ALA 17 3.453 -5.552 4.196
119 3HB ALA 17 3HB ALA 17 4.746 -5.737 5.382
120 H ALA 18 H ALA 18 7.364 -5.158 2.591
121 HA ALA 18 HA ALA 18 9.151 -5.485 4.686
122 1HB ALA 18 1HB ALA 18 9.336 -5.970 2.099
123 2HB ALA 18 2HB ALA 18 10.775 -5.765 3.098
124 3HB ALA 18 3HB ALA 18 10.193 -4.427 2.106
125 H LEU 19 H LEU 19 8.458 -2.608 2.785
126 HA LEU 19 HA LEU 19 10.332 -0.938 4.184
127 1HB LEU 19 2HB LEU 19 8.430 -0.640 1.970
128 2HB LEU 19 1HB LEU 19 8.661 0.791 2.941
129 HG LEU 19 HG LEU 19 10.985 0.861 2.441
130 1HD1 LEU 19 1HD1 LEU 19 10.984 -1.425 0.567
131 2HD1 LEU 19 2HD1 LEU 19 10.923 -1.841 2.280
132 3HD1 LEU 19 3HD1 LEU 19 12.245 -0.854 1.658
133 1HD2 LEU 19 1HD2 LEU 19 10.499 1.864 0.528
134 2HD2 LEU 19 2HD2 LEU 19 8.962 1.000 0.470
135 3HD2 LEU 19 3HD2 LEU 19 10.394 0.304 -0.289
136 H GLY 20 H GLY 20 7.301 -2.089 4.927
137 1HA GLY 20 2HA GLY 20 5.987 -1.599 6.793
138 2HA GLY 20 1HA GLY 20 7.030 -0.216 7.120
139 H CYS 21 H CYS 21 5.614 -0.955 4.057
140 HA CYS 21 HA CYS 21 4.690 1.579 3.496
141 1HB CYS 21 2HB CYS 21 4.202 -1.139 2.396
142 2HB CYS 21 1HB CYS 21 3.102 0.133 1.901
143 H THR 22 H THR 22 3.181 2.728 4.418
144 HA THR 22 HA THR 22 1.009 1.428 5.830
145 HB THR 22 HB THR 22 0.429 3.804 6.485
146 HG1 THR 22 1HG THR 22 3.060 4.549 5.903
147 1HG2 THR 22 1HG2 THR 22 3.023 2.501 7.278
148 2HG2 THR 22 2HG2 THR 22 1.474 2.465 8.121
149 3HG2 THR 22 3HG2 THR 22 2.421 3.953 8.077
150 H CYS 23 H CYS 23 -0.933 1.307 5.076
151 HA CYS 23 HA CYS 23 -1.523 2.466 2.471
152 1HB CYS 23 2HB CYS 23 -1.924 0.040 2.878
153 2HB CYS 23 1HB CYS 23 -3.091 0.450 4.125
154 H ASP 24 H ASP 24 -4.424 2.193 3.169
155 HA ASP 24 HA ASP 24 -4.975 4.291 5.085
156 1HB ASP 24 2HB ASP 24 -4.610 5.644 3.107
157 2HB ASP 24 1HB ASP 24 -5.588 4.559 2.125
158 H ASP 25 H ASP 25 -6.273 2.449 2.402
159 HA ASP 25 HA ASP 25 -8.006 1.095 2.065
160 1HB ASP 25 2HB ASP 25 -6.958 -0.386 3.629
161 2HB ASP 25 1HB ASP 25 -7.636 0.500 4.995
162 H ARG 26 H ARG 26 -9.848 1.293 1.574
163 HA ARG 26 HA ARG 26 -11.912 2.287 3.346
164 1HB ARG 26 2HB ARG 26 -11.822 3.643 0.696
165 2HB ARG 26 1HB ARG 26 -12.419 4.217 2.229
166 1HG ARG 26 2HG ARG 26 -10.016 4.479 2.943
167 2HG ARG 26 1HG ARG 26 -9.602 4.224 1.247
168 1HD ARG 26 2HD ARG 26 -9.704 6.553 1.497
169 2HD ARG 26 1HD ARG 26 -11.235 6.116 0.740
170 HE ARG 26 HE ARG 26 -12.312 6.908 2.582
171 1HH1 ARG 26 1HH1 ARG 26 -8.958 6.327 3.422
172 2HH1 ARG 26 2HH1 ARG 26 -9.134 6.906 5.049
173 1HH2 ARG 26 1HH2 ARG 26 -12.542 7.686 4.739
174 2HH2 ARG 26 2HH2 ARG 26 -11.170 7.680 5.795
175 H SER 27 H SER 27 -11.310 -0.141 2.424
176 HA SER 27 HA SER 27 -12.358 -1.956 1.522
177 1HB SER 27 2HB SER 27 -14.169 -0.008 0.057
178 2HB SER 27 1HB SER 27 -14.388 -1.747 0.187
179 HG SER 27 HG SER 27 -14.103 -0.508 2.603
180 H ASP 28 H ASP 28 -10.624 0.367 0.405
181 HA ASP 28 HA ASP 28 -9.118 -0.915 -1.437
182 1HB ASP 28 2HB ASP 28 -11.223 -0.694 -2.888
183 2HB ASP 28 1HB ASP 28 -10.927 1.040 -2.877
184 H GLY 29 H GLY 29 -7.395 0.514 -2.239
185 1HA GLY 29 2HA GLY 29 -7.422 3.295 -1.656
186 2HA GLY 29 1HA GLY 29 -6.621 2.426 -0.361
187 H LEU 30 H LEU 30 -4.540 2.764 -0.551
188 HA LEU 30 HA LEU 30 -3.103 1.808 -2.828
189 1HB LEU 30 2HB LEU 30 -4.022 4.043 -3.539
190 2HB LEU 30 1HB LEU 30 -3.050 4.769 -2.279
191 HG LEU 30 HG LEU 30 -1.024 3.767 -3.438
192 1HD1 LEU 30 1HD1 LEU 30 -2.158 2.072 -4.739
193 2HD1 LEU 30 2HD1 LEU 30 -1.337 3.201 -5.818
194 3HD1 LEU 30 3HD1 LEU 30 -3.084 3.306 -5.593
195 1HD2 LEU 30 1HD2 LEU 30 -0.793 5.605 -4.860
196 2HD2 LEU 30 2HD2 LEU 30 -1.929 6.161 -3.632
197 3HD2 LEU 30 3HD2 LEU 30 -2.519 5.664 -5.218
198 H CYS 31 H CYS 31 -1.191 1.093 -2.092
199 HA CYS 31 HA CYS 31 -0.386 1.476 0.606
200 1HB CYS 31 2HB CYS 31 1.377 0.406 -1.579
201 2HB CYS 31 1HB CYS 31 1.396 -0.005 0.128
202 H LYS 32 H LYS 32 1.284 2.666 1.474
203 HA LYS 32 HA LYS 32 2.649 4.550 -0.335
204 1HB LYS 32 2HB LYS 32 0.702 5.190 1.467
205 2HB LYS 32 1HB LYS 32 2.139 5.449 2.425
206 1HG LYS 32 2HG LYS 32 1.329 7.484 1.287
207 2HG LYS 32 1HG LYS 32 2.967 7.040 0.799
208 1HD LYS 32 2HD LYS 32 1.442 7.725 -1.094
209 2HD LYS 32 1HD LYS 32 2.204 6.150 -1.268
210 1HE LYS 32 2HE LYS 32 -0.156 6.115 -1.928
211 2HE LYS 32 1HE LYS 32 0.181 5.040 -0.578
212 1HZ LYS 32 1HZ LYS 32 -1.618 6.039 0.294
213 2HZ LYS 32 2HZ LYS 32 -1.469 7.429 -0.659
214 3HZ LYS 32 3HZ LYS 32 -0.519 7.250 0.730
215 H ARG 33 H ARG 33 4.839 4.730 -0.024
216 HA ARG 33 HA ARG 33 6.094 2.715 1.570
217 1HB ARG 33 2HB ARG 33 7.222 4.905 -0.167
218 2HB ARG 33 1HB ARG 33 8.227 3.731 0.672
219 1HG ARG 33 2HG ARG 33 7.066 1.924 -0.529
220 2HG ARG 33 1HG ARG 33 6.140 3.135 -1.412
221 1HD ARG 33 2HD ARG 33 9.149 2.952 -1.445
222 2HD ARG 33 1HD ARG 33 8.104 2.200 -2.648
223 HE ARG 33 HE ARG 33 7.568 4.322 -3.484
224 1HH1 ARG 33 1HH1 ARG 33 9.873 4.492 -0.858
225 2HH1 ARG 33 2HH1 ARG 33 10.313 6.148 -1.167
226 1HH2 ARG 33 1HH2 ARG 33 8.160 6.501 -3.904
227 2HH2 ARG 33 2HH2 ARG 33 9.349 7.282 -2.894
228 H ASN 34 H ASN 34 8.528 4.407 1.970
229 HA ASN 34 HA ASN 34 7.837 6.148 4.189
230 1HB ASN 34 2HB ASN 34 9.141 3.515 4.461
231 2HB ASN 34 1HB ASN 34 9.712 4.793 5.497
232 1HD2 ASN 34 1HD2 ASN 34 7.895 2.214 5.504
233 2HD2 ASN 34 2HD2 ASN 34 6.618 2.673 6.565
234 H GLY 35 H GLY 35 9.735 7.370 4.936
235 1HA GLY 35 2HA GLY 35 11.836 8.387 4.621
236 2HA GLY 35 1HA GLY 35 12.109 7.332 3.230
237 H ASP 36 H ASP 36 9.896 7.633 1.881
238 HA ASP 36 HA ASP 36 9.176 10.361 1.358
239 1HB ASP 36 2HB ASP 36 9.817 10.346 -1.000
240 2HB ASP 36 1HB ASP 36 11.251 10.078 -0.019
241 HA PRO 37 HA PRO 37 6.227 6.570 1.352
242 1HB PRO 37 2HB PRO 37 4.886 8.889 2.762
243 2HB PRO 37 1HB PRO 37 4.604 7.149 3.006
244 1HG PRO 37 2HG PRO 37 6.275 8.165 4.666
245 2HG PRO 37 1HG PRO 37 6.888 6.826 3.698
246 1HD PRO 37 2HD PRO 37 7.268 9.770 3.192
247 2HD PRO 37 1HD PRO 37 8.504 8.495 3.308
Start of MODEL 3
1 H THR 1 H THR 1 5.762 6.379 -0.916
2 HA THR 1 HA THR 1 3.484 7.750 -2.050
3 HB THR 1 HB THR 1 6.180 7.475 -3.441
4 HG1 THR 1 1HG THR 1 6.586 9.405 -2.663
5 1HG2 THR 1 1HG2 THR 1 3.650 7.616 -4.570
6 2HG2 THR 1 2HG2 THR 1 5.174 7.984 -5.378
7 3HG2 THR 1 3HG2 THR 1 4.236 9.279 -4.635
8 H PHE 2 H PHE 2 2.670 6.463 -3.811
9 HA PHE 2 HA PHE 2 2.081 3.954 -3.330
10 1HB PHE 2 2HB PHE 2 1.056 5.129 -5.143
11 2HB PHE 2 1HB PHE 2 2.570 5.213 -6.030
12 HD1 PHE 2 1HD PHE 2 2.175 4.129 -8.014
13 HD2 PHE 2 2HD PHE 2 0.942 2.295 -4.378
14 HE1 PHE 2 1HE PHE 2 1.558 2.098 -9.254
15 HE2 PHE 2 2HE PHE 2 0.325 0.261 -5.613
16 HZ PHE 2 HZ PHE 2 0.631 0.161 -8.053
17 H CYS 3 H CYS 3 3.494 2.524 -2.553
18 HA CYS 3 HA CYS 3 6.108 2.017 -3.368
19 1HB CYS 3 2HB CYS 3 4.292 -0.131 -2.285
20 2HB CYS 3 1HB CYS 3 6.014 0.080 -2.030
21 H GLY 4 H GLY 4 3.298 -0.084 -4.023
22 1HA GLY 4 2HA GLY 4 3.774 -0.401 -6.770
23 2HA GLY 4 1HA GLY 4 4.602 -1.695 -5.917
24 H GLU 5 H GLU 5 2.804 -2.160 -3.851
25 HA GLU 5 HA GLU 5 0.786 -3.668 -5.251
26 1HB GLU 5 2HB GLU 5 1.084 -3.321 -2.270
27 2HB GLU 5 1HB GLU 5 0.238 -4.607 -3.113
28 1HG GLU 5 2HG GLU 5 2.278 -5.550 -3.878
29 2HG GLU 5 1HG GLU 5 3.199 -4.158 -3.302
30 H THR 6 H THR 6 -1.456 -3.684 -4.200
31 HA THR 6 HA THR 6 -2.350 -1.050 -3.345
32 HB THR 6 HB THR 6 -4.399 -1.438 -4.947
33 HG1 THR 6 1HG THR 6 -2.301 -2.926 -6.172
34 1HG2 THR 6 1HG2 THR 6 -3.349 0.543 -5.368
35 2HG2 THR 6 2HG2 THR 6 -2.883 -0.324 -6.832
36 3HG2 THR 6 3HG2 THR 6 -1.752 -0.199 -5.484
37 H CYS 7 H CYS 7 -3.507 -1.352 -1.583
38 HA CYS 7 HA CYS 7 -4.442 -3.948 -0.829
39 1HB CYS 7 2HB CYS 7 -5.336 -2.707 1.182
40 2HB CYS 7 1HB CYS 7 -3.593 -2.570 0.957
41 H ARG 8 H ARG 8 -5.755 -4.100 -2.816
42 HA ARG 8 HA ARG 8 -8.065 -2.562 -3.275
43 1HB ARG 8 2HB ARG 8 -6.710 -4.254 -4.765
44 2HB ARG 8 1HB ARG 8 -7.877 -5.398 -4.206
45 1HG ARG 8 2HG ARG 8 -8.629 -4.560 -6.289
46 2HG ARG 8 1HG ARG 8 -9.674 -3.890 -5.033
47 1HD ARG 8 2HD ARG 8 -9.143 -2.128 -6.552
48 2HD ARG 8 1HD ARG 8 -8.258 -1.837 -5.055
49 HE ARG 8 HE ARG 8 -6.629 -3.265 -6.848
50 1HH1 ARG 8 1HH1 ARG 8 -7.992 -0.089 -6.297
51 2HH1 ARG 8 2HH1 ARG 8 -6.742 0.734 -7.181
52 1HH2 ARG 8 1HH2 ARG 8 -4.963 -2.178 -7.999
53 2HH2 ARG 8 2HH2 ARG 8 -5.022 -0.455 -8.153
54 H VAL 9 H VAL 9 -8.763 -5.925 -3.140
55 HA VAL 9 HA VAL 9 -10.976 -5.422 -1.325
56 HB VAL 9 HB VAL 9 -10.222 -8.001 -2.721
57 1HG1 VAL 9 1HG1 VAL 9 -11.836 -7.868 -0.635
58 2HG1 VAL 9 2HG1 VAL 9 -12.191 -8.916 -2.009
59 3HG1 VAL 9 3HG1 VAL 9 -12.994 -7.352 -1.862
60 1HG2 VAL 9 1HG2 VAL 9 -12.024 -5.746 -3.570
61 2HG2 VAL 9 2HG2 VAL 9 -12.128 -7.366 -4.258
62 3HG2 VAL 9 3HG2 VAL 9 -10.647 -6.426 -4.435
63 H ILE 10 H ILE 10 -8.013 -7.237 -1.497
64 HA ILE 10 HA ILE 10 -8.239 -7.865 1.362
65 HB ILE 10 HB ILE 10 -6.466 -9.626 0.911
66 1HG1 ILE 10 2HG1 ILE 10 -5.969 -8.679 -1.435
67 2HG1 ILE 10 1HG1 ILE 10 -6.013 -10.426 -1.248
68 1HG2 ILE 10 1HG2 ILE 10 -9.317 -9.723 0.328
69 2HG2 ILE 10 2HG2 ILE 10 -8.322 -10.777 1.332
70 3HG2 ILE 10 3HG2 ILE 10 -8.399 -11.036 -0.411
71 1HD1 ILE 10 1HD1 ILE 10 -8.200 -10.519 -2.250
72 2HD1 ILE 10 2HD1 ILE 10 -7.107 -9.623 -3.305
73 3HD1 ILE 10 3HD1 ILE 10 -8.282 -8.759 -2.314
74 HA PRO 11 HA PRO 11 -5.181 -4.546 0.853
75 1HB PRO 11 2HB PRO 11 -5.784 -4.166 3.716
76 2HB PRO 11 1HB PRO 11 -5.803 -3.000 2.389
77 1HG PRO 11 2HG PRO 11 -8.044 -3.857 3.446
78 2HG PRO 11 1HG PRO 11 -7.913 -3.631 1.692
79 1HD PRO 11 2HD PRO 11 -7.744 -6.186 3.273
80 2HD PRO 11 1HD PRO 11 -8.628 -5.860 1.764
81 H VAL 12 H VAL 12 -3.894 -3.738 3.105
82 HA VAL 12 HA VAL 12 -2.031 -3.960 4.257
83 HB VAL 12 HB VAL 12 -2.567 -6.921 4.479
84 1HG1 VAL 12 1HG1 VAL 12 -1.141 -6.947 6.298
85 2HG1 VAL 12 2HG1 VAL 12 -1.296 -5.213 6.579
86 3HG1 VAL 12 3HG1 VAL 12 -0.346 -5.804 5.215
87 1HG2 VAL 12 1HG2 VAL 12 -3.574 -4.765 6.338
88 2HG2 VAL 12 2HG2 VAL 12 -3.864 -6.500 6.466
89 3HG2 VAL 12 3HG2 VAL 12 -4.565 -5.585 5.131
90 H CYS 13 H CYS 13 -0.928 -3.422 2.404
91 HA CYS 13 HA CYS 13 0.107 -5.041 0.423
92 1HB CYS 13 2HB CYS 13 1.845 -2.914 1.600
93 2HB CYS 13 1HB CYS 13 1.435 -3.216 -0.089
94 H THR 14 H THR 14 1.054 -6.975 0.864
95 HA THR 14 HA THR 14 2.700 -7.335 3.205
96 HB THR 14 HB THR 14 2.038 -9.368 1.083
97 HG1 THR 14 1HG THR 14 0.331 -8.088 2.577
98 1HG2 THR 14 1HG2 THR 14 2.655 -11.001 2.619
99 2HG2 THR 14 2HG2 THR 14 2.496 -9.910 3.996
100 3HG2 THR 14 3HG2 THR 14 3.866 -9.750 2.897
101 H TYR 15 H TYR 15 3.318 -7.157 -0.288
102 HA TYR 15 HA TYR 15 5.952 -8.266 -0.079
103 1HB TYR 15 2HB TYR 15 4.649 -8.325 -2.178
104 2HB TYR 15 1HB TYR 15 4.758 -6.573 -2.284
105 HD1 TYR 15 1HD TYR 15 6.137 -5.983 -4.034
106 HD2 TYR 15 2HD TYR 15 7.278 -9.241 -1.546
107 HE1 TYR 15 1HE TYR 15 8.244 -6.190 -5.282
108 HE2 TYR 15 2HE TYR 15 9.391 -9.455 -2.787
109 HH TYR 15 HH TYR 15 10.863 -7.761 -4.221
110 H SER 16 H SER 16 4.659 -5.018 -0.378
111 HA SER 16 HA SER 16 7.292 -3.806 -0.050
112 1HB SER 16 2HB SER 16 6.027 -1.674 -0.332
113 2HB SER 16 1HB SER 16 5.734 -2.814 -1.635
114 HG SER 16 HG SER 16 3.786 -3.430 -0.516
115 H ALA 17 H ALA 17 5.322 -5.292 1.989
116 HA ALA 17 HA ALA 17 4.909 -3.516 4.124
117 1HB ALA 17 1HB ALA 17 3.944 -5.275 5.092
118 2HB ALA 17 2HB ALA 17 5.421 -6.235 5.000
119 3HB ALA 17 3HB ALA 17 4.324 -6.169 3.620
120 H ALA 18 H ALA 18 7.773 -5.167 3.059
121 HA ALA 18 HA ALA 18 9.279 -5.324 5.394
122 1HB ALA 18 1HB ALA 18 11.240 -5.313 3.986
123 2HB ALA 18 2HB ALA 18 10.328 -4.591 2.659
124 3HB ALA 18 3HB ALA 18 9.965 -6.234 3.189
125 H LEU 19 H LEU 19 8.736 -2.632 3.221
126 HA LEU 19 HA LEU 19 10.381 -0.801 4.719
127 1HB LEU 19 2HB LEU 19 8.877 -0.758 2.212
128 2HB LEU 19 1HB LEU 19 8.891 0.756 3.075
129 HG LEU 19 HG LEU 19 11.249 0.905 2.974
130 1HD1 LEU 19 1HD1 LEU 19 12.031 -1.321 1.387
131 2HD1 LEU 19 2HD1 LEU 19 11.134 -1.941 2.772
132 3HD1 LEU 19 3HD1 LEU 19 12.544 -0.912 3.023
133 1HD2 LEU 19 1HD2 LEU 19 10.090 -0.011 0.348
134 2HD2 LEU 19 2HD2 LEU 19 11.667 0.761 0.511
135 3HD2 LEU 19 3HD2 LEU 19 10.204 1.638 0.963
136 H GLY 20 H GLY 20 7.337 -2.004 5.127
137 1HA GLY 20 2HA GLY 20 5.801 -1.435 6.790
138 2HA GLY 20 1HA GLY 20 6.693 0.061 7.057
139 H CYS 21 H CYS 21 5.739 -1.036 3.922
140 HA CYS 21 HA CYS 21 4.519 1.374 3.191
141 1HB CYS 21 2HB CYS 21 4.681 -1.360 2.016
142 2HB CYS 21 1HB CYS 21 3.511 -0.241 1.344
143 H THR 22 H THR 22 2.806 2.099 4.247
144 HA THR 22 HA THR 22 0.550 0.263 4.597
145 HB THR 22 HB THR 22 -0.228 2.073 6.264
146 HG1 THR 22 1HG THR 22 2.591 2.541 6.304
147 1HG2 THR 22 1HG2 THR 22 0.496 0.740 7.974
148 2HG2 THR 22 2HG2 THR 22 2.141 0.640 7.346
149 3HG2 THR 22 3HG2 THR 22 0.859 -0.328 6.617
150 H CYS 23 H CYS 23 -1.247 0.714 3.594
151 HA CYS 23 HA CYS 23 -1.294 3.058 1.880
152 1HB CYS 23 2HB CYS 23 -3.168 1.938 0.758
153 2HB CYS 23 1HB CYS 23 -1.747 0.907 0.850
154 H ASP 24 H ASP 24 -4.293 2.763 1.792
155 HA ASP 24 HA ASP 24 -4.892 4.363 4.187
156 1HB ASP 24 2HB ASP 24 -5.057 5.499 1.945
157 2HB ASP 24 1HB ASP 24 -6.348 4.378 1.532
158 H ASP 25 H ASP 25 -6.362 2.141 1.866
159 HA ASP 25 HA ASP 25 -7.903 0.519 1.957
160 1HB ASP 25 2HB ASP 25 -6.426 -0.573 3.574
161 2HB ASP 25 1HB ASP 25 -7.173 0.334 4.889
162 H ARG 26 H ARG 26 -9.743 0.806 1.561
163 HA ARG 26 HA ARG 26 -11.811 1.379 3.408
164 1HB ARG 26 2HB ARG 26 -10.667 3.602 1.803
165 2HB ARG 26 1HB ARG 26 -12.406 3.481 1.854
166 1HG ARG 26 2HG ARG 26 -12.529 4.107 4.027
167 2HG ARG 26 1HG ARG 26 -11.017 3.299 4.443
168 1HD ARG 26 2HD ARG 26 -9.735 5.083 3.475
169 2HD ARG 26 1HD ARG 26 -11.197 5.853 2.858
170 HE ARG 26 HE ARG 26 -11.655 5.759 5.508
171 1HH1 ARG 26 1HH1 ARG 26 -8.859 6.780 3.689
172 2HH1 ARG 26 2HH1 ARG 26 -8.447 8.055 4.793
173 1HH2 ARG 26 1HH2 ARG 26 -11.133 7.457 6.968
174 2HH2 ARG 26 2HH2 ARG 26 -9.752 8.450 6.653
175 H SER 27 H SER 27 -11.414 -0.693 1.946
176 HA SER 27 HA SER 27 -12.571 -2.122 0.583
177 1HB SER 27 2HB SER 27 -14.602 -0.673 0.654
178 2HB SER 27 1HB SER 27 -13.920 0.308 -0.642
179 HG SER 27 HG SER 27 -13.788 -1.888 -1.748
180 H ASP 28 H ASP 28 -10.605 0.404 -0.017
181 HA ASP 28 HA ASP 28 -8.924 -0.788 -1.786
182 1HB ASP 28 2HB ASP 28 -10.876 -0.427 -3.407
183 2HB ASP 28 1HB ASP 28 -10.552 1.295 -3.258
184 H GLY 29 H GLY 29 -7.316 0.853 -2.717
185 1HA GLY 29 2HA GLY 29 -7.243 3.513 -1.833
186 2HA GLY 29 1HA GLY 29 -6.422 2.535 -0.629
187 H LEU 30 H LEU 30 -4.358 2.934 -0.875
188 HA LEU 30 HA LEU 30 -2.982 2.034 -3.214
189 1HB LEU 30 2HB LEU 30 -3.886 4.324 -3.804
190 2HB LEU 30 1HB LEU 30 -2.854 4.966 -2.549
191 HG LEU 30 HG LEU 30 -0.889 4.008 -3.810
192 1HD1 LEU 30 1HD1 LEU 30 -1.163 2.774 -5.646
193 2HD1 LEU 30 2HD1 LEU 30 -2.329 3.910 -6.327
194 3HD1 LEU 30 3HD1 LEU 30 -2.866 2.665 -5.200
195 1HD2 LEU 30 1HD2 LEU 30 -2.493 5.931 -5.469
196 2HD2 LEU 30 2HD2 LEU 30 -0.741 5.837 -5.287
197 3HD2 LEU 30 3HD2 LEU 30 -1.738 6.396 -3.944
198 H CYS 31 H CYS 31 -1.192 1.121 -2.386
199 HA CYS 31 HA CYS 31 -0.365 1.485 0.286
200 1HB CYS 31 2HB CYS 31 1.128 0.236 -2.017
201 2HB CYS 31 1HB CYS 31 1.525 0.034 -0.316
202 H LYS 32 H LYS 32 1.149 2.748 1.219
203 HA LYS 32 HA LYS 32 2.736 4.457 -0.575
204 1HB LYS 32 2HB LYS 32 0.901 5.142 1.550
205 2HB LYS 32 1HB LYS 32 2.489 5.803 1.865
206 1HG LYS 32 2HG LYS 32 1.076 7.369 0.632
207 2HG LYS 32 1HG LYS 32 2.490 6.891 -0.312
208 1HD LYS 32 2HD LYS 32 1.016 5.136 -1.383
209 2HD LYS 32 1HD LYS 32 -0.354 5.949 -0.622
210 1HE LYS 32 2HE LYS 32 1.544 6.992 -2.696
211 2HE LYS 32 1HE LYS 32 -0.196 6.773 -2.826
212 1HZ LYS 32 1HZ LYS 32 -0.041 9.026 -2.459
213 2HZ LYS 32 2HZ LYS 32 1.299 8.893 -1.434
214 3HZ LYS 32 3HZ LYS 32 -0.240 8.470 -0.872
215 H ARG 33 H ARG 33 4.850 4.804 -0.066
216 HA ARG 33 HA ARG 33 6.134 2.769 1.470
217 1HB ARG 33 2HB ARG 33 6.769 4.378 -0.715
218 2HB ARG 33 1HB ARG 33 7.886 4.889 0.542
219 1HG ARG 33 2HG ARG 33 8.811 2.738 0.740
220 2HG ARG 33 1HG ARG 33 7.492 2.001 -0.167
221 1HD ARG 33 2HD ARG 33 9.433 2.097 -1.575
222 2HD ARG 33 1HD ARG 33 8.243 3.247 -2.178
223 HE ARG 33 HE ARG 33 10.758 3.898 -0.809
224 1HH1 ARG 33 1HH1 ARG 33 7.967 4.943 -2.664
225 2HH1 ARG 33 2HH1 ARG 33 8.592 6.546 -2.923
226 1HH2 ARG 33 1HH2 ARG 33 11.572 6.013 -1.207
227 2HH2 ARG 33 2HH2 ARG 33 10.605 7.144 -2.119
228 H ASN 34 H ASN 34 8.444 4.634 2.025
229 HA ASN 34 HA ASN 34 7.564 6.255 4.264
230 1HB ASN 34 2HB ASN 34 8.936 3.676 4.537
231 2HB ASN 34 1HB ASN 34 9.509 4.952 5.579
232 1HD2 ASN 34 1HD2 ASN 34 7.696 2.365 5.563
233 2HD2 ASN 34 2HD2 ASN 34 6.440 2.807 6.648
234 H GLY 35 H GLY 35 9.196 7.743 4.930
235 1HA GLY 35 2HA GLY 35 11.192 8.965 4.702
236 2HA GLY 35 1HA GLY 35 11.769 7.754 3.550
237 H ASP 36 H ASP 36 9.628 7.630 1.960
238 HA ASP 36 HA ASP 36 8.911 10.185 0.844
239 1HB ASP 36 2HB ASP 36 10.899 9.897 -0.436
240 2HB ASP 36 1HB ASP 36 10.664 8.161 -0.568
241 HA PRO 37 HA PRO 37 5.985 6.433 1.210
242 1HB PRO 37 2HB PRO 37 4.474 8.668 2.554
243 2HB PRO 37 1HB PRO 37 4.477 6.930 2.933
244 1HG PRO 37 2HG PRO 37 6.006 8.337 4.452
245 2HG PRO 37 1HG PRO 37 6.790 7.019 3.583
246 1HD PRO 37 2HD PRO 37 6.646 9.905 2.697
247 2HD PRO 37 1HD PRO 37 8.108 8.938 3.037
Start of MODEL 4
1 H THR 1 H THR 1 5.998 6.246 -0.846
2 HA THR 1 HA THR 1 4.086 7.899 -2.211
3 HB THR 1 HB THR 1 6.608 6.967 -3.633
4 HG1 THR 1 1HG THR 1 7.566 8.693 -2.853
5 1HG2 THR 1 1HG2 THR 1 5.752 7.866 -5.528
6 2HG2 THR 1 2HG2 THR 1 4.979 9.200 -4.673
7 3HG2 THR 1 3HG2 THR 1 4.214 7.611 -4.704
8 H PHE 2 H PHE 2 3.237 6.522 -4.037
9 HA PHE 2 HA PHE 2 2.343 4.096 -3.193
10 1HB PHE 2 2HB PHE 2 1.261 5.085 -5.017
11 2HB PHE 2 1HB PHE 2 2.747 5.255 -5.930
12 HD1 PHE 2 1HD PHE 2 0.986 2.371 -4.319
13 HD2 PHE 2 2HD PHE 2 2.682 4.018 -7.858
14 HE1 PHE 2 1HE PHE 2 0.450 0.303 -5.536
15 HE2 PHE 2 2HE PHE 2 2.148 1.951 -9.080
16 HZ PHE 2 HZ PHE 2 1.029 0.091 -7.918
17 H CYS 3 H CYS 3 3.596 2.549 -2.421
18 HA CYS 3 HA CYS 3 6.196 1.904 -3.082
19 1HB CYS 3 2HB CYS 3 4.301 -0.246 -2.192
20 2HB CYS 3 1HB CYS 3 5.959 0.051 -1.699
21 H GLY 4 H GLY 4 3.401 -0.137 -3.970
22 1HA GLY 4 2HA GLY 4 3.621 -0.383 -6.633
23 2HA GLY 4 1HA GLY 4 4.962 -1.373 -6.078
24 H GLU 5 H GLU 5 1.730 -0.989 -4.670
25 HA GLU 5 HA GLU 5 0.882 -3.618 -5.534
26 1HB GLU 5 2HB GLU 5 1.178 -2.949 -2.591
27 2HB GLU 5 1HB GLU 5 0.351 -4.362 -3.225
28 1HG GLU 5 2HG GLU 5 2.391 -5.281 -4.034
29 2HG GLU 5 1HG GLU 5 3.267 -3.795 -3.670
30 H THR 6 H THR 6 -1.420 -3.931 -5.071
31 HA THR 6 HA THR 6 -2.741 -1.367 -4.497
32 HB THR 6 HB THR 6 -4.655 -2.206 -5.835
33 HG1 THR 6 1HG THR 6 -3.732 -4.484 -5.706
34 1HG2 THR 6 1HG2 THR 6 -3.844 -1.158 -7.657
35 2HG2 THR 6 2HG2 THR 6 -2.480 -2.264 -7.805
36 3HG2 THR 6 3HG2 THR 6 -2.404 -0.917 -6.670
37 H CYS 7 H CYS 7 -3.422 -1.438 -2.522
38 HA CYS 7 HA CYS 7 -4.371 -3.860 -1.259
39 1HB CYS 7 2HB CYS 7 -4.821 -1.952 0.592
40 2HB CYS 7 1HB CYS 7 -3.229 -2.687 0.377
41 H ARG 8 H ARG 8 -5.992 -3.645 -3.234
42 HA ARG 8 HA ARG 8 -8.248 -1.928 -2.865
43 1HB ARG 8 2HB ARG 8 -7.366 -3.929 -4.818
44 2HB ARG 8 1HB ARG 8 -9.111 -3.856 -4.600
45 1HG ARG 8 2HG ARG 8 -9.047 -1.450 -5.033
46 2HG ARG 8 1HG ARG 8 -7.308 -1.555 -5.308
47 1HD ARG 8 2HD ARG 8 -8.649 -1.528 -7.394
48 2HD ARG 8 1HD ARG 8 -7.636 -2.957 -7.222
49 HE ARG 8 HE ARG 8 -9.524 -4.191 -7.398
50 1HH1 ARG 8 1HH1 ARG 8 -10.483 -1.089 -6.011
51 2HH1 ARG 8 2HH1 ARG 8 -12.170 -1.501 -6.009
52 1HH2 ARG 8 1HH2 ARG 8 -11.752 -4.691 -7.384
53 2HH2 ARG 8 2HH2 ARG 8 -12.889 -3.531 -6.783
54 H VAL 9 H VAL 9 -8.804 -5.323 -3.471
55 HA VAL 9 HA VAL 9 -10.843 -5.348 -1.409
56 HB VAL 9 HB VAL 9 -10.062 -7.565 -3.318
57 1HG1 VAL 9 1HG1 VAL 9 -11.340 -8.690 -1.815
58 2HG1 VAL 9 2HG1 VAL 9 -12.635 -8.025 -2.811
59 3HG1 VAL 9 3HG1 VAL 9 -12.199 -7.241 -1.292
60 1HG2 VAL 9 1HG2 VAL 9 -12.406 -5.720 -3.655
61 2HG2 VAL 9 2HG2 VAL 9 -11.688 -6.820 -4.832
62 3HG2 VAL 9 3HG2 VAL 9 -10.827 -5.358 -4.352
63 H ILE 10 H ILE 10 -7.729 -6.624 -2.098
64 HA ILE 10 HA ILE 10 -7.613 -7.882 0.552
65 HB ILE 10 HB ILE 10 -5.667 -9.225 -0.474
66 1HG1 ILE 10 2HG1 ILE 10 -7.122 -8.478 -3.024
67 2HG1 ILE 10 1HG1 ILE 10 -5.517 -7.917 -2.572
68 1HG2 ILE 10 1HG2 ILE 10 -8.503 -9.667 -0.461
69 2HG2 ILE 10 2HG2 ILE 10 -7.191 -10.804 -0.151
70 3HG2 ILE 10 3HG2 ILE 10 -7.754 -10.535 -1.800
71 1HD1 ILE 10 1HD1 ILE 10 -6.087 -10.109 -4.110
72 2HD1 ILE 10 2HD1 ILE 10 -5.757 -10.813 -2.528
73 3HD1 ILE 10 3HD1 ILE 10 -4.554 -9.783 -3.302
74 HA PRO 11 HA PRO 11 -4.956 -4.144 0.324
75 1HB PRO 11 2HB PRO 11 -5.644 -3.969 3.181
76 2HB PRO 11 1HB PRO 11 -5.805 -2.759 1.902
77 1HG PRO 11 2HG PRO 11 -7.923 -3.973 2.945
78 2HG PRO 11 1HG PRO 11 -7.851 -3.573 1.219
79 1HD PRO 11 2HD PRO 11 -7.371 -6.213 2.569
80 2HD PRO 11 1HD PRO 11 -8.290 -5.861 1.088
81 H VAL 12 H VAL 12 -3.956 -3.578 2.983
82 HA VAL 12 HA VAL 12 -1.948 -3.675 3.901
83 HB VAL 12 HB VAL 12 -1.458 -5.836 5.158
84 1HG1 VAL 12 1HG1 VAL 12 -4.124 -4.489 5.589
85 2HG1 VAL 12 2HG1 VAL 12 -2.562 -3.881 6.139
86 3HG1 VAL 12 3HG1 VAL 12 -3.205 -5.387 6.797
87 1HG2 VAL 12 1HG2 VAL 12 -2.734 -7.666 4.968
88 2HG2 VAL 12 2HG2 VAL 12 -3.250 -6.977 3.428
89 3HG2 VAL 12 3HG2 VAL 12 -4.227 -6.730 4.876
90 H CYS 13 H CYS 13 -0.881 -3.325 2.001
91 HA CYS 13 HA CYS 13 0.244 -5.040 0.195
92 1HB CYS 13 2HB CYS 13 1.949 -2.859 1.311
93 2HB CYS 13 1HB CYS 13 1.567 -3.233 -0.370
94 H THR 14 H THR 14 1.060 -6.966 0.873
95 HA THR 14 HA THR 14 2.651 -7.246 3.227
96 HB THR 14 HB THR 14 2.201 -9.320 1.087
97 HG1 THR 14 1HG THR 14 0.368 -8.052 2.539
98 1HG2 THR 14 1HG2 THR 14 2.185 -10.115 3.897
99 2HG2 THR 14 2HG2 THR 14 3.721 -9.412 3.389
100 3HG2 THR 14 3HG2 THR 14 3.063 -10.807 2.532
101 H TYR 15 H TYR 15 3.446 -6.908 -0.189
102 HA TYR 15 HA TYR 15 6.080 -8.005 0.073
103 1HB TYR 15 2HB TYR 15 4.972 -7.977 -2.097
104 2HB TYR 15 1HB TYR 15 4.872 -6.222 -2.053
105 HD1 TYR 15 1HD TYR 15 6.252 -5.285 -3.630
106 HD2 TYR 15 2HD TYR 15 7.649 -8.666 -1.459
107 HE1 TYR 15 1HE TYR 15 8.415 -5.126 -4.788
108 HE2 TYR 15 2HE TYR 15 9.817 -8.516 -2.609
109 HH TYR 15 HH TYR 15 10.732 -5.803 -4.455
110 H SER 16 H SER 16 4.776 -4.756 -0.201
111 HA SER 16 HA SER 16 7.330 -3.525 0.426
112 1HB SER 16 2HB SER 16 4.595 -2.296 0.059
113 2HB SER 16 1HB SER 16 6.139 -1.439 0.051
114 HG SER 16 HG SER 16 5.146 -3.325 -1.819
115 H ALA 17 H ALA 17 5.315 -5.143 2.290
116 HA ALA 17 HA ALA 17 4.652 -3.402 4.402
117 1HB ALA 17 1HB ALA 17 3.588 -5.220 5.101
118 2HB ALA 17 2HB ALA 17 5.128 -6.010 5.443
119 3HB ALA 17 3HB ALA 17 4.389 -6.169 3.849
120 H ALA 18 H ALA 18 7.628 -4.999 3.554
121 HA ALA 18 HA ALA 18 8.971 -5.085 5.986
122 1HB ALA 18 1HB ALA 18 10.311 -6.060 4.469
123 2HB ALA 18 2HB ALA 18 10.974 -4.439 4.260
124 3HB ALA 18 3HB ALA 18 9.736 -5.036 3.155
125 H LEU 19 H LEU 19 8.633 -2.425 3.702
126 HA LEU 19 HA LEU 19 10.192 -0.579 5.249
127 1HB LEU 19 2HB LEU 19 8.683 -0.523 2.728
128 2HB LEU 19 1HB LEU 19 8.750 0.994 3.590
129 HG LEU 19 HG LEU 19 11.093 1.114 3.430
130 1HD1 LEU 19 1HD1 LEU 19 11.179 -1.646 2.207
131 2HD1 LEU 19 2HD1 LEU 19 11.460 -1.340 3.921
132 3HD1 LEU 19 3HD1 LEU 19 12.537 -0.642 2.711
133 1HD2 LEU 19 1HD2 LEU 19 11.034 0.110 0.766
134 2HD2 LEU 19 2HD2 LEU 19 10.939 1.780 1.324
135 3HD2 LEU 19 3HD2 LEU 19 9.466 0.828 1.134
136 H GLY 20 H GLY 20 7.065 -1.736 5.475
137 1HA GLY 20 2HA GLY 20 5.484 -1.192 7.105
138 2HA GLY 20 1HA GLY 20 6.404 0.266 7.471
139 H CYS 21 H CYS 21 5.479 -0.756 4.285
140 HA CYS 21 HA CYS 21 4.480 1.697 3.460
141 1HB CYS 21 2HB CYS 21 4.411 -1.083 2.452
142 2HB CYS 21 1HB CYS 21 3.237 0.012 1.754
143 H THR 22 H THR 22 2.842 2.725 4.345
144 HA THR 22 HA THR 22 0.569 1.249 5.363
145 HB THR 22 HB THR 22 -0.183 3.558 6.110
146 HG1 THR 22 1HG THR 22 2.446 4.437 6.034
147 1HG2 THR 22 1HG2 THR 22 2.374 3.163 7.480
148 2HG2 THR 22 2HG2 THR 22 1.430 1.685 7.295
149 3HG2 THR 22 3HG2 THR 22 0.728 3.083 8.109
150 H CYS 23 H CYS 23 -1.265 1.136 4.409
151 HA CYS 23 HA CYS 23 -1.650 2.460 1.846
152 1HB CYS 23 2HB CYS 23 -1.990 0.015 1.992
153 2HB CYS 23 1HB CYS 23 -3.231 0.252 3.213
154 H ASP 24 H ASP 24 -4.606 1.944 2.402
155 HA ASP 24 HA ASP 24 -5.235 4.181 4.178
156 1HB ASP 24 2HB ASP 24 -5.244 5.124 1.923
157 2HB ASP 24 1HB ASP 24 -6.254 3.807 1.342
158 H ASP 25 H ASP 25 -6.573 1.702 2.072
159 HA ASP 25 HA ASP 25 -8.219 0.196 2.222
160 1HB ASP 25 2HB ASP 25 -6.556 -0.773 3.801
161 2HB ASP 25 1HB ASP 25 -7.421 -0.001 5.127
162 H ARG 26 H ARG 26 -9.977 0.777 1.793
163 HA ARG 26 HA ARG 26 -12.030 1.160 3.720
164 1HB ARG 26 2HB ARG 26 -10.816 3.521 2.390
165 2HB ARG 26 1HB ARG 26 -12.556 3.449 2.431
166 1HG ARG 26 2HG ARG 26 -12.599 3.449 4.804
167 2HG ARG 26 1HG ARG 26 -10.862 3.152 4.886
168 1HD ARG 26 2HD ARG 26 -11.821 5.597 3.489
169 2HD ARG 26 1HD ARG 26 -11.878 5.561 5.250
170 HE ARG 26 HE ARG 26 -9.555 5.824 3.598
171 1HH1 ARG 26 1HH1 ARG 26 -10.654 4.502 6.655
172 2HH1 ARG 26 2HH1 ARG 26 -9.104 4.625 7.409
173 1HH2 ARG 26 1HH2 ARG 26 -7.532 6.030 4.590
174 2HH2 ARG 26 2HH2 ARG 26 -7.319 5.497 6.235
175 H SER 27 H SER 27 -11.717 -0.732 2.046
176 HA SER 27 HA SER 27 -12.903 -1.955 0.524
177 1HB SER 27 2HB SER 27 -14.898 -0.484 0.764
178 2HB SER 27 1HB SER 27 -14.184 0.639 -0.394
179 HG SER 27 HG SER 27 -14.101 -1.393 -1.774
180 H ASP 28 H ASP 28 -10.781 0.437 0.270
181 HA ASP 28 HA ASP 28 -9.289 -0.616 -1.770
182 1HB ASP 28 2HB ASP 28 -11.337 0.499 -3.018
183 2HB ASP 28 1HB ASP 28 -10.453 1.981 -2.710
184 H GLY 29 H GLY 29 -7.717 1.382 -2.601
185 1HA GLY 29 2HA GLY 29 -7.236 3.567 -0.991
186 2HA GLY 29 1HA GLY 29 -6.419 2.240 -0.189
187 H LEU 30 H LEU 30 -4.361 2.573 -0.516
188 HA LEU 30 HA LEU 30 -3.144 2.060 -2.982
189 1HB LEU 30 2HB LEU 30 -4.263 4.371 -3.268
190 2HB LEU 30 1HB LEU 30 -3.005 4.958 -2.213
191 HG LEU 30 HG LEU 30 -2.569 5.348 -4.631
192 1HD1 LEU 30 1HD1 LEU 30 -0.791 4.618 -2.718
193 2HD1 LEU 30 2HD1 LEU 30 -0.368 5.202 -4.328
194 3HD1 LEU 30 3HD1 LEU 30 -0.428 3.468 -4.005
195 1HD2 LEU 30 1HD2 LEU 30 -3.631 3.018 -5.163
