Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
559953 | 2lr7 RC | 18350 | cing | 1-original | 2 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 H1 ARG 1 H1 ARG 1 -5.679 -1.703 5.746
2 H2 ARG 1 H2 ARG 1 -6.372 -0.164 5.818
3 H3 ARG 1 H3 ARG 1 -6.071 -0.887 4.317
4 HA ARG 1 HA ARG 1 -7.689 -2.617 4.801
5 HB2 ARG 1 HB3 ARG 1 -8.347 -0.952 7.237
6 HB3 ARG 1 HB2 ARG 1 -9.107 -2.458 6.749
7 HG2 ARG 1 HG3 ARG 1 -7.111 -3.689 7.240
8 HG3 ARG 1 HG2 ARG 1 -6.224 -2.196 7.563
9 HD2 ARG 1 HD3 ARG 1 -8.579 -3.249 9.124
10 HD3 ARG 1 HD2 ARG 1 -6.895 -3.260 9.645
11 HE ARG 1 HE ARG 1 -7.935 -0.646 8.997
12 HH11 ARG 1 HH12 ARG 1 -7.501 -3.038 11.505
13 HH12 ARG 1 HH11 ARG 1 -7.583 -1.887 12.797
14 HH21 ARG 1 HH21 ARG 1 -8.060 0.879 10.690
15 HH22 ARG 1 HH22 ARG 1 -7.898 0.346 12.333
16 H LYS 2 H LYS 2 -9.192 -2.198 3.354
17 HA LYS 2 HA LYS 2 -11.191 -0.279 3.511
18 HB2 LYS 2 HB3 LYS 2 -8.726 0.775 2.418
19 HB3 LYS 2 HB2 LYS 2 -9.985 0.783 1.199
20 HG2 LYS 2 HG3 LYS 2 -11.425 1.917 3.027
21 HG3 LYS 2 HG2 LYS 2 -9.873 2.237 3.810
22 HD2 LYS 2 HD3 LYS 2 -10.416 4.144 2.480
23 HD3 LYS 2 HD2 LYS 2 -9.108 3.284 1.667
24 HE2 LYS 2 HE3 LYS 2 -10.814 2.193 0.216
25 HE3 LYS 2 HE2 LYS 2 -12.041 3.207 0.970
26 HZ1 LYS 2 HZ1 LYS 2 -9.708 4.158 -0.598
27 HZ2 LYS 2 HZ2 LYS 2 -10.842 5.157 0.166
28 HZ3 LYS 2 HZ3 LYS 2 -11.320 4.152 -1.107
29 H CYS 3 H CYS 3 -9.033 -2.001 1.344
30 HA CYS 3 HA CYS 3 -11.313 -2.850 -0.279
31 HB2 CYS 3 HB3 CYS 3 -9.534 -2.376 -2.229
32 HB3 CYS 3 HB2 CYS 3 -10.671 -1.149 -1.669
33 H ASN 4 H ASN 4 -7.816 -3.107 -0.807
34 HA ASN 4 HA ASN 4 -7.548 -5.780 0.075
35 HB2 ASN 4 HB3 ASN 4 -7.365 -6.918 -2.086
36 HB3 ASN 4 HB2 ASN 4 -8.976 -6.244 -1.886
37 HD21 ASN 4 HD22 ASN 4 