196 2HD2 LEU 30 2HD2 LEU 30 -1.973 2.450 -4.972
197 3HD2 LEU 30 3HD2 LEU 30 -2.352 3.676 -6.183
198 H CYS 31 H CYS 31 -1.255 1.206 -2.334
199 HA CYS 31 HA CYS 31 -0.237 1.395 0.279
200 1HB CYS 31 2HB CYS 31 1.215 0.541 -2.227
201 2HB CYS 31 1HB CYS 31 1.694 0.165 -0.578
202 H LYS 32 H LYS 32 1.285 2.670 1.232
203 HA LYS 32 HA LYS 32 2.723 4.554 -0.500
204 1HB LYS 32 2HB LYS 32 0.677 5.340 1.016
205 2HB LYS 32 1HB LYS 32 1.949 5.487 2.205
206 1HG LYS 32 2HG LYS 32 1.513 7.584 0.976
207 2HG LYS 32 1HG LYS 32 3.161 6.994 0.727
208 1HD LYS 32 2HD LYS 32 2.062 7.755 -1.392
209 2HD LYS 32 1HD LYS 32 2.570 6.072 -1.413
210 1HE LYS 32 2HE LYS 32 0.347 6.381 -2.392
211 2HE LYS 32 1HE LYS 32 0.325 5.332 -0.981
212 1HZ LYS 32 1HZ LYS 32 -1.295 6.627 -0.226
213 2HZ LYS 32 2HZ LYS 32 -1.020 7.819 -1.394
214 3HZ LYS 32 3HZ LYS 32 -0.126 7.821 0.042
215 H ARG 33 H ARG 33 4.795 4.776 -0.122
216 HA ARG 33 HA ARG 33 6.135 2.875 1.530
217 1HB ARG 33 2HB ARG 33 6.692 3.745 -0.811
218 2HB ARG 33 1HB ARG 33 7.339 5.166 -0.017
219 1HG ARG 33 2HG ARG 33 9.103 3.967 0.937
220 2HG ARG 33 1HG ARG 33 8.324 2.412 0.627
221 1HD ARG 33 2HD ARG 33 10.199 2.931 -0.929
222 2HD ARG 33 1HD ARG 33 8.659 2.633 -1.731
223 HE ARG 33 HE ARG 33 9.052 5.421 -1.262
224 1HH1 ARG 33 1HH1 ARG 33 9.996 2.780 -3.358
225 2HH1 ARG 33 2HH1 ARG 33 10.380 3.806 -4.697
226 1HH2 ARG 33 1HH2 ARG 33 9.562 6.800 -3.034
227 2HH2 ARG 33 2HH2 ARG 33 10.140 6.086 -4.511
228 H ASN 34 H ASN 34 8.456 4.236 2.236
229 HA ASN 34 HA ASN 34 7.803 6.396 4.070
230 1HB ASN 34 2HB ASN 34 8.888 3.753 4.923
231 2HB ASN 34 1HB ASN 34 9.126 5.177 5.888
232 1HD2 ASN 34 1HD2 ASN 34 7.435 2.505 5.762
233 2HD2 ASN 34 2HD2 ASN 34 5.922 3.014 6.413
234 H GLY 35 H GLY 35 9.761 7.530 4.737
235 1HA GLY 35 2HA GLY 35 12.005 8.199 4.471
236 2HA GLY 35 1HA GLY 35 12.282 6.771 3.465
237 H ASP 36 H ASP 36 10.239 6.943 1.811
238 HA ASP 36 HA ASP 36 10.113 9.474 0.426
239 1HB ASP 36 2HB ASP 36 12.058 8.234 -0.609
240 2HB ASP 36 1HB ASP 36 10.955 6.921 -0.999
241 HA PRO 37 HA PRO 37 6.390 6.601 1.203
242 1HB PRO 37 2HB PRO 37 5.478 9.302 2.196
243 2HB PRO 37 1HB PRO 37 5.065 7.687 2.817
244 1HG PRO 37 2HG PRO 37 6.916 8.862 4.155
245 2HG PRO 37 1HG PRO 37 7.353 7.299 3.469
246 1HD PRO 37 2HD PRO 37 7.856 9.996 2.207
247 2HD PRO 37 1HD PRO 37 9.067 8.782 2.700
Start of MODEL 5
1 H THR 1 H THR 1 5.476 6.384 -0.716
2 HA THR 1 HA THR 1 3.364 7.934 -1.902
3 HB THR 1 HB THR 1 5.714 7.165 -3.635
4 HG1 THR 1 1HG THR 1 6.598 8.583 -2.092
5 1HG2 THR 1 1HG2 THR 1 4.835 9.034 -5.029
6 2HG2 THR 1 2HG2 THR 1 3.524 9.233 -3.867
7 3HG2 THR 1 3HG2 THR 1 3.668 7.735 -4.785
8 H PHE 2 H PHE 2 2.857 6.525 -4.007
9 HA PHE 2 HA PHE 2 1.938 4.093 -3.147
10 1HB PHE 2 2HB PHE 2 0.982 5.024 -5.076
11 2HB PHE 2 1HB PHE 2 2.536 5.232 -5.856
12 HD1 PHE 2 1HD PHE 2 0.820 2.265 -4.359
13 HD2 PHE 2 2HD PHE 2 2.596 4.030 -7.799
14 HE1 PHE 2 1HE PHE 2 0.460 0.181 -5.611
15 HE2 PHE 2 2HE PHE 2 2.239 1.948 -9.057
16 HZ PHE 2 HZ PHE 2 1.169 0.021 -7.964
17 H CYS 3 H CYS 3 3.146 2.575 -2.288
18 HA CYS 3 HA CYS 3 5.820 2.035 -2.653
19 1HB CYS 3 2HB CYS 3 3.747 -0.051 -1.959
20 2HB CYS 3 1HB CYS 3 5.443 -0.041 -1.518
21 H GLY 4 H GLY 4 3.310 -0.210 -3.811
22 1HA GLY 4 2HA GLY 4 4.126 -0.360 -6.482
23 2HA GLY 4 1HA GLY 4 5.001 -1.595 -5.577
24 H GLU 5 H GLU 5 3.147 -2.315 -3.713
25 HA GLU 5 HA GLU 5 1.382 -4.000 -5.225
26 1HB GLU 5 2HB GLU 5 1.759 -3.513 -2.276
27 2HB GLU 5 1HB GLU 5 0.566 -4.624 -2.905
28 1HG GLU 5 2HG GLU 5 2.241 -6.040 -3.806
29 2HG GLU 5 1HG GLU 5 3.506 -4.867 -3.413
30 H THR 6 H THR 6 -0.997 -4.119 -4.474
31 HA THR 6 HA THR 6 -2.016 -1.420 -3.967
32 HB THR 6 HB THR 6 -3.976 -2.083 -5.480
33 HG1 THR 6 1HG THR 6 -1.981 -3.716 -6.686
34 1HG2 THR 6 1HG2 THR 6 -1.568 -0.717 -5.953
35 2HG2 THR 6 2HG2 THR 6 -3.086 -0.552 -6.834
36 3HG2 THR 6 3HG2 THR 6 -1.863 -1.693 -7.391
37 H CYS 7 H CYS 7 -2.933 -1.491 -2.097
38 HA CYS 7 HA CYS 7 -4.178 -3.868 -1.017
39 1HB CYS 7 2HB CYS 7 -4.692 -2.000 0.844
40 2HB CYS 7 1HB CYS 7 -3.107 -2.777 0.743
41 H ARG 8 H ARG 8 -5.678 -3.577 -3.088
42 HA ARG 8 HA ARG 8 -7.824 -1.662 -2.699
43 1HB ARG 8 2HB ARG 8 -7.993 -3.853 -4.728
44 2HB ARG 8 1HB ARG 8 -8.594 -2.221 -4.813
45 1HG ARG 8 2HG ARG 8 -5.751 -3.048 -4.912
46 2HG ARG 8 1HG ARG 8 -6.728 -2.665 -6.326
47 1HD ARG 8 2HD ARG 8 -5.723 -0.829 -4.168
48 2HD ARG 8 1HD ARG 8 -5.490 -0.707 -5.909
49 HE ARG 8 HE ARG 8 -8.219 -0.426 -4.858
50 1HH1 ARG 8 1HH1 ARG 8 -5.390 1.053 -6.313
51 2HH1 ARG 8 2HH1 ARG 8 -6.161 2.578 -6.572
52 1HH2 ARG 8 1HH2 ARG 8 -9.236 1.586 -5.161
53 2HH2 ARG 8 2HH2 ARG 8 -8.358 2.881 -5.925
54 H VAL 9 H VAL 9 -8.413 -4.943 -3.749
55 HA VAL 9 HA VAL 9 -10.540 -5.098 -1.858
56 HB VAL 9 HB VAL 9 -11.170 -7.213 -3.012
57 1HG1 VAL 9 1HG1 VAL 9 -11.230 -4.548 -4.039
58 2HG1 VAL 9 2HG1 VAL 9 -12.423 -5.834 -4.217
59 3HG1 VAL 9 3HG1 VAL 9 -11.104 -5.687 -5.379
60 1HG2 VAL 9 1HG2 VAL 9 -9.876 -8.236 -4.538
61 2HG2 VAL 9 2HG2 VAL 9 -8.569 -7.293 -3.823
62 3HG2 VAL 9 3HG2 VAL 9 -9.379 -6.715 -5.280
63 H ILE 10 H ILE 10 -7.402 -6.252 -2.265
64 HA ILE 10 HA ILE 10 -7.622 -7.875 0.164
65 HB ILE 10 HB ILE 10 -5.693 -9.257 -0.834
66 1HG1 ILE 10 2HG1 ILE 10 -6.844 -8.140 -3.405
67 2HG1 ILE 10 1HG1 ILE 10 -5.255 -7.753 -2.754
68 1HG2 ILE 10 1HG2 ILE 10 -8.577 -9.423 -1.416
69 2HG2 ILE 10 2HG2 ILE 10 -7.508 -10.576 -0.617
70 3HG2 ILE 10 3HG2 ILE 10 -7.531 -10.468 -2.378
71 1HD1 ILE 10 1HD1 ILE 10 -4.358 -9.715 -3.420
72 2HD1 ILE 10 2HD1 ILE 10 -5.651 -9.613 -4.614
73 3HD1 ILE 10 3HD1 ILE 10 -5.856 -10.613 -3.177
74 HA PRO 11 HA PRO 11 -4.660 -4.317 0.396
75 1HB PRO 11 2HB PRO 11 -5.732 -4.203 3.147
76 2HB PRO 11 1HB PRO 11 -5.505 -2.909 1.965
77 1HG PRO 11 2HG PRO 11 -7.919 -3.793 2.517
78 2HG PRO 11 1HG PRO 11 -7.471 -3.417 0.844
79 1HD PRO 11 2HD PRO 11 -7.608 -6.105 2.190
80 2HD PRO 11 1HD PRO 11 -8.220 -5.622 0.591
81 H VAL 12 H VAL 12 -3.660 -3.775 2.865
82 HA VAL 12 HA VAL 12 -1.959 -4.214 4.209
83 HB VAL 12 HB VAL 12 -2.690 -7.143 4.106
84 1HG1 VAL 12 1HG1 VAL 12 -1.475 -5.556 6.359
85 2HG1 VAL 12 2HG1 VAL 12 -0.532 -6.462 5.175
86 3HG1 VAL 12 3HG1 VAL 12 -1.652 -7.307 6.246
87 1HG2 VAL 12 1HG2 VAL 12 -3.890 -4.956 5.805
88 2HG2 VAL 12 2HG2 VAL 12 -4.089 -6.678 6.127
89 3HG2 VAL 12 3HG2 VAL 12 -4.723 -5.981 4.637
90 H CYS 13 H CYS 13 -0.807 -3.615 2.307
91 HA CYS 13 HA CYS 13 0.347 -5.214 0.407
92 1HB CYS 13 2HB CYS 13 1.986 -3.051 1.653
93 2HB CYS 13 1HB CYS 13 1.665 -3.373 -0.051
94 H THR 14 H THR 14 1.276 -7.150 0.909
95 HA THR 14 HA THR 14 2.856 -7.535 3.273
96 HB THR 14 HB THR 14 2.496 -9.431 0.952
97 HG1 THR 14 1HG THR 14 0.622 -8.449 2.476
98 1HG2 THR 14 1HG2 THR 14 2.721 -11.079 2.943
99 2HG2 THR 14 2HG2 THR 14 3.463 -9.715 3.779
100 3HG2 THR 14 3HG2 THR 14 4.180 -10.333 2.290
101 H TYR 15 H TYR 15 3.572 -7.235 -0.182
102 HA TYR 15 HA TYR 15 6.348 -7.892 0.070
103 1HB TYR 15 2HB TYR 15 4.481 -7.209 -2.029
104 2HB TYR 15 1HB TYR 15 5.982 -6.329 -2.250
105 HD1 TYR 15 1HD TYR 15 4.958 -9.776 -1.245
106 HD2 TYR 15 2HD TYR 15 7.473 -7.376 -3.689
107 HE1 TYR 15 1HE TYR 15 5.941 -11.811 -2.215
108 HE2 TYR 15 2HE TYR 15 8.465 -9.402 -4.671
109 HH TYR 15 HH TYR 15 7.114 -12.455 -4.341
110 H SER 16 H SER 16 4.485 -4.943 -0.176
111 HA SER 16 HA SER 16 6.758 -3.181 -0.008
112 1HB SER 16 2HB SER 16 3.856 -2.469 0.458
113 2HB SER 16 1HB SER 16 5.152 -1.427 -0.126
114 HG SER 16 HG SER 16 3.996 -3.645 -1.480
115 H ALA 17 H ALA 17 5.100 -5.058 2.209
116 HA ALA 17 HA ALA 17 4.934 -3.413 4.467
117 1HB ALA 17 1HB ALA 17 3.902 -5.275 5.112
118 2HB ALA 17 2HB ALA 17 5.499 -5.927 5.480
119 3HB ALA 17 3HB ALA 17 4.752 -6.252 3.915
120 H ALA 18 H ALA 18 7.715 -4.758 2.926
121 HA ALA 18 HA ALA 18 9.518 -5.008 5.046
122 1HB ALA 18 1HB ALA 18 10.952 -5.469 3.400
123 2HB ALA 18 2HB ALA 18 10.791 -3.846 2.730
124 3HB ALA 18 3HB ALA 18 9.655 -5.110 2.259
125 H LEU 19 H LEU 19 8.538 -2.213 3.171
126 HA LEU 19 HA LEU 19 10.218 -0.354 4.606
127 1HB LEU 19 2HB LEU 19 8.340 -0.252 2.338
128 2HB LEU 19 1HB LEU 19 8.419 1.200 3.302
129 HG LEU 19 HG LEU 19 10.744 1.471 2.846
130 1HD1 LEU 19 1HD1 LEU 19 11.419 -0.410 0.913
131 2HD1 LEU 19 2HD1 LEU 19 10.593 -1.350 2.157
132 3HD1 LEU 19 3HD1 LEU 19 11.996 -0.367 2.580
133 1HD2 LEU 19 1HD2 LEU 19 9.260 0.756 0.318
134 2HD2 LEU 19 2HD2 LEU 19 10.699 1.772 0.422
135 3HD2 LEU 19 3HD2 LEU 19 9.189 2.302 1.165
136 H GLY 20 H GLY 20 7.207 -1.780 5.033
137 1HA GLY 20 2HA GLY 20 6.041 -1.494 7.145
138 2HA GLY 20 1HA GLY 20 6.489 0.212 7.087
139 H CYS 21 H CYS 21 6.057 0.838 4.561
140 HA CYS 21 HA CYS 21 4.400 1.908 3.421
141 1HB CYS 21 2HB CYS 21 4.320 -1.010 2.905
142 2HB CYS 21 1HB CYS 21 3.095 -0.008 2.140
143 H THR 22 H THR 22 3.010 3.025 4.655
144 HA THR 22 HA THR 22 0.774 1.606 5.841
145 HB THR 22 HB THR 22 0.048 3.853 6.609
146 HG1 THR 22 1HG THR 22 1.450 4.938 4.960
147 1HG2 THR 22 1HG2 THR 22 1.079 2.626 8.286
148 2HG2 THR 22 2HG2 THR 22 2.083 4.074 8.238
149 3HG2 THR 22 3HG2 THR 22 2.632 2.596 7.450
150 H CYS 23 H CYS 23 -0.832 1.224 4.704
151 HA CYS 23 HA CYS 23 -1.428 2.729 2.284
152 1HB CYS 23 2HB CYS 23 -1.397 0.317 2.054
153 2HB CYS 23 1HB CYS 23 -2.428 0.097 3.457
154 H ASP 24 H ASP 24 -3.898 3.117 1.959
155 HA ASP 24 HA ASP 24 -4.903 4.463 4.338
156 1HB ASP 24 2HB ASP 24 -4.941 5.687 2.211
157 2HB ASP 24 1HB ASP 24 -5.931 4.427 1.486
158 H ASP 25 H ASP 25 -6.263 2.351 1.848
159 HA ASP 25 HA ASP 25 -7.923 0.828 1.803
160 1HB ASP 25 2HB ASP 25 -6.257 -0.551 2.909
161 2HB ASP 25 1HB ASP 25 -6.726 0.092 4.480
162 H ARG 26 H ARG 26 -9.796 1.212 1.709
163 HA ARG 26 HA ARG 26 -11.386 1.709 4.124
164 1HB ARG 26 2HB ARG 26 -11.823 3.263 1.571
165 2HB ARG 26 1HB ARG 26 -12.474 3.561 3.158
166 1HG ARG 26 2HG ARG 26 -9.573 3.860 2.512
167 2HG ARG 26 1HG ARG 26 -10.736 5.181 2.408
168 1HD ARG 26 2HD ARG 26 -10.673 3.659 4.944
169 2HD ARG 26 1HD ARG 26 -9.272 4.670 4.596
170 HE ARG 26 HE ARG 26 -11.869 5.544 5.373
171 1HH1 ARG 26 1HH1 ARG 26 -9.018 6.430 3.532
172 2HH1 ARG 26 2HH1 ARG 26 -9.343 8.131 3.620
173 1HH2 ARG 26 1HH2 ARG 26 -12.298 7.797 5.483
174 2HH2 ARG 26 2HH2 ARG 26 -11.211 8.910 4.726
175 H SER 27 H SER 27 -10.914 -0.608 2.879
176 HA SER 27 HA SER 27 -12.039 -2.450 2.116
177 1HB SER 27 2HB SER 27 -14.252 -1.458 2.739
178 2HB SER 27 1HB SER 27 -14.252 -0.558 1.222
179 HG SER 27 HG SER 27 -13.985 -2.770 0.255
180 H ASP 28 H ASP 28 -10.551 -0.108 0.975
181 HA ASP 28 HA ASP 28 -9.498 -1.087 -1.310
182 1HB ASP 28 2HB ASP 28 -11.730 -0.740 -2.371
183 2HB ASP 28 1HB ASP 28 -11.627 0.969 -1.964
184 H GLY 29 H GLY 29 -7.635 0.077 -1.696
185 1HA GLY 29 2HA GLY 29 -7.537 2.903 -1.127
186 2HA GLY 29 1HA GLY 29 -6.680 1.939 0.055
187 H LEU 30 H LEU 30 -4.639 2.470 -0.325
188 HA LEU 30 HA LEU 30 -3.339 1.414 -2.634
189 1HB LEU 30 2HB LEU 30 -4.483 3.572 -3.354
190 2HB LEU 30 1HB LEU 30 -3.360 4.404 -2.311
191 HG LEU 30 HG LEU 30 -2.810 4.388 -4.780
192 1HD1 LEU 30 1HD1 LEU 30 -0.384 3.737 -4.385
193 2HD1 LEU 30 2HD1 LEU 30 -0.877 3.391 -2.726
194 3HD1 LEU 30 3HD1 LEU 30 -1.061 5.019 -3.380
195 1HD2 LEU 30 1HD2 LEU 30 -1.477 1.880 -4.841
196 2HD2 LEU 30 2HD2 LEU 30 -2.759 2.477 -5.894
197 3HD2 LEU 30 3HD2 LEU 30 -3.166 1.605 -4.416
198 H CYS 31 H CYS 31 -1.298 0.899 -2.060
199 HA CYS 31 HA CYS 31 -0.363 1.277 0.573
200 1HB CYS 31 2HB CYS 31 1.242 0.422 -1.827
201 2HB CYS 31 1HB CYS 31 1.616 0.091 -0.144
202 H LYS 32 H LYS 32 1.107 2.657 1.473
203 HA LYS 32 HA LYS 32 2.428 4.552 -0.347
204 1HB LYS 32 2HB LYS 32 0.848 5.083 2.150
205 2HB LYS 32 1HB LYS 32 2.075 6.194 1.638
206 1HG LYS 32 2HG LYS 32 -0.489 5.492 0.296
207 2HG LYS 32 1HG LYS 32 0.138 7.086 0.722
208 1HD LYS 32 2HD LYS 32 1.813 6.926 -1.036
209 2HD LYS 32 1HD LYS 32 1.310 5.275 -1.386
210 1HE LYS 32 2HE LYS 32 0.412 6.812 -3.017
211 2HE LYS 32 1HE LYS 32 -0.879 6.075 -2.072
212 1HZ LYS 32 1HZ LYS 32 -1.311 8.035 -0.960
213 2HZ LYS 32 2HZ LYS 32 -0.931 8.603 -2.507
214 3HZ LYS 32 3HZ LYS 32 0.220 8.690 -1.270
215 H ARG 33 H ARG 33 4.571 4.856 0.093
216 HA ARG 33 HA ARG 33 5.854 2.953 1.786
217 1HB ARG 33 2HB ARG 33 7.066 5.281 0.298
218 2HB ARG 33 1HB ARG 33 7.940 3.910 0.959
219 1HG ARG 33 2HG ARG 33 6.890 2.425 -0.614
220 2HG ARG 33 1HG ARG 33 5.875 3.739 -1.221
221 1HD ARG 33 2HD ARG 33 7.975 4.956 -1.836
222 2HD ARG 33 1HD ARG 33 8.873 3.500 -1.413
223 HE ARG 33 HE ARG 33 6.903 2.775 -3.238
224 1HH1 ARG 33 1HH1 ARG 33 9.776 4.788 -3.138
225 2HH1 ARG 33 2HH1 ARG 33 10.127 4.555 -4.825
226 1HH2 ARG 33 1HH2 ARG 33 7.365 2.464 -5.440
227 2HH2 ARG 33 2HH2 ARG 33 8.754 3.234 -6.139
228 H ASN 34 H ASN 34 8.167 4.449 2.371
229 HA ASN 34 HA ASN 34 7.554 6.437 4.393
230 1HB ASN 34 2HB ASN 34 8.775 3.776 4.986
231 2HB ASN 34 1HB ASN 34 9.036 5.139 6.033
232 1HD2 ASN 34 1HD2 ASN 34 7.441 2.414 5.863
233 2HD2 ASN 34 2HD2 ASN 34 5.964 2.819 6.652
234 H GLY 35 H GLY 35 9.359 7.795 4.675
235 1HA GLY 35 2HA GLY 35 11.587 8.531 4.326
236 2HA GLY 35 1HA GLY 35 11.892 7.065 3.381
237 H ASP 36 H ASP 36 9.799 7.019 1.772
238 HA ASP 36 HA ASP 36 9.596 9.508 0.263
239 1HB ASP 36 2HB ASP 36 9.960 8.328 -1.865
240 2HB ASP 36 1HB ASP 36 11.386 8.185 -0.846
241 HA PRO 37 HA PRO 37 5.805 6.662 1.375
242 1HB PRO 37 2HB PRO 37 5.091 9.390 2.445
243 2HB PRO 37 1HB PRO 37 4.550 7.793 3.011
244 1HG PRO 37 2HG PRO 37 6.531 8.752 4.345
245 2HG PRO 37 1HG PRO 37 6.803 7.179 3.594
246 1HD PRO 37 2HD PRO 37 7.567 9.872 2.472
247 2HD PRO 37 1HD PRO 37 8.629 8.484 2.821
Start of MODEL 6
1 H THR 1 H THR 1 5.906 6.402 -0.862
2 HA THR 1 HA THR 1 3.777 7.890 -2.155
3 HB THR 1 HB THR 1 5.306 7.442 -4.262
4 HG1 THR 1 1HG THR 1 7.400 7.987 -2.467
5 1HG2 THR 1 1HG2 THR 1 6.528 9.700 -3.668
6 2HG2 THR 1 2HG2 THR 1 5.402 9.696 -2.312
7 3HG2 THR 1 3HG2 THR 1 4.790 9.666 -3.967
8 H PHE 2 H PHE 2 3.124 6.558 -4.109
9 HA PHE 2 HA PHE 2 2.236 4.092 -3.363
10 1HB PHE 2 2HB PHE 2 1.185 5.193 -5.186
11 2HB PHE 2 1HB PHE 2 2.688 5.300 -6.089
12 HD1 PHE 2 1HD PHE 2 1.067 2.368 -4.434
13 HD2 PHE 2 2HD PHE 2 2.341 4.190 -8.062
14 HE1 PHE 2 1HE PHE 2 0.476 0.324 -5.668
15 HE2 PHE 2 2HE PHE 2 1.753 2.149 -9.300
16 HZ PHE 2 HZ PHE 2 0.818 0.213 -8.102
17 H CYS 3 H CYS 3 3.643 2.620 -2.569
18 HA CYS 3 HA CYS 3 6.219 2.043 -3.468
19 1HB CYS 3 2HB CYS 3 4.612 -0.230 -2.420
20 2HB CYS 3 1HB CYS 3 6.209 0.326 -1.962
21 H GLY 4 H GLY 4 3.365 -0.002 -3.954
22 1HA GLY 4 2HA GLY 4 3.330 -0.345 -6.642
23 2HA GLY 4 1HA GLY 4 4.605 -1.436 -6.114
24 H GLU 5 H GLU 5 1.546 -0.587 -4.546
25 HA GLU 5 HA GLU 5 0.327 -3.126 -5.122
26 1HB GLU 5 2HB GLU 5 1.425 -2.482 -2.406
27 2HB GLU 5 1HB GLU 5 -0.034 -3.442 -2.550
28 1HG GLU 5 2HG GLU 5 1.157 -5.121 -3.818
29 2HG GLU 5 1HG GLU 5 2.623 -4.140 -3.773
30 H THR 6 H THR 6 -1.830 -3.244 -4.216
31 HA THR 6 HA THR 6 -2.959 -0.687 -3.346
32 HB THR 6 HB THR 6 -4.983 -1.257 -4.817
33 HG1 THR 6 1HG THR 6 -4.407 -2.506 -6.695
34 1HG2 THR 6 1HG2 THR 6 -4.204 0.078 -6.556
35 2HG2 THR 6 2HG2 THR 6 -2.574 -0.590 -6.469
36 3HG2 THR 6 3HG2 THR 6 -3.141 0.517 -5.219
37 H CYS 7 H CYS 7 -4.007 -1.029 -1.492
38 HA CYS 7 HA CYS 7 -4.649 -3.705 -0.660
39 1HB CYS 7 2HB CYS 7 -5.539 -2.467 1.402
40 2HB CYS 7 1HB CYS 7 -3.804 -2.396 1.117
41 H ARG 8 H ARG 8 -6.070 -3.965 -2.511
42 HA ARG 8 HA ARG 8 -8.557 -2.645 -2.757
43 1HB ARG 8 2HB ARG 8 -9.040 -4.640 -4.297
44 2HB ARG 8 1HB ARG 8 -7.713 -3.604 -4.702
45 1HG ARG 8 2HG ARG 8 -6.308 -5.345 -3.339
46 2HG ARG 8 1HG ARG 8 -7.669 -6.399 -3.734
47 1HD ARG 8 2HD ARG 8 -7.365 -5.822 -6.123
48 2HD ARG 8 1HD ARG 8 -5.944 -4.874 -5.684
49 HE ARG 8 HE ARG 8 -6.086 -7.696 -6.015
50 1HH1 ARG 8 1HH1 ARG 8 -4.418 -5.182 -4.214
51 2HH1 ARG 8 2HH1 ARG 8 -3.061 -6.193 -3.835
52 1HH2 ARG 8 1HH2 ARG 8 -4.274 -9.009 -5.520
53 2HH2 ARG 8 2HH2 ARG 8 -2.975 -8.356 -4.576
54 H VAL 9 H VAL 9 -9.456 -5.717 -3.168
55 HA VAL 9 HA VAL 9 -11.127 -5.710 -0.779
56 HB VAL 9 HB VAL 9 -12.239 -7.678 -1.816
57 1HG1 VAL 9 1HG1 VAL 9 -13.102 -5.469 -2.272
58 2HG1 VAL 9 2HG1 VAL 9 -13.219 -6.456 -3.729
59 3HG1 VAL 9 3HG1 VAL 9 -11.941 -5.251 -3.581
60 1HG2 VAL 9 1HG2 VAL 9 -9.974 -7.395 -3.712
61 2HG2 VAL 9 2HG2 VAL 9 -11.540 -7.861 -4.375
62 3HG2 VAL 9 3HG2 VAL 9 -10.784 -8.846 -3.123
63 H ILE 10 H ILE 10 -8.236 -6.271 -0.920
64 HA ILE 10 HA ILE 10 -8.043 -8.266 1.097
65 HB ILE 10 HB ILE 10 -6.146 -9.455 -0.282
66 1HG1 ILE 10 2HG1 ILE 10 -8.000 -8.569 -2.505
67 2HG1 ILE 10 1HG1 ILE 10 -6.349 -8.009 -2.266
68 1HG2 ILE 10 1HG2 ILE 10 -7.498 -11.168 0.055
69 2HG2 ILE 10 2HG2 ILE 10 -8.452 -10.701 -1.354
70 3HG2 ILE 10 3HG2 ILE 10 -8.863 -10.066 0.239
71 1HD1 ILE 10 1HD1 ILE 10 -5.493 -10.212 -2.718
72 2HD1 ILE 10 2HD1 ILE 10 -6.555 -9.707 -4.032
73 3HD1 ILE 10 3HD1 ILE 10 -7.130 -10.859 -2.827
74 HA PRO 11 HA PRO 11 -5.279 -4.511 0.784
75 1HB PRO 11 2HB PRO 11 -6.023 -4.348 3.643
76 2HB PRO 11 1HB PRO 11 -5.965 -3.082 2.413
77 1HG PRO 11 2HG PRO 11 -8.264 -3.999 3.237
78 2HG PRO 11 1HG PRO 11 -8.012 -3.691 1.511
79 1HD PRO 11 2HD PRO 11 -7.938 -6.317 2.978
80 2HD PRO 11 1HD PRO 11 -8.713 -5.922 1.427
81 H VAL 12 H VAL 12 -4.105 -3.785 3.137
82 HA VAL 12 HA VAL 12 -2.234 -3.998 4.289
83 HB VAL 12 HB VAL 12 -2.755 -6.974 4.413
84 1HG1 VAL 12 1HG1 VAL 12 -0.598 -5.573 5.306
85 2HG1 VAL 12 2HG1 VAL 12 -1.152 -7.108 5.977
86 3HG1 VAL 12 3HG1 VAL 12 -1.628 -5.590 6.738
87 1HG2 VAL 12 1HG2 VAL 12 -3.755 -4.915 6.379
88 2HG2 VAL 12 2HG2 VAL 12 -4.102 -6.644 6.357
89 3HG2 VAL 12 3HG2 VAL 12 -4.747 -5.599 5.092
90 H CYS 13 H CYS 13 -1.148 -3.389 2.435
91 HA CYS 13 HA CYS 13 -0.127 -4.882 0.384
92 1HB CYS 13 2HB CYS 13 1.663 -2.865 1.670
93 2HB CYS 13 1HB CYS 13 1.230 -3.057 -0.028
94 H THR 14 H THR 14 0.752 -6.881 0.735
95 HA THR 14 HA THR 14 2.531 -7.334 2.963
96 HB THR 14 HB THR 14 0.851 -9.006 2.504
97 HG1 THR 14 1HG THR 14 3.558 -9.580 2.426
98 1HG2 THR 14 1HG2 THR 14 0.514 -10.081 0.513
99 2HG2 THR 14 2HG2 THR 14 2.195 -9.905 0.005
100 3HG2 THR 14 3HG2 THR 14 1.097 -8.529 -0.089
101 H TYR 15 H TYR 15 2.926 -6.835 -0.485
102 HA TYR 15 HA TYR 15 5.514 -8.085 -0.596
103 1HB TYR 15 2HB TYR 15 4.157 -7.924 -2.610
104 2HB TYR 15 1HB TYR 15 4.139 -6.170 -2.492
105 HD1 TYR 15 1HD TYR 15 5.356 -5.214 -4.182
106 HD2 TYR 15 2HD TYR 15 6.855 -8.751 -2.352
107 HE1 TYR 15 1HE TYR 15 7.358 -5.092 -5.603
108 HE2 TYR 15 2HE TYR 15 8.865 -8.637 -3.767
109 HH TYR 15 HH TYR 15 9.658 -5.878 -5.613
110 H SER 16 H SER 16 4.338 -4.767 -0.536
111 HA SER 16 HA SER 16 7.042 -3.725 -0.156
112 1HB SER 16 2HB SER 16 4.362 -2.326 -0.317
113 2HB SER 16 1HB SER 16 5.941 -1.534 -0.331
114 HG SER 16 HG SER 16 4.867 -3.315 -2.261
115 H ALA 17 H ALA 17 5.149 -5.292 1.820
116 HA ALA 17 HA ALA 17 4.663 -3.635 4.027
117 1HB ALA 17 1HB ALA 17 3.547 -5.596 4.277
118 2HB ALA 17 2HB ALA 17 4.966 -5.984 5.249
119 3HB ALA 17 3HB ALA 17 4.853 -6.559 3.586
120 H ALA 18 H ALA 18 7.585 -5.255 2.977
121 HA ALA 18 HA ALA 18 9.077 -5.345 5.306
122 1HB ALA 18 1HB ALA 18 10.885 -4.592 3.309
123 2HB ALA 18 2HB ALA 18 9.602 -5.473 2.479
124 3HB ALA 18 3HB ALA 18 10.470 -6.229 3.816
125 H LEU 19 H LEU 19 8.627 -2.653 3.081
126 HA LEU 19 HA LEU 19 10.308 -0.849 4.538
127 1HB LEU 19 2HB LEU 19 8.653 -0.756 2.127
128 2HB LEU 19 1HB LEU 19 8.758 0.750 2.999
129 HG LEU 19 HG LEU 19 11.115 0.840 2.753
130 1HD1 LEU 19 1HD1 LEU 19 10.914 -1.993 2.525
131 2HD1 LEU 19 2HD1 LEU 19 12.368 -1.004 2.662
132 3HD1 LEU 19 3HD1 LEU 19 11.707 -1.385 1.071
133 1HD2 LEU 19 1HD2 LEU 19 10.142 1.709 0.834
134 2HD2 LEU 19 2HD2 LEU 19 9.603 0.129 0.265
135 3HD2 LEU 19 3HD2 LEU 19 11.313 0.555 0.196
136 H GLY 20 H GLY 20 7.227 -1.972 5.078
137 1HA GLY 20 2HA GLY 20 5.783 -1.362 6.810
138 2HA GLY 20 1HA GLY 20 6.754 0.087 7.067
139 H CYS 21 H CYS 21 5.684 -0.895 3.950
140 HA CYS 21 HA CYS 21 4.546 1.560 3.265
141 1HB CYS 21 2HB CYS 21 4.632 -1.162 2.102
142 2HB CYS 21 1HB CYS 21 3.397 -0.085 1.479
143 H THR 22 H THR 22 2.766 2.426 4.052
144 HA THR 22 HA THR 22 0.510 0.633 4.601
145 HB THR 22 HB THR 22 -0.236 2.523 6.183
146 HG1 THR 22 1HG THR 22 2.587 2.960 6.215
147 1HG2 THR 22 1HG2 THR 22 1.265 1.539 8.024
148 2HG2 THR 22 2HG2 THR 22 1.940 0.529 6.746
149 3HG2 THR 22 3HG2 THR 22 0.222 0.430 7.134
150 H CYS 23 H CYS 23 -1.244 1.007 3.560
151 HA CYS 23 HA CYS 23 -1.391 3.304 1.779
152 1HB CYS 23 2HB CYS 23 -3.228 2.055 0.711
153 2HB CYS 23 1HB CYS 23 -1.750 1.103 0.808
154 H ASP 24 H ASP 24 -4.411 2.578 1.884
155 HA ASP 24 HA ASP 24 -5.090 4.293 4.178
156 1HB ASP 24 2HB ASP 24 -5.514 5.379 1.980
157 2HB ASP 24 1HB ASP 24 -6.585 4.048 1.551
158 H ASP 25 H ASP 25 -6.664 2.034 1.937
159 HA ASP 25 HA ASP 25 -8.118 0.330 2.177
160 1HB ASP 25 2HB ASP 25 -6.374 -0.814 3.428
161 2HB ASP 25 1HB ASP 25 -6.838 0.025 4.905
162 H ARG 26 H ARG 26 -9.990 0.742 2.047
163 HA ARG 26 HA ARG 26 -11.847 0.973 4.128
164 1HB ARG 26 2HB ARG 26 -10.791 3.503 3.009
165 2HB ARG 26 1HB ARG 26 -12.514 3.376 3.220
166 1HG ARG 26 2HG ARG 26 -12.159 2.872 5.612
167 2HG ARG 26 1HG ARG 26 -10.426 3.089 5.359
168 1HD ARG 26 2HD ARG 26 -12.469 5.214 4.760
169 2HD ARG 26 1HD ARG 26 -11.659 5.066 6.317
170 HE ARG 26 HE ARG 26 -9.697 5.149 4.309
171 1HH1 ARG 26 1HH1 ARG 26 -12.164 7.228 5.675
172 2HH1 ARG 26 2HH1 ARG 26 -11.261 8.682 5.429
173 1HH2 ARG 26 1HH2 ARG 26 -8.480 7.045 4.013
174 2HH2 ARG 26 2HH2 ARG 26 -9.161 8.582 4.471
175 H SER 27 H SER 27 -11.017 1.939 0.975
176 HA SER 27 HA SER 27 -13.045 0.316 -0.218
177 1HB SER 27 2HB SER 27 -13.104 3.278 -0.815
178 2HB SER 27 1HB SER 27 -14.280 2.044 -1.222
179 HG SER 27 HG SER 27 -14.277 1.922 1.300
180 H ASP 28 H ASP 28 -10.480 0.086 -0.061
181 HA ASP 28 HA ASP 28 -8.667 -0.423 -1.279
182 1HB ASP 28 2HB ASP 28 -10.364 -0.334 -3.314
183 2HB ASP 28 1HB ASP 28 -9.581 1.204 -3.647
184 H GLY 29 H GLY 29 -7.350 1.458 -3.111
185 1HA GLY 29 2HA GLY 29 -7.199 4.058 -2.447
186 2HA GLY 29 1HA GLY 29 -6.424 3.303 -1.062
187 H LEU 30 H LEU 30 -4.348 3.144 -1.153
188 HA LEU 30 HA LEU 30 -2.903 2.175 -3.380
189 1HB LEU 30 2HB LEU 30 -3.667 4.547 -4.041
190 2HB LEU 30 1HB LEU 30 -2.495 5.106 -2.872
191 HG LEU 30 HG LEU 30 -0.714 3.941 -4.163
192 1HD1 LEU 30 1HD1 LEU 30 -1.620 2.222 -5.358
193 2HD1 LEU 30 2HD1 LEU 30 -1.605 3.458 -6.616
194 3HD1 LEU 30 3HD1 LEU 30 -3.094 3.113 -5.736
195 1HD2 LEU 30 1HD2 LEU 30 -1.868 6.354 -4.643
196 2HD2 LEU 30 2HD2 LEU 30 -1.980 5.594 -6.230
197 3HD2 LEU 30 3HD2 LEU 30 -0.411 5.764 -5.442
198 H CYS 31 H CYS 31 -1.144 1.252 -2.476
199 HA CYS 31 HA CYS 31 -0.460 1.727 0.241
200 1HB CYS 31 2HB CYS 31 1.039 0.197 -1.881
201 2HB CYS 31 1HB CYS 31 1.349 0.111 -0.151
202 H LYS 32 H LYS 32 1.066 2.961 1.156
203 HA LYS 32 HA LYS 32 2.788 4.506 -0.653
204 1HB LYS 32 2HB LYS 32 0.939 5.307 1.399
205 2HB LYS 32 1HB LYS 32 2.539 5.920 1.750
206 1HG LYS 32 2HG LYS 32 1.139 7.466 0.406
207 2HG LYS 32 1HG LYS 32 2.649 7.015 -0.390
208 1HD LYS 32 2HD LYS 32 1.419 5.286 -1.664
209 2HD LYS 32 1HD LYS 32 -0.085 5.849 -0.933
210 1HE LYS 32 2HE LYS 32 1.713 7.214 -2.890
211 2HE LYS 32 1HE LYS 32 -0.010 6.870 -3.023
212 1HZ LYS 32 1HZ LYS 32 0.128 9.152 -2.574
213 2HZ LYS 32 2HZ LYS 32 1.299 8.949 -1.369
214 3HZ LYS 32 3HZ LYS 32 -0.295 8.456 -1.091
215 H ARG 33 H ARG 33 4.885 4.836 -0.149
216 HA ARG 33 HA ARG 33 6.169 2.812 1.393
217 1HB ARG 33 2HB ARG 33 6.935 4.885 -0.548
218 2HB ARG 33 1HB ARG 33 8.186 4.468 0.610
219 1HG ARG 33 2HG ARG 33 7.998 2.120 -0.035
220 2HG ARG 33 1HG ARG 33 6.736 2.540 -1.192
221 1HD ARG 33 2HD ARG 33 8.931 2.260 -2.265
222 2HD ARG 33 1HD ARG 33 8.301 3.896 -2.453
223 HE ARG 33 HE ARG 33 10.511 3.084 -0.691
224 1HH1 ARG 33 1HH1 ARG 33 8.721 5.565 -2.386
225 2HH1 ARG 33 2HH1 ARG 33 9.784 6.859 -1.897
226 1HH2 ARG 33 1HH2 ARG 33 11.895 4.796 -0.016
227 2HH2 ARG 33 2HH2 ARG 33 11.551 6.430 -0.520
228 H ASN 34 H ASN 34 8.490 4.719 1.893
229 HA ASN 34 HA ASN 34 7.625 6.286 4.171
230 1HB ASN 34 2HB ASN 34 8.989 3.708 4.393
231 2HB ASN 34 1HB ASN 34 9.602 4.964 5.438
232 1HD2 ASN 34 1HD2 ASN 34 7.769 2.399 5.471
233 2HD2 ASN 34 2HD2 ASN 34 6.527 2.860 6.568
234 H GLY 35 H GLY 35 9.301 7.682 4.983
235 1HA GLY 35 2HA GLY 35 11.321 8.888 4.838
236 2HA GLY 35 1HA GLY 35 11.806 7.867 3.480
237 H ASP 36 H ASP 36 9.678 7.969 1.971
238 HA ASP 36 HA ASP 36 8.775 10.625 1.357
239 1HB ASP 36 2HB ASP 36 9.515 10.494 -1.021
240 2HB ASP 36 1HB ASP 36 10.882 10.593 0.080
241 HA PRO 37 HA PRO 37 6.174 6.603 1.215
242 1HB PRO 37 2HB PRO 37 4.517 8.749 2.557
243 2HB PRO 37 1HB PRO 37 4.436 6.987 2.789
244 1HG PRO 37 2HG PRO 37 5.882 8.194 4.532
245 2HG PRO 37 1HG PRO 37 6.699 6.937 3.605
246 1HD PRO 37 2HD PRO 37 6.747 9.905 3.083
247 2HD PRO 37 1HD PRO 37 8.124 8.796 3.301
Start of MODEL 7
1 H THR 1 H THR 1 5.916 6.353 -0.714
2 HA THR 1 HA THR 1 3.869 8.048 -1.771
3 HB THR 1 HB THR 1 6.018 8.979 -2.723
4 HG1 THR 1 1HG THR 1 5.203 8.999 -4.840
5 1HG2 THR 1 1HG2 THR 1 6.225 6.434 -4.305
6 2HG2 THR 1 2HG2 THR 1 7.110 6.655 -2.796
7 3HG2 THR 1 3HG2 THR 1 7.400 7.741 -4.155
8 H PHE 2 H PHE 2 3.172 6.820 -3.876
9 HA PHE 2 HA PHE 2 2.192 4.374 -3.166
10 1HB PHE 2 2HB PHE 2 1.195 5.476 -4.970
11 2HB PHE 2 1HB PHE 2 2.713 5.675 -5.818
12 HD1 PHE 2 1HD PHE 2 2.471 4.677 -7.868
13 HD2 PHE 2 2HD PHE 2 1.089 2.623 -4.409
14 HE1 PHE 2 1HE PHE 2 1.946 2.713 -9.252
15 HE2 PHE 2 2HE PHE 2 0.564 0.655 -5.786
16 HZ PHE 2 HZ PHE 2 0.991 0.698 -8.209
17 H CYS 3 H CYS 3 3.366 2.769 -2.429
18 HA CYS 3 HA CYS 3 5.978 2.063 -3.093
19 1HB CYS 3 2HB CYS 3 3.965 0.017 -2.192
20 2HB CYS 3 1HB CYS 3 5.666 0.145 -1.784
21 H GLY 4 H GLY 4 3.015 0.312 -4.022
22 1HA GLY 4 2HA GLY 4 3.476 -0.018 -6.706
23 2HA GLY 4 1HA GLY 4 4.382 -1.315 -5.934
24 H GLU 5 H GLU 5 2.639 -1.759 -3.776
25 HA GLU 5 HA GLU 5 0.704 -3.462 -5.021
26 1HB GLU 5 2HB GLU 5 1.488 -2.841 -2.203
27 2HB GLU 5 1HB GLU 5 0.029 -3.758 -2.530
28 1HG GLU 5 2HG GLU 5 1.269 -5.510 -3.550
29 2HG GLU 5 1HG GLU 5 2.764 -4.565 -3.497
30 H THR 6 H THR 6 -1.503 -3.558 -3.925
31 HA THR 6 HA THR 6 -2.700 -0.944 -3.414
32 HB THR 6 HB THR 6 -4.663 -1.646 -4.896
33 HG1 THR 6 1HG THR 6 -3.550 -3.861 -5.087
34 1HG2 THR 6 1HG2 THR 6 -3.076 -1.193 -7.058
35 2HG2 THR 6 2HG2 THR 6 -2.052 -0.597 -5.752
36 3HG2 THR 6 3HG2 THR 6 -3.670 0.068 -5.976
37 H CYS 7 H CYS 7 -3.823 -1.169 -1.553
38 HA CYS 7 HA CYS 7 -4.523 -3.821 -0.605
39 1HB CYS 7 2HB CYS 7 -5.314 -2.580 1.436
40 2HB CYS 7 1HB CYS 7 -3.593 -2.390 1.104
41 H ARG 8 H ARG 8 -5.853 -3.649 -2.717
42 HA ARG 8 HA ARG 8 -8.214 -2.256 -2.946
43 1HB ARG 8 2HB ARG 8 -7.287 -4.870 -4.088
44 2HB ARG 8 1HB ARG 8 -8.844 -4.159 -4.524
45 1HG ARG 8 2HG ARG 8 -7.767 -2.151 -5.202
46 2HG ARG 8 1HG ARG 8 -6.187 -2.788 -4.756
47 1HD ARG 8 2HD ARG 8 -6.298 -3.038 -7.074
48 2HD ARG 8 1HD ARG 8 -6.660 -4.636 -6.436
49 HE ARG 8 HE ARG 8 -8.651 -4.499 -7.524
50 1HH1 ARG 8 1HH1 ARG 8 -7.642 -1.211 -6.737
51 2HH1 ARG 8 2HH1 ARG 8 -8.990 -0.485 -7.553
52 1HH2 ARG 8 1HH2 ARG 8 -10.428 -3.514 -8.586
53 2HH2 ARG 8 2HH2 ARG 8 -10.572 -1.790 -8.598
54 H VAL 9 H VAL 9 -8.628 -5.738 -2.772
55 HA VAL 9 HA VAL 9 -11.013 -5.204 -1.274
56 HB VAL 9 HB VAL 9 -11.483 -7.673 -1.568
57 1HG1 VAL 9 1HG1 VAL 9 -12.501 -6.095 -3.044
58 2HG1 VAL 9 2HG1 VAL 9 -11.922 -7.448 -4.018
59 3HG1 VAL 9 3HG1 VAL 9 -11.017 -5.934 -3.984
60 1HG2 VAL 9 1HG2 VAL 9 -10.114 -8.729 -3.442
61 2HG2 VAL 9 2HG2 VAL 9 -9.356 -8.642 -1.852
62 3HG2 VAL 9 3HG2 VAL 9 -8.906 -7.489 -3.108
63 H ILE 10 H ILE 10 -8.004 -6.921 -0.866
64 HA ILE 10 HA ILE 10 -8.531 -7.136 2.017
65 HB ILE 10 HB ILE 10 -6.814 -9.063 1.911
66 1HG1 ILE 10 2HG1 ILE 10 -7.721 -8.971 -0.971
67 2HG1 ILE 10 1HG1 ILE 10 -6.079 -8.728 -0.387
68 1HG2 ILE 10 1HG2 ILE 10 -9.686 -9.084 1.235
69 2HG2 ILE 10 2HG2 ILE 10 -8.822 -9.874 2.554
70 3HG2 ILE 10 3HG2 ILE 10 -8.805 -10.583 0.938
71 1HD1 ILE 10 1HD1 ILE 10 -7.662 -11.285 -0.296
72 2HD1 ILE 10 2HD1 ILE 10 -6.068 -11.063 0.425
73 3HD1 ILE 10 3HD1 ILE 10 -6.273 -10.926 -1.321
74 HA PRO 11 HA PRO 11 -5.256 -4.118 1.380
75 1HB PRO 11 2HB PRO 11 -5.825 -3.642 4.246
76 2HB PRO 11 1HB PRO 11 -5.712 -2.495 2.905
77 1HG PRO 11 2HG PRO 11 -8.042 -3.121 3.898
78 2HG PRO 11 1HG PRO 11 -7.848 -2.984 2.143
79 1HD PRO 11 2HD PRO 11 -7.946 -5.479 3.828
80 2HD PRO 11 1HD PRO 11 -8.742 -5.153 2.269
81 H VAL 12 H VAL 12 -3.771 -3.258 3.340
82 HA VAL 12 HA VAL 12 -1.897 -3.496 4.465
83 HB VAL 12 HB VAL 12 -2.556 -6.411 4.909
84 1HG1 VAL 12 1HG1 VAL 12 -1.095 -6.278 6.807
85 2HG1 VAL 12 2HG1 VAL 12 -0.882 -4.542 6.580
86 3HG1 VAL 12 3HG1 VAL 12 -0.230 -5.673 5.394
87 1HG2 VAL 12 1HG2 VAL 12 -3.782 -5.868 6.831
88 2HG2 VAL 12 2HG2 VAL 12 -4.348 -4.713 5.625
89 3HG2 VAL 12 3HG2 VAL 12 -3.188 -4.208 6.853
90 H CYS 13 H CYS 13 -0.925 -3.095 2.526
91 HA CYS 13 HA CYS 13 -0.059 -4.826 0.559
92 1HB CYS 13 2HB CYS 13 1.807 -2.692 1.504
93 2HB CYS 13 1HB CYS 13 1.265 -3.060 -0.132
94 H THR 14 H THR 14 0.810 -6.784 1.094
95 HA THR 14 HA THR 14 2.681 -7.082 3.255
96 HB THR 14 HB THR 14 1.025 -8.806 2.900
97 HG1 THR 14 1HG THR 14 3.742 -9.329 2.813
98 1HG2 THR 14 1HG2 THR 14 2.397 -9.335 0.261
99 2HG2 THR 14 2HG2 THR 14 0.798 -8.618 0.462
100 3HG2 THR 14 3HG2 THR 14 1.085 -10.285 0.959
101 H TYR 15 H TYR 15 2.989 -6.793 -0.224
102 HA TYR 15 HA TYR 15 5.589 -7.980 -0.404
103 1HB TYR 15 2HB TYR 15 4.127 -7.768 -2.369
104 2HB TYR 15 1HB TYR 15 4.185 -6.016 -2.237
105 HD1 TYR 15 1HD TYR 15 6.211 -9.008 -2.939
106 HD2 TYR 15 2HD TYR 15 5.945 -4.785 -3.232
107 HE1 TYR 15 1HE TYR 15 8.188 -9.000 -4.406
108 HE2 TYR 15 2HE TYR 15 7.914 -4.752 -4.705
109 HH TYR 15 HH TYR 15 9.811 -6.090 -5.270
110 H SER 16 H SER 16 4.364 -4.691 -0.293
111 HA SER 16 HA SER 16 7.061 -3.607 0.047
112 1HB SER 16 2HB SER 16 4.356 -2.261 -0.178
113 2HB SER 16 1HB SER 16 5.907 -1.422 -0.110
114 HG SER 16 HG SER 16 5.403 -3.411 -2.042
115 H ALA 17 H ALA 17 5.237 -5.202 2.039
116 HA ALA 17 HA ALA 17 4.765 -3.507 4.240
117 1HB ALA 17 1HB ALA 17 4.971 -5.800 5.512
118 2HB ALA 17 2HB ALA 17 4.958 -6.459 3.876
119 3HB ALA 17 3HB ALA 17 3.608 -5.476 4.440
120 H ALA 18 H ALA 18 7.660 -5.021 3.062
121 HA ALA 18 HA ALA 18 9.223 -5.187 5.362
122 1HB ALA 18 1HB ALA 18 10.756 -4.218 3.104
123 2HB ALA 18 2HB ALA 18 9.641 -5.501 2.632
124 3HB ALA 18 3HB ALA 18 10.815 -5.783 3.917
125 H LEU 19 H LEU 19 8.575 -2.470 3.239
126 HA LEU 19 HA LEU 19 10.221 -0.606 4.671
127 1HB LEU 19 2HB LEU 19 8.441 -0.552 2.334
128 2HB LEU 19 1HB LEU 19 8.522 0.940 3.233
129 HG LEU 19 HG LEU 19 10.872 1.120 2.876
130 1HD1 LEU 19 1HD1 LEU 19 11.720 -1.064 3.016
131 2HD1 LEU 19 2HD1 LEU 19 11.971 -0.618 1.327
132 3HD1 LEU 19 3HD1 LEU 19 10.626 -1.668 1.772
133 1HD2 LEU 19 1HD2 LEU 19 9.057 1.517 0.982
134 2HD2 LEU 19 2HD2 LEU 19 10.011 0.280 0.163
135 3HD2 LEU 19 3HD2 LEU 19 10.779 1.774 0.702
136 H GLY 20 H GLY 20 7.169 -1.905 5.174
137 1HA GLY 20 2HA GLY 20 5.711 -1.461 6.945
138 2HA GLY 20 1HA GLY 20 6.632 0.002 7.299
139 H CYS 21 H CYS 21 5.624 -0.844 4.129
140 HA CYS 21 HA CYS 21 4.494 1.594 3.483
141 1HB CYS 21 2HB CYS 21 4.513 -1.114 2.297
142 2HB CYS 21 1HB CYS 21 3.275 -0.024 1.709
143 H THR 22 H THR 22 2.796 2.504 4.344
144 HA THR 22 HA THR 22 0.490 0.833 5.021
145 HB THR 22 HB THR 22 -0.316 2.955 6.184
146 HG1 THR 22 1HG THR 22 2.437 3.616 6.323
147 1HG2 THR 22 1HG2 THR 22 0.328 1.098 7.518
148 2HG2 THR 22 2HG2 THR 22 1.148 2.502 8.202
149 3HG2 THR 22 3HG2 THR 22 2.039 1.366 7.189
150 H CYS 23 H CYS 23 -1.239 1.014 3.800
151 HA CYS 23 HA CYS 23 -1.106 2.893 1.599
152 1HB CYS 23 2HB CYS 23 -2.824 1.572 0.555
153 2HB CYS 23 1HB CYS 23 -1.556 0.512 1.154
154 H ASP 24 H ASP 24 -3.777 3.133 0.982
155 HA ASP 24 HA ASP 24 -4.559 5.120 2.938
156 1HB ASP 24 2HB ASP 24 -5.742 4.458 0.226
157 2HB ASP 24 1HB ASP 24 -6.183 5.837 1.224
158 H ASP 25 H ASP 25 -5.871 2.210 1.380
159 HA ASP 25 HA ASP 25 -7.441 0.713 1.942
160 1HB ASP 25 2HB ASP 25 -6.391 0.187 3.960
161 2HB ASP 25 1HB ASP 25 -6.798 1.743 4.687
162 H ARG 26 H ARG 26 -9.363 0.362 1.811
163 HA ARG 26 HA ARG 26 -11.636 0.669 1.806
164 1HB ARG 26 2HB ARG 26 -10.927 3.325 3.022
165 2HB ARG 26 1HB ARG 26 -12.522 2.957 2.449
166 1HG ARG 26 2HG ARG 26 -11.044 1.710 4.723
167 2HG ARG 26 1HG ARG 26 -12.595 2.551 4.756
168 1HD ARG 26 2HD ARG 26 -13.510 0.700 3.322
169 2HD ARG 26 1HD ARG 26 -11.995 -0.158 3.586
170 HE ARG 26 HE ARG 26 -14.191 -0.025 5.354
171 1HH1 ARG 26 1HH1 ARG 26 -10.665 0.038 5.444
172 2HH1 ARG 26 2HH1 ARG 26 -10.593 -0.714 7.004
173 1HH2 ARG 26 1HH2 ARG 26 -14.053 -0.997 7.414
174 2HH2 ARG 26 2HH2 ARG 26 -12.502 -1.290 8.122
175 H SER 27 H SER 27 -12.304 0.639 -0.137
176 HA SER 27 HA SER 27 -12.690 1.173 -2.308
177 1HB SER 27 2HB SER 27 -11.789 3.981 -1.594
178 2HB SER 27 1HB SER 27 -12.755 3.492 -2.979
179 HG SER 27 HG SER 27 -13.656 4.273 -0.679
180 H ASP 28 H ASP 28 -10.254 0.300 -1.088
181 HA ASP 28 HA ASP 28 -8.237 -0.462 -1.693
182 1HB ASP 28 2HB ASP 28 -9.028 -0.667 -3.985
183 2HB ASP 28 1HB ASP 28 -8.778 1.049 -4.264
184 H GLY 29 H GLY 29 -8.357 2.807 -3.087
185 1HA GLY 29 2HA GLY 29 -7.168 4.704 -2.461
186 2HA GLY 29 1HA GLY 29 -6.534 3.814 -1.080
187 H LEU 30 H LEU 30 -4.439 3.442 -1.128
188 HA LEU 30 HA LEU 30 -3.068 2.271 -3.259
189 1HB LEU 30 2HB LEU 30 -3.657 4.589 -4.147
190 2HB LEU 30 1HB LEU 30 -2.483 5.201 -3.014
191 HG LEU 30 HG LEU 30 -0.726 3.882 -4.150
192 1HD1 LEU 30 1HD1 LEU 30 -2.241 3.308 -6.541
193 2HD1 LEU 30 2HD1 LEU 30 -2.914 2.464 -5.146
194 3HD1 LEU 30 3HD1 LEU 30 -1.218 2.242 -5.578
195 1HD2 LEU 30 1HD2 LEU 30 -1.733 6.238 -4.911
196 2HD2 LEU 30 2HD2 LEU 30 -2.052 5.309 -6.377
197 3HD2 LEU 30 3HD2 LEU 30 -0.404 5.449 -5.762
198 H CYS 31 H CYS 31 -1.127 1.486 -2.503
199 HA CYS 31 HA CYS 31 -0.469 1.823 0.243
200 1HB CYS 31 2HB CYS 31 1.132 0.528 -1.972
201 2HB CYS 31 1HB CYS 31 1.459 0.364 -0.251
202 H LYS 32 H LYS 32 1.079 3.022 1.278
203 HA LYS 32 HA LYS 32 2.727 4.798 -0.414
204 1HB LYS 32 2HB LYS 32 0.769 5.484 1.457
205 2HB LYS 32 1HB LYS 32 2.284 5.788 2.279
206 1HG LYS 32 2HG LYS 32 1.264 7.730 1.048
207 2HG LYS 32 1HG LYS 32 2.949 7.376 0.676
208 1HD LYS 32 2HD LYS 32 1.601 7.901 -1.341
209 2HD LYS 32 1HD LYS 32 2.328 6.304 -1.381
210 1HE LYS 32 2HE LYS 32 0.014 6.373 -2.215
211 2HE LYS 32 1HE LYS 32 0.256 5.256 -0.885
212 1HZ LYS 32 1HZ LYS 32 -0.518 7.478 0.416
213 2HZ LYS 32 2HZ LYS 32 -1.584 6.249 -0.052
214 3HZ LYS 32 3HZ LYS 32 -1.405 7.628 -1.015
215 H ARG 33 H ARG 33 4.844 4.965 0.053
216 HA ARG 33 HA ARG 33 6.099 2.905 1.584
217 1HB ARG 33 2HB ARG 33 7.094 5.197 -0.090
218 2HB ARG 33 1HB ARG 33 8.208 4.193 0.820
219 1HG ARG 33 2HG ARG 33 8.079 2.521 -0.651
220 2HG ARG 33 1HG ARG 33 6.330 2.676 -0.821
221 1HD ARG 33 2HD ARG 33 7.461 3.142 -2.930
222 2HD ARG 33 1HD ARG 33 6.631 4.570 -2.325
223 HE ARG 33 HE ARG 33 8.637 5.649 -2.261
224 1HH1 ARG 33 1HH1 ARG 33 9.283 2.199 -2.258
225 2HH1 ARG 33 2HH1 ARG 33 10.993 2.395 -2.429
226 1HH2 ARG 33 1HH2 ARG 33 10.857 5.919 -2.536
227 2HH2 ARG 33 2HH2 ARG 33 11.898 4.521 -2.579
228 H ASN 34 H ASN 34 8.462 4.317 2.268
229 HA ASN 34 HA ASN 34 7.861 6.266 4.323
230 1HB ASN 34 2HB ASN 34 8.912 3.543 4.917
231 2HB ASN 34 1HB ASN 34 9.262 4.876 5.978
232 1HD2 ASN 34 1HD2 ASN 34 7.435 2.296 5.688
233 2HD2 ASN 34 2HD2 ASN 34 5.989 2.802 6.476
234 H GLY 35 H GLY 35 9.782 7.427 4.922
235 1HA GLY 35 2HA GLY 35 12.014 8.133 4.661
236 2HA GLY 35 1HA GLY 35 12.316 6.717 3.646
237 H ASP 36 H ASP 36 10.249 6.901 1.989
238 HA ASP 36 HA ASP 36 10.157 9.439 0.603
239 1HB ASP 36 2HB ASP 36 12.033 8.385 -0.527
240 2HB ASP 36 1HB ASP 36 11.175 6.853 -0.628
241 HA PRO 37 HA PRO 37 6.409 6.571 1.349
242 1HB PRO 37 2HB PRO 37 5.511 9.183 2.542
243 2HB PRO 37 1HB PRO 37 5.156 7.528 3.077
244 1HG PRO 37 2HG PRO 37 7.024 8.688 4.410
245 2HG PRO 37 1HG PRO 37 7.456 7.157 3.652
246 1HD PRO 37 2HD PRO 37 7.897 9.909 2.487
247 2HD PRO 37 1HD PRO 37 9.132 8.687 2.893
Start of MODEL 8
1 H THR 1 H THR 1 5.989 6.423 -1.196
2 HA THR 1 HA THR 1 3.784 7.805 -2.491
3 HB THR 1 HB THR 1 6.346 7.015 -3.919
4 HG1 THR 1 1HG THR 1 6.916 8.679 -2.511
5 1HG2 THR 1 1HG2 THR 1 3.874 7.617 -4.927
6 2HG2 THR 1 2HG2 THR 1 5.393 7.812 -5.802
7 3HG2 THR 1 3HG2 THR 1 4.673 9.189 -4.967
8 H PHE 2 H PHE 2 3.168 6.339 -4.405
9 HA PHE 2 HA PHE 2 2.382 3.885 -3.460
10 1HB PHE 2 2HB PHE 2 1.192 4.763 -5.268
11 2HB PHE 2 1HB PHE 2 2.643 5.051 -6.210
12 HD1 PHE 2 1HD PHE 2 2.516 3.877 -8.165
13 HD2 PHE 2 2HD PHE 2 1.269 1.987 -4.562
14 HE1 PHE 2 1HE PHE 2 2.117 1.790 -9.403
15 HE2 PHE 2 2HE PHE 2 0.872 -0.103 -5.796
16 HZ PHE 2 HZ PHE 2 1.295 -0.205 -8.217
17 H CYS 3 H CYS 3 3.845 2.500 -2.637
18 HA CYS 3 HA CYS 3 6.426 1.975 -3.523
19 1HB CYS 3 2HB CYS 3 4.852 -0.271 -2.331
20 2HB CYS 3 1HB CYS 3 6.481 0.267 -1.977
21 H GLY 4 H GLY 4 3.678 -0.256 -3.922
22 1HA GLY 4 2HA GLY 4 3.730 -0.665 -6.625
23 2HA GLY 4 1HA GLY 4 5.003 -1.706 -6.008
24 H GLU 5 H GLU 5 1.895 -0.920 -4.503
25 HA GLU 5 HA GLU 5 0.772 -3.517 -5.107
26 1HB GLU 5 2HB GLU 5 1.222 -2.667 -2.234
27 2HB GLU 5 1HB GLU 5 0.337 -4.088 -2.760
28 1HG GLU 5 2HG GLU 5 2.373 -5.066 -3.624
29 2HG GLU 5 1HG GLU 5 3.276 -3.615 -3.180
30 H THR 6 H THR 6 -1.489 -3.629 -4.328
31 HA THR 6 HA THR 6 -2.605 -0.981 -3.750
32 HB THR 6 HB THR 6 -4.611 -1.750 -5.170
33 HG1 THR 6 1HG THR 6 -2.623 -3.215 -6.566
34 1HG2 THR 6 1HG2 THR 6 -3.628 0.091 -6.083
35 2HG2 THR 6 2HG2 THR 6 -3.187 -1.082 -7.324
36 3HG2 THR 6 3HG2 THR 6 -2.020 -0.631 -6.082
37 H CYS 7 H CYS 7 -3.525 -1.100 -1.845
38 HA CYS 7 HA CYS 7 -4.491 -3.605 -0.778
39 1HB CYS 7 2HB CYS 7 -5.081 -2.204 1.231
40 2HB CYS 7 1HB CYS 7 -3.365 -2.186 0.836
41 H ARG 8 H ARG 8 -5.967 -3.628 -2.717
42 HA ARG 8 HA ARG 8 -8.231 -1.897 -2.732
43 1HB ARG 8 2HB ARG 8 -7.285 -4.199 -4.338
44 2HB ARG 8 1HB ARG 8 -9.008 -3.838 -4.388
45 1HG ARG 8 2HG ARG 8 -8.510 -1.548 -5.014
46 2HG ARG 8 1HG ARG 8 -6.782 -1.913 -5.010
47 1HD ARG 8 2HD ARG 8 -7.603 -1.980 -7.278
48 2HD ARG 8 1HD ARG 8 -7.182 -3.611 -6.764
49 HE ARG 8 HE ARG 8 -9.342 -4.204 -7.143
50 1HH1 ARG 8 1HH1 ARG 8 -9.277 -0.740 -6.640
51 2HH1 ARG 8 2HH1 ARG 8 -10.987 -0.551 -6.809
52 1HH2 ARG 8 1HH2 ARG 8 -11.607 -3.947 -7.407
53 2HH2 ARG 8 2HH2 ARG 8 -12.312 -2.374 -7.252
54 H VAL 9 H VAL 9 -9.102 -5.173 -3.220
55 HA VAL 9 HA VAL 9 -11.055 -4.930 -1.115
56 HB VAL 9 HB VAL 9 -11.719 -5.819 -3.322
57 1HG1 VAL 9 1HG1 VAL 9 -11.085 -8.167 -3.895
58 2HG1 VAL 9 2HG1 VAL 9 -9.862 -8.082 -2.627
59 3HG1 VAL 9 3HG1 VAL 9 -9.772 -6.997 -4.015
60 1HG2 VAL 9 1HG2 VAL 9 -13.092 -6.413 -1.447
61 2HG2 VAL 9 2HG2 VAL 9 -12.015 -7.743 -1.023
62 3HG2 VAL 9 3HG2 VAL 9 -12.958 -7.813 -2.512
63 H ILE 10 H ILE 10 -8.052 -6.352 -1.684
64 HA ILE 10 HA ILE 10 -8.107 -7.714 0.912
65 HB ILE 10 HB ILE 10 -6.331 -9.272 -0.091
66 1HG1 ILE 10 2HG1 ILE 10 -7.613 -8.349 -2.676
67 2HG1 ILE 10 1HG1 ILE 10 -5.972 -7.963 -2.170
68 1HG2 ILE 10 1HG2 ILE 10 -8.435 -10.171 0.506
69 2HG2 ILE 10 2HG2 ILE 10 -8.097 -10.751 -1.125
70 3HG2 ILE 10 3HG2 ILE 10 -9.230 -9.421 -0.880
71 1HD1 ILE 10 1HD1 ILE 10 -5.210 -10.092 -2.563
72 2HD1 ILE 10 2HD1 ILE 10 -6.414 -9.905 -3.839
73 3HD1 ILE 10 3HD1 ILE 10 -6.808 -10.815 -2.381
74 HA PRO 11 HA PRO 11 -5.092 -4.228 0.587
75 1HB PRO 11 2HB PRO 11 -5.846 -3.900 3.416
76 2HB PRO 11 1HB PRO 11 -5.783 -2.708 2.116
77 1HG PRO 11 2HG PRO 11 -8.085 -3.572 3.049
78 2HG PRO 11 1HG PRO 11 -7.868 -3.280 1.314
79 1HD PRO 11 2HD PRO 11 -7.826 -5.891 2.806
80 2HD PRO 11 1HD PRO 11 -8.606 -5.496 1.257
81 H VAL 12 H VAL 12 -3.941 -3.482 2.929
82 HA VAL 12 HA VAL 12 -2.158 -3.739 4.195
83 HB VAL 12 HB VAL 12 -2.724 -6.703 4.304
84 1HG1 VAL 12 1HG1 VAL 12 -0.531 -5.778 5.177
85 2HG1 VAL 12 2HG1 VAL 12 -1.487 -6.734 6.309
86 3HG1 VAL 12 3HG1 VAL 12 -1.481 -4.974 6.426
87 1HG2 VAL 12 1HG2 VAL 12 -4.543 -6.368 5.549
88 2HG2 VAL 12 2HG2 VAL 12 -4.455 -4.660 5.114
89 3HG2 VAL 12 3HG2 VAL 12 -3.685 -5.234 6.594
90 H CYS 13 H CYS 13 -0.930 -3.151 2.439
91 HA CYS 13 HA CYS 13 0.237 -4.728 0.490
92 1HB CYS 13 2HB CYS 13 1.890 -2.622 1.818
93 2HB CYS 13 1HB CYS 13 1.598 -2.899 0.100
94 H THR 14 H THR 14 1.136 -6.669 0.962
95 HA THR 14 HA THR 14 2.775 -6.981 3.345
96 HB THR 14 HB THR 14 1.939 -9.120 1.391
97 HG1 THR 14 1HG THR 14 0.296 -7.688 2.727
98 1HG2 THR 14 1HG2 THR 14 2.441 -10.669 3.097
99 2HG2 THR 14 2HG2 THR 14 2.542 -9.408 4.326
100 3HG2 THR 14 3HG2 THR 14 3.799 -9.545 3.097
101 H TYR 15 H TYR 15 3.283 -6.738 -0.110
102 HA TYR 15 HA TYR 15 5.794 -8.126 -0.103
103 1HB TYR 15 2HB TYR 15 4.447 -7.898 -2.153
104 2HB TYR 15 1HB TYR 15 4.682 -6.155 -2.113
105 HD1 TYR 15 1HD TYR 15 6.052 -5.505 -3.847
106 HD2 TYR 15 2HD TYR 15 7.014 -9.055 -1.709
107 HE1 TYR 15 1HE TYR 15 8.100 -5.749 -5.185
108 HE2 TYR 15 2HE TYR 15 9.066 -9.308 -3.040
109 HH TYR 15 HH TYR 15 10.560 -7.168 -4.540
110 H SER 16 H SER 16 4.846 -4.739 -0.226
111 HA SER 16 HA SER 16 7.596 -3.887 0.285
112 1HB SER 16 2HB SER 16 5.056 -2.341 -0.262
113 2HB SER 16 1HB SER 16 6.644 -1.603 -0.031
114 HG SER 16 HG SER 16 5.936 -3.480 -2.044
115 H ALA 17 H ALA 17 5.562 -5.240 2.190
116 HA ALA 17 HA ALA 17 4.963 -3.430 4.255
117 1HB ALA 17 1HB ALA 17 5.129 -6.398 4.052
118 2HB ALA 17 2HB ALA 17 3.759 -5.366 4.464
119 3HB ALA 17 3HB ALA 17 5.028 -5.663 5.652
120 H ALA 18 H ALA 18 7.904 -5.114 3.440
121 HA ALA 18 HA ALA 18 9.256 -5.113 5.878
122 1HB ALA 18 1HB ALA 18 11.321 -5.132 4.552
123 2HB ALA 18 2HB ALA 18 10.401 -4.678 3.118
124 3HB ALA 18 3HB ALA 18 10.116 -6.237 3.891
125 H LEU 19 H LEU 19 8.879 -2.587 3.478
126 HA LEU 19 HA LEU 19 10.511 -0.659 4.836
127 1HB LEU 19 2HB LEU 19 8.863 -0.753 2.404
128 2HB LEU 19 1HB LEU 19 8.974 0.812 3.172
129 HG LEU 19 HG LEU 19 11.252 0.989 2.799
130 1HD1 LEU 19 1HD1 LEU 19 11.431 -1.653 3.428
131 2HD1 LEU 19 2HD1 LEU 19 12.754 -0.704 2.751
132 3HD1 LEU 19 3HD1 LEU 19 11.754 -1.701 1.695
133 1HD2 LEU 19 1HD2 LEU 19 10.394 1.394 0.717
134 2HD2 LEU 19 2HD2 LEU 19 9.765 -0.244 0.531
135 3HD2 LEU 19 3HD2 LEU 19 11.490 0.065 0.341
136 H GLY 20 H GLY 20 7.400 -1.800 5.279
137 1HA GLY 20 2HA GLY 20 5.877 -1.152 6.922
138 2HA GLY 20 1HA GLY 20 6.819 0.318 7.175
139 H CYS 21 H CYS 21 5.901 -0.792 4.038
140 HA CYS 21 HA CYS 21 4.773 1.631 3.221
141 1HB CYS 21 2HB CYS 21 4.950 -1.122 2.141
142 2HB CYS 21 1HB CYS 21 3.719 -0.094 1.437
143 H THR 22 H THR 22 3.055 2.460 4.203
144 HA THR 22 HA THR 22 0.739 0.705 4.615
145 HB THR 22 HB THR 22 -0.038 2.433 6.253
146 HG1 THR 22 1HG THR 22 1.644 3.993 5.392
147 1HG2 THR 22 1HG2 THR 22 2.142 0.511 6.593
148 2HG2 THR 22 2HG2 THR 22 0.673 0.735 7.541
149 3HG2 THR 22 3HG2 THR 22 2.083 1.747 7.850
150 H CYS 23 H CYS 23 -0.988 1.133 3.524
151 HA CYS 23 HA CYS 23 -1.014 3.473 1.796
152 1HB CYS 23 2HB CYS 23 -2.834 2.333 0.638
153 2HB CYS 23 1HB CYS 23 -1.430 1.288 0.798
154 H ASP 24 H ASP 24 -4.026 3.000 1.720
155 HA ASP 24 HA ASP 24 -4.707 4.676 4.036
156 1HB ASP 24 2HB ASP 24 -4.965 5.794 1.847
157 2HB ASP 24 1HB ASP 24 -6.048 4.512 1.321
158 H ASP 25 H ASP 25 -6.227 2.398 1.772
159 HA ASP 25 HA ASP 25 -7.783 0.787 1.974
160 1HB ASP 25 2HB ASP 25 -6.195 -0.476 3.265
161 2HB ASP 25 1HB ASP 25 -6.504 0.492 4.700
162 H ARG 26 H ARG 26 -9.469 1.736 1.632
163 HA ARG 26 HA ARG 26 -11.560 1.768 3.428
164 1HB ARG 26 2HB ARG 26 -10.074 4.333 3.250
165 2HB ARG 26 1HB ARG 26 -11.806 4.400 3.175
166 1HG ARG 26 2HG ARG 26 -10.046 3.602 5.436
167 2HG ARG 26 1HG ARG 26 -11.401 4.729 5.426
168 1HD ARG 26 2HD ARG 26 -12.171 2.850 6.623
169 2HD ARG 26 1HD ARG 26 -12.886 2.692 5.019
170 HE ARG 26 HE ARG 26 -10.432 1.324 5.050
171 1HH1 ARG 26 1HH1 ARG 26 -13.612 1.034 6.502
172 2HH1 ARG 26 2HH1 ARG 26 -13.560 -0.695 6.568
173 1HH2 ARG 26 1HH2 ARG 26 -10.359 -0.933 5.088
174 2HH2 ARG 26 2HH2 ARG 26 -11.692 -1.824 5.768
175 H SER 27 H SER 27 -12.495 0.782 1.716
176 HA SER 27 HA SER 27 -13.703 0.596 -0.191
177 1HB SER 27 2HB SER 27 -13.606 3.627 -0.230
178 2HB SER 27 1HB SER 27 -14.694 2.610 -1.168
179 HG SER 27 HG SER 27 -15.851 3.195 0.592
180 H ASP 28 H ASP 28 -11.045 0.290 -0.165
181 HA ASP 28 HA ASP 28 -9.347 -0.183 -1.538
182 1HB ASP 28 2HB ASP 28 -11.098 1.041 -3.682
183 2HB ASP 28 1HB ASP 28 -9.580 0.221 -3.991
184 H GLY 29 H GLY 29 -7.409 0.749 -1.865
185 1HA GLY 29 2HA GLY 29 -7.309 3.626 -2.406
186 2HA GLY 29 1HA GLY 29 -6.559 3.054 -0.930
187 H LEU 30 H LEU 30 -4.470 3.423 -1.304
188 HA LEU 30 HA LEU 30 -3.124 1.782 -3.275
189 1HB LEU 30 2HB LEU 30 -3.840 3.800 -4.493
190 2HB LEU 30 1HB LEU 30 -2.987 4.793 -3.336
191 HG LEU 30 HG LEU 30 -0.861 3.614 -4.081
192 1HD1 LEU 30 1HD1 LEU 30 -0.867 2.418 -6.137
193 2HD1 LEU 30 2HD1 LEU 30 -2.570 2.785 -6.416
194 3HD1 LEU 30 3HD1 LEU 30 -2.105 1.696 -5.109
195 1HD2 LEU 30 1HD2 LEU 30 -1.406 4.834 -6.536
196 2HD2 LEU 30 2HD2 LEU 30 -0.654 5.568 -5.120
197 3HD2 LEU 30 3HD2 LEU 30 -2.397 5.688 -5.355
198 H CYS 31 H CYS 31 -1.210 1.119 -2.468
199 HA CYS 31 HA CYS 31 -0.399 1.726 0.150
200 1HB CYS 31 2HB CYS 31 1.167 0.394 -2.048
201 2HB CYS 31 1HB CYS 31 1.548 0.324 -0.332
202 H LYS 32 H LYS 32 1.389 2.776 1.022
203 HA LYS 32 HA LYS 32 2.850 4.572 -0.783
204 1HB LYS 32 2HB LYS 32 1.465 5.285 1.797
205 2HB LYS 32 1HB LYS 32 2.720 6.284 1.107
206 1HG LYS 32 2HG LYS 32 0.011 5.672 -0.002
207 2HG LYS 32 1HG LYS 32 0.727 7.246 0.358
208 1HD LYS 32 2HD LYS 32 2.140 7.154 -1.529
209 2HD LYS 32 1HD LYS 32 1.915 5.417 -1.704
210 1HE LYS 32 2HE LYS 32 0.709 6.539 -3.432
211 2HE LYS 32 1HE LYS 32 -0.432 5.816 -2.304
212 1HZ LYS 32 1HZ LYS 32 0.365 8.614 -1.906
213 2HZ LYS 32 2HZ LYS 32 -1.086 7.844 -1.500
214 3HZ LYS 32 3HZ LYS 32 -0.768 8.253 -3.111
215 H ARG 33 H ARG 33 4.974 4.939 -0.271
216 HA ARG 33 HA ARG 33 6.261 2.905 1.270
217 1HB ARG 33 2HB ARG 33 6.932 4.170 -0.967
218 2HB ARG 33 1HB ARG 33 7.778 5.220 0.160
219 1HG ARG 33 2HG ARG 33 9.068 3.355 0.992
220 2HG ARG 33 1HG ARG 33 8.159 2.237 -0.027
221 1HD ARG 33 2HD ARG 33 10.094 2.585 -1.257
222 2HD ARG 33 1HD ARG 33 8.964 3.724 -1.980
223 HE ARG 33 HE ARG 33 10.251 5.477 -1.214
224 1HH1 ARG 33 1HH1 ARG 33 11.301 2.509 0.346
225 2HH1 ARG 33 2HH1 ARG 33 12.716 3.225 1.038
226 1HH2 ARG 33 1HH2 ARG 33 12.123 6.417 -0.326
227 2HH2 ARG 33 2HH2 ARG 33 13.183 5.449 0.658
228 H ASN 34 H ASN 34 8.548 4.867 1.790
229 HA ASN 34 HA ASN 34 7.666 6.445 4.045
230 1HB ASN 34 2HB ASN 34 9.024 3.861 4.325
231 2HB ASN 34 1HB ASN 34 9.616 5.137 5.360
232 1HD2 ASN 34 1HD2 ASN 34 7.809 2.567 5.423
233 2HD2 ASN 34 2HD2 ASN 34 6.538 3.040 6.478
234 H GLY 35 H GLY 35 9.248 7.966 4.686
235 1HA GLY 35 2HA GLY 35 11.258 9.180 4.499
236 2HA GLY 35 1HA GLY 35 11.833 7.998 3.316
237 H ASP 36 H ASP 36 9.742 7.883 1.692
238 HA ASP 36 HA ASP 36 8.995 10.477 0.657
239 1HB ASP 36 2HB ASP 36 9.708 9.712 -1.679
240 2HB ASP 36 1HB ASP 36 11.017 10.188 -0.605
241 HA PRO 37 HA PRO 37 6.127 6.586 0.923
242 1HB PRO 37 2HB PRO 37 4.611 8.884 2.163
243 2HB PRO 37 1HB PRO 37 4.449 7.144 2.488
244 1HG PRO 37 2HG PRO 37 5.977 8.375 4.148
245 2HG PRO 37 1HG PRO 37 6.713 7.024 3.286
246 1HD PRO 37 2HD PRO 37 6.904 9.949 2.584
247 2HD PRO 37 1HD PRO 37 8.227 8.790 2.862
Start of MODEL 9
1 H THR 1 H THR 1 5.965 6.461 -0.591
2 HA THR 1 HA THR 1 3.994 8.321 -1.499
3 HB THR 1 HB THR 1 6.152 9.211 -2.452
4 HG1 THR 1 1HG THR 1 5.324 9.322 -4.578
5 1HG2 THR 1 1HG2 THR 1 7.535 7.355 -2.770
6 2HG2 THR 1 2HG2 THR 1 7.049 7.800 -4.406
7 3HG2 THR 1 3HG2 THR 1 6.272 6.440 -3.594
8 H PHE 2 H PHE 2 3.149 7.248 -3.625
9 HA PHE 2 HA PHE 2 2.077 4.808 -3.020
10 1HB PHE 2 2HB PHE 2 1.099 6.081 -4.731
11 2HB PHE 2 1HB PHE 2 2.594 6.186 -5.634
12 HD1 PHE 2 1HD PHE 2 0.605 3.325 -4.266
13 HD2 PHE 2 2HD PHE 2 2.366 5.164 -7.678
14 HE1 PHE 2 1HE PHE 2 -0.135 1.438 -5.661
15 HE2 PHE 2 2HE PHE 2 1.629 3.279 -9.077
16 HZ PHE 2 HZ PHE 2 0.378 1.414 -8.069
17 H CYS 3 H CYS 3 3.207 3.102 -2.408
18 HA CYS 3 HA CYS 3 5.758 2.332 -3.215
19 1HB CYS 3 2HB CYS 3 3.753 0.253 -2.418
20 2HB CYS 3 1HB CYS 3 5.444 0.396 -1.979
21 H GLY 4 H GLY 4 2.714 0.724 -4.123
22 1HA GLY 4 2HA GLY 4 2.994 0.589 -6.839
23 2HA GLY 4 1HA GLY 4 3.959 -0.755 -6.238
24 H GLU 5 H GLU 5 2.491 -1.510 -4.059
25 HA GLU 5 HA GLU 5 0.401 -3.038 -5.260
26 1HB GLU 5 2HB GLU 5 1.528 -2.769 -2.497
27 2HB GLU 5 1HB GLU 5 0.003 -3.609 -2.734
28 1HG GLU 5 2HG GLU 5 2.521 -4.336 -4.197
29 2HG GLU 5 1HG GLU 5 2.061 -5.043 -2.648
30 H THR 6 H THR 6 -1.730 -3.207 -3.984
31 HA THR 6 HA THR 6 -2.722 -0.606 -3.099
32 HB THR 6 HB THR 6 -4.843 -0.956 -4.394
33 HG1 THR 6 1HG THR 6 -4.983 -2.502 -5.898
34 1HG2 THR 6 1HG2 THR 6 -3.269 -0.684 -6.699
35 2HG2 THR 6 2HG2 THR 6 -2.303 -0.037 -5.375
36 3HG2 THR 6 3HG2 THR 6 -3.917 0.603 -5.682
37 H CYS 7 H CYS 7 -4.192 -0.785 -1.439
38 HA CYS 7 HA CYS 7 -4.527 -3.452 -0.348
39 1HB CYS 7 2HB CYS 7 -5.588 -2.147 1.580
40 2HB CYS 7 1HB CYS 7 -3.863 -1.893 1.318
41 H ARG 8 H ARG 8 -5.901 -3.869 -2.348
42 HA ARG 8 HA ARG 8 -8.498 -2.784 -2.607
43 1HB ARG 8 2HB ARG 8 -8.911 -4.828 -4.066
44 2HB ARG 8 1HB ARG 8 -7.617 -3.779 -4.530
45 1HG ARG 8 2HG ARG 8 -6.870 -6.048 -2.816
46 2HG ARG 8 1HG ARG 8 -7.371 -6.420 -4.467
47 1HD ARG 8 2HD ARG 8 -5.677 -5.006 -5.375
48 2HD ARG 8 1HD ARG 8 -5.276 -4.367 -3.781
49 HE ARG 8 HE ARG 8 -4.899 -7.152 -3.772
50 1HH1 ARG 8 1HH1 ARG 8 -3.501 -4.262 -5.189
51 2HH1 ARG 8 2HH1 ARG 8 -1.881 -4.925 -5.228
52 1HH2 ARG 8 1HH2 ARG 8 -2.740 -8.001 -3.849
53 2HH2 ARG 8 2HH2 ARG 8 -1.462 -7.008 -4.479
54 H VAL 9 H VAL 9 -9.308 -5.855 -2.923
55 HA VAL 9 HA VAL 9 -10.844 -5.884 -0.446
56 HB VAL 9 HB VAL 9 -10.942 -8.039 -2.550
57 1HG1 VAL 9 1HG1 VAL 9 -12.155 -8.292 -0.377
58 2HG1 VAL 9 2HG1 VAL 9 -13.187 -8.363 -1.805
59 3HG1 VAL 9 3HG1 VAL 9 -13.133 -6.896 -0.828
60 1HG2 VAL 9 1HG2 VAL 9 -11.857 -6.728 -4.098
61 2HG2 VAL 9 2HG2 VAL 9 -11.344 -5.346 -3.129
62 3HG2 VAL 9 3HG2 VAL 9 -12.965 -6.013 -2.927
63 H ILE 10 H ILE 10 -8.093 -6.140 -0.398
64 HA ILE 10 HA ILE 10 -7.629 -8.175 1.475
65 HB ILE 10 HB ILE 10 -5.615 -9.104 0.026
66 1HG1 ILE 10 2HG1 ILE 10 -7.688 -8.579 -2.116
67 2HG1 ILE 10 1HG1 ILE 10 -6.163 -7.714 -1.955
68 1HG2 ILE 10 1HG2 ILE 10 -6.929 -10.751 0.878
69 2HG2 ILE 10 2HG2 ILE 10 -7.292 -10.940 -0.837
70 3HG2 ILE 10 3HG2 ILE 10 -8.414 -10.072 0.211
71 1HD1 ILE 10 1HD1 ILE 10 -5.754 -9.279 -3.615
72 2HD1 ILE 10 2HD1 ILE 10 -6.637 -10.551 -2.770
73 3HD1 ILE 10 3HD1 ILE 10 -5.065 -10.019 -2.169
74 HA PRO 11 HA PRO 11 -5.244 -4.162 1.105
75 1HB PRO 11 2HB PRO 11 -5.916 -4.069 3.986
76 2HB PRO 11 1HB PRO 11 -6.010 -2.801 2.758
77 1HG PRO 11 2HG PRO 11 -8.196 -3.941 3.652
78 2HG PRO 11 1HG PRO 11 -8.028 -3.582 1.925
79 1HD PRO 11 2HD PRO 11 -7.688 -6.210 3.345
80 2HD PRO 11 1HD PRO 11 -8.521 -5.861 1.813
81 H VAL 12 H VAL 12 -3.973 -3.327 3.342
82 HA VAL 12 HA VAL 12 -1.991 -3.421 4.341
83 HB VAL 12 HB VAL 12 -2.495 -6.373 4.771
84 1HG1 VAL 12 1HG1 VAL 12 -1.300 -4.900 6.957
85 2HG1 VAL 12 2HG1 VAL 12 -0.349 -4.760 5.479
86 3HG1 VAL 12 3HG1 VAL 12 -0.733 -6.352 6.132
87 1HG2 VAL 12 1HG2 VAL 12 -3.966 -5.970 6.472
88 2HG2 VAL 12 2HG2 VAL 12 -4.351 -4.594 5.437
89 3HG2 VAL 12 3HG2 VAL 12 -3.289 -4.381 6.830
90 H CYS 13 H CYS 13 -1.238 -3.052 2.194
91 HA CYS 13 HA CYS 13 -0.341 -4.651 0.236
92 1HB CYS 13 2HB CYS 13 1.599 -2.608 1.223
93 2HB CYS 13 1HB CYS 13 0.981 -2.870 -0.407
94 H THR 14 H THR 14 0.503 -6.664 0.679
95 HA THR 14 HA THR 14 2.445 -7.107 2.722
96 HB THR 14 HB THR 14 2.500 -9.435 1.525
97 HG1 THR 14 1HG THR 14 -0.002 -9.180 0.651
98 1HG2 THR 14 1HG2 THR 14 0.098 -9.805 2.559
99 2HG2 THR 14 2HG2 THR 14 0.360 -8.175 3.178
100 3HG2 THR 14 3HG2 THR 14 1.488 -9.467 3.591
101 H TYR 15 H TYR 15 2.667 -6.758 -0.791
102 HA TYR 15 HA TYR 15 5.308 -7.779 -1.003
103 1HB TYR 15 2HB TYR 15 3.765 -7.576 -2.942
104 2HB TYR 15 1HB TYR 15 3.894 -5.824 -2.835
105 HD1 TYR 15 1HD TYR 15 5.081 -5.038 -4.654
106 HD2 TYR 15 2HD TYR 15 6.443 -8.557 -2.688
107 HE1 TYR 15 1HE TYR 15 7.051 -5.093 -6.127
108 HE2 TYR 15 2HE TYR 15 8.416 -8.620 -4.152
109 HH TYR 15 HH TYR 15 9.754 -6.863 -5.515
110 H SER 16 H SER 16 3.937 -4.578 -0.682
111 HA SER 16 HA SER 16 6.577 -3.350 -0.420
112 1HB SER 16 2HB SER 16 3.808 -2.120 -0.363
113 2HB SER 16 1HB SER 16 5.339 -1.243 -0.445
114 HG SER 16 HG SER 16 5.431 -2.959 -2.402
115 H ALA 17 H ALA 17 4.874 -5.149 1.581
116 HA ALA 17 HA ALA 17 4.592 -3.495 3.881
117 1HB ALA 17 1HB ALA 17 4.631 -5.832 5.062
118 2HB ALA 17 2HB ALA 17 4.528 -6.448 3.413
119 3HB ALA 17 3HB ALA 17 3.272 -5.378 4.034
120 H ALA 18 H ALA 18 7.301 -5.070 2.437
121 HA ALA 18 HA ALA 18 8.963 -5.604 4.600
122 1HB ALA 18 1HB ALA 18 10.562 -4.496 2.529
123 2HB ALA 18 2HB ALA 18 9.239 -5.391 1.780
124 3HB ALA 18 3HB ALA 18 10.306 -6.195 2.931
125 H LEU 19 H LEU 19 8.391 -2.616 2.873
126 HA LEU 19 HA LEU 19 10.181 -1.020 4.443
127 1HB LEU 19 2HB LEU 19 8.313 -0.625 2.201
128 2HB LEU 19 1HB LEU 19 8.507 0.758 3.239
129 HG LEU 19 HG LEU 19 10.842 0.887 2.772
130 1HD1 LEU 19 1HD1 LEU 19 11.205 -1.066 0.733
131 2HD1 LEU 19 2HD1 LEU 19 10.576 -1.882 2.162
132 3HD1 LEU 19 3HD1 LEU 19 12.048 -0.920 2.273
133 1HD2 LEU 19 1HD2 LEU 19 8.864 0.820 0.623
134 2HD2 LEU 19 2HD2 LEU 19 10.530 0.666 0.065
135 3HD2 LEU 19 3HD2 LEU 19 10.052 2.055 1.041
136 H GLY 20 H GLY 20 6.867 -1.952 4.563
137 1HA GLY 20 2HA GLY 20 5.536 -1.812 6.528
138 2HA GLY 20 1HA GLY 20 6.533 -0.456 7.065
139 H CYS 21 H CYS 21 5.350 -0.919 3.861
140 HA CYS 21 HA CYS 21 4.448 1.633 3.409
141 1HB CYS 21 2HB CYS 21 4.087 -1.007 2.132
142 2HB CYS 21 1HB CYS 21 2.946 0.231 1.659
143 H THR 22 H THR 22 2.886 2.726 4.346
144 HA THR 22 HA THR 22 0.591 1.337 5.455
145 HB THR 22 HB THR 22 -0.071 3.645 6.228
146 HG1 THR 22 1HG THR 22 2.636 4.340 5.728
147 1HG2 THR 22 1HG2 THR 22 2.609 2.704 7.247
148 2HG2 THR 22 2HG2 THR 22 1.079 1.924 7.640
149 3HG2 THR 22 3HG2 THR 22 1.373 3.587 8.141
150 H CYS 23 H CYS 23 -1.229 1.223 4.437
151 HA CYS 23 HA CYS 23 -1.503 2.618 1.905
152 1HB CYS 23 2HB CYS 23 -1.879 0.077 2.310
153 2HB CYS 23 1HB CYS 23 -3.444 0.571 2.947
154 H ASP 24 H ASP 24 -4.485 2.096 2.180
155 HA ASP 24 HA ASP 24 -5.237 4.328 3.936
156 1HB ASP 24 2HB ASP 24 -4.915 4.913 1.404
157 2HB ASP 24 1HB ASP 24 -6.434 4.052 1.185
158 H ASP 25 H ASP 25 -6.477 1.879 1.710
159 HA ASP 25 HA ASP 25 -8.106 0.354 1.747
160 1HB ASP 25 2HB ASP 25 -6.880 -0.538 3.682
161 2HB ASP 25 1HB ASP 25 -7.847 0.471 4.757
162 H ARG 26 H ARG 26 -9.860 0.529 1.110
163 HA ARG 26 HA ARG 26 -12.212 1.234 2.424
164 1HB ARG 26 2HB ARG 26 -10.796 3.440 1.030
165 2HB ARG 26 1HB ARG 26 -12.501 3.277 0.707
166 1HG ARG 26 2HG ARG 26 -13.092 3.727 2.921
167 2HG ARG 26 1HG ARG 26 -11.468 3.372 3.509
168 1HD ARG 26 2HD ARG 26 -11.628 5.564 1.560
169 2HD ARG 26 1HD ARG 26 -12.451 5.871 3.090
170 HE ARG 26 HE ARG 26 -9.619 5.744 2.638
171 1HH1 ARG 26 1HH1 ARG 26 -12.120 5.278 5.057
172 2HH1 ARG 26 2HH1 ARG 26 -11.027 5.410 6.390
173 1HH2 ARG 26 1HH2 ARG 26 -8.198 5.931 4.354
174 2HH2 ARG 26 2HH2 ARG 26 -8.772 5.784 5.994
175 H SER 27 H SER 27 -11.621 -0.887 1.154
176 HA SER 27 HA SER 27 -12.554 -2.332 -0.375
177 1HB SER 27 2HB SER 27 -14.418 -0.758 -0.909
178 2HB SER 27 1HB SER 27 -13.352 0.076 -2.040
179 HG SER 27 HG SER 27 -13.119 -2.151 -2.990
180 H ASP 28 H ASP 28 -10.434 0.153 -0.733
181 HA ASP 28 HA ASP 28 -8.338 -1.221 -1.782
182 1HB ASP 28 2HB ASP 28 -9.901 -1.035 -3.898
183 2HB ASP 28 1HB ASP 28 -9.344 0.628 -3.934
184 H GLY 29 H GLY 29 -6.961 0.954 -3.055
185 1HA GLY 29 2HA GLY 29 -7.407 3.425 -1.840
186 2HA GLY 29 1HA GLY 29 -6.393 2.511 -0.741
187 H LEU 30 H LEU 30 -4.411 3.050 -0.881
188 HA LEU 30 HA LEU 30 -2.932 2.971 -3.310
189 1HB LEU 30 2HB LEU 30 -4.342 5.165 -3.222
190 2HB LEU 30 1HB LEU 30 -3.165 5.680 -2.042
191 HG LEU 30 HG LEU 30 -2.748 6.532 -4.339
192 1HD1 LEU 30 1HD1 LEU 30 -0.786 4.919 -2.826
193 2HD1 LEU 30 2HD1 LEU 30 -0.806 6.647 -3.188
194 3HD1 LEU 30 3HD1 LEU 30 -0.327 5.489 -4.430
195 1HD2 LEU 30 1HD2 LEU 30 -3.118 5.117 -6.014
196 2HD2 LEU 30 2HD2 LEU 30 -3.014 3.708 -4.956
197 3HD2 LEU 30 3HD2 LEU 30 -1.546 4.416 -5.631
198 H CYS 31 H CYS 31 -1.414 1.741 -2.277
199 HA CYS 31 HA CYS 31 -0.546 2.027 0.365
200 1HB CYS 31 2HB CYS 31 0.958 0.815 -1.959
201 2HB CYS 31 1HB CYS 31 1.290 0.535 -0.252
202 H LYS 32 H LYS 32 1.092 3.092 1.351
203 HA LYS 32 HA LYS 32 2.669 4.939 -0.314
204 1HB LYS 32 2HB LYS 32 0.732 5.641 1.422
205 2HB LYS 32 1HB LYS 32 2.110 5.674 2.494
206 1HG LYS 32 2HG LYS 32 1.606 7.869 1.480
207 2HG LYS 32 1HG LYS 32 3.213 7.283 1.034
208 1HD LYS 32 2HD LYS 32 1.890 8.243 -0.890
209 2HD LYS 32 1HD LYS 32 2.457 6.596 -1.116
210 1HE LYS 32 2HE LYS 32 0.135 6.940 -1.870
211 2HE LYS 32 1HE LYS 32 0.305 5.702 -0.636
212 1HZ LYS 32 1HZ LYS 32 -1.101 8.229 -0.516
213 2HZ LYS 32 2HZ LYS 32 -0.199 7.857 0.866
214 3HZ LYS 32 3HZ LYS 32 -1.389 6.786 0.319
215 H ARG 33 H ARG 33 4.808 5.010 0.037
216 HA ARG 33 HA ARG 33 6.045 2.855 1.432
217 1HB ARG 33 2HB ARG 33 7.057 5.186 -0.166
218 2HB ARG 33 1HB ARG 33 8.174 4.131 0.682
219 1HG ARG 33 2HG ARG 33 7.952 2.490 -0.821
220 2HG ARG 33 1HG ARG 33 6.210 2.733 -0.977
221 1HD ARG 33 2HD ARG 33 7.387 3.212 -3.075
222 2HD ARG 33 1HD ARG 33 6.577 4.640 -2.434
223 HE ARG 33 HE ARG 33 8.601 5.679 -2.334
224 1HH1 ARG 33 1HH1 ARG 33 9.195 2.217 -2.381
225 2HH1 ARG 33 2HH1 ARG 33 10.910 2.395 -2.534
226 1HH2 ARG 33 1HH2 ARG 33 10.831 5.919 -2.590
227 2HH2 ARG 33 2HH2 ARG 33 11.846 4.504 -2.648
228 H ASN 34 H ASN 34 8.452 3.961 2.172
229 HA ASN 34 HA ASN 34 7.998 5.805 4.384
230 1HB ASN 34 2HB ASN 34 9.578 3.351 4.907
231 2HB ASN 34 1HB ASN 34 8.802 4.385 6.054
232 1HD2 ASN 34 1HD2 ASN 34 7.087 3.553 7.017
233 2HD2 ASN 34 2HD2 ASN 34 6.064 2.318 6.374
234 H GLY 35 H GLY 35 10.002 6.860 4.980
235 1HA GLY 35 2HA GLY 35 12.248 7.497 4.699
236 2HA GLY 35 1HA GLY 35 12.458 6.152 3.574
237 H ASP 36 H ASP 36 10.409 6.532 1.967
238 HA ASP 36 HA ASP 36 10.422 9.177 0.775
239 1HB ASP 36 2HB ASP 36 12.200 8.051 -0.465
240 2HB ASP 36 1HB ASP 36 11.199 6.619 -0.675
241 HA PRO 37 HA PRO 37 6.519 6.523 1.460
242 1HB PRO 37 2HB PRO 37 5.842 9.110 2.849
243 2HB PRO 37 1HB PRO 37 5.388 7.449 3.291
244 1HG PRO 37 2HG PRO 37 7.386 8.389 4.625
245 2HG PRO 37 1HG PRO 37 7.679 6.885 3.751
246 1HD PRO 37 2HD PRO 37 8.264 9.672 2.749
247 2HD PRO 37 1HD PRO 37 9.428 8.348 3.031
Start of MODEL 10
1 H THR 1 H THR 1 5.208 6.357 -0.576
2 HA THR 1 HA THR 1 2.938 7.904 -1.397
3 HB THR 1 HB THR 1 4.926 9.114 -2.375
4 HG1 THR 1 1HG THR 1 4.081 8.964 -4.579
5 1HG2 THR 1 1HG2 THR 1 5.968 6.608 -2.769
6 2HG2 THR 1 2HG2 THR 1 6.565 8.092 -3.512
7 3HG2 THR 1 3HG2 THR 1 5.436 7.059 -4.389
8 H PHE 2 H PHE 2 2.337 6.747 -3.602
9 HA PHE 2 HA PHE 2 1.593 4.224 -2.966
10 1HB PHE 2 2HB PHE 2 0.499 5.278 -4.760
11 2HB PHE 2 1HB PHE 2 2.005 5.562 -5.620
12 HD1 PHE 2 1HD PHE 2 1.771 4.509 -7.663
13 HD2 PHE 2 2HD PHE 2 0.664 2.418 -4.124
14 HE1 PHE 2 1HE PHE 2 1.419 2.464 -8.984
15 HE2 PHE 2 2HE PHE 2 0.311 0.371 -5.441
16 HZ PHE 2 HZ PHE 2 0.689 0.392 -7.873
17 H CYS 3 H CYS 3 2.759 2.562 -2.466
18 HA CYS 3 HA CYS 3 5.452 2.093 -3.204
19 1HB CYS 3 2HB CYS 3 3.514 -0.015 -2.236
20 2HB CYS 3 1HB CYS 3 5.251 0.047 -2.002
21 H GLY 4 H GLY 4 4.808 -0.898 -3.670
22 1HA GLY 4 2HA GLY 4 4.578 -0.640 -6.583
23 2HA GLY 4 1HA GLY 4 5.222 -2.032 -5.720
24 H GLU 5 H GLU 5 3.169 -2.327 -3.852
25 HA GLU 5 HA GLU 5 1.166 -3.617 -5.513
26 1HB GLU 5 2HB GLU 5 1.824 -3.715 -2.584
27 2HB GLU 5 1HB GLU 5 0.411 -4.504 -3.254
28 1HG GLU 5 2HG GLU 5 1.665 -6.090 -4.366
29 2HG GLU 5 1HG GLU 5 3.119 -5.087 -4.364
30 H THR 6 H THR 6 -1.087 -3.506 -4.960
31 HA THR 6 HA THR 6 -1.897 -0.936 -3.788
32 HB THR 6 HB THR 6 -3.976 -1.556 -5.435
33 HG1 THR 6 1HG THR 6 -1.720 -2.016 -7.071
34 1HG2 THR 6 1HG2 THR 6 -1.599 0.216 -5.668
35 2HG2 THR 6 2HG2 THR 6 -3.308 0.630 -5.537
36 3HG2 THR 6 3HG2 THR 6 -2.655 0.055 -7.071
37 H CYS 7 H CYS 7 -3.087 -1.168 -2.046
38 HA CYS 7 HA CYS 7 -4.108 -3.745 -1.255
39 1HB CYS 7 2HB CYS 7 -4.856 -2.255 0.771
40 2HB CYS 7 1HB CYS 7 -3.142 -2.613 0.561
41 H ARG 8 H ARG 8 -5.908 -4.325 -2.396
42 HA ARG 8 HA ARG 8 -8.077 -2.419 -2.855
43 1HB ARG 8 2HB ARG 8 -8.419 -5.273 -3.592
44 2HB ARG 8 1HB ARG 8 -8.803 -3.825 -4.512
45 1HG ARG 8 2HG ARG 8 -6.055 -4.815 -4.012
46 2HG ARG 8 1HG ARG 8 -6.999 -5.302 -5.421
47 1HD ARG 8 2HD ARG 8 -7.219 -2.567 -5.476
48 2HD ARG 8 1HD ARG 8 -5.574 -2.792 -4.880
49 HE ARG 8 HE ARG 8 -6.448 -3.119 -7.527
50 1HH1 ARG 8 1HH1 ARG 8 -4.295 -4.623 -5.200
51 2HH1 ARG 8 2HH1 ARG 8 -3.337 -5.410 -6.411
52 1HH2 ARG 8 1HH2 ARG 8 -5.178 -4.156 -9.119
53 2HH2 ARG 8 2HH2 ARG 8 -3.836 -5.141 -8.640
54 H VAL 9 H VAL 9 -9.709 -5.205 -2.734
55 HA VAL 9 HA VAL 9 -10.638 -4.673 -0.077
56 HB VAL 9 HB VAL 9 -12.434 -6.338 -0.576
57 1HG1 VAL 9 1HG1 VAL 9 -13.155 -4.903 -2.780
58 2HG1 VAL 9 2HG1 VAL 9 -11.974 -3.835 -2.022
59 3HG1 VAL 9 3HG1 VAL 9 -13.383 -4.380 -1.111
60 1HG2 VAL 9 1HG2 VAL 9 -11.573 -6.361 -3.433
61 2HG2 VAL 9 2HG2 VAL 9 -12.576 -7.511 -2.549
62 3HG2 VAL 9 3HG2 VAL 9 -10.830 -7.493 -2.303
63 H ILE 10 H ILE 10 -8.136 -5.694 -0.579
64 HA ILE 10 HA ILE 10 -7.877 -7.737 1.382
65 HB ILE 10 HB ILE 10 -6.314 -9.075 -0.229
66 1HG1 ILE 10 2HG1 ILE 10 -8.244 -7.912 -2.250
67 2HG1 ILE 10 1HG1 ILE 10 -6.541 -7.493 -2.123
68 1HG2 ILE 10 1HG2 ILE 10 -8.113 -10.226 0.722
69 2HG2 ILE 10 2HG2 ILE 10 -8.285 -10.486 -1.014
70 3HG2 ILE 10 3HG2 ILE 10 -9.304 -9.303 -0.194
71 1HD1 ILE 10 1HD1 ILE 10 -6.865 -9.050 -3.921
72 2HD1 ILE 10 2HD1 ILE 10 -7.677 -10.182 -2.840
73 3HD1 ILE 10 3HD1 ILE 10 -5.962 -9.834 -2.625
74 HA PRO 11 HA PRO 11 -4.893 -4.247 0.689
75 1HB PRO 11 2HB PRO 11 -5.263 -3.683 3.523
76 2HB PRO 11 1HB PRO 11 -5.508 -2.633 2.127
77 1HG PRO 11 2HG PRO 11 -7.529 -3.603 3.629
78 2HG PRO 11 1HG PRO 11 -7.702 -3.219 1.910
79 1HD PRO 11 2HD PRO 11 -7.376 -5.871 3.241
80 2HD PRO 11 1HD PRO 11 -8.348 -5.431 1.821
81 H VAL 12 H VAL 12 -3.460 -3.464 2.868
82 HA VAL 12 HA VAL 12 -1.501 -3.778 3.859
83 HB VAL 12 HB VAL 12 -2.199 -6.653 4.388
84 1HG1 VAL 12 1HG1 VAL 12 -0.213 -4.785 5.324
85 2HG1 VAL 12 2HG1 VAL 12 -0.320 -6.529 5.564
86 3HG1 VAL 12 3HG1 VAL 12 -1.151 -5.434 6.670
87 1HG2 VAL 12 1HG2 VAL 12 -4.176 -5.173 4.883
88 2HG2 VAL 12 2HG2 VAL 12 -3.172 -4.338 6.067
89 3HG2 VAL 12 3HG2 VAL 12 -3.543 -6.049 6.276
90 H CYS 13 H CYS 13 -0.706 -3.615 1.645
91 HA CYS 13 HA CYS 13 0.003 -5.732 0.026
92 1HB CYS 13 2HB CYS 13 1.576 -3.187 0.482
93 2HB CYS 13 1HB CYS 13 1.669 -4.226 -0.939
94 H THR 14 H THR 14 1.179 -7.454 0.496
95 HA THR 14 HA THR 14 2.806 -7.614 2.820
96 HB THR 14 HB THR 14 2.607 -9.667 0.627
97 HG1 THR 14 1HG THR 14 0.654 -8.633 2.179
98 1HG2 THR 14 1HG2 THR 14 4.270 -9.936 2.545
99 2HG2 THR 14 2HG2 THR 14 3.127 -11.256 2.301
100 3HG2 THR 14 3HG2 THR 14 2.864 -10.091 3.599
101 H TYR 15 H TYR 15 3.652 -7.506 -0.674
102 HA TYR 15 HA TYR 15 6.419 -8.066 -0.174
103 1HB TYR 15 2HB TYR 15 5.358 -8.456 -2.380
104 2HB TYR 15 1HB TYR 15 5.151 -6.720 -2.572
105 HD1 TYR 15 1HD TYR 15 6.551 -5.961 -4.233
106 HD2 TYR 15 2HD TYR 15 8.047 -8.821 -1.460
107 HE1 TYR 15 1HE TYR 15 8.767 -5.817 -5.288
108 HE2 TYR 15 2HE TYR 15 10.268 -8.682 -2.507
109 HH TYR 15 HH TYR 15 11.463 -6.596 -4.025
110 H SER 16 H SER 16 4.498 -5.190 -0.698
111 HA SER 16 HA SER 16 6.655 -3.319 -0.460
112 1HB SER 16 2HB SER 16 3.688 -2.856 -0.062
113 2HB SER 16 1HB SER 16 4.903 -1.643 -0.458
114 HG SER 16 HG SER 16 4.033 -3.815 -2.077
115 H ALA 17 H ALA 17 4.866 -5.182 1.758
116 HA ALA 17 HA ALA 17 4.845 -3.475 3.997
117 1HB ALA 17 1HB ALA 17 3.563 -5.188 4.621
118 2HB ALA 17 2HB ALA 17 5.062 -5.996 5.080
119 3HB ALA 17 3HB ALA 17 4.344 -6.300 3.498
120 H ALA 18 H ALA 18 7.450 -5.034 2.428
121 HA ALA 18 HA ALA 18 9.224 -5.563 4.532
122 1HB ALA 18 1HB ALA 18 10.983 -5.461 2.907
123 2HB ALA 18 2HB ALA 18 9.998 -4.478 1.822
124 3HB ALA 18 3HB ALA 18 9.571 -6.164 2.118
125 H LEU 19 H LEU 19 8.454 -2.637 2.790
126 HA LEU 19 HA LEU 19 10.291 -0.964 4.266
127 1HB LEU 19 2HB LEU 19 8.412 -0.643 2.023
128 2HB LEU 19 1HB LEU 19 8.604 0.761 3.039
129 HG LEU 19 HG LEU 19 10.901 0.941 2.541
130 1HD1 LEU 19 1HD1 LEU 19 11.010 -1.746 2.438
131 2HD1 LEU 19 2HD1 LEU 19 12.259 -0.711 1.748
132 3HD1 LEU 19 3HD1 LEU 19 11.008 -1.394 0.709
133 1HD2 LEU 19 1HD2 LEU 19 10.563 1.805 0.513
134 2HD2 LEU 19 2HD2 LEU 19 8.931 1.145 0.623
135 3HD2 LEU 19 3HD2 LEU 19 10.198 0.230 -0.192
136 H GLY 20 H GLY 20 7.224 -2.212 4.732
137 1HA GLY 20 2HA GLY 20 5.838 -1.925 6.586
138 2HA GLY 20 1HA GLY 20 6.791 -0.516 7.047
139 H CYS 21 H CYS 21 5.514 -1.141 3.876
140 HA CYS 21 HA CYS 21 4.493 1.377 3.420
141 1HB CYS 21 2HB CYS 21 4.044 -1.311 2.206
142 2HB CYS 21 1HB CYS 21 2.967 -0.010 1.741
143 H THR 22 H THR 22 2.959 2.416 4.482
144 HA THR 22 HA THR 22 0.836 0.906 5.762
145 HB THR 22 HB THR 22 0.159 3.129 6.691
146 HG1 THR 22 1HG THR 22 2.713 4.131 6.148
147 1HG2 THR 22 1HG2 THR 22 2.635 1.642 7.301
148 2HG2 THR 22 2HG2 THR 22 1.251 2.009 8.331
149 3HG2 THR 22 3HG2 THR 22 2.490 3.232 8.050
150 H CYS 23 H CYS 23 -0.996 0.674 4.897
151 HA CYS 23 HA CYS 23 -1.690 2.198 2.524
152 1HB CYS 23 2HB CYS 23 -1.874 -0.192 2.262
153 2HB CYS 23 1HB CYS 23 -2.804 -0.350 3.745
154 H ASP 24 H ASP 24 -3.801 3.094 2.280
155 HA ASP 24 HA ASP 24 -4.816 4.290 4.735
156 1HB ASP 24 2HB ASP 24 -4.389 5.659 2.679
157 2HB ASP 24 1HB ASP 24 -5.638 4.741 1.849
158 H ASP 25 H ASP 25 -6.131 2.699 1.872
159 HA ASP 25 HA ASP 25 -7.857 1.373 1.417
160 1HB ASP 25 2HB ASP 25 -6.744 -0.246 2.831
161 2HB ASP 25 1HB ASP 25 -7.507 0.440 4.265
162 H ARG 26 H ARG 26 -9.796 1.350 1.154
163 HA ARG 26 HA ARG 26 -11.782 2.229 3.022
164 1HB ARG 26 2HB ARG 26 -10.726 4.037 0.898
165 2HB ARG 26 1HB ARG 26 -12.456 4.002 1.141
166 1HG ARG 26 2HG ARG 26 -12.331 4.964 3.211
167 2HG ARG 26 1HG ARG 26 -10.715 4.331 3.516
168 1HD ARG 26 2HD ARG 26 -10.375 6.018 1.347
169 2HD ARG 26 1HD ARG 26 -11.536 6.867 2.370
170 HE ARG 26 HE ARG 26 -8.753 6.527 2.864
171 1HH1 ARG 26 1HH1 ARG 26 -11.853 6.742 4.502
172 2HH1 ARG 26 2HH1 ARG 26 -11.156 7.130 6.036
173 1HH2 ARG 26 1HH2 ARG 26 -7.832 6.993 4.880
174 2HH2 ARG 26 2HH2 ARG 26 -8.864 7.276 6.252
175 H SER 27 H SER 27 -11.456 -0.110 1.999
176 HA SER 27 HA SER 27 -12.531 -1.787 0.904
177 1HB SER 27 2HB SER 27 -14.350 0.363 -0.240
178 2HB SER 27 1HB SER 27 -14.643 -1.373 -0.243
179 HG SER 27 HG SER 27 -14.151 -0.251 2.230
180 H ASP 28 H ASP 28 -10.322 -0.452 0.204
181 HA ASP 28 HA ASP 28 -8.850 -1.076 -1.550
182 1HB ASP 28 2HB ASP 28 -10.487 -1.703 -3.254
183 2HB ASP 28 1HB ASP 28 -11.011 -0.030 -3.401
184 H GLY 29 H GLY 29 -7.239 0.325 -2.165
185 1HA GLY 29 2HA GLY 29 -7.741 3.153 -2.343
186 2HA GLY 29 1HA GLY 29 -6.994 2.689 -0.823
187 H LEU 30 H LEU 30 -4.876 2.697 -0.746
188 HA LEU 30 HA LEU 30 -3.237 1.903 -2.965
189 1HB LEU 30 2HB LEU 30 -4.108 4.300 -3.383
190 2HB LEU 30 1HB LEU 30 -3.032 4.766 -2.091
191 HG LEU 30 HG LEU 30 -1.150 3.752 -3.446
192 1HD1 LEU 30 1HD1 LEU 30 -2.829 2.428 -4.858
193 2HD1 LEU 30 2HD1 LEU 30 -1.471 3.185 -5.689
194 3HD1 LEU 30 3HD1 LEU 30 -3.067 3.933 -5.747
195 1HD2 LEU 30 1HD2 LEU 30 -2.306 6.251 -3.513
196 2HD2 LEU 30 2HD2 LEU 30 -2.164 5.822 -5.218
197 3HD2 LEU 30 3HD2 LEU 30 -0.734 5.814 -4.185
198 H CYS 31 H CYS 31 -1.362 1.105 -2.142
199 HA CYS 31 HA CYS 31 -0.808 1.408 0.666
200 1HB CYS 31 2HB CYS 31 0.372 -0.203 -1.558
201 2HB CYS 31 1HB CYS 31 1.323 0.044 -0.097
202 H LYS 32 H LYS 32 0.807 2.581 1.619
203 HA LYS 32 HA LYS 32 2.276 4.356 -0.208
204 1HB LYS 32 2HB LYS 32 0.392 4.905 1.813
205 2HB LYS 32 1HB LYS 32 1.925 5.498 2.394
206 1HG LYS 32 2HG LYS 32 0.727 7.230 1.173
207 2HG LYS 32 1HG LYS 32 2.191 6.773 0.294
208 1HD LYS 32 2HD LYS 32 0.847 5.263 -1.119
209 2HD LYS 32 1HD LYS 32 -0.611 5.794 -0.277
210 1HE LYS 32 2HE LYS 32 1.159 7.280 -2.163
211 2HE LYS 32 1HE LYS 32 -0.580 7.038 -2.233
212 1HZ LYS 32 1HZ LYS 32 0.919 8.862 -0.441
213 2HZ LYS 32 2HZ LYS 32 -0.693 8.437 -0.151
214 3HZ LYS 32 3HZ LYS 32 -0.278 9.260 -1.570
215 H ARG 33 H ARG 33 4.397 4.748 0.170
216 HA ARG 33 HA ARG 33 5.875 2.764 1.577
217 1HB ARG 33 2HB ARG 33 6.514 5.091 -0.174
218 2HB ARG 33 1HB ARG 33 7.809 4.394 0.781
219 1HG ARG 33 2HG ARG 33 7.932 2.543 -0.486
220 2HG ARG 33 1HG ARG 33 6.186 2.468 -0.732
221 1HD ARG 33 2HD ARG 33 7.577 2.924 -2.790
222 2HD ARG 33 1HD ARG 33 6.258 4.047 -2.484
223 HE ARG 33 HE ARG 33 7.795 5.716 -2.413
224 1HH1 ARG 33 1HH1 ARG 33 9.492 2.750 -1.601
225 2HH1 ARG 33 2HH1 ARG 33 11.041 3.517 -1.535
226 1HH2 ARG 33 1HH2 ARG 33 9.817 6.716 -2.369
227 2HH2 ARG 33 2HH2 ARG 33 11.229 5.774 -1.970
228 H ASN 34 H ASN 34 8.161 4.414 2.155
229 HA ASN 34 HA ASN 34 7.485 6.087 4.436
230 1HB ASN 34 2HB ASN 34 8.838 3.458 4.591
231 2HB ASN 34 1HB ASN 34 9.294 4.689 5.731
232 1HD2 ASN 34 1HD2 ASN 34 7.626 2.029 5.507
233 2HD2 ASN 34 2HD2 ASN 34 6.279 2.353 6.527
234 H GLY 35 H GLY 35 9.243 7.480 4.993
235 1HA GLY 35 2HA GLY 35 11.317 8.544 4.675
236 2HA GLY 35 1HA GLY 35 11.756 7.282 3.520
237 H ASP 36 H ASP 36 9.585 7.290 1.991
238 HA ASP 36 HA ASP 36 9.045 9.897 0.859
239 1HB ASP 36 2HB ASP 36 10.976 9.256 -0.457
240 2HB ASP 36 1HB ASP 36 10.370 7.616 -0.649
241 HA PRO 37 HA PRO 37 5.789 6.465 1.473
242 1HB PRO 37 2HB PRO 37 4.610 8.806 2.956
243 2HB PRO 37 1HB PRO 37 4.511 7.073 3.341
244 1HG PRO 37 2HG PRO 37 6.277 8.350 4.703
245 2HG PRO 37 1HG PRO 37 6.874 6.979 3.771
246 1HD PRO 37 2HD PRO 37 6.855 9.863 2.876
247 2HD PRO 37 1HD PRO 37 8.274 8.803 3.106
Start of MODEL 11
1 H THR 1 H THR 1 5.916 6.534 -0.349
2 HA THR 1 HA THR 1 3.730 8.200 -1.165
3 HB THR 1 HB THR 1 5.821 9.313 -2.093
4 HG1 THR 1 1HG THR 1 4.839 9.628 -4.079
5 1HG2 THR 1 1HG2 THR 1 7.336 7.674 -2.663
6 2HG2 THR 1 2HG2 THR 1 6.620 8.029 -4.235
7 3HG2 THR 1 3HG2 THR 1 6.097 6.610 -3.328
8 H PHE 2 H PHE 2 3.186 7.140 -3.482
9 HA PHE 2 HA PHE 2 2.242 4.622 -2.943
10 1HB PHE 2 2HB PHE 2 1.258 5.846 -4.685
11 2HB PHE 2 1HB PHE 2 2.793 6.109 -5.488
12 HD1 PHE 2 1HD PHE 2 2.732 5.171 -7.580
13 HD2 PHE 2 2HD PHE 2 1.032 3.019 -4.326
14 HE1 PHE 2 1HE PHE 2 2.248 3.285 -9.084
15 HE2 PHE 2 2HE PHE 2 0.550 1.130 -5.823
16 HZ PHE 2 HZ PHE 2 1.157 1.261 -8.206
17 H CYS 3 H CYS 3 3.478 2.988 -2.314
18 HA CYS 3 HA CYS 3 6.121 2.437 -3.031
19 1HB CYS 3 2HB CYS 3 4.218 0.217 -2.346
20 2HB CYS 3 1HB CYS 3 5.896 0.419 -1.886
21 H GLY 4 H GLY 4 3.237 0.647 -4.015
22 1HA GLY 4 2HA GLY 4 3.489 0.520 -6.721
23 2HA GLY 4 1HA GLY 4 4.581 -0.737 -6.137
24 H GLU 5 H GLU 5 3.181 -1.413 -3.843
25 HA GLU 5 HA GLU 5 1.352 -3.345 -4.767
26 1HB GLU 5 2HB GLU 5 2.315 -2.348 -2.142
27 2HB GLU 5 1HB GLU 5 0.816 -3.259 -2.152
28 1HG GLU 5 2HG GLU 5 3.040 -4.461 -3.644
29 2HG GLU 5 1HG GLU 5 3.242 -4.359 -1.892
30 H THR 6 H THR 6 -0.864 -3.570 -3.828
31 HA THR 6 HA THR 6 -2.234 -1.032 -3.379
32 HB THR 6 HB THR 6 -4.120 -1.936 -4.907
33 HG1 THR 6 1HG THR 6 -1.862 -3.421 -5.768
34 1HG2 THR 6 1HG2 THR 6 -1.622 -0.892 -6.239
35 2HG2 THR 6 2HG2 THR 6 -2.733 0.107 -5.301
36 3HG2 THR 6 3HG2 THR 6 -3.288 -0.684 -6.777
37 H CYS 7 H CYS 7 -3.261 -1.279 -1.544
38 HA CYS 7 HA CYS 7 -4.010 -3.884 -0.557
39 1HB CYS 7 2HB CYS 7 -4.871 -2.524 1.420
40 2HB CYS 7 1HB CYS 7 -3.131 -2.435 1.141
41 H ARG 8 H ARG 8 -5.466 -4.248 -2.392
42 HA ARG 8 HA ARG 8 -7.857 -2.714 -2.646
43 1HB ARG 8 2HB ARG 8 -6.637 -5.020 -4.002
44 2HB ARG 8 1HB ARG 8 -8.393 -4.990 -4.033
45 1HG ARG 8 2HG ARG 8 -8.403 -2.810 -5.003
46 2HG ARG 8 1HG ARG 8 -6.645 -2.715 -4.896
47 1HD ARG 8 2HD ARG 8 -7.683 -3.324 -7.156
48 2HD ARG 8 1HD ARG 8 -6.334 -4.293 -6.573
49 HE ARG 8 HE ARG 8 -7.702 -6.087 -6.711
50 1HH1 ARG 8 1HH1 ARG 8 -9.798 -3.317 -6.059
51 2HH1 ARG 8 2HH1 ARG 8 -11.246 -4.265 -6.182
52 1HH2 ARG 8 1HH2 ARG 8 -9.630 -7.290 -6.862
53 2HH2 ARG 8 2HH2 ARG 8 -11.156 -6.503 -6.633
54 H VAL 9 H VAL 9 -8.819 -5.948 -2.859
55 HA VAL 9 HA VAL 9 -10.544 -5.588 -0.569
56 HB VAL 9 HB VAL 9 -11.649 -7.675 -1.344
57 1HG1 VAL 9 1HG1 VAL 9 -11.287 -5.655 -3.554
58 2HG1 VAL 9 2HG1 VAL 9 -12.334 -5.433 -2.152
59 3HG1 VAL 9 3HG1 VAL 9 -12.669 -6.723 -3.306
60 1HG2 VAL 9 1HG2 VAL 9 -10.992 -8.832 -3.280
61 2HG2 VAL 9 2HG2 VAL 9 -9.492 -8.568 -2.389
62 3HG2 VAL 9 3HG2 VAL 9 -9.886 -7.550 -3.775
63 H ILE 10 H ILE 10 -7.652 -6.177 -0.519
64 HA ILE 10 HA ILE 10 -7.597 -7.938 1.730
65 HB ILE 10 HB ILE 10 -5.597 -9.223 0.630
66 1HG1 ILE 10 2HG1 ILE 10 -7.239 -8.566 -1.827
67 2HG1 ILE 10 1HG1 ILE 10 -5.631 -7.940 -1.482
68 1HG2 ILE 10 1HG2 ILE 10 -7.077 -10.789 1.179
69 2HG2 ILE 10 2HG2 ILE 10 -7.593 -10.726 -0.506
70 3HG2 ILE 10 3HG2 ILE 10 -8.448 -9.781 0.713
71 1HD1 ILE 10 1HD1 ILE 10 -6.456 -10.529 -2.555
72 2HD1 ILE 10 2HD1 ILE 10 -5.218 -10.619 -1.302
73 3HD1 ILE 10 3HD1 ILE 10 -4.943 -9.645 -2.746
74 HA PRO 11 HA PRO 11 -4.882 -4.153 1.328
75 1HB PRO 11 2HB PRO 11 -5.733 -3.944 4.166
76 2HB PRO 11 1HB PRO 11 -5.597 -2.689 2.927
77 1HG PRO 11 2HG PRO 11 -7.958 -3.580 3.615
78 2HG PRO 11 1HG PRO 11 -7.593 -3.308 1.904
79 1HD PRO 11 2HD PRO 11 -7.656 -5.898 3.428
80 2HD PRO 11 1HD PRO 11 -8.296 -5.533 1.810
81 H VAL 12 H VAL 12 -3.479 -3.298 3.328
82 HA VAL 12 HA VAL 12 -1.597 -3.520 4.488
83 HB VAL 12 HB VAL 12 -2.257 -6.437 4.936
84 1HG1 VAL 12 1HG1 VAL 12 -0.454 -6.497 6.233
85 2HG1 VAL 12 2HG1 VAL 12 -0.999 -5.084 7.137
86 3HG1 VAL 12 3HG1 VAL 12 -0.048 -4.877 5.666
87 1HG2 VAL 12 1HG2 VAL 12 -4.168 -5.513 5.813
88 2HG2 VAL 12 2HG2 VAL 12 -3.382 -3.984 6.204
89 3HG2 VAL 12 3HG2 VAL 12 -3.099 -5.404 7.212
90 H CYS 13 H CYS 13 -0.899 -3.211 2.307
91 HA CYS 13 HA CYS 13 -0.015 -4.875 0.386
92 1HB CYS 13 2HB CYS 13 1.899 -2.776 1.302
93 2HB CYS 13 1HB CYS 13 1.263 -3.085 -0.314
94 H THR 14 H THR 14 0.811 -6.860 0.897
95 HA THR 14 HA THR 14 2.762 -7.249 2.947
96 HB THR 14 HB THR 14 1.848 -9.237 0.874
97 HG1 THR 14 1HG THR 14 0.397 -7.969 2.703
98 1HG2 THR 14 1HG2 THR 14 3.863 -9.655 2.484
99 2HG2 THR 14 2HG2 THR 14 2.632 -10.902 2.286
100 3HG2 THR 14 3HG2 THR 14 2.606 -9.855 3.705
101 H TYR 15 H TYR 15 2.976 -6.993 -0.583
102 HA TYR 15 HA TYR 15 5.599 -8.117 -0.741
103 1HB TYR 15 2HB TYR 15 4.089 -7.974 -2.698
104 2HB TYR 15 1HB TYR 15 4.221 -6.220 -2.658
105 HD1 TYR 15 1HD TYR 15 5.430 -5.487 -4.478
106 HD2 TYR 15 2HD TYR 15 6.749 -8.970 -2.420
107 HE1 TYR 15 1HE TYR 15 7.400 -5.602 -5.946
108 HE2 TYR 15 2HE TYR 15 8.723 -9.093 -3.880
109 HH TYR 15 HH TYR 15 10.079 -7.289 -5.298
110 H SER 16 H SER 16 4.320 -4.858 -0.564
111 HA SER 16 HA SER 16 7.011 -3.735 -0.332
112 1HB SER 16 2HB SER 16 4.294 -2.384 -0.397
113 2HB SER 16 1HB SER 16 5.852 -1.554 -0.394
114 HG SER 16 HG SER 16 5.689 -3.461 -2.332
115 H ALA 17 H ALA 17 5.249 -5.393 1.696
116 HA ALA 17 HA ALA 17 4.913 -3.724 3.955
117 1HB ALA 17 1HB ALA 17 4.980 -6.680 3.540
118 2HB ALA 17 2HB ALA 17 3.673 -5.651 4.128
119 3HB ALA 17 3HB ALA 17 5.036 -6.032 5.181
120 H ALA 18 H ALA 18 7.700 -5.328 2.642
121 HA ALA 18 HA ALA 18 9.321 -5.644 4.879
122 1HB ALA 18 1HB ALA 18 9.708 -6.160 2.319
123 2HB ALA 18 2HB ALA 18 11.067 -5.933 3.421
124 3HB ALA 18 3HB ALA 18 10.552 -4.613 2.371
125 H LEU 19 H LEU 19 8.699 -2.811 2.920
126 HA LEU 19 HA LEU 19 10.451 -1.086 4.408
127 1HB LEU 19 2HB LEU 19 8.712 -0.873 2.059
128 2HB LEU 19 1HB LEU 19 8.831 0.582 3.013
129 HG LEU 19 HG LEU 19 11.177 0.712 2.692
130 1HD1 LEU 19 1HD1 LEU 19 11.688 -1.423 0.854
131 2HD1 LEU 19 2HD1 LEU 19 11.013 -2.094 2.338
132 3HD1 LEU 19 3HD1 LEU 19 12.460 -1.090 2.404
133 1HD2 LEU 19 1HD2 LEU 19 10.585 -0.062 -0.064
134 2HD2 LEU 19 2HD2 LEU 19 11.039 1.503 0.607
135 3HD2 LEU 19 3HD2 LEU 19 9.359 0.971 0.670
136 H GLY 20 H GLY 20 7.379 -2.278 4.916
137 1HA GLY 20 2HA GLY 20 5.963 -1.828 6.718
138 2HA GLY 20 1HA GLY 20 6.931 -0.399 7.081
139 H CYS 21 H CYS 21 5.748 -1.171 3.929
140 HA CYS 21 HA CYS 21 4.630 1.345 3.450
141 1HB CYS 21 2HB CYS 21 4.645 -1.282 2.086
142 2HB CYS 21 1HB CYS 21 3.404 -0.149 1.589
143 H THR 22 H THR 22 2.991 2.111 4.591
144 HA THR 22 HA THR 22 0.662 0.366 4.968
145 HB THR 22 HB THR 22 -0.043 1.989 6.726
146 HG1 THR 22 1HG THR 22 1.591 3.610 5.893
147 1HG2 THR 22 1HG2 THR 22 1.146 -0.203 7.167
148 2HG2 THR 22 2HG2 THR 22 1.259 1.000 8.452
149 3HG2 THR 22 3HG2 THR 22 2.625 0.738 7.366
150 H CYS 23 H CYS 23 -1.068 0.872 3.897
151 HA CYS 23 HA CYS 23 -1.077 3.338 2.351
152 1HB CYS 23 2HB CYS 23 -3.011 2.300 1.180
153 2HB CYS 23 1HB CYS 23 -1.540 1.343 1.101
154 H ASP 24 H ASP 24 -4.070 3.024 2.201
155 HA ASP 24 HA ASP 24 -4.788 4.216 4.787
156 1HB ASP 24 2HB ASP 24 -6.213 5.824 3.581
157 2HB ASP 24 1HB ASP 24 -4.527 5.984 3.101
158 H ASP 25 H ASP 25 -6.040 2.812 1.798
159 HA ASP 25 HA ASP 25 -7.727 1.423 1.283
160 1HB ASP 25 2HB ASP 25 -6.904 -0.227 2.842
161 2HB ASP 25 1HB ASP 25 -7.610 0.646 4.204
162 H ARG 26 H ARG 26 -9.572 1.839 0.703
163 HA ARG 26 HA ARG 26 -11.631 2.848 2.445
164 1HB ARG 26 2HB ARG 26 -10.080 4.625 0.617
165 2HB ARG 26 1HB ARG 26 -11.805 4.849 0.692
166 1HG ARG 26 2HG ARG 26 -9.808 5.148 2.904
167 2HG ARG 26 1HG ARG 26 -10.854 6.388 2.208
168 1HD ARG 26 2HD ARG 26 -11.726 4.007 3.839
169 2HD ARG 26 1HD ARG 26 -11.700 5.686 4.371
170 HE ARG 26 HE ARG 26 -13.285 5.591 2.098
171 1HH1 ARG 26 1HH1 ARG 26 -13.301 4.224 5.311
172 2HH1 ARG 26 2HH1 ARG 26 -15.030 4.153 5.422
173 1HH2 ARG 26 1HH2 ARG 26 -15.576 5.503 2.221
174 2HH2 ARG 26 2HH2 ARG 26 -16.330 4.885 3.653
175 H SER 27 H SER 27 -11.600 0.566 1.131
176 HA SER 27 HA SER 27 -12.778 -0.713 -0.343
177 1HB SER 27 2HB SER 27 -14.726 0.840 -0.007
178 2HB SER 27 1HB SER 27 -14.077 1.876 -1.276
179 HG SER 27 HG SER 27 -14.257 0.021 -2.683
180 H ASP 28 H ASP 28 -10.367 -0.111 -0.595
181 HA ASP 28 HA ASP 28 -8.761 -0.595 -2.137
182 1HB ASP 28 2HB ASP 28 -10.736 0.514 -4.107
183 2HB ASP 28 1HB ASP 28 -9.046 0.381 -4.531
184 H GLY 29 H GLY 29 -7.421 0.654 -0.985
185 1HA GLY 29 2HA GLY 29 -7.425 3.544 -1.498
186 2HA GLY 29 1HA GLY 29 -6.556 2.742 -0.201
187 H LEU 30 H LEU 30 -4.541 3.418 -0.539
188 HA LEU 30 HA LEU 30 -3.162 2.333 -2.851
189 1HB LEU 30 2HB LEU 30 -4.239 4.545 -3.451
190 2HB LEU 30 1HB LEU 30 -3.152 5.292 -2.312
191 HG LEU 30 HG LEU 30 -2.481 5.481 -4.720
192 1HD1 LEU 30 1HD1 LEU 30 -0.695 4.226 -2.686
193 2HD1 LEU 30 2HD1 LEU 30 -0.732 5.889 -3.276
194 3HD1 LEU 30 3HD1 LEU 30 -0.101 4.602 -4.304
195 1HD2 LEU 30 1HD2 LEU 30 -1.257 3.249 -5.443
196 2HD2 LEU 30 2HD2 LEU 30 -2.953 3.549 -5.819
197 3HD2 LEU 30 3HD2 LEU 30 -2.520 2.528 -4.448
198 H CYS 31 H CYS 31 -1.350 1.478 -2.067
199 HA CYS 31 HA CYS 31 -0.417 1.781 0.550
200 1HB CYS 31 2HB CYS 31 1.105 0.731 -1.824
201 2HB CYS 31 1HB CYS 31 1.468 0.410 -0.135
202 H LYS 32 H LYS 32 1.302 2.792 1.513
203 HA LYS 32 HA LYS 32 2.773 4.741 -0.128
204 1HB LYS 32 2HB LYS 32 1.441 5.144 2.547
205 2HB LYS 32 1HB LYS 32 2.689 6.217 1.961
206 1HG LYS 32 2HG LYS 32 -0.032 5.736 0.818
207 2HG LYS 32 1HG LYS 32 0.672 7.255 1.380
208 1HD LYS 32 2HD LYS 32 2.137 7.357 -0.509
209 2HD LYS 32 1HD LYS 32 1.747 5.701 -0.962
210 1HE LYS 32 2HE LYS 32 0.634 7.278 -2.414
211 2HE LYS 32 1HE LYS 32 -0.529 6.360 -1.465
212 1HZ LYS 32 1HZ LYS 32 -1.204 8.175 -0.340
213 2HZ LYS 32 2HZ LYS 32 -0.632 8.995 -1.705
214 3HZ LYS 32 3HZ LYS 32 0.332 8.889 -0.318
215 H ARG 33 H ARG 33 4.915 4.919 0.261
216 HA ARG 33 HA ARG 33 6.230 2.788 1.638
217 1HB ARG 33 2HB ARG 33 7.074 5.065 -0.088
218 2HB ARG 33 1HB ARG 33 8.295 4.280 0.893
219 1HG ARG 33 2HG ARG 33 7.323 2.102 -0.183
220 2HG ARG 33 1HG ARG 33 6.743 3.227 -1.414
221 1HD ARG 33 2HD ARG 33 9.608 3.003 -0.492
222 2HD ARG 33 1HD ARG 33 8.958 2.236 -1.938
223 HE ARG 33 HE ARG 33 9.736 4.984 -1.618
224 1HH1 ARG 33 1HH1 ARG 33 7.635 2.811 -3.414
225 2HH1 ARG 33 2HH1 ARG 33 7.459 3.881 -4.761
226 1HH2 ARG 33 1HH2 ARG 33 9.551 6.370 -3.392
227 2HH2 ARG 33 2HH2 ARG 33 8.566 5.909 -4.756
228 H ASN 34 H ASN 34 8.627 4.188 2.218
229 HA ASN 34 HA ASN 34 8.171 5.981 4.444
230 1HB ASN 34 2HB ASN 34 9.251 3.223 4.747
231 2HB ASN 34 1HB ASN 34 9.742 4.475 5.854
232 1HD2 ASN 34 1HD2 ASN 34 7.809 1.959 5.555
233 2HD2 ASN 34 2HD2 ASN 34 6.474 2.435 6.530
234 H GLY 35 H GLY 35 10.133 7.102 4.986
235 1HA GLY 35 2HA GLY 35 12.363 7.801 4.612
236 2HA GLY 35 1HA GLY 35 12.509 6.568 3.352
237 H ASP 36 H ASP 36 10.329 6.962 1.945
238 HA ASP 36 HA ASP 36 10.049 9.713 1.088
239 1HB ASP 36 2HB ASP 36 10.556 9.294 -1.220
240 2HB ASP 36 1HB ASP 36 11.912 8.658 -0.303
241 HA PRO 37 HA PRO 37 6.433 6.587 1.721
242 1HB PRO 37 2HB PRO 37 5.659 9.108 3.187
243 2HB PRO 37 1HB PRO 37 5.184 7.430 3.534
244 1HG PRO 37 2HG PRO 37 7.167 8.268 4.939
245 2HG PRO 37 1HG PRO 37 7.464 6.817 3.981
246 1HD PRO 37 2HD PRO 37 8.150 9.657 3.237
247 2HD PRO 37 1HD PRO 37 9.235 8.248 3.333
Start of MODEL 12
1 H THR 1 H THR 1 5.067 6.295 -1.906
2 HA THR 1 HA THR 1 2.475 7.410 -2.516
3 HB THR 1 HB THR 1 4.693 8.018 -4.426
4 HG1 THR 1 1HG THR 1 5.416 9.270 -2.819
5 1HG2 THR 1 1HG2 THR 1 1.974 9.226 -3.935
6 2HG2 THR 1 2HG2 THR 1 2.441 8.199 -5.290
7 3HG2 THR 1 3HG2 THR 1 3.131 9.813 -5.128
8 H PHE 2 H PHE 2 2.601 4.982 -2.234
9 HA PHE 2 HA PHE 2 1.922 3.110 -3.191
10 1HB PHE 2 2HB PHE 2 1.056 4.172 -5.118
11 2HB PHE 2 1HB PHE 2 2.654 4.509 -5.746
12 HD1 PHE 2 1HD PHE 2 3.149 3.339 -7.640
13 HD2 PHE 2 2HD PHE 2 0.805 1.459 -4.627
14 HE1 PHE 2 1HE PHE 2 3.009 1.310 -9.022
15 HE2 PHE 2 2HE PHE 2 0.667 -0.575 -6.002
16 HZ PHE 2 HZ PHE 2 1.769 -0.651 -8.202
17 H CYS 3 H CYS 3 3.307 1.821 -2.196
18 HA CYS 3 HA CYS 3 6.073 1.591 -2.608
19 1HB CYS 3 2HB CYS 3 4.582 -0.847 -1.788
20 2HB CYS 3 1HB CYS 3 6.027 -0.132 -1.103
21 H GLY 4 H GLY 4 3.561 -0.752 -3.541
22 1HA GLY 4 2HA GLY 4 4.468 -1.144 -6.186
23 2HA GLY 4 1HA GLY 4 5.158 -2.381 -5.140
24 H GLU 5 H GLU 5 3.123 -2.795 -3.359
25 HA GLU 5 HA GLU 5 1.219 -4.267 -4.983
26 1HB GLU 5 2HB GLU 5 1.497 -4.038 -1.976
27 2HB GLU 5 1HB GLU 5 0.406 -5.130 -2.813
28 1HG GLU 5 2HG GLU 5 2.127 -6.500 -3.538
29 2HG GLU 5 1HG GLU 5 3.351 -5.248 -3.307
30 H THR 6 H THR 6 -1.158 -4.126 -4.253
31 HA THR 6 HA THR 6 -1.814 -1.344 -3.563
32 HB THR 6 HB THR 6 -3.799 -1.515 -5.052
33 HG1 THR 6 1HG THR 6 -3.357 -3.992 -5.156
34 1HG2 THR 6 1HG2 THR 6 -1.051 -1.145 -5.812
35 2HG2 THR 6 2HG2 THR 6 -2.490 -0.303 -6.387
36 3HG2 THR 6 3HG2 THR 6 -1.972 -1.798 -7.166
37 H CYS 7 H CYS 7 -2.745 -1.395 -1.640
38 HA CYS 7 HA CYS 7 -4.260 -3.701 -0.778
39 1HB CYS 7 2HB CYS 7 -4.583 -2.197 1.326
40 2HB CYS 7 1HB CYS 7 -2.994 -2.898 1.036
41 H ARG 8 H ARG 8 -5.575 -2.937 -2.859
42 HA ARG 8 HA ARG 8 -7.630 -0.991 -2.177
43 1HB ARG 8 2HB ARG 8 -6.435 -1.749 -4.573
44 2HB ARG 8 1HB ARG 8 -8.052 -2.413 -4.675
45 1HG ARG 8 2HG ARG 8 -9.038 -0.266 -4.294
46 2HG ARG 8 1HG ARG 8 -7.454 0.453 -4.014
47 1HD ARG 8 2HD ARG 8 -8.378 0.919 -6.266
48 2HD ARG 8 1HD ARG 8 -6.820 0.101 -6.295
49 HE ARG 8 HE ARG 8 -7.814 -1.552 -7.481
50 1HH1 ARG 8 1HH1 ARG 8 -10.342 -0.047 -5.536
51 2HH1 ARG 8 2HH1 ARG 8 -11.603 -1.000 -6.253
52 1HH2 ARG 8 1HH2 ARG 8 -9.497 -2.791 -8.403
53 2HH2 ARG 8 2HH2 ARG 8 -11.129 -2.553 -7.870
54 H VAL 9 H VAL 9 -8.219 -3.950 -4.000
55 HA VAL 9 HA VAL 9 -10.531 -4.467 -2.311
56 HB VAL 9 HB VAL 9 -11.028 -6.300 -3.986
57 1HG1 VAL 9 1HG1 VAL 9 -11.572 -4.578 -5.825
58 2HG1 VAL 9 2HG1 VAL 9 -10.890 -3.396 -4.709
59 3HG1 VAL 9 3HG1 VAL 9 -12.287 -4.358 -4.229
60 1HG2 VAL 9 1HG2 VAL 9 -8.775 -6.613 -4.866
61 2HG2 VAL 9 2HG2 VAL 9 -8.785 -4.968 -5.503
62 3HG2 VAL 9 3HG2 VAL 9 -9.896 -6.172 -6.155
63 H ILE 10 H ILE 10 -7.369 -5.630 -2.869
64 HA ILE 10 HA ILE 10 -7.769 -7.685 -0.824
65 HB ILE 10 HB ILE 10 -6.048 -9.115 -1.855
66 1HG1 ILE 10 2HG1 ILE 10 -4.948 -7.268 -3.214
67 2HG1 ILE 10 1HG1 ILE 10 -5.156 -8.808 -4.033
68 1HG2 ILE 10 1HG2 ILE 10 -7.499 -9.655 -3.998
69 2HG2 ILE 10 2HG2 ILE 10 -8.615 -8.539 -3.209
70 3HG2 ILE 10 3HG2 ILE 10 -8.070 -9.989 -2.363
71 1HD1 ILE 10 1HD1 ILE 10 -5.894 -7.511 -5.698
72 2HD1 ILE 10 2HD1 ILE 10 -6.303 -6.176 -4.621
73 3HD1 ILE 10 3HD1 ILE 10 -7.408 -7.539 -4.795
74 HA PRO 11 HA PRO 11 -4.730 -4.363 0.253
75 1HB PRO 11 2HB PRO 11 -6.026 -4.682 2.888
76 2HB PRO 11 1HB PRO 11 -5.660 -3.214 1.975
77 1HG PRO 11 2HG PRO 11 -8.136 -4.054 2.154
78 2HG PRO 11 1HG PRO 11 -7.524 -3.449 0.606
79 1HD PRO 11 2HD PRO 11 -7.845 -6.306 1.502
80 2HD PRO 11 1HD PRO 11 -8.333 -5.556 -0.035
81 H VAL 12 H VAL 12 -3.929 -4.270 2.843
82 HA VAL 12 HA VAL 12 -2.342 -4.977 4.221
83 HB VAL 12 HB VAL 12 -3.064 -7.835 3.597
84 1HG1 VAL 12 1HG1 VAL 12 -1.501 -8.212 5.132
85 2HG1 VAL 12 2HG1 VAL 12 -2.611 -7.527 6.319
86 3HG1 VAL 12 3HG1 VAL 12 -1.401 -6.502 5.549
87 1HG2 VAL 12 1HG2 VAL 12 -5.007 -6.122 4.250
88 2HG2 VAL 12 2HG2 VAL 12 -4.401 -6.469 5.870
89 3HG2 VAL 12 3HG2 VAL 12 -4.974 -7.784 4.843
90 H CYS 13 H CYS 13 -1.033 -4.137 2.455
91 HA CYS 13 HA CYS 13 0.236 -5.596 0.485
92 1HB CYS 13 2HB CYS 13 1.840 -3.613 2.034
93 2HB CYS 13 1HB CYS 13 1.630 -3.766 0.292
94 H THR 14 H THR 14 1.248 -7.514 0.792
95 HA THR 14 HA THR 14 2.411 -8.229 3.300
96 HB THR 14 HB THR 14 3.135 -10.305 1.957
97 HG1 THR 14 1HG THR 14 2.381 -8.806 -0.069
98 1HG2 THR 14 1HG2 THR 14 0.713 -9.522 3.159
99 2HG2 THR 14 2HG2 THR 14 1.304 -11.161 2.889
100 3HG2 THR 14 3HG2 THR 14 0.281 -10.381 1.682
101 H TYR 15 H TYR 15 3.781 -7.417 0.124
102 HA TYR 15 HA TYR 15 6.478 -7.914 1.075
103 1HB TYR 15 2HB TYR 15 5.910 -8.477 -1.236
104 2HB TYR 15 1HB TYR 15 5.465 -6.806 -1.552
105 HD1 TYR 15 1HD TYR 15 6.976 -5.814 -2.972
106 HD2 TYR 15 2HD TYR 15 8.438 -8.422 0.056
107 HE1 TYR 15 1HE TYR 15 9.282 -5.323 -3.669
108 HE2 TYR 15 2HE TYR 15 10.748 -7.937 -0.633
109 HH TYR 15 HH TYR 15 11.484 -5.448 -2.968
110 H SER 16 H SER 16 4.492 -5.192 0.095
111 HA SER 16 HA SER 16 6.413 -3.167 0.414
112 1HB SER 16 2HB SER 16 3.424 -2.894 0.777
113 2HB SER 16 1HB SER 16 4.560 -1.640 0.288
114 HG SER 16 HG SER 16 3.768 -3.951 -1.162
115 H ALA 17 H ALA 17 4.484 -4.918 2.693
116 HA ALA 17 HA ALA 17 4.441 -3.092 4.822
117 1HB ALA 17 1HB ALA 17 3.082 -5.096 4.839
118 2HB ALA 17 2HB ALA 17 4.102 -5.047 6.277
119 3HB ALA 17 3HB ALA 17 4.524 -6.108 4.932
120 H ALA 18 H ALA 18 7.042 -5.079 3.614
121 HA ALA 18 HA ALA 18 8.677 -5.323 5.847
122 1HB ALA 18 1HB ALA 18 9.224 -6.484 3.832
123 2HB ALA 18 2HB ALA 18 10.567 -5.408 4.216
124 3HB ALA 18 3HB ALA 18 9.420 -4.969 2.949
125 H LEU 19 H LEU 19 8.379 -2.628 3.590
126 HA LEU 19 HA LEU 19 10.416 -1.043 4.855
127 1HB LEU 19 2HB LEU 19 8.503 -0.699 2.626
128 2HB LEU 19 1HB LEU 19 9.027 0.759 3.436
129 HG LEU 19 HG LEU 19 11.318 0.347 2.860
130 1HD1 LEU 19 1HD1 LEU 19 11.074 -1.905 1.104
131 2HD1 LEU 19 2HD1 LEU 19 10.519 -2.353 2.716
132 3HD1 LEU 19 3HD1 LEU 19 12.138 -1.689 2.496
133 1HD2 LEU 19 1HD2 LEU 19 9.747 -0.281 0.380
134 2HD2 LEU 19 2HD2 LEU 19 11.220 0.675 0.539
135 3HD2 LEU 19 3HD2 LEU 19 9.693 1.299 1.161
136 H GLY 20 H GLY 20 7.212 -1.736 5.546
137 1HA GLY 20 2HA GLY 20 5.947 -0.994 7.367
138 2HA GLY 20 1HA GLY 20 7.128 0.290 7.626
139 H CYS 21 H CYS 21 5.468 -0.605 4.693
140 HA CYS 21 HA CYS 21 4.979 1.871 3.712
141 1HB CYS 21 2HB CYS 21 3.755 -0.799 3.272
142 2HB CYS 21 1HB CYS 21 2.954 0.588 2.555
143 H THR 22 H THR 22 3.367 3.315 3.630
144 HA THR 22 HA THR 22 1.842 3.679 6.062
145 HB THR 22 HB THR 22 1.716 5.417 3.679
146 HG1 THR 22 1HG THR 22 3.999 4.892 5.254
147 1HG2 THR 22 1HG2 THR 22 0.589 5.845 5.985
148 2HG2 THR 22 2HG2 THR 22 1.425 7.180 5.193
149 3HG2 THR 22 3HG2 THR 22 2.210 6.304 6.506
150 H CYS 23 H CYS 23 1.138 1.914 3.558
151 HA CYS 23 HA CYS 23 -1.037 2.611 2.164
152 1HB CYS 23 2HB CYS 23 -0.455 0.423 1.715
153 2HB CYS 23 1HB CYS 23 -0.255 0.009 3.414
154 H ASP 24 H ASP 24 -3.168 3.031 2.513
155 HA ASP 24 HA ASP 24 -4.063 3.364 5.252
156 1HB ASP 24 2HB ASP 24 -4.360 5.156 3.564
157 2HB ASP 24 1HB ASP 24 -5.410 4.096 2.639
158 H ASP 25 H ASP 25 -6.047 2.432 2.506
159 HA ASP 25 HA ASP 25 -7.531 0.795 2.096
160 1HB ASP 25 2HB ASP 25 -6.082 -1.023 2.444
161 2HB ASP 25 1HB ASP 25 -5.933 -0.693 4.171
162 H ARG 26 H ARG 26 -9.448 0.760 2.393
163 HA ARG 26 HA ARG 26 -10.740 0.699 4.974
164 1HB ARG 26 2HB ARG 26 -10.523 3.166 3.290
165 2HB ARG 26 1HB ARG 26 -12.025 2.850 4.117
166 1HG ARG 26 2HG ARG 26 -11.185 3.397 6.130
167 2HG ARG 26 1HG ARG 26 -9.637 2.617 5.795
168 1HD ARG 26 2HD ARG 26 -9.323 5.003 6.038
169 2HD ARG 26 1HD ARG 26 -9.011 4.522 4.371
170 HE ARG 26 HE ARG 26 -11.704 5.365 4.740
171 1HH1 ARG 26 1HH1 ARG 26 -8.426 6.483 4.223
172 2HH1 ARG 26 2HH1 ARG 26 -8.925 8.042 3.635
173 1HH2 ARG 26 1HH2 ARG 26 -12.364 7.414 3.944
174 2HH2 ARG 26 2HH2 ARG 26 -11.166 8.569 3.469
175 H SER 27 H SER 27 -10.613 -1.098 3.075
176 HA SER 27 HA SER 27 -11.997 -2.547 1.962
177 1HB SER 27 2HB SER 27 -14.049 -1.542 2.967
178 2HB SER 27 1HB SER 27 -14.004 -0.271 1.746
179 HG SER 27 HG SER 27 -14.013 -2.178 0.222
180 H ASP 28 H ASP 28 -10.426 0.060 1.310
181 HA ASP 28 HA ASP 28 -9.602 -0.508 -1.224
182 1HB ASP 28 2HB ASP 28 -11.949 0.279 -1.835
183 2HB ASP 28 1HB ASP 28 -11.463 1.876 -1.278
184 H GLY 29 H GLY 29 -7.816 0.729 -1.763
185 1HA GLY 29 2HA GLY 29 -7.247 3.284 -0.762
186 2HA GLY 29 1HA GLY 29 -6.500 2.107 0.298
187 H LEU 30 H LEU 30 -4.431 2.356 -0.113
188 HA LEU 30 HA LEU 30 -3.340 1.310 -2.529
189 1HB LEU 30 2HB LEU 30 -4.169 3.733 -2.986
190 2HB LEU 30 1HB LEU 30 -2.811 4.213 -2.021
191 HG LEU 30 HG LEU 30 -2.440 4.332 -4.490
192 1HD1 LEU 30 1HD1 LEU 30 -0.289 2.870 -4.401
193 2HD1 LEU 30 2HD1 LEU 30 -0.715 2.707 -2.697
194 3HD1 LEU 30 3HD1 LEU 30 -0.439 4.305 -3.389
195 1HD2 LEU 30 1HD2 LEU 30 -2.562 2.543 -5.873
196 2HD2 LEU 30 2HD2 LEU 30 -3.742 2.019 -4.672
197 3HD2 LEU 30 3HD2 LEU 30 -2.093 1.397 -4.617
198 H CYS 31 H CYS 31 -1.303 0.544 -2.049
199 HA CYS 31 HA CYS 31 -0.291 0.855 0.605
200 1HB CYS 31 2HB CYS 31 1.061 -0.334 -1.821
201 2HB CYS 31 1HB CYS 31 1.580 -0.536 -0.155
202 H LYS 32 H LYS 32 0.676 2.714 1.238
203 HA LYS 32 HA LYS 32 2.151 4.247 -0.765
204 1HB LYS 32 2HB LYS 32 1.457 4.999 2.077
205 2HB LYS 32 1HB LYS 32 2.061 6.059 0.832
206 1HG LYS 32 2HG LYS 32 -0.654 4.874 1.123
207 2HG LYS 32 1HG LYS 32 -0.194 6.558 0.894
208 1HD LYS 32 2HD LYS 32 0.091 4.412 -1.222
209 2HD LYS 32 1HD LYS 32 -1.283 5.513 -1.103
210 1HE LYS 32 2HE LYS 32 1.558 6.047 -1.805
211 2HE LYS 32 1HE LYS 32 0.122 6.387 -2.737
212 1HZ LYS 32 1HZ LYS 32 -0.113 7.817 -0.357
213 2HZ LYS 32 2HZ LYS 32 0.144 8.439 -1.907
214 3HZ LYS 32 3HZ LYS 32 1.467 8.080 -0.912
215 H ARG 33 H ARG 33 4.388 4.502 -0.656
216 HA ARG 33 HA ARG 33 5.742 2.490 0.867
217 1HB ARG 33 2HB ARG 33 6.251 3.688 -1.506
218 2HB ARG 33 1HB ARG 33 7.389 4.542 -0.472
219 1HG ARG 33 2HG ARG 33 8.344 2.414 0.247
220 2HG ARG 33 1HG ARG 33 7.198 1.551 -0.776
221 1HD ARG 33 2HD ARG 33 9.171 1.603 -2.030
222 2HD ARG 33 1HD ARG 33 8.187 2.895 -2.713
223 HE ARG 33 HE ARG 33 10.596 3.201 -1.084
224 1HH1 ARG 33 1HH1 ARG 33 8.065 4.687 -2.998
225 2HH1 ARG 33 2HH1 ARG 33 8.807 6.267 -2.985
226 1HH2 ARG 33 1HH2 ARG 33 11.570 5.271 -1.089
227 2HH2 ARG 33 2HH2 ARG 33 10.788 6.597 -1.905
228 H ASN 34 H ASN 34 8.121 4.569 0.920
229 HA ASN 34 HA ASN 34 7.505 6.166 3.227
230 1HB ASN 34 2HB ASN 34 8.949 3.630 3.482
231 2HB ASN 34 1HB ASN 34 9.670 4.979 4.332
232 1HD2 ASN 34 1HD2 ASN 34 8.021 2.434 4.972
233 2HD2 ASN 34 2HD2 ASN 34 6.859 3.000 6.118
234 H GLY 35 H GLY 35 9.131 7.699 3.701
235 1HA GLY 35 2HA GLY 35 11.072 8.964 3.219
236 2HA GLY 35 1HA GLY 35 11.411 7.881 1.862
237 H ASP 36 H ASP 36 9.034 7.779 0.701
238 HA ASP 36 HA ASP 36 7.896 10.336 0.108
239 1HB ASP 36 2HB ASP 36 8.330 10.157 -2.354
240 2HB ASP 36 1HB ASP 36 9.791 10.453 -1.422
241 HA PRO 37 HA PRO 37 5.506 6.169 0.273
242 1HB PRO 37 2HB PRO 37 3.917 8.139 1.910
243 2HB PRO 37 1HB PRO 37 4.071 6.381 2.112
244 1HG PRO 37 2HG PRO 37 5.576 7.806 3.662
245 2HG PRO 37 1HG PRO 37 6.376 6.569 2.691
246 1HD PRO 37 2HD PRO 37 6.162 9.512 2.099
247 2HD PRO 37 1HD PRO 37 7.618 8.489 2.144
Start of MODEL 13
1 H THR 1 H THR 1 5.380 6.250 -0.831
2 HA THR 1 HA THR 1 2.990 7.481 -1.886
3 HB THR 1 HB THR 1 5.616 7.301 -3.421
4 HG1 THR 1 1HG THR 1 6.044 9.210 -2.607
5 1HG2 THR 1 1HG2 THR 1 3.181 8.851 -4.251
6 2HG2 THR 1 2HG2 THR 1 3.336 7.137 -4.636
7 3HG2 THR 1 3HG2 THR 1 4.529 8.288 -5.239
8 H PHE 2 H PHE 2 2.282 6.136 -3.710
9 HA PHE 2 HA PHE 2 1.763 3.626 -3.174
10 1HB PHE 2 2HB PHE 2 0.795 4.766 -5.064
11 2HB PHE 2 1HB PHE 2 2.338 4.805 -5.897
12 HD1 PHE 2 1HD PHE 2 0.528 2.002 -4.221
13 HD2 PHE 2 2HD PHE 2 2.099 3.612 -7.832
14 HE1 PHE 2 1HE PHE 2 -0.078 -0.067 -5.404
15 HE2 PHE 2 2HE PHE 2 1.499 1.546 -9.021
16 HZ PHE 2 HZ PHE 2 0.407 -0.295 -7.807
17 H CYS 3 H CYS 3 3.247 2.267 -2.314
18 HA CYS 3 HA CYS 3 5.892 1.869 -3.041
19 1HB CYS 3 2HB CYS 3 4.142 -0.366 -2.024
20 2HB CYS 3 1HB CYS 3 5.844 -0.086 -1.720
21 H GLY 4 H GLY 4 3.157 -0.264 -3.894
22 1HA GLY 4 2HA GLY 4 3.734 -0.571 -6.585
23 2HA GLY 4 1HA GLY 4 4.654 -1.808 -5.738
24 H GLU 5 H GLU 5 2.963 -2.517 -3.719
25 HA GLU 5 HA GLU 5 1.078 -4.170 -5.102
26 1HB GLU 5 2HB GLU 5 1.113 -3.714 -2.126
27 2HB GLU 5 1HB GLU 5 0.588 -5.141 -2.996
28 1HG GLU 5 2HG GLU 5 2.583 -5.897 -2.271
29 2HG GLU 5 1HG GLU 5 3.136 -5.129 -3.760
30 H THR 6 H THR 6 -1.232 -4.226 -4.654
31 HA THR 6 HA THR 6 -2.263 -1.560 -3.994
32 HB THR 6 HB THR 6 -4.292 -2.333 -5.384
33 HG1 THR 6 1HG THR 6 -2.419 -3.791 -6.885
34 1HG2 THR 6 1HG2 THR 6 -2.770 -1.767 -7.543
35 2HG2 THR 6 2HG2 THR 6 -1.702 -1.218 -6.251
36 3HG2 THR 6 3HG2 THR 6 -3.330 -0.552 -6.394
37 H CYS 7 H CYS 7 -3.083 -1.597 -2.079
38 HA CYS 7 HA CYS 7 -4.246 -3.977 -0.896
39 1HB CYS 7 2HB CYS 7 -4.649 -2.207 1.012
40 2HB CYS 7 1HB CYS 7 -3.013 -2.824 0.744
41 H ARG 8 H ARG 8 -5.739 -3.539 -2.967
42 HA ARG 8 HA ARG 8 -7.811 -1.616 -2.566
43 1HB ARG 8 2HB ARG 8 -7.241 -3.706 -4.606
44 2HB ARG 8 1HB ARG 8 -8.848 -2.987 -4.533
45 1HG ARG 8 2HG ARG 8 -7.689 -0.764 -4.559
46 2HG ARG 8 1HG ARG 8 -6.225 -1.631 -5.042
47 1HD ARG 8 2HD ARG 8 -7.298 -0.856 -7.032
48 2HD ARG 8 1HD ARG 8 -7.551 -2.599 -6.931
49 HE ARG 8 HE ARG 8 -9.696 -1.229 -5.686
50 1HH1 ARG 8 1HH1 ARG 8 -8.424 -1.943 -8.880
51 2HH1 ARG 8 2HH1 ARG 8 -9.963 -1.804 -9.657
52 1HH2 ARG 8 1HH2 ARG 8 -11.688 -1.045 -6.678
53 2HH2 ARG 8 2HH2 ARG 8 -11.847 -1.286 -8.391
54 H VAL 9 H VAL 9 -8.784 -4.816 -3.522
55 HA VAL 9 HA VAL 9 -10.844 -4.671 -1.526
56 HB VAL 9 HB VAL 9 -10.358 -6.869 -3.551
57 1HG1 VAL 9 1HG1 VAL 9 -13.030 -6.224 -2.401
58 2HG1 VAL 9 2HG1 VAL 9 -11.891 -7.171 -1.443
59 3HG1 VAL 9 3HG1 VAL 9 -12.408 -7.753 -3.025
60 1HG2 VAL 9 1HG2 VAL 9 -12.288 -4.569 -3.788
61 2HG2 VAL 9 2HG2 VAL 9 -11.902 -5.784 -5.006
62 3HG2 VAL 9 3HG2 VAL 9 -10.692 -4.589 -4.538
63 H ILE 10 H ILE 10 -7.914 -6.325 -2.146
64 HA ILE 10 HA ILE 10 -8.112 -7.741 0.419
65 HB ILE 10 HB ILE 10 -6.389 -9.350 -0.615
66 1HG1 ILE 10 2HG1 ILE 10 -7.595 -8.253 -3.170
67 2HG1 ILE 10 1HG1 ILE 10 -5.934 -8.004 -2.643
68 1HG2 ILE 10 1HG2 ILE 10 -8.133 -10.793 -1.514
69 2HG2 ILE 10 2HG2 ILE 10 -9.226 -9.414 -1.631
70 3HG2 ILE 10 3HG2 ILE 10 -8.682 -9.977 -0.051
71 1HD1 ILE 10 1HD1 ILE 10 -6.170 -9.745 -4.369
72 2HD1 ILE 10 2HD1 ILE 10 -7.153 -10.688 -3.248
73 3HD1 ILE 10 3HD1 ILE 10 -5.463 -10.350 -2.871
74 HA PRO 11 HA PRO 11 -4.857 -4.477 0.366
75 1HB PRO 11 2HB PRO 11 -5.631 -4.235 3.198
76 2HB PRO 11 1HB PRO 11 -5.491 -2.990 1.954
77 1HG PRO 11 2HG PRO 11 -7.858 -3.775 2.837
78 2HG PRO 11 1HG PRO 11 -7.608 -3.396 1.123
79 1HD PRO 11 2HD PRO 11 -7.716 -6.087 2.460
80 2HD PRO 11 1HD PRO 11 -8.468 -5.560 0.937
81 H VAL 12 H VAL 12 -3.698 -3.985 2.804
82 HA VAL 12 HA VAL 12 -2.012 -4.508 4.121
83 HB VAL 12 HB VAL 12 -2.753 -7.422 3.810
84 1HG1 VAL 12 1HG1 VAL 12 -1.669 -7.654 6.021
85 2HG1 VAL 12 2HG1 VAL 12 -1.173 -5.965 5.926
86 3HG1 VAL 12 3HG1 VAL 12 -0.554 -7.133 4.758
87 1HG2 VAL 12 1HG2 VAL 12 -4.174 -7.225 5.704
88 2HG2 VAL 12 2HG2 VAL 12 -4.630 -5.928 4.598
89 3HG2 VAL 12 3HG2 VAL 12 -3.642 -5.572 6.016
90 H CYS 13 H CYS 13 -0.744 -3.715 2.484
91 HA CYS 13 HA CYS 13 0.483 -5.126 0.417
92 1HB CYS 13 2HB CYS 13 1.970 -2.989 1.878
93 2HB CYS 13 1HB CYS 13 1.727 -3.199 0.144
94 H THR 14 H THR 14 1.382 -7.090 0.931
95 HA THR 14 HA THR 14 3.116 -7.338 3.241
96 HB THR 14 HB THR 14 3.208 -9.785 2.233
97 HG1 THR 14 1HG THR 14 0.620 -9.244 1.392
98 1HG2 THR 14 1HG2 THR 14 1.038 -10.238 3.457
99 2HG2 THR 14 2HG2 THR 14 0.906 -8.495 3.690
100 3HG2 THR 14 3HG2 THR 14 2.270 -9.375 4.378
101 H TYR 15 H TYR 15 3.572 -6.646 -0.061
102 HA TYR 15 HA TYR 15 6.109 -7.994 -0.311
103 1HB TYR 15 2HB TYR 15 4.719 -7.673 -2.290
104 2HB TYR 15 1HB TYR 15 4.768 -5.929 -2.068
105 HD1 TYR 15 1HD TYR 15 7.148 -8.779 -2.425
106 HD2 TYR 15 2HD TYR 15 6.232 -4.747 -3.398
107 HE1 TYR 15 1HE TYR 15 9.161 -8.673 -3.835
108 HE2 TYR 15 2HE TYR 15 8.238 -4.624 -4.815
109 HH TYR 15 HH TYR 15 10.306 -5.687 -5.170
110 H SER 16 H SER 16 5.047 -4.624 -0.176
111 HA SER 16 HA SER 16 7.769 -3.746 0.378
112 1HB SER 16 2HB SER 16 5.205 -2.228 -0.066
113 2HB SER 16 1HB SER 16 6.769 -1.470 0.237
114 HG SER 16 HG SER 16 5.806 -2.783 -2.026
115 H ALA 17 H ALA 17 5.920 -5.302 2.216
116 HA ALA 17 HA ALA 17 5.265 -3.663 4.415
117 1HB ALA 17 1HB ALA 17 4.312 -5.546 5.115
118 2HB ALA 17 2HB ALA 17 5.888 -6.320 5.283
119 3HB ALA 17 3HB ALA 17 5.029 -6.393 3.744
120 H ALA 18 H ALA 18 8.241 -5.126 3.363
121 HA ALA 18 HA ALA 18 9.707 -5.211 5.738
122 1HB ALA 18 1HB ALA 18 11.589 -5.494 4.428
123 2HB ALA 18 2HB ALA 18 11.017 -4.385 3.181
124 3HB ALA 18 3HB ALA 18 10.309 -5.994 3.323
125 H LEU 19 H LEU 19 9.190 -2.572 3.461
126 HA LEU 19 HA LEU 19 10.795 -0.673 4.882
127 1HB LEU 19 2HB LEU 19 9.050 -0.656 2.512
128 2HB LEU 19 1HB LEU 19 9.160 0.858 3.378
129 HG LEU 19 HG LEU 19 11.483 1.021 3.009
130 1HD1 LEU 19 1HD1 LEU 19 12.788 -0.725 1.862
131 2HD1 LEU 19 2HD1 LEU 19 11.371 -1.775 1.858
132 3HD1 LEU 19 3HD1 LEU 19 12.118 -1.308 3.385
133 1HD2 LEU 19 1HD2 LEU 19 10.349 -0.036 0.429
134 2HD2 LEU 19 2HD2 LEU 19 11.595 1.194 0.645
135 3HD2 LEU 19 3HD2 LEU 19 9.929 1.536 1.112
136 H GLY 20 H GLY 20 7.740 -1.943 5.345
137 1HA GLY 20 2HA GLY 20 6.278 -1.475 7.099
138 2HA GLY 20 1HA GLY 20 7.171 0.012 7.412
139 H CYS 21 H CYS 21 6.077 -0.965 4.263
140 HA CYS 21 HA CYS 21 4.900 1.449 3.590
141 1HB CYS 21 2HB CYS 21 4.877 -1.303 2.500
142 2HB CYS 21 1HB CYS 21 3.585 -0.263 1.948
143 H THR 22 H THR 22 3.178 2.413 4.356
144 HA THR 22 HA THR 22 1.111 0.777 5.611
145 HB THR 22 HB THR 22 0.366 3.006 6.587
146 HG1 THR 22 1HG THR 22 3.051 3.798 6.141
147 1HG2 THR 22 1HG2 THR 22 3.079 2.017 7.465
148 2HG2 THR 22 2HG2 THR 22 1.566 1.179 7.812
149 3HG2 THR 22 3HG2 THR 22 1.847 2.794 8.460
150 H CYS 23 H CYS 23 -0.756 0.643 4.777
151 HA CYS 23 HA CYS 23 -1.394 2.168 2.387
152 1HB CYS 23 2HB CYS 23 -1.646 -0.262 2.285
153 2HB CYS 23 1HB CYS 23 -2.705 -0.246 3.689
154 H ASP 24 H ASP 24 -3.634 2.988 2.174
155 HA ASP 24 HA ASP 24 -4.470 4.346 4.612
156 1HB ASP 24 2HB ASP 24 -4.298 5.776 2.699
157 2HB ASP 24 1HB ASP 24 -5.200 4.652 1.691
158 H ASP 25 H ASP 25 -5.986 2.504 1.998
159 HA ASP 25 HA ASP 25 -7.755 1.149 1.825
160 1HB ASP 25 2HB ASP 25 -6.485 -0.431 3.064
161 2HB ASP 25 1HB ASP 25 -6.846 0.376 4.590
162 H ARG 26 H ARG 26 -9.695 1.247 1.686
163 HA ARG 26 HA ARG 26 -11.402 2.204 3.849
164 1HB ARG 26 2HB ARG 26 -11.891 3.450 1.184
165 2HB ARG 26 1HB ARG 26 -12.181 4.075 2.786
166 1HG ARG 26 2HG ARG 26 -9.762 4.490 3.039
167 2HG ARG 26 1HG ARG 26 -9.555 3.995 1.359
168 1HD ARG 26 2HD ARG 26 -9.655 6.331 1.285
169 2HD ARG 26 1HD ARG 26 -11.261 5.800 0.793
170 HE ARG 26 HE ARG 26 -12.105 6.890 2.598
171 1HH1 ARG 26 1HH1 ARG 26 -8.707 6.239 3.221
172 2HH1 ARG 26 2HH1 ARG 26 -8.693 7.123 4.717
173 1HH2 ARG 26 1HH2 ARG 26 -12.074 8.040 4.584
174 2HH2 ARG 26 2HH2 ARG 26 -10.604 8.133 5.493
175 H SER 27 H SER 27 -10.952 -0.281 2.840
176 HA SER 27 HA SER 27 -12.111 -2.137 2.172
177 1HB SER 27 2HB SER 27 -14.288 -1.013 2.711
178 2HB SER 27 1HB SER 27 -14.261 -0.261 1.117
179 HG SER 27 HG SER 27 -14.055 -2.568 0.371
180 H ASP 28 H ASP 28 -10.565 0.071 0.856
181 HA ASP 28 HA ASP 28 -9.472 -1.077 -1.308
182 1HB ASP 28 2HB ASP 28 -11.860 -0.738 -2.290
183 2HB ASP 28 1HB ASP 28 -11.447 0.971 -2.334
184 H GLY 29 H GLY 29 -7.592 0.100 -1.645
185 1HA GLY 29 2HA GLY 29 -7.655 2.976 -1.293
186 2HA GLY 29 1HA GLY 29 -6.787 2.122 -0.038
187 H LEU 30 H LEU 30 -4.753 2.583 -0.330
188 HA LEU 30 HA LEU 30 -3.416 1.712 -2.739
189 1HB LEU 30 2HB LEU 30 -4.422 4.095 -2.990
190 2HB LEU 30 1HB LEU 30 -3.153 4.579 -1.910
191 HG LEU 30 HG LEU 30 -2.733 4.954 -4.364
192 1HD1 LEU 30 1HD1 LEU 30 -0.412 4.107 -4.290
193 2HD1 LEU 30 2HD1 LEU 30 -0.822 3.238 -2.811
194 3HD1 LEU 30 3HD1 LEU 30 -0.897 5.000 -2.849
195 1HD2 LEU 30 1HD2 LEU 30 -2.124 2.034 -4.544
196 2HD2 LEU 30 2HD2 LEU 30 -2.370 3.209 -5.835
197 3HD2 LEU 30 3HD2 LEU 30 -3.745 2.630 -4.895
198 H CYS 31 H CYS 31 -1.428 0.971 -2.199
199 HA CYS 31 HA CYS 31 -0.497 1.041 0.498
200 1HB CYS 31 2HB CYS 31 0.774 0.063 -2.058
201 2HB CYS 31 1HB CYS 31 1.493 -0.165 -0.471
202 H LYS 32 H LYS 32 1.016 2.375 1.451
203 HA LYS 32 HA LYS 32 2.391 4.218 -0.383
204 1HB LYS 32 2HB LYS 32 0.537 4.798 1.691
205 2HB LYS 32 1HB LYS 32 2.083 5.454 2.159
206 1HG LYS 32 2HG LYS 32 0.800 7.099 0.926
207 2HG LYS 32 1HG LYS 32 2.215 6.613 -0.016
208 1HD LYS 32 2HD LYS 32 0.684 4.906 -1.127
209 2HD LYS 32 1HD LYS 32 -0.658 5.801 -0.405
210 1HE LYS 32 2HE LYS 32 1.307 6.648 -2.484
211 2HE LYS 32 1HE LYS 32 -0.440 6.642 -2.561
212 1HZ LYS 32 1HZ LYS 32 -0.444 8.429 -0.866
213 2HZ LYS 32 2HZ LYS 32 0.317 8.894 -2.303
214 3HZ LYS 32 3HZ LYS 32 1.247 8.488 -0.948
215 H ARG 33 H ARG 33 4.467 4.692 0.021
216 HA ARG 33 HA ARG 33 6.013 2.746 1.410
217 1HB ARG 33 2HB ARG 33 6.361 4.117 -0.816
218 2HB ARG 33 1HB ARG 33 7.161 5.250 0.258
219 1HG ARG 33 2HG ARG 33 8.697 3.455 0.957
220 2HG ARG 33 1HG ARG 33 7.917 2.373 -0.204
221 1HD ARG 33 2HD ARG 33 8.484 3.957 -2.009
222 2HD ARG 33 1HD ARG 33 9.327 4.964 -0.836
223 HE ARG 33 HE ARG 33 10.360 2.346 -0.752
224 1HH1 ARG 33 1HH1 ARG 33 10.311 5.194 -2.776
225 2HH1 ARG 33 2HH1 ARG 33 11.829 4.847 -3.534
226 1HH2 ARG 33 1HH2 ARG 33 12.375 1.870 -1.746
227 2HH2 ARG 33 2HH2 ARG 33 13.009 2.947 -2.945
228 H ASN 34 H ASN 34 8.199 4.710 1.877
229 HA ASN 34 HA ASN 34 7.457 6.304 4.170
230 1HB ASN 34 2HB ASN 34 8.931 3.759 4.374
231 2HB ASN 34 1HB ASN 34 9.468 5.062 5.398
232 1HD2 ASN 34 1HD2 ASN 34 7.931 2.376 5.582
233 2HD2 ASN 34 2HD2 ASN 34 6.642 2.745 6.658
234 H GLY 35 H GLY 35 9.136 7.817 4.674
235 1HA GLY 35 2HA GLY 35 11.115 9.024 4.263
236 2HA GLY 35 1HA GLY 35 11.587 7.794 3.083
237 H ASP 36 H ASP 36 9.374 7.619 1.656
238 HA ASP 36 HA ASP 36 8.502 10.156 0.590
239 1HB ASP 36 2HB ASP 36 10.585 9.493 -0.734
240 2HB ASP 36 1HB ASP 36 9.712 8.053 -1.240
241 HA PRO 37 HA PRO 37 5.702 6.362 1.271
242 1HB PRO 37 2HB PRO 37 4.233 8.613 2.636
243 2HB PRO 37 1HB PRO 37 4.298 6.890 3.071
244 1HG PRO 37 2HG PRO 37 5.899 8.370 4.435
245 2HG PRO 37 1HG PRO 37 6.648 7.041 3.554
246 1HD PRO 37 2HD PRO 37 6.384 9.894 2.595
247 2HD PRO 37 1HD PRO 37 7.884 8.965 2.856
Start of MODEL 14
1 H THR 1 H THR 1 5.793 6.109 -0.760
2 HA THR 1 HA THR 1 3.843 7.781 -2.015
3 HB THR 1 HB THR 1 6.108 8.530 -2.913
4 HG1 THR 1 1HG THR 1 5.281 8.684 -4.964
5 1HG2 THR 1 1HG2 THR 1 7.595 7.047 -3.645
6 2HG2 THR 1 2HG2 THR 1 6.427 6.404 -4.799
7 3HG2 THR 1 3HG2 THR 1 6.503 5.748 -3.164
8 H PHE 2 H PHE 2 3.167 6.462 -4.047
9 HA PHE 2 HA PHE 2 2.110 4.064 -3.236
10 1HB PHE 2 2HB PHE 2 1.165 5.128 -5.103
11 2HB PHE 2 1HB PHE 2 2.704 5.246 -5.931
12 HD1 PHE 2 1HD PHE 2 0.885 2.341 -4.436
13 HD2 PHE 2 2HD PHE 2 2.544 4.124 -7.925
14 HE1 PHE 2 1HE PHE 2 0.323 0.327 -5.730
15 HE2 PHE 2 2HE PHE 2 1.985 2.113 -9.224
16 HZ PHE 2 HZ PHE 2 0.871 0.211 -8.127
17 H CYS 3 H CYS 3 3.295 2.501 -2.407
18 HA CYS 3 HA CYS 3 5.901 1.793 -2.898
19 1HB CYS 3 2HB CYS 3 3.814 -0.260 -2.190
20 2HB CYS 3 1HB CYS 3 5.483 -0.162 -1.656
21 H GLY 4 H GLY 4 3.126 -0.108 -4.058
22 1HA GLY 4 2HA GLY 4 3.776 -0.319 -6.723
23 2HA GLY 4 1HA GLY 4 4.685 -1.595 -5.918
24 H GLU 5 H GLU 5 2.964 -2.314 -3.930
25 HA GLU 5 HA GLU 5 1.096 -3.962 -5.337
26 1HB GLU 5 2HB GLU 5 1.085 -3.499 -2.364
27 2HB GLU 5 1HB GLU 5 0.606 -4.939 -3.238
28 1HG GLU 5 2HG GLU 5 2.602 -5.653 -2.476
29 2HG GLU 5 1HG GLU 5 3.169 -4.872 -3.952
30 H THR 6 H THR 6 -1.228 -4.076 -4.624
31 HA THR 6 HA THR 6 -2.274 -1.426 -3.963
32 HB THR 6 HB THR 6 -4.233 -1.971 -5.509
33 HG1 THR 6 1HG THR 6 -2.257 -3.730 -6.580
34 1HG2 THR 6 1HG2 THR 6 -1.665 -1.487 -6.989
35 2HG2 THR 6 2HG2 THR 6 -2.322 -0.294 -5.868
36 3HG2 THR 6 3HG2 THR 6 -3.258 -0.787 -7.279
37 H CYS 7 H CYS 7 -3.202 -1.601 -2.131
38 HA CYS 7 HA CYS 7 -4.237 -4.059 -1.073
39 1HB CYS 7 2HB CYS 7 -4.930 -2.222 0.764
40 2HB CYS 7 1HB CYS 7 -3.282 -2.856 0.660
41 H ARG 8 H ARG 8 -5.788 -4.130 -2.999
42 HA ARG 8 HA ARG 8 -8.070 -2.409 -3.046
43 1HB ARG 8 2HB ARG 8 -7.829 -5.161 -4.267
44 2HB ARG 8 1HB ARG 8 -8.938 -3.877 -4.747
45 1HG ARG 8 2HG ARG 8 -6.006 -3.624 -4.794
46 2HG ARG 8 1HG ARG 8 -6.906 -4.229 -6.186
47 1HD ARG 8 2HD ARG 8 -8.217 -2.112 -6.156
48 2HD ARG 8 1HD ARG 8 -7.173 -1.523 -4.866
49 HE ARG 8 HE ARG 8 -5.622 -2.307 -7.092
50 1HH1 ARG 8 1HH1 ARG 8 -7.783 0.227 -5.973
51 2HH1 ARG 8 2HH1 ARG 8 -7.102 1.431 -7.022
52 1HH2 ARG 8 1HH2 ARG 8 -4.735 -0.709 -8.481
53 2HH2 ARG 8 2HH2 ARG 8 -5.373 0.900 -8.450
54 H VAL 9 H VAL 9 -9.114 -5.605 -3.328
55 HA VAL 9 HA VAL 9 -10.671 -5.216 -0.986
56 HB VAL 9 HB VAL 9 -11.757 -5.990 -3.089
57 1HG1 VAL 9 1HG1 VAL 9 -11.510 -8.232 -3.876
58 2HG1 VAL 9 2HG1 VAL 9 -10.435 -8.638 -2.537
59 3HG1 VAL 9 3HG1 VAL 9 -9.908 -7.501 -3.778
60 1HG2 VAL 9 1HG2 VAL 9 -12.022 -7.483 -0.527
61 2HG2 VAL 9 2HG2 VAL 9 -12.942 -8.026 -1.930
62 3HG2 VAL 9 3HG2 VAL 9 -13.153 -6.386 -1.319
63 H ILE 10 H ILE 10 -7.835 -6.531 -1.778
64 HA ILE 10 HA ILE 10 -7.710 -8.149 0.655
65 HB ILE 10 HB ILE 10 -5.984 -9.596 -0.439
66 1HG1 ILE 10 2HG1 ILE 10 -5.569 -7.982 -2.380
67 2HG1 ILE 10 1HG1 ILE 10 -5.645 -9.692 -2.777
68 1HG2 ILE 10 1HG2 ILE 10 -8.008 -10.658 -0.155
69 2HG2 ILE 10 2HG2 ILE 10 -7.704 -10.872 -1.878
70 3HG2 ILE 10 3HG2 ILE 10 -8.832 -9.633 -1.330
71 1HD1 ILE 10 1HD1 ILE 10 -6.968 -7.686 -4.070
72 2HD1 ILE 10 2HD1 ILE 10 -8.215 -8.336 -3.005
73 3HD1 ILE 10 3HD1 ILE 10 -7.381 -9.399 -4.139
74 HA PRO 11 HA PRO 11 -4.872 -4.515 0.453
75 1HB PRO 11 2HB PRO 11 -5.617 -4.201 3.271
76 2HB PRO 11 1HB PRO 11 -5.691 -3.036 1.949
77 1HG PRO 11 2HG PRO 11 -7.888 -4.113 3.011
78 2HG PRO 11 1HG PRO 11 -7.780 -3.720 1.287
79 1HD PRO 11 2HD PRO 11 -7.505 -6.380 2.641
80 2HD PRO 11 1HD PRO 11 -8.344 -5.969 1.129
81 H VAL 12 H VAL 12 -3.772 -3.822 2.884
82 HA VAL 12 HA VAL 12 -1.965 -4.105 4.116
83 HB VAL 12 HB VAL 12 -2.588 -7.062 4.156
84 1HG1 VAL 12 1HG1 VAL 12 -0.879 -5.274 5.850
85 2HG1 VAL 12 2HG1 VAL 12 -0.464 -6.805 5.078
86 3HG1 VAL 12 3HG1 VAL 12 -1.527 -6.787 6.484
87 1HG2 VAL 12 1HG2 VAL 12 -4.404 -5.269 4.887
88 2HG2 VAL 12 2HG2 VAL 12 -3.445 -5.273 6.367
89 3HG2 VAL 12 3HG2 VAL 12 -4.166 -6.771 5.780
90 H CYS 13 H CYS 13 -0.830 -3.467 2.294
91 HA CYS 13 HA CYS 13 0.327 -5.026 0.330
92 1HB CYS 13 2HB CYS 13 1.870 -2.767 1.527
93 2HB CYS 13 1HB CYS 13 1.540 -3.126 -0.168
94 H THR 14 H THR 14 1.274 -6.930 0.910
95 HA THR 14 HA THR 14 3.051 -7.105 3.169
96 HB THR 14 HB THR 14 3.235 -9.541 2.150
97 HG1 THR 14 1HG THR 14 0.645 -9.189 1.311
98 1HG2 THR 14 1HG2 THR 14 0.667 -9.618 3.197
99 2HG2 THR 14 2HG2 THR 14 1.390 -8.195 3.944
100 3HG2 THR 14 3HG2 THR 14 2.171 -9.768 4.105
101 H TYR 15 H TYR 15 3.513 -6.478 -0.172
102 HA TYR 15 HA TYR 15 6.095 -7.723 -0.370
103 1HB TYR 15 2HB TYR 15 4.689 -7.376 -2.362
104 2HB TYR 15 1HB TYR 15 4.789 -5.636 -2.131
105 HD1 TYR 15 1HD TYR 15 7.082 -8.558 -2.476
106 HD2 TYR 15 2HD TYR 15 6.308 -4.492 -3.433
107 HE1 TYR 15 1HE TYR 15 9.116 -8.507 -3.860
108 HE2 TYR 15 2HE TYR 15 8.335 -4.426 -4.825
109 HH TYR 15 HH TYR 15 10.429 -5.586 -5.081
110 H SER 16 H SER 16 4.937 -4.393 -0.227
111 HA SER 16 HA SER 16 7.610 -3.438 0.447
112 1HB SER 16 2HB SER 16 5.031 -1.986 -0.106
113 2HB SER 16 1HB SER 16 6.569 -1.198 0.256
114 HG SER 16 HG SER 16 5.725 -2.545 -2.041
115 H ALA 17 H ALA 17 5.769 -5.083 2.182
116 HA ALA 17 HA ALA 17 4.929 -3.495 4.358
117 1HB ALA 17 1HB ALA 17 5.170 -6.345 3.769
118 2HB ALA 17 2HB ALA 17 3.941 -5.477 4.691
119 3HB ALA 17 3HB ALA 17 5.451 -5.956 5.467
120 H ALA 18 H ALA 18 8.018 -4.765 3.416
121 HA ALA 18 HA ALA 18 9.394 -4.812 5.845
122 1HB ALA 18 1HB ALA 18 10.088 -4.748 3.018
123 2HB ALA 18 2HB ALA 18 10.858 -5.608 4.352
124 3HB ALA 18 3HB ALA 18 11.274 -3.923 4.031
125 H LEU 19 H LEU 19 8.799 -2.171 3.594
126 HA LEU 19 HA LEU 19 10.207 -0.193 5.106
127 1HB LEU 19 2HB LEU 19 8.537 -0.250 2.678
128 2HB LEU 19 1HB LEU 19 8.512 1.251 3.570
129 HG LEU 19 HG LEU 19 10.864 1.538 3.309
130 1HD1 LEU 19 1HD1 LEU 19 11.075 -1.166 3.253
131 2HD1 LEU 19 2HD1 LEU 19 12.355 -0.067 2.738
132 3HD1 LEU 19 3HD1 LEU 19 11.280 -0.790 1.542
133 1HD2 LEU 19 1HD2 LEU 19 9.108 1.125 1.013
134 2HD2 LEU 19 2HD2 LEU 19 10.825 1.053 0.614
135 3HD2 LEU 19 3HD2 LEU 19 10.164 2.480 1.411
136 H GLY 20 H GLY 20 7.163 -1.642 5.336
137 1HA GLY 20 2HA GLY 20 5.609 -1.328 7.060
138 2HA GLY 20 1HA GLY 20 6.408 0.191 7.467
139 H CYS 21 H CYS 21 5.514 -0.785 4.264
140 HA CYS 21 HA CYS 21 4.348 1.575 3.493
141 1HB CYS 21 2HB CYS 21 4.407 -1.187 2.471
142 2HB CYS 21 1HB CYS 21 3.120 -0.192 1.834
143 H THR 22 H THR 22 2.735 2.573 4.370
144 HA THR 22 HA THR 22 0.517 1.096 5.504
145 HB THR 22 HB THR 22 -0.221 3.417 6.235
146 HG1 THR 22 1HG THR 22 2.434 4.253 5.966
147 1HG2 THR 22 1HG2 THR 22 1.576 3.506 8.037
148 2HG2 THR 22 2HG2 THR 22 2.324 2.139 7.211
149 3HG2 THR 22 3HG2 THR 22 0.698 1.985 7.876
150 H CYS 23 H CYS 23 -1.358 0.981 4.635
151 HA CYS 23 HA CYS 23 -1.832 2.208 2.041
152 1HB CYS 23 2HB CYS 23 -2.174 -0.226 2.318
153 2HB CYS 23 1HB CYS 23 -3.384 0.084 3.554
154 H ASP 24 H ASP 24 -4.738 1.573 2.978
155 HA ASP 24 HA ASP 24 -5.387 3.846 4.647
156 1HB ASP 24 2HB ASP 24 -5.414 4.909 2.474
157 2HB ASP 24 1HB ASP 24 -6.316 3.571 1.774
158 H ASP 25 H ASP 25 -6.526 1.274 2.545
159 HA ASP 25 HA ASP 25 -8.186 -0.254 2.660
160 1HB ASP 25 2HB ASP 25 -6.462 -1.089 4.279
161 2HB ASP 25 1HB ASP 25 -7.429 -0.393 5.575
162 H ARG 26 H ARG 26 -9.868 0.676 2.123
163 HA ARG 26 HA ARG 26 -11.972 0.932 4.072
164 1HB ARG 26 2HB ARG 26 -11.759 3.240 2.206
165 2HB ARG 26 1HB ARG 26 -12.429 3.138 3.808
166 1HG ARG 26 2HG ARG 26 -9.523 2.899 3.663
167 2HG ARG 26 1HG ARG 26 -10.193 4.468 3.222
168 1HD ARG 26 2HD ARG 26 -10.937 3.046 5.765
169 2HD ARG 26 1HD ARG 26 -9.551 4.129 5.658
170 HE ARG 26 HE ARG 26 -12.263 4.879 5.906
171 1HH1 ARG 26 1HH1 ARG 26 -9.260 5.853 4.352
172 2HH1 ARG 26 2HH1 ARG 26 -9.752 7.511 4.192
173 1HH2 ARG 26 1HH2 ARG 26 -12.885 7.077 5.702
174 2HH2 ARG 26 2HH2 ARG 26 -11.802 8.207 4.964
175 H SER 27 H SER 27 -12.682 2.701 1.377
176 HA SER 27 HA SER 27 -13.933 0.429 0.041
177 1HB SER 27 2HB SER 27 -15.320 2.430 0.388
178 2HB SER 27 1HB SER 27 -14.123 3.423 -0.437
179 HG SER 27 HG SER 27 -14.534 2.130 -2.325
180 H ASP 28 H ASP 28 -11.346 0.184 0.046
181 HA ASP 28 HA ASP 28 -9.614 -0.383 -1.293
182 1HB ASP 28 2HB ASP 28 -11.086 -0.653 -3.238
183 2HB ASP 28 1HB ASP 28 -11.060 1.087 -3.516
184 H GLY 29 H GLY 29 -7.611 0.563 -1.517
185 1HA GLY 29 2HA GLY 29 -7.555 3.507 -1.455
186 2HA GLY 29 1HA GLY 29 -6.709 2.602 -0.216
187 H LEU 30 H LEU 30 -4.636 2.825 -0.539
188 HA LEU 30 HA LEU 30 -3.392 1.800 -2.889
189 1HB LEU 30 2HB LEU 30 -4.375 4.074 -3.511
190 2HB LEU 30 1HB LEU 30 -3.176 4.768 -2.449
191 HG LEU 30 HG LEU 30 -2.682 4.769 -4.949
192 1HD1 LEU 30 1HD1 LEU 30 -0.774 3.674 -2.919
193 2HD1 LEU 30 2HD1 LEU 30 -0.913 5.323 -3.532
194 3HD1 LEU 30 3HD1 LEU 30 -0.283 4.045 -4.571
195 1HD2 LEU 30 1HD2 LEU 30 -3.151 2.004 -4.600
196 2HD2 LEU 30 2HD2 LEU 30 -1.450 2.208 -5.017
197 3HD2 LEU 30 3HD2 LEU 30 -2.701 2.864 -6.073
198 H CYS 31 H CYS 31 -1.473 1.040 -2.275
199 HA CYS 31 HA CYS 31 -0.450 1.265 0.326
200 1HB CYS 31 2HB CYS 31 0.890 0.324 -2.209
201 2HB CYS 31 1HB CYS 31 1.485 0.009 -0.587
202 H LYS 32 H LYS 32 1.116 2.516 1.260
203 HA LYS 32 HA LYS 32 2.573 4.390 -0.479
204 1HB LYS 32 2HB LYS 32 0.469 5.178 0.958
205 2HB LYS 32 1HB LYS 32 1.692 5.346 2.196
206 1HG LYS 32 2HG LYS 32 1.303 7.439 0.981
207 2HG LYS 32 1HG LYS 32 2.950 6.850 0.726
208 1HD LYS 32 2HD LYS 32 1.857 7.639 -1.384
209 2HD LYS 32 1HD LYS 32 2.362 5.957 -1.424
210 1HE LYS 32 2HE LYS 32 0.130 6.335 -2.403
211 2HE LYS 32 1HE LYS 32 0.138 5.195 -1.067
212 1HZ LYS 32 1HZ LYS 32 -1.260 7.668 -1.307
213 2HZ LYS 32 2HZ LYS 32 -0.333 7.622 0.108
214 3HZ LYS 32 3HZ LYS 32 -1.479 6.413 -0.191
215 H ARG 33 H ARG 33 4.679 4.634 -0.008
216 HA ARG 33 HA ARG 33 5.942 2.782 1.770
217 1HB ARG 33 2HB ARG 33 7.104 5.038 0.132
218 2HB ARG 33 1HB ARG 33 8.034 3.772 0.902
219 1HG ARG 33 2HG ARG 33 7.170 2.126 -0.572
220 2HG ARG 33 1HG ARG 33 5.959 3.247 -1.204
221 1HD ARG 33 2HD ARG 33 7.839 4.683 -2.023
222 2HD ARG 33 1HD ARG 33 8.951 3.399 -1.552
223 HE ARG 33 HE ARG 33 7.073 2.220 -3.186
224 1HH1 ARG 33 1HH1 ARG 33 9.441 4.801 -3.497
225 2HH1 ARG 33 2HH1 ARG 33 9.678 4.527 -5.190
226 1HH2 ARG 33 1HH2 ARG 33 7.378 1.875 -5.413
227 2HH2 ARG 33 2HH2 ARG 33 8.509 2.865 -6.282
228 H ASN 34 H ASN 34 8.215 4.126 2.472
229 HA ASN 34 HA ASN 34 7.645 6.376 4.208
230 1HB ASN 34 2HB ASN 34 8.703 3.778 5.256
231 2HB ASN 34 1HB ASN 34 8.772 5.266 6.147
232 1HD2 ASN 34 1HD2 ASN 34 7.226 2.477 5.958
233 2HD2 ASN 34 2HD2 ASN 34 5.653 2.924 6.504
234 H GLY 35 H GLY 35 9.613 7.536 4.632
235 1HA GLY 35 2HA GLY 35 11.899 8.050 4.322
236 2HA GLY 35 1HA GLY 35 12.123 6.468 3.561
237 H ASP 36 H ASP 36 10.078 6.485 1.869
238 HA ASP 36 HA ASP 36 10.217 8.741 0.035
239 1HB ASP 36 2HB ASP 36 11.883 7.137 -0.833
240 2HB ASP 36 1HB ASP 36 10.714 5.830 -0.708
241 HA PRO 37 HA PRO 37 6.156 6.488 1.333
242 1HB PRO 37 2HB PRO 37 5.594 9.322 2.172
243 2HB PRO 37 1HB PRO 37 5.067 7.800 2.923
244 1HG PRO 37 2HG PRO 37 7.093 8.904 4.073
245 2HG PRO 37 1HG PRO 37 7.320 7.244 3.527
246 1HD PRO 37 2HD PRO 37 8.059 9.741 1.998
247 2HD PRO 37 1HD PRO 37 9.146 8.440 2.552
Start of MODEL 15
1 H THR 1 H THR 1 5.640 6.194 -1.198
2 HA THR 1 HA THR 1 3.562 7.640 -2.550
3 HB THR 1 HB THR 1 5.954 6.697 -4.152
4 HG1 THR 1 1HG THR 1 6.753 8.355 -2.835
5 1HG2 THR 1 1HG2 THR 1 3.786 8.710 -4.770
6 2HG2 THR 1 2HG2 THR 1 3.803 7.034 -5.318
7 3HG2 THR 1 3HG2 THR 1 5.044 8.157 -5.875
8 H PHE 2 H PHE 2 2.789 6.073 -4.304
9 HA PHE 2 HA PHE 2 1.967 3.719 -3.249
10 1HB PHE 2 2HB PHE 2 0.896 4.433 -5.168
11 2HB PHE 2 1HB PHE 2 2.392 4.706 -6.029
12 HD1 PHE 2 1HD PHE 2 2.597 3.391 -7.882
13 HD2 PHE 2 2HD PHE 2 0.752 1.755 -4.415
14 HE1 PHE 2 1HE PHE 2 2.280 1.258 -9.063
15 HE2 PHE 2 2HE PHE 2 0.438 -0.382 -5.589
16 HZ PHE 2 HZ PHE 2 1.200 -0.632 -7.916
17 H CYS 3 H CYS 3 3.247 2.338 -2.256
18 HA CYS 3 HA CYS 3 5.882 1.759 -2.596
19 1HB CYS 3 2HB CYS 3 4.030 -0.473 -1.841
20 2HB CYS 3 1HB CYS 3 5.597 -0.057 -1.181
21 H GLY 4 H GLY 4 3.356 -0.505 -3.685
22 1HA GLY 4 2HA GLY 4 4.294 -0.888 -6.292
23 2HA GLY 4 1HA GLY 4 5.090 -2.074 -5.259
24 H GLU 5 H GLU 5 3.139 -2.587 -3.440
25 HA GLU 5 HA GLU 5 1.340 -4.276 -4.939
26 1HB GLU 5 2HB GLU 5 1.751 -3.771 -1.995
27 2HB GLU 5 1HB GLU 5 0.515 -4.850 -2.612
28 1HG GLU 5 2HG GLU 5 2.126 -6.367 -3.444
29 2HG GLU 5 1HG GLU 5 3.449 -5.213 -3.197
30 H THR 6 H THR 6 -1.031 -4.254 -4.351
31 HA THR 6 HA THR 6 -1.939 -1.522 -3.770
32 HB THR 6 HB THR 6 -3.924 -2.081 -5.281
33 HG1 THR 6 1HG THR 6 -2.117 -3.758 -6.652
34 1HG2 THR 6 1HG2 THR 6 -1.196 -1.253 -6.047
35 2HG2 THR 6 2HG2 THR 6 -2.734 -0.411 -6.240
36 3HG2 THR 6 3HG2 THR 6 -2.274 -1.678 -7.376
37 H CYS 7 H CYS 7 -2.899 -1.583 -1.878
38 HA CYS 7 HA CYS 7 -4.201 -3.991 -0.943
39 1HB CYS 7 2HB CYS 7 -4.674 -2.456 1.104
40 2HB CYS 7 1HB CYS 7 -3.029 -3.038 0.855
41 H ARG 8 H ARG 8 -5.659 -3.603 -2.915
42 HA ARG 8 HA ARG 8 -7.796 -1.701 -2.409
43 1HB ARG 8 2HB ARG 8 -6.900 -3.292 -4.729
44 2HB ARG 8 1HB ARG 8 -8.629 -2.974 -4.621
45 1HG ARG 8 2HG ARG 8 -8.057 -0.565 -4.311
46 2HG ARG 8 1HG ARG 8 -6.393 -0.975 -4.745
47 1HD ARG 8 2HD ARG 8 -7.541 -0.193 -6.713
48 2HD ARG 8 1HD ARG 8 -7.248 -1.927 -6.873
49 HE ARG 8 HE ARG 8 -9.792 -1.484 -5.712
50 1HH1 ARG 8 1HH1 ARG 8 -8.158 -1.223 -8.811
51 2HH1 ARG 8 2HH1 ARG 8 -9.615 -1.416 -9.725
52 1HH2 ARG 8 1HH2 ARG 8 -11.668 -1.726 -6.868
53 2HH2 ARG 8 2HH2 ARG 8 -11.642 -1.708 -8.609
54 H VAL 9 H VAL 9 -8.673 -4.649 -3.977
55 HA VAL 9 HA VAL 9 -10.662 -5.098 -1.932
56 HB VAL 9 HB VAL 9 -11.529 -6.867 -3.454
57 1HG1 VAL 9 1HG1 VAL 9 -12.702 -5.345 -4.606
58 2HG1 VAL 9 2HG1 VAL 9 -11.257 -4.627 -5.319
59 3HG1 VAL 9 3HG1 VAL 9 -11.761 -4.165 -3.693
60 1HG2 VAL 9 1HG2 VAL 9 -9.207 -6.014 -5.176
61 2HG2 VAL 9 2HG2 VAL 9 -10.578 -6.954 -5.765
62 3HG2 VAL 9 3HG2 VAL 9 -9.523 -7.619 -4.517
63 H ILE 10 H ILE 10 -7.657 -5.734 -1.957
64 HA ILE 10 HA ILE 10 -7.764 -8.038 -0.248
65 HB ILE 10 HB ILE 10 -5.766 -9.069 -1.572
66 1HG1 ILE 10 2HG1 ILE 10 -7.211 -7.654 -3.824
67 2HG1 ILE 10 1HG1 ILE 10 -5.609 -7.236 -3.225
68 1HG2 ILE 10 1HG2 ILE 10 -7.143 -10.708 -2.373
69 2HG2 ILE 10 2HG2 ILE 10 -8.346 -9.563 -2.968
70 3HG2 ILE 10 3HG2 ILE 10 -8.227 -9.900 -1.241
71 1HD1 ILE 10 1HD1 ILE 10 -6.171 -9.991 -4.228
72 2HD1 ILE 10 2HD1 ILE 10 -4.638 -9.124 -4.135
73 3HD1 ILE 10 3HD1 ILE 10 -5.834 -8.674 -5.352
74 HA PRO 11 HA PRO 11 -4.802 -4.465 0.426
75 1HB PRO 11 2HB PRO 11 -6.007 -4.589 3.129
76 2HB PRO 11 1HB PRO 11 -5.662 -3.191 2.103
77 1HG PRO 11 2HG PRO 11 -8.137 -3.996 2.395
78 2HG PRO 11 1HG PRO 11 -7.553 -3.535 0.788
79 1HD PRO 11 2HD PRO 11 -7.865 -6.301 1.939
80 2HD PRO 11 1HD PRO 11 -8.389 -5.685 0.353
81 H VAL 12 H VAL 12 -3.828 -4.109 2.882
82 HA VAL 12 HA VAL 12 -2.212 -4.670 4.283
83 HB VAL 12 HB VAL 12 -2.893 -7.586 3.912
84 1HG1 VAL 12 1HG1 VAL 12 -2.061 -6.493 6.526
85 2HG1 VAL 12 2HG1 VAL 12 -0.831 -6.530 5.264
86 3HG1 VAL 12 3HG1 VAL 12 -1.644 -8.019 5.745
87 1HG2 VAL 12 1HG2 VAL 12 -4.483 -7.407 5.726
88 2HG2 VAL 12 2HG2 VAL 12 -4.935 -6.278 4.449
89 3HG2 VAL 12 3HG2 VAL 12 -4.136 -5.688 5.906
90 H CYS 13 H CYS 13 -1.038 -3.902 2.414
91 HA CYS 13 HA CYS 13 0.279 -5.472 0.533
92 1HB CYS 13 2HB CYS 13 1.720 -3.166 1.759
93 2HB CYS 13 1HB CYS 13 1.439 -3.533 0.057
94 H THR 14 H THR 14 1.387 -7.296 1.142
95 HA THR 14 HA THR 14 2.808 -7.449 3.631
96 HB THR 14 HB THR 14 2.844 -9.420 1.344
97 HG1 THR 14 1HG THR 14 0.757 -8.646 2.665
98 1HG2 THR 14 1HG2 THR 14 4.550 -9.613 3.240
99 2HG2 THR 14 2HG2 THR 14 3.551 -11.030 2.917
100 3HG2 THR 14 3HG2 THR 14 3.177 -9.980 4.283
101 H TYR 15 H TYR 15 3.762 -7.244 0.227
102 HA TYR 15 HA TYR 15 6.570 -7.499 0.685
103 1HB TYR 15 2HB TYR 15 6.008 -7.988 -1.508
104 2HB TYR 15 1HB TYR 15 4.792 -6.726 -1.592
105 HD1 TYR 15 1HD TYR 15 8.481 -7.091 -1.296
106 HD2 TYR 15 2HD TYR 15 5.243 -4.870 -2.890
107 HE1 TYR 15 1HE TYR 15 10.080 -5.656 -2.496
108 HE2 TYR 15 2HE TYR 15 6.818 -3.423 -4.104
109 HH TYR 15 HH TYR 15 10.155 -4.173 -4.387
110 H SER 16 H SER 16 4.374 -4.859 0.095
111 HA SER 16 HA SER 16 6.287 -2.762 0.301
112 1HB SER 16 2HB SER 16 3.309 -2.533 0.766
113 2HB SER 16 1HB SER 16 4.409 -1.308 0.145
114 HG SER 16 HG SER 16 3.574 -3.708 -1.130
115 H ALA 17 H ALA 17 4.556 -4.639 2.628
116 HA ALA 17 HA ALA 17 4.494 -2.809 4.765
117 1HB ALA 17 1HB ALA 17 3.255 -4.579 5.396
118 2HB ALA 17 2HB ALA 17 4.775 -5.172 6.066
119 3HB ALA 17 3HB ALA 17 4.233 -5.729 4.482
120 H ALA 18 H ALA 18 7.136 -4.554 3.363
121 HA ALA 18 HA ALA 18 8.906 -4.822 5.488
122 1HB ALA 18 1HB ALA 18 9.439 -4.225 2.583
123 2HB ALA 18 2HB ALA 18 9.449 -5.797 3.382
124 3HB ALA 18 3HB ALA 18 10.704 -4.614 3.749
125 H LEU 19 H LEU 19 8.274 -2.028 3.431
126 HA LEU 19 HA LEU 19 10.208 -0.346 4.742
127 1HB LEU 19 2HB LEU 19 8.212 -0.035 2.585
128 2HB LEU 19 1HB LEU 19 8.618 1.407 3.474
129 HG LEU 19 HG LEU 19 10.093 1.570 1.770
130 1HD1 LEU 19 1HD1 LEU 19 12.151 1.432 2.672
131 2HD1 LEU 19 2HD1 LEU 19 11.948 -0.248 3.168
132 3HD1 LEU 19 3HD1 LEU 19 11.226 1.047 4.124
133 1HD2 LEU 19 1HD2 LEU 19 9.674 -0.249 0.412
134 2HD2 LEU 19 2HD2 LEU 19 9.985 -1.415 1.698
135 3HD2 LEU 19 3HD2 LEU 19 11.329 -0.575 0.926
136 H GLY 20 H GLY 20 7.041 -1.323 5.357
137 1HA GLY 20 2HA GLY 20 5.760 -0.815 7.257
138 2HA GLY 20 1HA GLY 20 6.812 0.567 7.562
139 H CYS 21 H CYS 21 5.230 -0.365 4.592
140 HA CYS 21 HA CYS 21 4.490 2.111 3.755
141 1HB CYS 21 2HB CYS 21 3.494 -0.632 3.139
142 2HB CYS 21 1HB CYS 21 2.639 0.742 2.466
143 H THR 22 H THR 22 2.808 3.421 3.851
144 HA THR 22 HA THR 22 1.279 3.436 6.291
145 HB THR 22 HB THR 22 0.890 5.350 4.092
146 HG1 THR 22 1HG THR 22 3.316 5.096 5.580
147 1HG2 THR 22 1HG2 THR 22 -0.209 5.911 6.131
148 2HG2 THR 22 2HG2 THR 22 1.191 6.978 6.031
149 3HG2 THR 22 3HG2 THR 22 1.234 5.564 7.084
150 H CYS 23 H CYS 23 0.606 1.870 3.589
151 HA CYS 23 HA CYS 23 -1.705 2.567 2.408
152 1HB CYS 23 2HB CYS 23 -0.916 0.519 1.657
153 2HB CYS 23 1HB CYS 23 -0.747 -0.133 3.286
154 H ASP 24 H ASP 24 -3.805 2.900 3.002
155 HA ASP 24 HA ASP 24 -4.549 2.278 5.770
156 1HB ASP 24 2HB ASP 24 -4.599 4.621 5.345
157 2HB ASP 24 1HB ASP 24 -5.506 4.402 3.856
158 H ASP 25 H ASP 25 -6.338 2.655 2.700
159 HA ASP 25 HA ASP 25 -7.950 1.451 1.679
160 1HB ASP 25 2HB ASP 25 -6.698 -0.642 2.065
161 2HB ASP 25 1HB ASP 25 -7.396 -0.751 3.681
162 H ARG 26 H ARG 26 -9.993 1.388 1.668
163 HA ARG 26 HA ARG 26 -11.558 1.399 4.139
164 1HB ARG 26 2HB ARG 26 -11.403 3.808 2.311
165 2HB ARG 26 1HB ARG 26 -12.609 3.575 3.537
166 1HG ARG 26 2HG ARG 26 -9.673 3.834 4.045
167 2HG ARG 26 1HG ARG 26 -10.861 5.122 4.236
168 1HD ARG 26 2HD ARG 26 -11.765 4.189 6.133
169 2HD ARG 26 1HD ARG 26 -11.271 2.551 5.692
170 HE ARG 26 HE ARG 26 -8.948 4.036 6.078
171 1HH1 ARG 26 1HH1 ARG 26 -11.657 2.913 7.999
172 2HH1 ARG 26 2HH1 ARG 26 -10.732 2.784 9.455
173 1HH2 ARG 26 1HH2 ARG 26 -7.724 3.866 7.952
174 2HH2 ARG 26 2HH2 ARG 26 -8.474 3.329 9.432
175 H SER 27 H SER 27 -11.433 2.135 0.768
176 HA SER 27 HA SER 27 -13.489 0.264 0.050
177 1HB SER 27 2HB SER 27 -14.803 2.337 0.510
178 2HB SER 27 1HB SER 27 -13.753 3.228 -0.590
179 HG SER 27 HG SER 27 -14.467 1.629 -2.210
180 H ASP 28 H ASP 28 -11.021 -0.024 -0.161
181 HA ASP 28 HA ASP 28 -9.504 -0.733 -1.628
182 1HB ASP 28 2HB ASP 28 -11.167 0.771 -3.644
183 2HB ASP 28 1HB ASP 28 -9.588 0.143 -4.062
184 H GLY 29 H GLY 29 -8.083 0.337 -0.326
185 1HA GLY 29 2HA GLY 29 -7.487 3.127 -0.797
186 2HA GLY 29 1HA GLY 29 -6.657 2.070 0.325
187 H LEU 30 H LEU 30 -4.612 2.436 -0.149
188 HA LEU 30 HA LEU 30 -3.449 1.257 -2.441
189 1HB LEU 30 2HB LEU 30 -4.514 3.373 -3.329
190 2HB LEU 30 1HB LEU 30 -3.402 4.269 -2.326
191 HG LEU 30 HG LEU 30 -2.854 4.031 -4.813
192 1HD1 LEU 30 1HD1 LEU 30 -0.854 3.290 -2.700
193 2HD1 LEU 30 2HD1 LEU 30 -1.202 4.893 -3.349
194 3HD1 LEU 30 3HD1 LEU 30 -0.426 3.679 -4.366
195 1HD2 LEU 30 1HD2 LEU 30 -1.482 1.888 -5.212
196 2HD2 LEU 30 2HD2 LEU 30 -3.241 1.802 -5.319
197 3HD2 LEU 30 3HD2 LEU 30 -2.417 1.226 -3.871
198 H CYS 31 H CYS 31 -1.398 0.717 -1.882
199 HA CYS 31 HA CYS 31 -0.404 1.331 0.697
200 1HB CYS 31 2HB CYS 31 1.275 0.213 -1.517
201 2HB CYS 31 1HB CYS 31 1.388 -0.115 0.200
202 H LYS 32 H LYS 32 1.049 2.810 1.393
203 HA LYS 32 HA LYS 32 2.394 4.470 -0.632
204 1HB LYS 32 2HB LYS 32 0.438 5.389 0.940
205 2HB LYS 32 1HB LYS 32 1.780 5.633 2.038
206 1HG LYS 32 2HG LYS 32 1.213 7.615 0.647
207 2HG LYS 32 1HG LYS 32 2.878 7.061 0.441
208 1HD LYS 32 2HD LYS 32 1.845 7.592 -1.733
209 2HD LYS 32 1HD LYS 32 2.253 5.887 -1.599
210 1HE LYS 32 2HE LYS 32 0.092 6.152 -2.632
211 2HE LYS 32 1HE LYS 32 -0.068 5.366 -1.069
212 1HZ LYS 32 1HZ LYS 32 -1.425 6.966 -0.390
213 2HZ LYS 32 2HZ LYS 32 -1.384 7.643 -1.940
214 3HZ LYS 32 3HZ LYS 32 -0.292 8.168 -0.759
215 H ARG 33 H ARG 33 4.568 4.559 -0.435
216 HA ARG 33 HA ARG 33 5.810 2.821 1.464
217 1HB ARG 33 2HB ARG 33 6.371 3.455 -1.051
218 2HB ARG 33 1HB ARG 33 7.414 4.634 -0.272
219 1HG ARG 33 2HG ARG 33 8.787 3.022 0.636
220 2HG ARG 33 1HG ARG 33 7.541 1.773 0.563
221 1HD ARG 33 2HD ARG 33 9.163 1.271 -1.110
222 2HD ARG 33 1HD ARG 33 7.715 1.853 -1.925
223 HE ARG 33 HE ARG 33 9.556 3.987 -1.467
224 1HH1 ARG 33 1HH1 ARG 33 8.865 1.261 -3.568
225 2HH1 ARG 33 2HH1 ARG 33 9.842 1.851 -4.867
226 1HH2 ARG 33 1HH2 ARG 33 10.876 4.756 -3.158
227 2HH2 ARG 33 2HH2 ARG 33 10.986 3.844 -4.637
228 H ASN 34 H ASN 34 8.313 4.153 1.728
229 HA ASN 34 HA ASN 34 7.845 6.486 3.408
230 1HB ASN 34 2HB ASN 34 9.012 3.913 4.356
231 2HB ASN 34 1HB ASN 34 9.378 5.410 5.157
232 1HD2 ASN 34 1HD2 ASN 34 7.692 2.784 5.525
233 2HD2 ASN 34 2HD2 ASN 34 6.252 3.371 6.279
234 H GLY 35 H GLY 35 9.860 7.638 3.842
235 1HA GLY 35 2HA GLY 35 12.079 8.263 3.337
236 2HA GLY 35 1HA GLY 35 12.224 6.825 2.316
237 H ASP 36 H ASP 36 10.015 6.993 0.893
238 HA ASP 36 HA ASP 36 9.805 9.526 -0.505
239 1HB ASP 36 2HB ASP 36 9.904 8.240 -2.708
240 2HB ASP 36 1HB ASP 36 11.448 8.461 -1.894
241 HA PRO 37 HA PRO 37 6.069 6.688 0.799
242 1HB PRO 37 2HB PRO 37 5.440 9.515 1.667
243 2HB PRO 37 1HB PRO 37 4.812 7.991 2.336
244 1HG PRO 37 2HG PRO 37 6.850 8.905 3.610
245 2HG PRO 37 1HG PRO 37 7.037 7.284 2.943
246 1HD PRO 37 2HD PRO 37 7.970 9.875 1.719
247 2HD PRO 37 1HD PRO 37 8.923 8.415 2.080
Start of MODEL 16
1 H THR 1 H THR 1 5.326 6.022 -1.234
2 HA THR 1 HA THR 1 2.980 7.189 -2.406
3 HB THR 1 HB THR 1 5.012 8.433 -3.365
4 HG1 THR 1 1HG THR 1 4.184 8.180 -5.525
5 1HG2 THR 1 1HG2 THR 1 6.570 6.563 -3.477
6 2HG2 THR 1 2HG2 THR 1 6.303 7.237 -5.084
7 3HG2 THR 1 3HG2 THR 1 5.513 5.730 -4.617
8 H PHE 2 H PHE 2 2.491 5.709 -4.334
9 HA PHE 2 HA PHE 2 1.826 3.268 -3.649
10 1HB PHE 2 2HB PHE 2 1.209 4.149 -5.775
11 2HB PHE 2 1HB PHE 2 2.878 4.206 -6.315
12 HD1 PHE 2 1HD PHE 2 3.182 2.809 -8.085
13 HD2 PHE 2 2HD PHE 2 0.750 1.498 -4.850
14 HE1 PHE 2 1HE PHE 2 2.885 0.636 -9.196
15 HE2 PHE 2 2HE PHE 2 0.453 -0.680 -5.953
16 HZ PHE 2 HZ PHE 2 1.521 -1.113 -8.129
17 H CYS 3 H CYS 3 3.035 1.992 -2.394
18 HA CYS 3 HA CYS 3 5.738 1.488 -2.410
19 1HB CYS 3 2HB CYS 3 3.692 -0.642 -1.771
20 2HB CYS 3 1HB CYS 3 5.312 -0.487 -1.138
21 H GLY 4 H GLY 4 3.359 -0.835 -3.654
22 1HA GLY 4 2HA GLY 4 4.539 -1.296 -6.154
23 2HA GLY 4 1HA GLY 4 5.193 -2.465 -5.007
24 H GLU 5 H GLU 5 3.074 -2.879 -3.373
25 HA GLU 5 HA GLU 5 1.312 -4.477 -5.042
26 1HB GLU 5 2HB GLU 5 1.503 -4.150 -2.041
27 2HB GLU 5 1HB GLU 5 0.423 -5.267 -2.858
28 1HG GLU 5 2HG GLU 5 2.154 -6.654 -3.520
29 2HG GLU 5 1HG GLU 5 3.372 -5.392 -3.309
30 H THR 6 H THR 6 -1.095 -4.416 -4.235
31 HA THR 6 HA THR 6 -1.847 -1.620 -3.752
32 HB THR 6 HB THR 6 -3.830 -1.969 -5.216
33 HG1 THR 6 1HG THR 6 -3.384 -4.397 -5.176
34 1HG2 THR 6 1HG2 THR 6 -1.212 -2.281 -6.685
35 2HG2 THR 6 2HG2 THR 6 -1.778 -0.769 -5.973
36 3HG2 THR 6 3HG2 THR 6 -2.687 -1.520 -7.284
37 H CYS 7 H CYS 7 -2.751 -1.601 -1.814
38 HA CYS 7 HA CYS 7 -4.239 -3.888 -0.849
39 1HB CYS 7 2HB CYS 7 -4.613 -2.327 1.186
40 2HB CYS 7 1HB CYS 7 -2.996 -2.978 0.938
41 H ARG 8 H ARG 8 -5.475 -3.302 -2.942
42 HA ARG 8 HA ARG 8 -7.524 -1.292 -2.563
43 1HB ARG 8 2HB ARG 8 -6.779 -3.099 -4.846
44 2HB ARG 8 1HB ARG 8 -8.242 -2.112 -4.870
45 1HG ARG 8 2HG ARG 8 -6.636 -0.236 -4.196
46 2HG ARG 8 1HG ARG 8 -5.391 -1.271 -4.900
47 1HD ARG 8 2HD ARG 8 -6.066 0.120 -6.668
48 2HD ARG 8 1HD ARG 8 -6.942 -1.386 -6.941
49 HE ARG 8 HE ARG 8 -8.527 0.305 -5.350
50 1HH1 ARG 8 1HH1 ARG 8 -7.335 0.082 -8.645
51 2HH1 ARG 8 2HH1 ARG 8 -8.642 0.998 -9.311
52 1HH2 ARG 8 1HH2 ARG 8 -10.220 1.513 -6.192
53 2HH2 ARG 8 2HH2 ARG 8 -10.302 1.821 -7.908
54 H VAL 9 H VAL 9 -8.065 -4.406 -4.079
55 HA VAL 9 HA VAL 9 -10.475 -4.581 -2.542
56 HB VAL 9 HB VAL 9 -10.612 -5.064 -4.941
57 1HG1 VAL 9 1HG1 VAL 9 -9.662 -7.201 -5.815
58 2HG1 VAL 9 2HG1 VAL 9 -8.741 -7.337 -4.317
59 3HG1 VAL 9 3HG1 VAL 9 -8.460 -5.978 -5.406
60 1HG2 VAL 9 1HG2 VAL 9 -11.846 -7.186 -4.835
61 2HG2 VAL 9 2HG2 VAL 9 -12.247 -6.114 -3.492
62 3HG2 VAL 9 3HG2 VAL 9 -11.169 -7.486 -3.234
63 H ILE 10 H ILE 10 -7.380 -6.002 -2.774
64 HA ILE 10 HA ILE 10 -7.897 -7.680 -0.428
65 HB ILE 10 HB ILE 10 -6.025 -9.182 -1.332
66 1HG1 ILE 10 2HG1 ILE 10 -6.834 -7.866 -3.938
67 2HG1 ILE 10 1HG1 ILE 10 -5.285 -7.647 -3.133
68 1HG2 ILE 10 1HG2 ILE 10 -8.232 -10.034 -1.205
69 2HG2 ILE 10 2HG2 ILE 10 -7.629 -10.437 -2.813
70 3HG2 ILE 10 3HG2 ILE 10 -8.751 -9.091 -2.603
71 1HD1 ILE 10 1HD1 ILE 10 -6.108 -10.418 -3.769
72 2HD1 ILE 10 2HD1 ILE 10 -4.508 -9.676 -3.779
73 3HD1 ILE 10 3HD1 ILE 10 -5.630 -9.373 -5.107
74 HA PRO 11 HA PRO 11 -4.872 -4.319 0.346
75 1HB PRO 11 2HB PRO 11 -5.951 -4.717 3.078
76 2HB PRO 11 1HB PRO 11 -5.702 -3.225 2.162
77 1HG PRO 11 2HG PRO 11 -8.129 -4.157 2.468
78 2HG PRO 11 1HG PRO 11 -7.625 -3.545 0.883
79 1HD PRO 11 2HD PRO 11 -7.792 -6.399 1.823
80 2HD PRO 11 1HD PRO 11 -8.387 -5.687 0.304
81 H VAL 12 H VAL 12 -4.108 -4.343 3.127
82 HA VAL 12 HA VAL 12 -2.225 -4.782 4.204
83 HB VAL 12 HB VAL 12 -1.940 -7.166 5.012
84 1HG1 VAL 12 1HG1 VAL 12 -4.630 -6.737 5.840
85 2HG1 VAL 12 2HG1 VAL 12 -3.843 -5.171 5.646
86 3HG1 VAL 12 3HG1 VAL 12 -3.135 -6.388 6.708
87 1HG2 VAL 12 1HG2 VAL 12 -2.924 -8.566 3.442
88 2HG2 VAL 12 2HG2 VAL 12 -4.347 -7.538 3.267
89 3HG2 VAL 12 3HG2 VAL 12 -4.133 -8.508 4.725
90 H CYS 13 H CYS 13 -1.041 -4.090 2.377
91 HA CYS 13 HA CYS 13 0.217 -5.700 0.483
92 1HB CYS 13 2HB CYS 13 1.739 -3.444 1.708
93 2HB CYS 13 1HB CYS 13 1.434 -3.793 0.008
94 H THR 14 H THR 14 1.284 -7.566 1.101
95 HA THR 14 HA THR 14 2.672 -7.713 3.599
96 HB THR 14 HB THR 14 1.492 -9.666 2.868
97 HG1 THR 14 1HG THR 14 4.198 -9.694 3.350
98 1HG2 THR 14 1HG2 THR 14 1.862 -9.221 0.388
99 2HG2 THR 14 2HG2 THR 14 1.942 -10.902 0.913
100 3HG2 THR 14 3HG2 THR 14 3.428 -10.010 0.591
101 H TYR 15 H TYR 15 3.741 -7.393 0.233
102 HA TYR 15 HA TYR 15 6.512 -7.820 0.944
103 1HB TYR 15 2HB TYR 15 5.691 -8.416 -1.301
104 2HB TYR 15 1HB TYR 15 5.284 -6.731 -1.603
105 HD1 TYR 15 1HD TYR 15 6.694 -5.856 -3.197
106 HD2 TYR 15 2HD TYR 15 8.327 -8.414 -0.215
107 HE1 TYR 15 1HE TYR 15 8.944 -5.470 -4.107
108 HE2 TYR 15 2HE TYR 15 10.583 -8.033 -1.116
109 HH TYR 15 HH TYR 15 11.244 -5.599 -3.448
110 H SER 16 H SER 16 4.419 -5.139 0.136
111 HA SER 16 HA SER 16 6.339 -3.062 0.294
112 1HB SER 16 2HB SER 16 3.367 -2.856 0.813
113 2HB SER 16 1HB SER 16 4.446 -1.592 0.235
114 HG SER 16 HG SER 16 3.658 -3.965 -1.122
115 H ALA 17 H ALA 17 4.627 -4.892 2.654
116 HA ALA 17 HA ALA 17 4.659 -3.097 4.810
117 1HB ALA 17 1HB ALA 17 3.692 -4.780 5.904
118 2HB ALA 17 2HB ALA 17 5.070 -5.849 5.642
119 3HB ALA 17 3HB ALA 17 3.817 -5.707 4.408
120 H ALA 18 H ALA 18 7.282 -4.681 3.259
121 HA ALA 18 HA ALA 18 9.085 -5.074 5.378
122 1HB ALA 18 1HB ALA 18 10.561 -5.581 3.758
123 2HB ALA 18 2HB ALA 18 10.304 -4.054 2.915
124 3HB ALA 18 3HB ALA 18 9.193 -5.399 2.661
125 H LEU 19 H LEU 19 8.348 -2.261 3.415
126 HA LEU 19 HA LEU 19 10.153 -0.503 4.841
127 1HB LEU 19 2HB LEU 19 8.327 -0.304 2.527
128 2HB LEU 19 1HB LEU 19 8.528 1.158 3.458
129 HG LEU 19 HG LEU 19 10.866 1.222 3.010
130 1HD1 LEU 19 1HD1 LEU 19 10.986 -1.064 1.178
131 2HD1 LEU 19 2HD1 LEU 19 10.756 -1.512 2.868
132 3HD1 LEU 19 3HD1 LEU 19 12.141 -0.527 2.397
133 1HD2 LEU 19 1HD2 LEU 19 9.200 0.620 0.580
134 2HD2 LEU 19 2HD2 LEU 19 10.850 1.237 0.490
135 3HD2 LEU 19 3HD2 LEU 19 9.592 2.193 1.274
136 H GLY 20 H GLY 20 7.106 -1.752 5.238
137 1HA GLY 20 2HA GLY 20 5.852 -1.396 7.256
138 2HA GLY 20 1HA GLY 20 6.416 0.273 7.254
139 H CYS 21 H CYS 21 6.033 1.215 4.925
140 HA CYS 21 HA CYS 21 4.601 2.178 3.526
141 1HB CYS 21 2HB CYS 21 3.727 -0.668 3.528
142 2HB CYS 21 1HB CYS 21 2.717 0.487 2.687
143 H THR 22 H THR 22 2.980 3.533 3.563
144 HA THR 22 HA THR 22 1.501 3.854 6.029
145 HB THR 22 HB THR 22 1.269 5.529 3.578
146 HG1 THR 22 1HG THR 22 3.506 5.180 5.225
147 1HG2 THR 22 1HG2 THR 22 -0.082 5.956 5.709
148 2HG2 THR 22 2HG2 THR 22 0.816 7.326 5.056
149 3HG2 THR 22 3HG2 THR 22 1.445 6.441 6.446
150 H CYS 23 H CYS 23 0.918 2.120 3.350
151 HA CYS 23 HA CYS 23 -1.375 2.577 2.096
152 1HB CYS 23 2HB CYS 23 -0.587 0.458 1.610
153 2HB CYS 23 1HB CYS 23 -0.387 0.024 3.307
154 H ASP 24 H ASP 24 -3.430 3.101 2.612
155 HA ASP 24 HA ASP 24 -4.229 3.090 5.392
156 1HB ASP 24 2HB ASP 24 -4.532 5.080 3.950
157 2HB ASP 24 1HB ASP 24 -5.663 4.169 2.958
158 H ASP 25 H ASP 25 -6.252 2.509 2.581
159 HA ASP 25 HA ASP 25 -7.797 0.965 2.024
160 1HB ASP 25 2HB ASP 25 -6.413 -0.948 2.432
161 2HB ASP 25 1HB ASP 25 -6.520 -0.728 4.180
162 H ARG 26 H ARG 26 -9.685 1.294 2.234
163 HA ARG 26 HA ARG 26 -11.286 0.984 4.516
164 1HB ARG 26 2HB ARG 26 -10.146 3.690 4.055
165 2HB ARG 26 1HB ARG 26 -11.853 3.601 4.393
166 1HG ARG 26 2HG ARG 26 -11.359 2.389 6.482
167 2HG ARG 26 1HG ARG 26 -9.638 2.554 6.132
168 1HD ARG 26 2HD ARG 26 -11.413 4.960 6.266
169 2HD ARG 26 1HD ARG 26 -10.773 4.234 7.738
170 HE ARG 26 HE ARG 26 -8.646 4.629 5.943
171 1HH1 ARG 26 1HH1 ARG 26 -10.928 6.550 7.787
172 2HH1 ARG 26 2HH1 ARG 26 -9.813 7.842 8.065
173 1HH2 ARG 26 1HH2 ARG 26 -7.160 6.283 6.343
174 2HH2 ARG 26 2HH2 ARG 26 -7.656 7.698 7.233
175 H SER 27 H SER 27 -12.022 -0.192 2.697
176 HA SER 27 HA SER 27 -13.633 -0.591 1.150
177 1HB SER 27 2HB SER 27 -14.273 2.374 1.202
178 2HB SER 27 1HB SER 27 -15.283 1.076 0.579
179 HG SER 27 HG SER 27 -14.908 1.931 3.161
180 H ASP 28 H ASP 28 -11.023 -0.261 0.676
181 HA ASP 28 HA ASP 28 -9.723 -0.466 -1.159
182 1HB ASP 28 2HB ASP 28 -11.514 -0.530 -2.753
183 2HB ASP 28 1HB ASP 28 -11.817 1.192 -2.565
184 H GLY 29 H GLY 29 -7.901 0.547 -1.731
185 1HA GLY 29 2HA GLY 29 -7.608 3.410 -1.550
186 2HA GLY 29 1HA GLY 29 -6.833 2.543 -0.236
187 H LEU 30 H LEU 30 -4.725 2.500 -0.577
188 HA LEU 30 HA LEU 30 -3.589 1.156 -2.808
189 1HB LEU 30 2HB LEU 30 -4.364 3.446 -3.682
190 2HB LEU 30 1HB LEU 30 -3.087 4.119 -2.711
191 HG LEU 30 HG LEU 30 -2.624 3.802 -5.193
192 1HD1 LEU 30 1HD1 LEU 30 -0.814 2.680 -3.087
193 2HD1 LEU 30 2HD1 LEU 30 -0.774 4.273 -3.842
194 3HD1 LEU 30 3HD1 LEU 30 -0.321 2.844 -4.772
195 1HD2 LEU 30 1HD2 LEU 30 -1.849 1.515 -5.815
196 2HD2 LEU 30 2HD2 LEU 30 -3.589 1.655 -5.559
197 3HD2 LEU 30 3HD2 LEU 30 -2.570 0.924 -4.318
198 H CYS 31 H CYS 31 -1.498 0.515 -2.288
199 HA CYS 31 HA CYS 31 -0.547 0.991 0.361
200 1HB CYS 31 2HB CYS 31 1.005 -0.209 -1.929
201 2HB CYS 31 1HB CYS 31 1.339 -0.410 -0.222
202 H LYS 32 H LYS 32 0.689 2.638 1.062
203 HA LYS 32 HA LYS 32 2.259 4.113 -0.947
204 1HB LYS 32 2HB LYS 32 0.371 5.028 1.039
205 2HB LYS 32 1HB LYS 32 1.938 5.768 1.301
206 1HG LYS 32 2HG LYS 32 0.489 7.105 -0.176
207 2HG LYS 32 1HG LYS 32 1.971 6.581 -0.984
208 1HD LYS 32 2HD LYS 32 0.651 4.634 -1.888
209 2HD LYS 32 1HD LYS 32 -0.802 5.436 -1.285
210 1HE LYS 32 2HE LYS 32 1.105 6.327 -3.420
211 2HE LYS 32 1HE LYS 32 -0.613 5.989 -3.565
212 1HZ LYS 32 1HZ LYS 32 0.597 8.447 -3.040
213 2HZ LYS 32 2HZ LYS 32 -0.249 8.010 -1.642
214 3HZ LYS 32 3HZ LYS 32 -1.059 8.103 -3.125
215 H ARG 33 H ARG 33 4.403 4.513 -0.477
216 HA ARG 33 HA ARG 33 5.661 2.699 1.318
217 1HB ARG 33 2HB ARG 33 6.537 4.705 -0.695
218 2HB ARG 33 1HB ARG 33 7.725 4.157 0.474
219 1HG ARG 33 2HG ARG 33 7.588 1.931 -0.276
220 2HG ARG 33 1HG ARG 33 6.105 2.247 -1.177
221 1HD ARG 33 2HD ARG 33 8.105 2.048 -2.624
222 2HD ARG 33 1HD ARG 33 7.297 3.607 -2.765
223 HE ARG 33 HE ARG 33 9.761 3.189 -1.194
224 1HH1 ARG 33 1HH1 ARG 33 7.808 5.069 -3.397
225 2HH1 ARG 33 2HH1 ARG 33 8.906 6.423 -3.438
226 1HH2 ARG 33 1HH2 ARG 33 11.247 4.964 -1.296
227 2HH2 ARG 33 2HH2 ARG 33 10.849 6.341 -2.275
228 H ASN 34 H ASN 34 7.970 4.473 1.810
229 HA ASN 34 HA ASN 34 7.090 6.387 3.812
230 1HB ASN 34 2HB ASN 34 8.536 3.870 4.435
231 2HB ASN 34 1HB ASN 34 8.807 5.268 5.431
232 1HD2 ASN 34 1HD2 ASN 34 7.492 2.529 5.720
233 2HD2 ASN 34 2HD2 ASN 34 5.979 2.877 6.474
234 H GLY 35 H GLY 35 8.807 7.850 4.391
235 1HA GLY 35 2HA GLY 35 10.876 8.928 4.100
236 2HA GLY 35 1HA GLY 35 11.405 7.580 3.085
237 H ASP 36 H ASP 36 9.319 7.427 1.443
238 HA ASP 36 HA ASP 36 8.791 9.905 0.059
239 1HB ASP 36 2HB ASP 36 10.835 9.244 -1.065
240 2HB ASP 36 1HB ASP 36 10.310 7.570 -1.153
241 HA PRO 37 HA PRO 37 5.655 6.391 0.835
242 1HB PRO 37 2HB PRO 37 4.277 8.843 1.913
243 2HB PRO 37 1HB PRO 37 4.177 7.161 2.483
244 1HG PRO 37 2HG PRO 37 5.803 8.619 3.833
245 2HG PRO 37 1HG PRO 37 6.502 7.177 3.099
246 1HD PRO 37 2HD PRO 37 6.501 9.957 1.920
247 2HD PRO 37 1HD PRO 37 7.914 8.957 2.352
Start of MODEL 17
1 H THR 1 H THR 1 5.584 7.200 -1.010
2 HA THR 1 HA THR 1 3.223 8.860 -1.256
3 HB THR 1 HB THR 1 5.474 9.440 -3.160
4 HG1 THR 1 1HG THR 1 6.574 10.384 -1.622
5 1HG2 THR 1 1HG2 THR 1 3.263 11.203 -2.106
6 2HG2 THR 1 2HG2 THR 1 3.130 10.220 -3.565
7 3HG2 THR 1 3HG2 THR 1 4.319 11.520 -3.481
8 H PHE 2 H PHE 2 2.996 6.387 -1.434
9 HA PHE 2 HA PHE 2 2.032 4.808 -2.740
10 1HB PHE 2 2HB PHE 2 1.289 6.052 -4.516
11 2HB PHE 2 1HB PHE 2 2.876 6.695 -4.883
12 HD1 PHE 2 1HD PHE 2 1.407 3.249 -4.734
13 HD2 PHE 2 2HD PHE 2 3.537 6.152 -7.005
14 HE1 PHE 2 1HE PHE 2 1.609 1.647 -6.590
15 HE2 PHE 2 2HE PHE 2 3.740 4.553 -8.864
16 HZ PHE 2 HZ PHE 2 2.775 2.298 -8.658
17 H CYS 3 H CYS 3 3.179 3.215 -1.961
18 HA CYS 3 HA CYS 3 5.924 2.653 -2.372
19 1HB CYS 3 2HB CYS 3 4.144 1.752 -0.610
20 2HB CYS 3 1HB CYS 3 3.966 0.467 -1.783
21 H GLY 4 H GLY 4 3.101 0.808 -3.431
22 1HA GLY 4 2HA GLY 4 3.638 0.691 -6.134
23 2HA GLY 4 1HA GLY 4 4.500 -0.659 -5.414
24 H GLU 5 H GLU 5 2.805 -1.464 -3.460
25 HA GLU 5 HA GLU 5 0.853 -2.927 -4.912
26 1HB GLU 5 2HB GLU 5 1.785 -2.802 -2.105
27 2HB GLU 5 1HB GLU 5 0.162 -3.425 -2.368
28 1HG GLU 5 2HG GLU 5 2.600 -4.479 -3.771
29 2HG GLU 5 1HG GLU 5 1.956 -5.152 -2.270
30 H THR 6 H THR 6 -1.359 -3.197 -3.759
31 HA THR 6 HA THR 6 -2.580 -0.619 -3.104
32 HB THR 6 HB THR 6 -4.547 -1.322 -4.603
33 HG1 THR 6 1HG THR 6 -2.812 -2.628 -6.303
34 1HG2 THR 6 1HG2 THR 6 -2.708 0.461 -5.074
35 2HG2 THR 6 2HG2 THR 6 -3.763 -0.061 -6.388
36 3HG2 THR 6 3HG2 THR 6 -2.127 -0.710 -6.258
37 H CYS 7 H CYS 7 -3.952 -0.868 -1.388
38 HA CYS 7 HA CYS 7 -4.394 -3.541 -0.394
39 1HB CYS 7 2HB CYS 7 -5.721 -2.131 1.400
40 2HB CYS 7 1HB CYS 7 -3.959 -2.197 1.431
41 H ARG 8 H ARG 8 -5.535 -3.830 -2.525
42 HA ARG 8 HA ARG 8 -8.110 -2.833 -3.018
43 1HB ARG 8 2HB ARG 8 -8.209 -4.894 -4.562
44 2HB ARG 8 1HB ARG 8 -6.996 -3.691 -4.858
45 1HG ARG 8 2HG ARG 8 -5.443 -5.158 -3.435
46 2HG ARG 8 1HG ARG 8 -6.651 -6.413 -3.702
47 1HD ARG 8 2HD ARG 8 -6.406 -6.144 -6.121
48 2HD ARG 8 1HD ARG 8 -5.209 -4.875 -5.862
49 HE ARG 8 HE ARG 8 -4.802 -7.720 -5.678
50 1HH1 ARG 8 1HH1 ARG 8 -3.533 -4.569 -4.783
51 2HH1 ARG 8 2HH1 ARG 8 -1.958 -5.198 -4.372
52 1HH2 ARG 8 1HH2 ARG 8 -2.692 -8.499 -5.164
53 2HH2 ARG 8 2HH2 ARG 8 -1.484 -7.379 -4.616
54 H VAL 9 H VAL 9 -8.548 -6.029 -3.445
55 HA VAL 9 HA VAL 9 -10.533 -6.155 -1.318
56 HB VAL 9 HB VAL 9 -9.999 -8.379 -3.276
57 1HG1 VAL 9 1HG1 VAL 9 -12.374 -8.808 -3.033
58 2HG1 VAL 9 2HG1 VAL 9 -12.549 -7.383 -2.009
59 3HG1 VAL 9 3HG1 VAL 9 -11.600 -8.760 -1.449
60 1HG2 VAL 9 1HG2 VAL 9 -11.971 -6.283 -4.001
61 2HG2 VAL 9 2HG2 VAL 9 -11.013 -7.343 -5.033
62 3HG2 VAL 9 3HG2 VAL 9 -10.264 -5.937 -4.276
63 H ILE 10 H ILE 10 -7.714 -6.209 -0.823
64 HA ILE 10 HA ILE 10 -7.525 -8.118 1.239
65 HB ILE 10 HB ILE 10 -5.276 -9.055 0.208
66 1HG1 ILE 10 2HG1 ILE 10 -6.950 -8.643 -2.279
67 2HG1 ILE 10 1HG1 ILE 10 -5.457 -7.793 -1.900
68 1HG2 ILE 10 1HG2 ILE 10 -7.214 -10.379 0.999
69 2HG2 ILE 10 2HG2 ILE 10 -6.363 -11.105 -0.364
70 3HG2 ILE 10 3HG2 ILE 10 -7.897 -10.275 -0.623
71 1HD1 ILE 10 1HD1 ILE 10 -4.648 -10.373 -1.727
72 2HD1 ILE 10 2HD1 ILE 10 -4.518 -9.371 -3.172
73 3HD1 ILE 10 3HD1 ILE 10 -5.879 -10.477 -2.985
74 HA PRO 11 HA PRO 11 -5.251 -4.023 1.187
75 1HB PRO 11 2HB PRO 11 -6.261 -4.137 3.988
76 2HB PRO 11 1HB PRO 11 -6.173 -2.767 2.869
77 1HG PRO 11 2HG PRO 11 -8.480 -3.881 3.271
78 2HG PRO 11 1HG PRO 11 -7.986 -3.540 1.602
79 1HD PRO 11 2HD PRO 11 -7.877 -6.172 3.072
80 2HD PRO 11 1HD PRO 11 -8.492 -5.831 1.438
81 H VAL 12 H VAL 12 -4.332 -3.297 3.747
82 HA VAL 12 HA VAL 12 -2.313 -3.243 4.695
83 HB VAL 12 HB VAL 12 -1.759 -5.256 6.129
84 1HG1 VAL 12 1HG1 VAL 12 -2.836 -3.717 7.384
85 2HG1 VAL 12 2HG1 VAL 12 -4.113 -4.933 7.371
86 3HG1 VAL 12 3HG1 VAL 12 -4.180 -3.572 6.251
87 1HG2 VAL 12 1HG2 VAL 12 -4.488 -6.321 5.663
88 2HG2 VAL 12 2HG2 VAL 12 -3.022 -7.145 6.198
89 3HG2 VAL 12 3HG2 VAL 12 -3.239 -6.749 4.492
90 H CYS 13 H CYS 13 -1.545 -3.152 2.483
91 HA CYS 13 HA CYS 13 -0.445 -4.768 0.754
92 1HB CYS 13 2HB CYS 13 1.449 -2.732 1.827
93 2HB CYS 13 1HB CYS 13 0.963 -3.045 0.163
94 H THR 14 H THR 14 0.082 -6.822 1.645
95 HA THR 14 HA THR 14 2.145 -7.117 3.600
96 HB THR 14 HB THR 14 1.077 -9.313 1.840
97 HG1 THR 14 1HG THR 14 -0.279 -7.702 3.602
98 1HG2 THR 14 1HG2 THR 14 2.971 -9.704 3.492
99 2HG2 THR 14 2HG2 THR 14 1.555 -10.740 3.671
100 3HG2 THR 14 3HG2 THR 14 1.796 -9.379 4.766
101 H TYR 15 H TYR 15 2.103 -7.054 0.114
102 HA TYR 15 HA TYR 15 4.546 -8.468 -0.263
103 1HB TYR 15 2HB TYR 15 2.862 -8.196 -2.060
104 2HB TYR 15 1HB TYR 15 3.194 -6.468 -2.092
105 HD1 TYR 15 1HD TYR 15 5.419 -9.469 -1.991
106 HD2 TYR 15 2HD TYR 15 4.277 -5.935 -4.062
107 HE1 TYR 15 1HE TYR 15 7.219 -9.853 -3.625
108 HE2 TYR 15 2HE TYR 15 6.069 -6.308 -5.701
109 HH TYR 15 HH TYR 15 8.431 -7.634 -5.576
110 H SER 16 H SER 16 3.653 -5.071 -0.174
111 HA SER 16 HA SER 16 6.454 -4.247 -0.196
112 1HB SER 16 2HB SER 16 5.411 -1.938 -0.260
113 2HB SER 16 1HB SER 16 5.003 -2.977 -1.610
114 HG SER 16 HG SER 16 2.995 -2.871 -1.058
115 H ALA 17 H ALA 17 4.622 -5.511 2.076
116 HA ALA 17 HA ALA 17 4.679 -3.650 4.203
117 1HB ALA 17 1HB ALA 17 3.168 -5.396 4.504
118 2HB ALA 17 2HB ALA 17 4.468 -5.785 5.630
119 3HB ALA 17 3HB ALA 17 4.357 -6.629 4.087
120 H ALA 18 H ALA 18 7.101 -5.768 2.897
121 HA ALA 18 HA ALA 18 8.780 -6.149 5.081
122 1HB ALA 18 1HB ALA 18 9.606 -5.701 2.213
123 2HB ALA 18 2HB ALA 18 9.098 -7.241 2.904
124 3HB ALA 18 3HB ALA 18 10.578 -6.465 3.470
125 H LEU 19 H LEU 19 8.392 -3.410 2.964
126 HA LEU 19 HA LEU 19 10.575 -1.890 4.034
127 1HB LEU 19 2HB LEU 19 8.455 -1.517 2.015
128 2HB LEU 19 1HB LEU 19 9.049 -0.060 2.768
129 HG LEU 19 HG LEU 19 11.323 -0.617 2.059
130 1HD1 LEU 19 1HD1 LEU 19 10.776 -2.575 0.067
131 2HD1 LEU 19 2HD1 LEU 19 10.207 -3.188 1.620
132 3HD1 LEU 19 3HD1 LEU 19 11.885 -2.675 1.435
133 1HD2 LEU 19 1HD2 LEU 19 9.329 0.441 0.565
134 2HD2 LEU 19 2HD2 LEU 19 9.884 -0.861 -0.488
135 3HD2 LEU 19 3HD2 LEU 19 11.019 0.369 0.066
136 H GLY 20 H GLY 20 7.315 -2.430 4.890
137 1HA GLY 20 2HA GLY 20 6.367 -1.766 6.960
138 2HA GLY 20 1HA GLY 20 7.513 -0.426 7.024
139 H CYS 21 H CYS 21 6.218 -1.000 4.024
140 HA CYS 21 HA CYS 21 5.006 1.497 3.703
141 1HB CYS 21 2HB CYS 21 5.299 -1.013 2.181
142 2HB CYS 21 1HB CYS 21 4.018 0.059 1.642
143 H THR 22 H THR 22 2.978 2.208 3.969
144 HA THR 22 HA THR 22 0.827 0.275 4.398
145 HB THR 22 HB THR 22 0.010 1.973 6.221
146 HG1 THR 22 1HG THR 22 2.848 2.286 6.316
147 1HG2 THR 22 1HG2 THR 22 1.779 0.606 7.798
148 2HG2 THR 22 2HG2 THR 22 1.730 -0.395 6.348
149 3HG2 THR 22 3HG2 THR 22 0.240 -0.029 7.218
150 H CYS 23 H CYS 23 -1.085 0.882 3.577
151 HA CYS 23 HA CYS 23 -1.104 3.301 1.967
152 1HB CYS 23 2HB CYS 23 -3.076 2.313 0.897
153 2HB CYS 23 1HB CYS 23 -1.706 1.212 0.885
154 H ASP 24 H ASP 24 -4.169 2.564 2.308
155 HA ASP 24 HA ASP 24 -4.741 4.280 4.619
156 1HB ASP 24 2HB ASP 24 -4.732 5.598 2.493
157 2HB ASP 24 1HB ASP 24 -5.982 4.538 1.862
158 H ASP 25 H ASP 25 -6.215 2.308 2.055
159 HA ASP 25 HA ASP 25 -7.863 0.795 1.952
160 1HB ASP 25 2HB ASP 25 -6.536 -0.624 3.403
161 2HB ASP 25 1HB ASP 25 -7.141 0.215 4.834
162 H ARG 26 H ARG 26 -9.538 1.479 1.495
163 HA ARG 26 HA ARG 26 -11.751 1.715 3.200
164 1HB ARG 26 2HB ARG 26 -10.401 4.211 2.343
165 2HB ARG 26 1HB ARG 26 -12.123 4.145 2.098
166 1HG ARG 26 2HG ARG 26 -12.293 4.911 4.185
167 2HG ARG 26 1HG ARG 26 -11.876 3.276 4.680
168 1HD ARG 26 2HD ARG 26 -10.545 5.030 5.808
169 2HD ARG 26 1HD ARG 26 -9.571 3.865 4.920
170 HE ARG 26 HE ARG 26 -8.672 5.642 3.867
171 1HH1 ARG 26 1HH1 ARG 26 -12.001 6.519 4.583
172 2HH1 ARG 26 2HH1 ARG 26 -11.878 8.069 3.824
173 1HH2 ARG 26 1HH2 ARG 26 -8.502 7.641 2.894
174 2HH2 ARG 26 2HH2 ARG 26 -9.872 8.719 2.857
175 H SER 27 H SER 27 -11.528 -0.024 1.476
176 HA SER 27 HA SER 27 -12.528 -1.005 -0.321
177 1HB SER 27 2HB SER 27 -14.448 0.584 -0.092
178 2HB SER 27 1HB SER 27 -13.562 1.756 -1.070
179 HG SER 27 HG SER 27 -13.573 0.194 -2.767
180 H ASP 28 H ASP 28 -9.977 -0.296 -0.106
181 HA ASP 28 HA ASP 28 -8.047 -0.295 -1.253
182 1HB ASP 28 2HB ASP 28 -9.435 -1.455 -3.081
183 2HB ASP 28 1HB ASP 28 -9.527 0.125 -3.852
184 H GLY 29 H GLY 29 -6.749 1.153 -2.777
185 1HA GLY 29 2HA GLY 29 -7.551 3.781 -3.340
186 2HA GLY 29 1HA GLY 29 -6.813 3.763 -1.743
187 H LEU 30 H LEU 30 -4.650 2.895 -1.550
188 HA LEU 30 HA LEU 30 -2.948 2.147 -3.583
189 1HB LEU 30 2HB LEU 30 -3.569 4.411 -4.509
190 2HB LEU 30 1HB LEU 30 -2.751 5.127 -3.140
191 HG LEU 30 HG LEU 30 -0.631 4.128 -3.878
192 1HD1 LEU 30 1HD1 LEU 30 -1.948 3.327 -6.440
193 2HD1 LEU 30 2HD1 LEU 30 -1.922 2.216 -5.071
194 3HD1 LEU 30 3HD1 LEU 30 -0.409 2.802 -5.761
195 1HD2 LEU 30 1HD2 LEU 30 -0.699 6.237 -4.716
196 2HD2 LEU 30 2HD2 LEU 30 -2.220 5.969 -5.568
197 3HD2 LEU 30 3HD2 LEU 30 -0.712 5.352 -6.242
198 H CYS 31 H CYS 31 -1.172 1.365 -2.581
199 HA CYS 31 HA CYS 31 -0.757 1.876 0.205
200 1HB CYS 31 2HB CYS 31 0.931 0.323 -1.766
201 2HB CYS 31 1HB CYS 31 1.157 0.323 -0.018
202 H LYS 32 H LYS 32 0.838 3.052 1.232
203 HA LYS 32 HA LYS 32 2.267 4.913 -0.510
204 1HB LYS 32 2HB LYS 32 1.709 4.988 2.450
205 2HB LYS 32 1HB LYS 32 2.659 6.180 1.604
206 1HG LYS 32 2HG LYS 32 -0.254 5.579 1.231
207 2HG LYS 32 1HG LYS 32 0.483 7.079 1.809
208 1HD LYS 32 2HD LYS 32 0.881 7.810 -0.282
209 2HD LYS 32 1HD LYS 32 1.484 6.237 -0.786
210 1HE LYS 32 2HE LYS 32 -0.419 6.701 -2.102
211 2HE LYS 32 1HE LYS 32 -0.859 5.456 -0.939
212 1HZ LYS 32 1HZ LYS 32 -1.400 7.985 0.176
213 2HZ LYS 32 2HZ LYS 32 -2.484 6.735 -0.179
214 3HZ LYS 32 3HZ LYS 32 -2.123 7.899 -1.352
215 H ARG 33 H ARG 33 4.495 5.348 -0.220
216 HA ARG 33 HA ARG 33 6.014 2.953 0.231
217 1HB ARG 33 2HB ARG 33 6.267 5.087 -1.435
218 2HB ARG 33 1HB ARG 33 7.451 5.493 -0.201
219 1HG ARG 33 2HG ARG 33 8.598 3.391 -0.566
220 2HG ARG 33 1HG ARG 33 7.373 2.905 -1.742
221 1HD ARG 33 2HD ARG 33 9.320 5.197 -1.971
222 2HD ARG 33 1HD ARG 33 9.304 3.715 -2.926
223 HE ARG 33 HE ARG 33 7.151 4.515 -3.861
224 1HH1 ARG 33 1HH1 ARG 33 9.408 6.793 -2.472
225 2HH1 ARG 33 2HH1 ARG 33 8.716 8.183 -3.250
226 1HH2 ARG 33 1HH2 ARG 33 6.267 6.326 -4.962
227 2HH2 ARG 33 2HH2 ARG 33 6.958 7.899 -4.711
228 H ASN 34 H ASN 34 8.434 4.294 1.060
229 HA ASN 34 HA ASN 34 8.004 5.253 3.776
230 1HB ASN 34 2HB ASN 34 9.193 2.660 3.059
231 2HB ASN 34 1HB ASN 34 10.005 3.554 4.318
232 1HD2 ASN 34 1HD2 ASN 34 9.515 2.585 6.132
233 2HD2 ASN 34 2HD2 ASN 34 7.947 2.082 6.623
234 H GLY 35 H GLY 35 9.814 6.479 4.504
235 1HA GLY 35 2HA GLY 35 11.862 7.608 4.298
236 2HA GLY 35 1HA GLY 35 12.185 6.694 2.821
237 H ASP 36 H ASP 36 9.900 7.098 1.512
238 HA ASP 36 HA ASP 36 9.334 9.920 1.183
239 1HB ASP 36 2HB ASP 36 11.233 9.471 -0.386
240 2HB ASP 36 1HB ASP 36 10.300 8.173 -1.118
241 HA PRO 37 HA PRO 37 6.023 6.477 1.002
242 1HB PRO 37 2HB PRO 37 4.983 8.283 3.170
243 2HB PRO 37 1HB PRO 37 4.880 6.515 3.030
244 1HG PRO 37 2HG PRO 37 6.740 7.342 4.613
245 2HG PRO 37 1HG PRO 37 7.255 6.290 3.297
246 1HD PRO 37 2HD PRO 37 7.262 9.311 3.265
247 2HD PRO 37 1HD PRO 37 8.662 8.216 3.097
Start of MODEL 18
1 H THR 1 H THR 1 5.522 6.127 -1.043
2 HA THR 1 HA THR 1 3.266 7.421 -2.329
3 HB THR 1 HB THR 1 5.868 6.802 -3.771
4 HG1 THR 1 1HG THR 1 6.654 8.589 -2.939
5 1HG2 THR 1 1HG2 THR 1 4.928 8.355 -5.468
6 2HG2 THR 1 2HG2 THR 1 3.460 8.478 -4.499
7 3HG2 THR 1 3HG2 THR 1 3.919 6.931 -5.210
8 H PHE 2 H PHE 2 2.820 5.911 -4.293
9 HA PHE 2 HA PHE 2 1.955 3.517 -3.521
10 1HB PHE 2 2HB PHE 2 1.363 4.383 -5.654
11 2HB PHE 2 1HB PHE 2 3.032 4.402 -6.196
12 HD1 PHE 2 1HD PHE 2 3.239 3.024 -8.001
13 HD2 PHE 2 2HD PHE 2 0.911 1.713 -4.690
14 HE1 PHE 2 1HE PHE 2 2.900 0.853 -9.106
15 HE2 PHE 2 2HE PHE 2 0.570 -0.460 -5.789
16 HZ PHE 2 HZ PHE 2 1.564 -0.892 -7.999
17 H CYS 3 H CYS 3 3.116 2.197 -2.262
18 HA CYS 3 HA CYS 3 5.777 1.593 -2.223
19 1HB CYS 3 2HB CYS 3 3.619 -0.465 -1.707
20 2HB CYS 3 1HB CYS 3 5.237 -0.440 -1.053
21 H GLY 4 H GLY 4 3.428 -0.682 -3.580
22 1HA GLY 4 2HA GLY 4 4.606 -1.060 -6.088
23 2HA GLY 4 1HA GLY 4 5.285 -2.254 -4.980
24 H GLU 5 H GLU 5 3.178 -2.714 -3.335
25 HA GLU 5 HA GLU 5 1.419 -4.302 -5.010
26 1HB GLU 5 2HB GLU 5 1.804 -4.033 -2.032
27 2HB GLU 5 1HB GLU 5 0.495 -4.975 -2.725
28 1HG GLU 5 2HG GLU 5 1.908 -6.599 -3.525
29 2HG GLU 5 1HG GLU 5 3.305 -5.519 -3.544
30 H THR 6 H THR 6 -0.971 -4.283 -4.222
31 HA THR 6 HA THR 6 -1.783 -1.512 -3.681
32 HB THR 6 HB THR 6 -3.758 -1.892 -5.163
33 HG1 THR 6 1HG THR 6 -3.184 -4.317 -5.163
34 1HG2 THR 6 1HG2 THR 6 -0.958 -1.667 -6.127
35 2HG2 THR 6 2HG2 THR 6 -2.292 -0.520 -6.248
36 3HG2 THR 6 3HG2 THR 6 -2.218 -1.904 -7.338
37 H CYS 7 H CYS 7 -2.734 -1.519 -1.771
38 HA CYS 7 HA CYS 7 -4.111 -3.867 -0.792
39 1HB CYS 7 2HB CYS 7 -4.581 -2.264 1.206
40 2HB CYS 7 1HB CYS 7 -2.942 -2.871 0.990
41 H ARG 8 H ARG 8 -5.410 -3.480 -2.842
42 HA ARG 8 HA ARG 8 -7.498 -1.495 -2.601
43 1HB ARG 8 2HB ARG 8 -6.653 -3.408 -4.739
44 2HB ARG 8 1HB ARG 8 -8.212 -2.591 -4.829
45 1HG ARG 8 2HG ARG 8 -6.857 -0.484 -4.362
46 2HG ARG 8 1HG ARG 8 -5.468 -1.430 -4.913
47 1HD ARG 8 2HD ARG 8 -6.303 -0.270 -6.813
48 2HD ARG 8 1HD ARG 8 -6.821 -1.949 -6.980
49 HE ARG 8 HE ARG 8 -8.813 -0.479 -5.624
50 1HH1 ARG 8 1HH1 ARG 8 -7.433 -0.815 -8.833
51 2HH1 ARG 8 2HH1 ARG 8 -8.877 -0.307 -9.639
52 1HH2 ARG 8 1HH2 ARG 8 -10.682 0.177 -6.644
53 2HH2 ARG 8 2HH2 ARG 8 -10.752 0.269 -8.384
54 H VAL 9 H VAL 9 -8.163 -4.609 -3.995
55 HA VAL 9 HA VAL 9 -10.510 -4.739 -2.349
56 HB VAL 9 HB VAL 9 -9.625 -6.664 -4.513
57 1HG1 VAL 9 1HG1 VAL 9 -11.649 -7.716 -4.371
58 2HG1 VAL 9 2HG1 VAL 9 -12.468 -6.296 -3.721
59 3HG1 VAL 9 3HG1 VAL 9 -11.424 -7.265 -2.681
60 1HG2 VAL 9 1HG2 VAL 9 -11.840 -4.788 -5.022
61 2HG2 VAL 9 2HG2 VAL 9 -10.563 -5.359 -6.096
62 3HG2 VAL 9 3HG2 VAL 9 -10.230 -4.072 -4.937
63 H ILE 10 H ILE 10 -7.470 -6.261 -2.744
64 HA ILE 10 HA ILE 10 -7.909 -7.912 -0.358
65 HB ILE 10 HB ILE 10 -6.064 -9.416 -1.346
66 1HG1 ILE 10 2HG1 ILE 10 -7.039 -8.136 -3.912
67 2HG1 ILE 10 1HG1 ILE 10 -5.446 -7.898 -3.203
68 1HG2 ILE 10 1HG2 ILE 10 -8.467 -10.010 -1.074
69 2HG2 ILE 10 2HG2 ILE 10 -7.662 -10.843 -2.404
70 3HG2 ILE 10 3HG2 ILE 10 -8.734 -9.482 -2.735
71 1HD1 ILE 10 1HD1 ILE 10 -4.930 -10.244 -3.531
72 2HD1 ILE 10 2HD1 ILE 10 -5.409 -9.491 -5.052
73 3HD1 ILE 10 3HD1 ILE 10 -6.545 -10.523 -4.183
74 HA PRO 11 HA PRO 11 -4.752 -4.590 0.161
75 1HB PRO 11 2HB PRO 11 -5.885 -4.602 2.890
76 2HB PRO 11 1HB PRO 11 -5.589 -3.251 1.791
77 1HG PRO 11 2HG PRO 11 -8.050 -4.077 2.226
78 2HG PRO 11 1HG PRO 11 -7.540 -3.637 0.585
79 1HD PRO 11 2HD PRO 11 -7.780 -6.377 1.805
80 2HD PRO 11 1HD PRO 11 -8.365 -5.799 0.227
81 H VAL 12 H VAL 12 -3.876 -4.261 2.776
82 HA VAL 12 HA VAL 12 -2.228 -4.843 4.152
83 HB VAL 12 HB VAL 12 -2.933 -7.743 3.685
84 1HG1 VAL 12 1HG1 VAL 12 -2.065 -8.075 5.933
85 2HG1 VAL 12 2HG1 VAL 12 -1.738 -6.348 6.079
86 3HG1 VAL 12 3HG1 VAL 12 -0.849 -7.319 4.905
87 1HG2 VAL 12 1HG2 VAL 12 -4.753 -5.883 4.510
88 2HG2 VAL 12 2HG2 VAL 12 -4.084 -6.435 6.046
89 3HG2 VAL 12 3HG2 VAL 12 -4.803 -7.596 4.929
90 H CYS 13 H CYS 13 -0.976 -4.025 2.365
91 HA CYS 13 HA CYS 13 0.309 -5.534 0.411
92 1HB CYS 13 2HB CYS 13 1.807 -3.331 1.757
93 2HB CYS 13 1HB CYS 13 1.516 -3.598 0.040
94 H THR 14 H THR 14 1.348 -7.446 0.970
95 HA THR 14 HA THR 14 2.719 -7.690 3.469
96 HB THR 14 HB THR 14 1.550 -9.617 2.709
97 HG1 THR 14 1HG THR 14 4.251 -9.671 3.132
98 1HG2 THR 14 1HG2 THR 14 3.396 -9.932 0.361
99 2HG2 THR 14 2HG2 THR 14 1.873 -9.050 0.228
100 3HG2 THR 14 3HG2 THR 14 1.869 -10.752 0.688
101 H TYR 15 H TYR 15 3.844 -7.358 0.102
102 HA TYR 15 HA TYR 15 6.602 -7.758 0.870
103 1HB TYR 15 2HB TYR 15 5.815 -8.351 -1.394
104 2HB TYR 15 1HB TYR 15 5.422 -6.665 -1.697
105 HD1 TYR 15 1HD TYR 15 6.862 -5.775 -3.251
106 HD2 TYR 15 2HD TYR 15 8.435 -8.383 -0.280
107 HE1 TYR 15 1HE TYR 15 9.126 -5.404 -4.134
108 HE2 TYR 15 2HE TYR 15 10.705 -8.018 -1.154
109 HH TYR 15 HH TYR 15 11.942 -6.425 -2.459
110 H SER 16 H SER 16 4.465 -5.111 0.085
111 HA SER 16 HA SER 16 6.347 -2.992 0.283
112 1HB SER 16 2HB SER 16 3.378 -2.829 0.812
113 2HB SER 16 1HB SER 16 4.441 -1.561 0.215
114 HG SER 16 HG SER 16 3.641 -3.938 -1.125
115 H ALA 17 H ALA 17 4.656 -4.905 2.597
116 HA ALA 17 HA ALA 17 4.641 -3.154 4.788
117 1HB ALA 17 1HB ALA 17 4.286 -5.073 6.167
118 2HB ALA 17 2HB ALA 17 4.964 -6.151 4.946
119 3HB ALA 17 3HB ALA 17 3.427 -5.337 4.648
120 H ALA 18 H ALA 18 7.310 -4.627 3.213
121 HA ALA 18 HA ALA 18 9.111 -5.042 5.328
122 1HB ALA 18 1HB ALA 18 9.228 -5.054 2.511
123 2HB ALA 18 2HB ALA 18 10.457 -5.614 3.646
124 3HB ALA 18 3HB ALA 18 10.489 -3.950 3.060
125 H LEU 19 H LEU 19 8.316 -2.189 3.449
126 HA LEU 19 HA LEU 19 10.052 -0.428 4.950
127 1HB LEU 19 2HB LEU 19 8.254 -0.210 2.621
128 2HB LEU 19 1HB LEU 19 8.380 1.225 3.603
129 HG LEU 19 HG LEU 19 10.722 1.398 3.204
130 1HD1 LEU 19 1HD1 LEU 19 11.221 -0.625 1.268
131 2HD1 LEU 19 2HD1 LEU 19 10.548 -1.405 2.699
132 3HD1 LEU 19 3HD1 LEU 19 11.991 -0.400 2.839
133 1HD2 LEU 19 1HD2 LEU 19 9.858 0.681 0.467
134 2HD2 LEU 19 2HD2 LEU 19 10.580 2.168 1.083
135 3HD2 LEU 19 3HD2 LEU 19 8.864 1.848 1.340
136 H GLY 20 H GLY 20 7.022 -1.762 5.267
137 1HA GLY 20 2HA GLY 20 5.748 -1.508 7.289
138 2HA GLY 20 1HA GLY 20 6.281 0.171 7.355
139 H CYS 21 H CYS 21 5.910 1.167 5.030
140 HA CYS 21 HA CYS 21 4.477 2.143 3.643
141 1HB CYS 21 2HB CYS 21 3.615 -0.708 3.598
142 2HB CYS 21 1HB CYS 21 2.626 0.458 2.747
143 H THR 22 H THR 22 2.951 3.564 3.806
144 HA THR 22 HA THR 22 1.389 3.749 6.234
145 HB THR 22 HB THR 22 1.256 5.604 3.929
146 HG1 THR 22 1HG THR 22 3.477 5.142 5.616
147 1HG2 THR 22 1HG2 THR 22 1.389 6.139 6.905
148 2HG2 THR 22 2HG2 THR 22 -0.100 6.051 5.963
149 3HG2 THR 22 3HG2 THR 22 1.072 7.329 5.642
150 H CYS 23 H CYS 23 0.795 2.119 3.579
151 HA CYS 23 HA CYS 23 -1.391 2.764 2.199
152 1HB CYS 23 2HB CYS 23 -0.707 0.609 1.703
153 2HB CYS 23 1HB CYS 23 -0.610 0.131 3.396
154 H ASP 24 H ASP 24 -3.545 3.128 2.537
155 HA ASP 24 HA ASP 24 -4.437 3.386 5.278
156 1HB ASP 24 2HB ASP 24 -4.786 5.172 3.580
157 2HB ASP 24 1HB ASP 24 -5.872 4.098 2.711
158 H ASP 25 H ASP 25 -6.399 2.374 2.517
159 HA ASP 25 HA ASP 25 -7.902 0.709 2.181
160 1HB ASP 25 2HB ASP 25 -6.223 -0.986 2.695
161 2HB ASP 25 1HB ASP 25 -6.442 -0.716 4.423
162 H ARG 26 H ARG 26 -9.795 1.156 2.483
163 HA ARG 26 HA ARG 26 -10.999 1.044 5.140
164 1HB ARG 26 2HB ARG 26 -11.216 3.545 3.451
165 2HB ARG 26 1HB ARG 26 -11.865 3.272 5.037
166 1HG ARG 26 2HG ARG 26 -8.929 3.241 4.571
167 2HG ARG 26 1HG ARG 26 -9.806 4.751 4.820
168 1HD ARG 26 2HD ARG 26 -10.261 2.562 6.770
169 2HD ARG 26 1HD ARG 26 -8.702 3.385 6.820
170 HE ARG 26 HE ARG 26 -11.195 4.405 7.716
171 1HH1 ARG 26 1HH1 ARG 26 -8.123 5.333 6.289
172 2HH1 ARG 26 2HH1 ARG 26 -8.254 6.989 6.801
173 1HH2 ARG 26 1HH2 ARG 26 -11.351 6.592 8.401
174 2HH2 ARG 26 2HH2 ARG 26 -10.082 7.701 8.008
175 H SER 27 H SER 27 -11.303 2.070 1.852
176 HA SER 27 HA SER 27 -13.485 0.291 1.275
177 1HB SER 27 2HB SER 27 -14.662 2.325 2.114
178 2HB SER 27 1HB SER 27 -13.778 3.305 0.947
179 HG SER 27 HG SER 27 -14.771 1.996 -0.704
180 H ASP 28 H ASP 28 -10.929 0.193 0.685
181 HA ASP 28 HA ASP 28 -9.625 -0.339 -1.074
182 1HB ASP 28 2HB ASP 28 -11.670 -0.442 -2.525
183 2HB ASP 28 1HB ASP 28 -11.509 1.281 -2.821
184 H GLY 29 H GLY 29 -7.744 0.633 -1.857
185 1HA GLY 29 2HA GLY 29 -7.539 3.500 -2.050
186 2HA GLY 29 1HA GLY 29 -6.783 2.859 -0.605
187 H LEU 30 H LEU 30 -4.680 2.831 -0.838
188 HA LEU 30 HA LEU 30 -3.410 1.372 -2.956
189 1HB LEU 30 2HB LEU 30 -4.119 3.665 -3.881
190 2HB LEU 30 1HB LEU 30 -2.909 4.336 -2.826
191 HG LEU 30 HG LEU 30 -2.314 3.992 -5.290
192 1HD1 LEU 30 1HD1 LEU 30 -0.677 4.509 -3.552
193 2HD1 LEU 30 2HD1 LEU 30 -0.023 3.431 -4.785
194 3HD1 LEU 30 3HD1 LEU 30 -0.505 2.788 -3.214
195 1HD2 LEU 30 1HD2 LEU 30 -1.284 1.595 -5.524
196 2HD2 LEU 30 2HD2 LEU 30 -2.985 1.887 -5.890
197 3HD2 LEU 30 3HD2 LEU 30 -2.524 1.178 -4.341
198 H CYS 31 H CYS 31 -1.348 0.729 -2.301
199 HA CYS 31 HA CYS 31 -0.567 1.238 0.405
200 1HB CYS 31 2HB CYS 31 1.119 -0.027 -1.749
201 2HB CYS 31 1HB CYS 31 1.331 -0.193 -0.020
202 H LYS 32 H LYS 32 0.765 2.785 1.172
203 HA LYS 32 HA LYS 32 2.429 4.245 -0.774
204 1HB LYS 32 2HB LYS 32 0.482 5.190 1.134
205 2HB LYS 32 1HB LYS 32 2.050 5.881 1.486
206 1HG LYS 32 2HG LYS 32 0.702 7.277 -0.036
207 2HG LYS 32 1HG LYS 32 2.218 6.743 -0.769
208 1HD LYS 32 2HD LYS 32 0.966 4.874 -1.842
209 2HD LYS 32 1HD LYS 32 -0.530 5.579 -1.227
210 1HE LYS 32 2HE LYS 32 1.344 6.593 -3.313
211 2HE LYS 32 1HE LYS 32 -0.389 6.340 -3.410
212 1HZ LYS 32 1HZ LYS 32 -0.435 8.178 -1.583
213 2HZ LYS 32 2HZ LYS 32 -0.285 8.611 -3.211
214 3HZ LYS 32 3HZ LYS 32 1.082 8.588 -2.213
215 H ARG 33 H ARG 33 4.601 4.574 -0.187
216 HA ARG 33 HA ARG 33 5.662 2.689 1.684
217 1HB ARG 33 2HB ARG 33 7.140 4.896 0.246
218 2HB ARG 33 1HB ARG 33 7.836 3.441 0.940
219 1HG ARG 33 2HG ARG 33 7.018 2.091 -0.757
220 2HG ARG 33 1HG ARG 33 5.799 3.273 -1.240
221 1HD ARG 33 2HD ARG 33 7.655 4.783 -1.957
222 2HD ARG 33 1HD ARG 33 8.783 3.469 -1.629
223 HE ARG 33 HE ARG 33 6.928 2.390 -3.325
224 1HH1 ARG 33 1HH1 ARG 33 9.037 5.197 -3.470
225 2HH1 ARG 33 2HH1 ARG 33 9.251 5.090 -5.181
226 1HH2 ARG 33 1HH2 ARG 33 7.200 2.262 -5.573
227 2HH2 ARG 33 2HH2 ARG 33 8.208 3.418 -6.384
228 H ASN 34 H ASN 34 7.992 4.360 2.287
229 HA ASN 34 HA ASN 34 7.144 6.373 4.197
230 1HB ASN 34 2HB ASN 34 8.521 3.840 4.965
231 2HB ASN 34 1HB ASN 34 8.668 5.262 5.948
232 1HD2 ASN 34 1HD2 ASN 34 7.334 2.459 6.040
233 2HD2 ASN 34 2HD2 ASN 34 5.781 2.796 6.714
234 H GLY 35 H GLY 35 8.857 7.867 4.515
235 1HA GLY 35 2HA GLY 35 11.001 8.790 4.153
236 2HA GLY 35 1HA GLY 35 11.489 7.278 3.371
237 H ASP 36 H ASP 36 9.437 6.929 1.718
238 HA ASP 36 HA ASP 36 9.119 9.199 -0.071
239 1HB ASP 36 2HB ASP 36 11.020 7.989 -1.038
240 2HB ASP 36 1HB ASP 36 10.164 6.461 -0.886
241 HA PRO 37 HA PRO 37 5.525 6.282 1.177
242 1HB PRO 37 2HB PRO 37 4.502 8.946 2.121
243 2HB PRO 37 1HB PRO 37 4.277 7.333 2.834
244 1HG PRO 37 2HG PRO 37 6.110 8.738 3.981
245 2HG PRO 37 1HG PRO 37 6.618 7.172 3.355
246 1HD PRO 37 2HD PRO 37 6.810 9.805 1.885
247 2HD PRO 37 1HD PRO 37 8.156 8.747 2.392
Start of MODEL 19
1 H THR 1 H THR 1 5.862 6.392 -1.216
2 HA THR 1 HA THR 1 4.043 8.151 -2.569
3 HB THR 1 HB THR 1 6.489 7.035 -3.996
4 HG1 THR 1 1HG THR 1 7.495 8.752 -3.270
5 1HG2 THR 1 1HG2 THR 1 4.557 9.138 -4.962
6 2HG2 THR 1 2HG2 THR 1 4.343 7.418 -5.292
7 3HG2 THR 1 3HG2 THR 1 5.769 8.262 -5.897
8 H PHE 2 H PHE 2 2.961 6.852 -4.230
9 HA PHE 2 HA PHE 2 1.933 4.522 -3.352
10 1HB PHE 2 2HB PHE 2 0.820 5.530 -5.114
11 2HB PHE 2 1HB PHE 2 2.273 5.684 -6.082
12 HD1 PHE 2 1HD PHE 2 0.432 2.825 -4.512
13 HD2 PHE 2 2HD PHE 2 2.141 4.496 -8.033
14 HE1 PHE 2 1HE PHE 2 -0.215 0.816 -5.775
15 HE2 PHE 2 2HE PHE 2 1.498 2.489 -9.302
16 HZ PHE 2 HZ PHE 2 0.318 0.647 -8.174
17 H CYS 3 H CYS 3 2.961 2.824 -2.674
18 HA CYS 3 HA CYS 3 5.446 1.840 -3.516
19 1HB CYS 3 2HB CYS 3 3.280 0.150 -2.256
20 2HB CYS 3 1HB CYS 3 5.019 -0.036 -2.113
21 H GLY 4 H GLY 4 5.427 -0.755 -4.095
22 1HA GLY 4 2HA GLY 4 4.595 -0.830 -6.828
23 2HA GLY 4 1HA GLY 4 5.341 -2.145 -5.935
24 H GLU 5 H GLU 5 3.457 -2.382 -3.882
25 HA GLU 5 HA GLU 5 1.460 -3.945 -5.218
26 1HB GLU 5 2HB GLU 5 2.306 -3.463 -2.418
27 2HB GLU 5 1HB GLU 5 0.674 -4.052 -2.681
28 1HG GLU 5 2HG GLU 5 1.462 -6.038 -3.700
29 2HG GLU 5 1HG GLU 5 3.118 -5.420 -3.783
30 H THR 6 H THR 6 -0.827 -3.845 -4.445
31 HA THR 6 HA THR 6 -1.763 -1.107 -3.993
32 HB THR 6 HB THR 6 -3.746 -1.809 -5.536
33 HG1 THR 6 1HG THR 6 -1.918 -3.174 -7.093
34 1HG2 THR 6 1HG2 THR 6 -1.449 -1.324 -7.286
35 2HG2 THR 6 2HG2 THR 6 -1.542 -0.232 -5.904
36 3HG2 THR 6 3HG2 THR 6 -2.899 -0.356 -7.024
37 H CYS 7 H CYS 7 -2.960 -1.086 -2.222
38 HA CYS 7 HA CYS 7 -4.145 -3.551 -1.221
39 1HB CYS 7 2HB CYS 7 -4.737 -1.809 0.703
40 2HB CYS 7 1HB CYS 7 -3.122 -2.523 0.594
41 H ARG 8 H ARG 8 -5.610 -3.429 -3.133
42 HA ARG 8 HA ARG 8 -7.626 -1.468 -3.376
43 1HB ARG 8 2HB ARG 8 -8.767 -3.212 -4.825
44 2HB ARG 8 1HB ARG 8 -7.170 -2.738 -5.303
45 1HG ARG 8 2HG ARG 8 -7.430 -5.129 -3.583
46 2HG ARG 8 1HG ARG 8 -7.904 -5.256 -5.276
47 1HD ARG 8 2HD ARG 8 -5.724 -4.679 -6.019
48 2HD ARG 8 1HD ARG 8 -5.232 -4.178 -4.401
49 HE ARG 8 HE ARG 8 -5.965 -6.852 -4.243
50 1HH1 ARG 8 1HH1 ARG 8 -3.501 -4.938 -5.844
51 2HH1 ARG 8 2HH1 ARG 8 -2.330 -6.216 -5.827
52 1HH2 ARG 8 1HH2 ARG 8 -4.409 -8.524 -4.203
53 2HH2 ARG 8 2HH2 ARG 8 -2.841 -8.251 -4.884
54 H VAL 9 H VAL 9 -9.328 -4.239 -3.595
55 HA VAL 9 HA VAL 9 -10.919 -3.601 -1.244
56 HB VAL 9 HB VAL 9 -12.001 -4.135 -3.431
57 1HG1 VAL 9 1HG1 VAL 9 -11.444 -5.917 -4.608
58 2HG1 VAL 9 2HG1 VAL 9 -11.975 -6.970 -3.297
59 3HG1 VAL 9 3HG1 VAL 9 -10.311 -6.392 -3.344
60 1HG2 VAL 9 1HG2 VAL 9 -13.719 -5.691 -2.494
61 2HG2 VAL 9 2HG2 VAL 9 -13.351 -4.297 -1.477
62 3HG2 VAL 9 3HG2 VAL 9 -12.685 -5.881 -1.078
63 H ILE 10 H ILE 10 -8.384 -5.528 -2.070
64 HA ILE 10 HA ILE 10 -8.600 -7.058 0.410
65 HB ILE 10 HB ILE 10 -7.243 -8.895 -0.626
66 1HG1 ILE 10 2HG1 ILE 10 -6.632 -7.401 -2.682
67 2HG1 ILE 10 1HG1 ILE 10 -6.867 -9.128 -2.907
68 1HG2 ILE 10 1HG2 ILE 10 -9.453 -9.456 -0.256
69 2HG2 ILE 10 2HG2 ILE 10 -9.233 -9.836 -1.964
70 3HG2 ILE 10 3HG2 ILE 10 -10.051 -8.346 -1.492
71 1HD1 ILE 10 1HD1 ILE 10 -8.831 -6.944 -3.555
72 2HD1 ILE 10 2HD1 ILE 10 -9.159 -8.672 -3.698
73 3HD1 ILE 10 3HD1 ILE 10 -7.912 -7.925 -4.697
74 HA PRO 11 HA PRO 11 -5.125 -4.074 0.147
75 1HB PRO 11 2HB PRO 11 -5.733 -3.696 2.994
76 2HB PRO 11 1HB PRO 11 -5.640 -2.507 1.693
77 1HG PRO 11 2HG PRO 11 -7.970 -3.212 2.793
78 2HG PRO 11 1HG PRO 11 -7.830 -2.824 1.067
79 1HD PRO 11 2HD PRO 11 -7.966 -5.507 2.399
80 2HD PRO 11 1HD PRO 11 -8.773 -4.944 0.920
81 H VAL 12 H VAL 12 -3.908 -3.625 2.618
82 HA VAL 12 HA VAL 12 -2.207 -4.233 3.893
83 HB VAL 12 HB VAL 12 -3.070 -7.111 3.573
84 1HG1 VAL 12 1HG1 VAL 12 -1.651 -5.853 5.908
85 2HG1 VAL 12 2HG1 VAL 12 -0.788 -6.567 4.545
86 3HG1 VAL 12 3HG1 VAL 12 -1.850 -7.566 5.538
87 1HG2 VAL 12 1HG2 VAL 12 -4.995 -5.985 4.372
88 2HG2 VAL 12 2HG2 VAL 12 -4.044 -4.985 5.470
89 3HG2 VAL 12 3HG2 VAL 12 -4.234 -6.708 5.790
90 H CYS 13 H CYS 13 -0.925 -3.494 2.186
91 HA CYS 13 HA CYS 13 0.170 -5.066 0.134
92 1HB CYS 13 2HB CYS 13 1.827 -2.943 1.432
93 2HB CYS 13 1HB CYS 13 1.498 -3.212 -0.278
94 H THR 14 H THR 14 1.084 -7.020 0.670
95 HA THR 14 HA THR 14 2.528 -7.402 3.117
96 HB THR 14 HB THR 14 2.282 -9.306 0.789
97 HG1 THR 14 1HG THR 14 0.319 -8.316 2.128
98 1HG2 THR 14 1HG2 THR 14 3.901 -9.583 2.911
99 2HG2 THR 14 2HG2 THR 14 3.081 -10.946 2.151
100 3HG2 THR 14 3HG2 THR 14 2.409 -10.213 3.608
101 H TYR 15 H TYR 15 3.471 -7.265 -0.306
102 HA TYR 15 HA TYR 15 6.219 -7.904 0.137
103 1HB TYR 15 2HB TYR 15 4.943 -8.099 -2.050
104 2HB TYR 15 1HB TYR 15 5.031 -6.347 -2.174
105 HD1 TYR 15 1HD TYR 15 6.819 -9.469 -2.499
106 HD2 TYR 15 2HD TYR 15 7.207 -5.243 -2.584
107 HE1 TYR 15 1HE TYR 15 9.010 -9.704 -3.599
108 HE2 TYR 15 2HE TYR 15 9.393 -5.455 -3.691
109 HH TYR 15 HH TYR 15 11.184 -7.109 -3.928
110 H SER 16 H SER 16 4.396 -4.963 -0.365
111 HA SER 16 HA SER 16 6.657 -3.209 -0.080
112 1HB SER 16 2HB SER 16 3.710 -2.533 0.029
113 2HB SER 16 1HB SER 16 5.041 -1.449 -0.372
114 HG SER 16 HG SER 16 4.116 -3.686 -1.858
115 H ALA 17 H ALA 17 4.816 -4.955 2.110
116 HA ALA 17 HA ALA 17 4.516 -3.119 4.227
117 1HB ALA 17 1HB ALA 17 3.280 -4.975 4.667
118 2HB ALA 17 2HB ALA 17 4.714 -5.394 5.603
119 3HB ALA 17 3HB ALA 17 4.481 -6.078 3.994
120 H ALA 18 H ALA 18 7.307 -4.810 3.048
121 HA ALA 18 HA ALA 18 8.924 -4.993 5.298
122 1HB ALA 18 1HB ALA 18 10.246 -5.837 3.721
123 2HB ALA 18 2HB ALA 18 10.612 -4.192 3.201
124 3HB ALA 18 3HB ALA 18 9.286 -5.079 2.451
125 H LEU 19 H LEU 19 8.351 -2.262 3.166
126 HA LEU 19 HA LEU 19 10.085 -0.477 4.619
127 1HB LEU 19 2HB LEU 19 8.430 -0.360 2.195
128 2HB LEU 19 1HB LEU 19 8.569 1.142 3.074
129 HG LEU 19 HG LEU 19 10.876 1.273 2.737
130 1HD1 LEU 19 1HD1 LEU 19 12.256 -0.486 2.677
131 2HD1 LEU 19 2HD1 LEU 19 11.416 -1.182 1.291
132 3HD1 LEU 19 3HD1 LEU 19 10.843 -1.512 2.926
133 1HD2 LEU 19 1HD2 LEU 19 9.560 1.755 0.736
134 2HD2 LEU 19 2HD2 LEU 19 9.714 0.075 0.223
135 3HD2 LEU 19 3HD2 LEU 19 11.144 1.102 0.322
136 H GLY 20 H GLY 20 6.973 -1.602 5.024
137 1HA GLY 20 2HA GLY 20 5.472 -1.059 6.725
138 2HA GLY 20 1HA GLY 20 6.443 0.367 7.085
139 H CYS 21 H CYS 21 5.306 -0.594 3.942
140 HA CYS 21 HA CYS 21 4.413 1.876 3.123
141 1HB CYS 21 2HB CYS 21 3.947 -0.926 2.247
142 2HB CYS 21 1HB CYS 21 2.894 0.301 1.579
143 H THR 22 H THR 22 2.889 3.106 3.961
144 HA THR 22 HA THR 22 0.667 1.921 5.386
145 HB THR 22 HB THR 22 0.064 4.333 5.838
146 HG1 THR 22 1HG THR 22 2.669 5.120 5.311
147 1HG2 THR 22 1HG2 THR 22 1.249 2.886 7.453
148 2HG2 THR 22 2HG2 THR 22 1.732 4.578 7.588
149 3HG2 THR 22 3HG2 THR 22 2.788 3.421 6.776
150 H CYS 23 H CYS 23 -1.235 1.698 4.596
151 HA CYS 23 HA CYS 23 -1.790 2.638 1.901
152 1HB CYS 23 2HB CYS 23 -2.129 0.242 2.550
153 2HB CYS 23 1HB CYS 23 -3.396 0.754 3.656
154 H ASP 24 H ASP 24 -4.699 2.251 2.634
155 HA ASP 24 HA ASP 24 -5.314 4.684 4.132
156 1HB ASP 24 2HB ASP 24 -5.234 5.171 1.631
157 2HB ASP 24 1HB ASP 24 -6.572 4.042 1.447
158 H ASP 25 H ASP 25 -6.902 2.210 2.134
159 HA ASP 25 HA ASP 25 -8.472 0.633 2.519
160 1HB ASP 25 2HB ASP 25 -6.928 -0.162 4.248
161 2HB ASP 25 1HB ASP 25 -7.636 0.951 5.406
162 H ARG 26 H ARG 26 -10.371 0.706 2.236
163 HA ARG 26 HA ARG 26 -12.616 0.949 3.145
164 1HB ARG 26 2HB ARG 26 -11.434 3.478 4.120
165 2HB ARG 26 1HB ARG 26 -13.070 3.540 3.536
166 1HG ARG 26 2HG ARG 26 -12.731 3.151 6.032
167 2HG ARG 26 1HG ARG 26 -13.857 2.081 5.200
168 1HD ARG 26 2HD ARG 26 -12.047 0.408 4.987
169 2HD ARG 26 1HD ARG 26 -10.991 1.472 5.911
170 HE ARG 26 HE ARG 26 -13.239 1.076 7.463
171 1HH1 ARG 26 1HH1 ARG 26 -10.741 -0.912 6.024
172 2HH1 ARG 26 2HH1 ARG 26 -10.739 -2.067 7.319
173 1HH2 ARG 26 1HH2 ARG 26 -13.260 -0.473 9.169
174 2HH2 ARG 26 2HH2 ARG 26 -12.184 -1.826 9.099
175 H SER 27 H SER 27 -13.663 0.727 1.429
176 HA SER 27 HA SER 27 -14.668 1.153 -0.574
177 1HB SER 27 2HB SER 27 -13.017 3.683 -0.797
178 2HB SER 27 1HB SER 27 -14.458 3.255 -1.708
179 HG SER 27 HG SER 27 -14.227 4.349 0.789
180 H ASP 28 H ASP 28 -11.290 1.864 -0.145
181 HA ASP 28 HA ASP 28 -10.243 -0.265 -1.482
182 1HB ASP 28 2HB ASP 28 -11.248 1.073 -3.498
183 2HB ASP 28 1HB ASP 28 -9.912 2.183 -3.228
184 H GLY 29 H GLY 29 -8.000 1.612 -2.622
185 1HA GLY 29 2HA GLY 29 -7.123 3.235 -0.517
186 2HA GLY 29 1HA GLY 29 -6.443 1.648 -0.254
187 H LEU 30 H LEU 30 -4.401 2.294 -0.490
188 HA LEU 30 HA LEU 30 -3.199 2.123 -2.990
189 1HB LEU 30 2HB LEU 30 -4.489 4.339 -3.116
190 2HB LEU 30 1HB LEU 30 -3.332 4.947 -1.966
191 HG LEU 30 HG LEU 30 -2.874 5.611 -4.318
192 1HD1 LEU 30 1HD1 LEU 30 -0.588 3.867 -3.691
193 2HD1 LEU 30 2HD1 LEU 30 -1.082 5.003 -2.437
194 3HD1 LEU 30 3HD1 LEU 30 -0.645 5.593 -4.040
195 1HD2 LEU 30 1HD2 LEU 30 -3.320 4.042 -5.841
196 2HD2 LEU 30 2HD2 LEU 30 -3.090 2.723 -4.693
197 3HD2 LEU 30 3HD2 LEU 30 -1.695 3.453 -5.488
198 H CYS 31 H CYS 31 -1.299 1.250 -2.295
199 HA CYS 31 HA CYS 31 -0.311 1.567 0.342
200 1HB CYS 31 2HB CYS 31 1.206 0.549 -2.059
201 2HB CYS 31 1HB CYS 31 1.577 0.228 -0.374
202 H LYS 32 H LYS 32 1.229 2.904 1.190
203 HA LYS 32 HA LYS 32 2.580 4.721 -0.687
204 1HB LYS 32 2HB LYS 32 0.635 5.583 0.841
205 2HB LYS 32 1HB LYS 32 1.881 5.638 2.068
206 1HG LYS 32 2HG LYS 32 1.625 7.795 0.958
207 2HG LYS 32 1HG LYS 32 3.211 7.103 0.594
208 1HD LYS 32 2HD LYS 32 2.090 8.043 -1.431
209 2HD LYS 32 1HD LYS 32 2.431 6.322 -1.552
210 1HE LYS 32 2HE LYS 32 0.192 6.907 -2.382
211 2HE LYS 32 1HE LYS 32 0.158 5.768 -1.042
212 1HZ LYS 32 1HZ LYS 32 0.010 8.463 -0.124
213 2HZ LYS 32 2HZ LYS 32 -1.031 7.165 0.182
214 3HZ LYS 32 3HZ LYS 32 -1.246 8.112 -1.203
215 H ARG 33 H ARG 33 4.688 5.044 -0.390
216 HA ARG 33 HA ARG 33 6.146 3.137 1.146
217 1HB ARG 33 2HB ARG 33 6.617 4.170 -1.168
218 2HB ARG 33 1HB ARG 33 7.277 5.534 -0.287
219 1HG ARG 33 2HG ARG 33 8.880 3.949 0.796
220 2HG ARG 33 1HG ARG 33 8.291 2.705 -0.312
221 1HD ARG 33 2HD ARG 33 8.916 4.130 -2.218
222 2HD ARG 33 1HD ARG 33 9.538 5.341 -1.098
223 HE ARG 33 HE ARG 33 10.774 2.846 -0.622
224 1HH1 ARG 33 1HH1 ARG 33 10.774 5.543 -2.880
225 2HH1 ARG 33 2HH1 ARG 33 12.391 5.231 -3.423
226 1HH2 ARG 33 1HH2 ARG 33 12.911 2.451 -1.351
227 2HH2 ARG 33 2HH2 ARG 33 13.604 3.479 -2.558
228 H ASN 34 H ASN 34 8.434 4.479 1.877
229 HA ASN 34 HA ASN 34 7.814 6.575 3.795
230 1HB ASN 34 2HB ASN 34 8.862 3.883 4.520
231 2HB ASN 34 1HB ASN 34 9.168 5.257 5.538
232 1HD2 ASN 34 1HD2 ASN 34 7.410 2.643 5.362
233 2HD2 ASN 34 2HD2 ASN 34 5.923 3.162 6.066
234 H GLY 35 H GLY 35 9.723 7.767 4.354
235 1HA GLY 35 2HA GLY 35 11.959 8.457 4.092
236 2HA GLY 35 1HA GLY 35 12.278 6.984 3.168
237 H ASP 36 H ASP 36 10.214 7.087 1.476
238 HA ASP 36 HA ASP 36 10.193 9.534 -0.070
239 1HB ASP 36 2HB ASP 36 12.047 8.366 -1.111
240 2HB ASP 36 1HB ASP 36 11.165 6.845 -1.099
241 HA PRO 37 HA PRO 37 6.348 6.782 0.811
242 1HB PRO 37 2HB PRO 37 5.542 9.524 1.785
243 2HB PRO 37 1HB PRO 37 5.048 7.933 2.406
244 1HG PRO 37 2HG PRO 37 6.944 9.017 3.755
245 2HG PRO 37 1HG PRO 37 7.312 7.436 3.070
246 1HD PRO 37 2HD PRO 37 7.950 10.111 1.823
247 2HD PRO 37 1HD PRO 37 9.098 8.836 2.316
Start of MODEL 20
1 H THR 1 H THR 1 5.565 6.223 -0.816
2 HA THR 1 HA THR 1 3.545 7.864 -2.032
3 HB THR 1 HB THR 1 5.761 8.668 -2.988
4 HG1 THR 1 1HG THR 1 4.936 8.678 -5.069
5 1HG2 THR 1 1HG2 THR 1 7.017 6.606 -2.963
6 2HG2 THR 1 2HG2 THR 1 6.865 7.165 -4.629
7 3HG2 THR 1 3HG2 THR 1 5.855 5.841 -4.047
8 H PHE 2 H PHE 2 3.025 6.435 -4.157
9 HA PHE 2 HA PHE 2 1.894 4.108 -3.272
10 1HB PHE 2 2HB PHE 2 1.170 5.044 -5.302
11 2HB PHE 2 1HB PHE 2 2.785 5.036 -5.982
12 HD1 PHE 2 1HD PHE 2 0.791 2.314 -4.384
13 HD2 PHE 2 2HD PHE 2 2.704 3.768 -7.895
14 HE1 PHE 2 1HE PHE 2 0.279 0.202 -5.536
15 HE2 PHE 2 2HE PHE 2 2.195 1.659 -9.052
16 HZ PHE 2 HZ PHE 2 0.979 -0.127 -7.873
17 H CYS 3 H CYS 3 2.923 2.568 -2.225
18 HA CYS 3 HA CYS 3 5.547 1.799 -2.302
19 1HB CYS 3 2HB CYS 3 3.255 -0.116 -1.813
20 2HB CYS 3 1HB CYS 3 4.898 -0.273 -1.245
21 H GLY 4 H GLY 4 3.035 -0.286 -3.684
22 1HA GLY 4 2HA GLY 4 4.054 -0.552 -6.265
23 2HA GLY 4 1HA GLY 4 4.791 -1.810 -5.270
24 H GLU 5 H GLU 5 2.795 -2.352 -3.526
25 HA GLU 5 HA GLU 5 0.952 -3.878 -5.152
26 1HB GLU 5 2HB GLU 5 1.387 -3.650 -2.173
27 2HB GLU 5 1HB GLU 5 0.160 -4.678 -2.893
28 1HG GLU 5 2HG GLU 5 1.716 -6.150 -3.757
29 2HG GLU 5 1HG GLU 5 3.019 -4.958 -3.705
30 H THR 6 H THR 6 -1.408 -3.880 -4.263
31 HA THR 6 HA THR 6 -2.203 -1.124 -3.651
32 HB THR 6 HB THR 6 -4.319 -1.786 -5.054
33 HG1 THR 6 1HG THR 6 -2.304 -3.176 -6.505
34 1HG2 THR 6 1HG2 THR 6 -3.215 0.133 -5.732
35 2HG2 THR 6 2HG2 THR 6 -3.019 -0.911 -7.140
36 3HG2 THR 6 3HG2 THR 6 -1.690 -0.715 -5.997
37 H CYS 7 H CYS 7 -3.067 -1.155 -1.727
38 HA CYS 7 HA CYS 7 -4.375 -3.513 -0.700
39 1HB CYS 7 2HB CYS 7 -4.706 -1.903 1.341
40 2HB CYS 7 1HB CYS 7 -3.113 -2.577 1.022
41 H ARG 8 H ARG 8 -5.881 -3.217 -2.569
42 HA ARG 8 HA ARG 8 -8.001 -1.264 -2.245
43 1HB ARG 8 2HB ARG 8 -8.909 -2.583 -4.298
44 2HB ARG 8 1HB ARG 8 -7.519 -1.564 -4.478
45 1HG ARG 8 2HG ARG 8 -6.177 -3.740 -3.986
46 2HG ARG 8 1HG ARG 8 -7.677 -4.519 -4.499
47 1HD ARG 8 2HD ARG 8 -7.584 -3.504 -6.635
48 2HD ARG 8 1HD ARG 8 -6.314 -2.390 -6.129
49 HE ARG 8 HE ARG 8 -4.751 -4.015 -6.513
50 1HH1 ARG 8 1HH1 ARG 8 -7.943 -5.457 -6.602
51 2HH1 ARG 8 2HH1 ARG 8 -7.367 -7.023 -7.068
52 1HH2 ARG 8 1HH2 ARG 8 -3.985 -6.075 -7.132
53 2HH2 ARG 8 2HH2 ARG 8 -5.104 -7.376 -7.372
54 H VAL 9 H VAL 9 -9.251 -4.017 -3.569
55 HA VAL 9 HA VAL 9 -10.965 -4.490 -1.260
56 HB VAL 9 HB VAL 9 -12.222 -6.009 -2.774
57 1HG1 VAL 9 1HG1 VAL 9 -11.669 -3.199 -3.687
58 2HG1 VAL 9 2HG1 VAL 9 -13.006 -3.786 -2.697
59 3HG1 VAL 9 3HG1 VAL 9 -12.927 -4.202 -4.409
60 1HG2 VAL 9 1HG2 VAL 9 -11.061 -5.181 -5.262
61 2HG2 VAL 9 2HG2 VAL 9 -11.334 -6.813 -4.649
62 3HG2 VAL 9 3HG2 VAL 9 -9.836 -5.966 -4.265
63 H ILE 10 H ILE 10 -8.137 -5.230 -1.539
64 HA ILE 10 HA ILE 10 -8.093 -7.648 -0.075
65 HB ILE 10 HB ILE 10 -6.341 -8.670 -1.742
66 1HG1 ILE 10 2HG1 ILE 10 -8.132 -7.191 -3.683
67 2HG1 ILE 10 1HG1 ILE 10 -6.446 -6.802 -3.359
68 1HG2 ILE 10 1HG2 ILE 10 -7.923 -10.213 -1.477
69 2HG2 ILE 10 2HG2 ILE 10 -8.552 -9.638 -3.021
70 3HG2 ILE 10 3HG2 ILE 10 -9.224 -9.021 -1.512
71 1HD1 ILE 10 1HD1 ILE 10 -5.744 -8.920 -4.269
72 2HD1 ILE 10 2HD1 ILE 10 -6.762 -8.076 -5.434
73 3HD1 ILE 10 3HD1 ILE 10 -7.423 -9.412 -4.492
74 HA PRO 11 HA PRO 11 -4.931 -4.261 0.273
75 1HB PRO 11 2HB PRO 11 -5.698 -4.269 3.102
76 2HB PRO 11 1HB PRO 11 -5.620 -2.929 1.955
77 1HG PRO 11 2HG PRO 11 -7.943 -3.869 2.821
78 2HG PRO 11 1HG PRO 11 -7.741 -3.328 1.145
79 1HD PRO 11 2HD PRO 11 -7.714 -6.131 2.229
80 2HD PRO 11 1HD PRO 11 -8.545 -5.493 0.791
81 H VAL 12 H VAL 12 -3.880 -4.036 2.861
82 HA VAL 12 HA VAL 12 -2.137 -4.661 4.081
83 HB VAL 12 HB VAL 12 -2.831 -7.545 3.519
84 1HG1 VAL 12 1HG1 VAL 12 -1.622 -6.322 5.991
85 2HG1 VAL 12 2HG1 VAL 12 -0.669 -6.985 4.663
86 3HG1 VAL 12 3HG1 VAL 12 -1.751 -8.033 5.582
87 1HG2 VAL 12 1HG2 VAL 12 -4.562 -5.673 4.647
88 2HG2 VAL 12 2HG2 VAL 12 -3.878 -6.539 6.023
89 3HG2 VAL 12 3HG2 VAL 12 -4.697 -7.428 4.738
90 H CYS 13 H CYS 13 -0.916 -3.759 2.349
91 HA CYS 13 HA CYS 13 0.192 -5.162 0.215
92 1HB CYS 13 2HB CYS 13 1.836 -3.106 1.631
93 2HB CYS 13 1HB CYS 13 1.481 -3.264 -0.088
94 H THR 14 H THR 14 1.260 -7.082 0.485
95 HA THR 14 HA THR 14 2.633 -7.715 2.908
96 HB THR 14 HB THR 14 3.275 -9.821 1.577
97 HG1 THR 14 1HG THR 14 2.302 -8.381 -0.421
98 1HG2 THR 14 1HG2 THR 14 1.573 -10.582 2.790
99 2HG2 THR 14 2HG2 THR 14 0.464 -10.070 1.517
100 3HG2 THR 14 3HG2 THR 14 0.854 -8.972 2.842
101 H TYR 15 H TYR 15 3.785 -7.146 -0.422
102 HA TYR 15 HA TYR 15 6.533 -7.590 0.287
103 1HB TYR 15 2HB TYR 15 5.699 -7.959 -2.010
104 2HB TYR 15 1HB TYR 15 5.340 -6.242 -2.152
105 HD1 TYR 15 1HD TYR 15 6.784 -5.259 -3.651
106 HD2 TYR 15 2HD TYR 15 8.326 -8.129 -0.914
107 HE1 TYR 15 1HE TYR 15 9.050 -4.855 -4.514
108 HE2 TYR 15 2HE TYR 15 10.597 -7.731 -1.768
109 HH TYR 15 HH TYR 15 11.811 -5.812 -2.945
110 H SER 16 H SER 16 4.451 -4.846 -0.246
111 HA SER 16 HA SER 16 6.380 -2.793 0.117
112 1HB SER 16 2HB SER 16 3.401 -2.632 0.599
113 2HB SER 16 1HB SER 16 4.490 -1.329 0.141
114 HG SER 16 HG SER 16 3.708 -3.577 -1.414
115 H ALA 17 H ALA 17 4.703 -4.877 2.274
116 HA ALA 17 HA ALA 17 4.670 -3.252 4.577
117 1HB ALA 17 1HB ALA 17 3.812 -5.793 3.978
118 2HB ALA 17 2HB ALA 17 3.766 -5.038 5.572
119 3HB ALA 17 3HB ALA 17 5.115 -6.086 5.131
120 H ALA 18 H ALA 18 7.315 -4.659 2.912
121 HA ALA 18 HA ALA 18 9.116 -5.243 4.979
122 1HB ALA 18 1HB ALA 18 9.795 -4.062 2.285
123 2HB ALA 18 2HB ALA 18 9.496 -5.774 2.585
124 3HB ALA 18 3HB ALA 18 10.874 -4.973 3.341
125 H LEU 19 H LEU 19 8.403 -2.245 3.296
126 HA LEU 19 HA LEU 19 10.181 -0.638 4.909
127 1HB LEU 19 2HB LEU 19 8.332 -0.209 2.636
128 2HB LEU 19 1HB LEU 19 8.547 1.155 3.700
129 HG LEU 19 HG LEU 19 10.887 1.260 3.226
130 1HD1 LEU 19 1HD1 LEU 19 12.134 -0.335 2.115
131 2HD1 LEU 19 2HD1 LEU 19 10.734 -1.004 1.278
132 3HD1 LEU 19 3HD1 LEU 19 10.988 -1.351 2.989
133 1HD2 LEU 19 1HD2 LEU 19 10.707 1.292 0.597
134 2HD2 LEU 19 2HD2 LEU 19 9.863 2.475 1.593
135 3HD2 LEU 19 3HD2 LEU 19 8.991 1.088 0.944
136 H GLY 20 H GLY 20 6.993 -1.778 4.948
137 1HA GLY 20 2HA GLY 20 5.802 -1.753 7.084
138 2HA GLY 20 1HA GLY 20 6.328 -0.081 7.263
139 H CYS 21 H CYS 21 5.970 1.005 4.937
140 HA CYS 21 HA CYS 21 4.533 2.075 3.638
141 1HB CYS 21 2HB CYS 21 3.653 -0.752 3.448
142 2HB CYS 21 1HB CYS 21 2.608 0.453 2.727
143 H THR 22 H THR 22 3.106 3.539 3.929
144 HA THR 22 HA THR 22 1.551 3.637 6.370
145 HB THR 22 HB THR 22 1.632 5.641 4.183
146 HG1 THR 22 1HG THR 22 3.766 4.646 5.406
147 1HG2 THR 22 1HG2 THR 22 1.306 5.785 7.176
148 2HG2 THR 22 2HG2 THR 22 0.197 6.350 5.927
149 3HG2 THR 22 3HG2 THR 22 1.707 7.212 6.220
150 H CYS 23 H CYS 23 0.846 2.167 3.703
151 HA CYS 23 HA CYS 23 -1.296 3.060 2.348
152 1HB CYS 23 2HB CYS 23 -0.773 0.909 1.686
153 2HB CYS 23 1HB CYS 23 -0.615 0.317 3.337
154 H ASP 24 H ASP 24 -3.504 3.355 2.728
155 HA ASP 24 HA ASP 24 -4.284 3.591 5.505
156 1HB ASP 24 2HB ASP 24 -4.754 5.441 4.037
157 2HB ASP 24 1HB ASP 24 -5.654 4.402 2.940
158 H ASP 25 H ASP 25 -5.728 2.014 2.632
159 HA ASP 25 HA ASP 25 -7.068 0.200 2.384
160 1HB ASP 25 2HB ASP 25 -5.511 -1.184 3.491
161 2HB ASP 25 1HB ASP 25 -5.827 -0.451 5.055
162 H ARG 26 H ARG 26 -8.997 0.277 2.166
163 HA ARG 26 HA ARG 26 -10.847 0.551 4.383
164 1HB ARG 26 2HB ARG 26 -10.867 2.437 2.010
165 2HB ARG 26 1HB ARG 26 -12.057 2.353 3.269
166 1HG ARG 26 2HG ARG 26 -9.215 3.208 3.625
167 2HG ARG 26 1HG ARG 26 -10.611 4.279 3.532
168 1HD ARG 26 2HD ARG 26 -11.483 3.433 5.592
169 2HD ARG 26 1HD ARG 26 -10.271 2.150 5.637
170 HE ARG 26 HE ARG 26 -8.631 3.726 6.199
171 1HH1 ARG 26 1HH1 ARG 26 -11.822 5.146 6.027
172 2HH1 ARG 26 2HH1 ARG 26 -11.312 6.681 6.640
173 1HH2 ARG 26 1HH2 ARG 26 -7.929 5.733 6.940
174 2HH2 ARG 26 2HH2 ARG 26 -9.081 7.018 7.177
175 H SER 27 H SER 27 -12.632 1.370 1.898
176 HA SER 27 HA SER 27 -13.380 -1.316 1.199
177 1HB SER 27 2HB SER 27 -15.082 0.473 1.299
178 2HB SER 27 1HB SER 27 -14.231 1.355 0.034
179 HG SER 27 HG SER 27 -14.572 -0.855 -1.106
180 H ASP 28 H ASP 28 -11.263 1.115 0.244
181 HA ASP 28 HA ASP 28 -9.703 -0.388 -1.463
182 1HB ASP 28 2HB ASP 28 -11.723 -0.027 -2.994
183 2HB ASP 28 1HB ASP 28 -11.337 1.687 -2.964
184 H GLY 29 H GLY 29 -7.887 0.927 -2.278
185 1HA GLY 29 2HA GLY 29 -7.667 3.689 -1.668
186 2HA GLY 29 1HA GLY 29 -6.943 2.738 -0.382
187 H LEU 30 H LEU 30 -4.825 2.880 -0.599
188 HA LEU 30 HA LEU 30 -3.505 1.731 -2.837
189 1HB LEU 30 2HB LEU 30 -4.216 3.909 -3.776
190 2HB LEU 30 1HB LEU 30 -3.325 4.723 -2.510
191 HG LEU 30 HG LEU 30 -1.229 3.678 -3.417
192 1HD1 LEU 30 1HD1 LEU 30 -1.256 2.198 -5.083
193 2HD1 LEU 30 2HD1 LEU 30 -2.395 3.157 -6.028
194 3HD1 LEU 30 3HD1 LEU 30 -2.988 2.058 -4.783
195 1HD2 LEU 30 1HD2 LEU 30 -2.142 5.088 -5.772
196 2HD2 LEU 30 2HD2 LEU 30 -0.938 5.559 -4.572
197 3HD2 LEU 30 3HD2 LEU 30 -2.645 5.903 -4.290
198 H CYS 31 H CYS 31 -1.478 1.102 -2.245
199 HA CYS 31 HA CYS 31 -0.653 1.448 0.463
200 1HB CYS 31 2HB CYS 31 0.901 0.321 -1.862
201 2HB CYS 31 1HB CYS 31 1.304 0.111 -0.173
202 H LYS 32 H LYS 32 0.831 2.819 1.327
203 HA LYS 32 HA LYS 32 2.319 4.547 -0.529
204 1HB LYS 32 2HB LYS 32 0.823 5.254 1.972
205 2HB LYS 32 1HB LYS 32 2.137 6.254 1.412
206 1HG LYS 32 2HG LYS 32 -0.489 5.710 0.097
207 2HG LYS 32 1HG LYS 32 0.253 7.262 0.486
208 1HD LYS 32 2HD LYS 32 1.924 6.923 -1.254
209 2HD LYS 32 1HD LYS 32 1.285 5.315 -1.572
210 1HE LYS 32 2HE LYS 32 0.533 6.883 -3.247
211 2HE LYS 32 1HE LYS 32 -0.823 6.288 -2.294
212 1HZ LYS 32 1HZ LYS 32 -0.516 8.836 -2.813
213 2HZ LYS 32 2HZ LYS 32 0.455 8.773 -1.429
214 3HZ LYS 32 3HZ LYS 32 -1.170 8.310 -1.343
215 H ARG 33 H ARG 33 4.460 4.804 -0.105
216 HA ARG 33 HA ARG 33 5.713 2.834 1.519
217 1HB ARG 33 2HB ARG 33 6.844 5.129 -0.079
218 2HB ARG 33 1HB ARG 33 7.824 3.892 0.684
219 1HG ARG 33 2HG ARG 33 6.857 2.196 -0.721
220 2HG ARG 33 1HG ARG 33 5.738 3.371 -1.417
221 1HD ARG 33 2HD ARG 33 7.720 4.660 -2.226
222 2HD ARG 33 1HD ARG 33 8.741 3.330 -1.678
223 HE ARG 33 HE ARG 33 6.767 2.279 -3.356
224 1HH1 ARG 33 1HH1 ARG 33 9.543 4.401 -3.566
225 2HH1 ARG 33 2HH1 ARG 33 9.879 4.003 -5.218
226 1HH2 ARG 33 1HH2 ARG 33 7.188 1.751 -5.517
227 2HH2 ARG 33 2HH2 ARG 33 8.529 2.487 -6.339
228 H ASN 34 H ASN 34 8.079 4.169 2.164
229 HA ASN 34 HA ASN 34 7.487 6.119 4.252
230 1HB ASN 34 2HB ASN 34 9.278 3.856 4.931
231 2HB ASN 34 1HB ASN 34 8.421 4.899 6.010
232 1HD2 ASN 34 1HD2 ASN 34 6.878 3.920 7.115
233 2HD2 ASN 34 2HD2 ASN 34 5.960 2.554 6.587
234 H GLY 35 H GLY 35 9.400 7.349 4.759
235 1HA GLY 35 2HA GLY 35 11.585 8.148 4.449
236 2HA GLY 35 1HA GLY 35 11.903 6.770 3.388
237 H ASP 36 H ASP 36 10.022 6.821 1.679
238 HA ASP 36 HA ASP 36 9.786 9.432 0.377
239 1HB ASP 36 2HB ASP 36 10.599 6.848 -1.009
240 2HB ASP 36 1HB ASP 36 10.141 8.325 -1.842
241 HA PRO 37 HA PRO 37 6.045 6.545 1.206
242 1HB PRO 37 2HB PRO 37 5.201 9.218 2.322
243 2HB PRO 37 1HB PRO 37 4.750 7.589 2.875
244 1HG PRO 37 2HG PRO 37 6.665 8.647 4.230
245 2HG PRO 37 1HG PRO 37 7.037 7.103 3.463
246 1HD PRO 37 2HD PRO 37 7.609 9.844 2.341
247 2HD PRO 37 1HD PRO 37 8.779 8.555 2.728
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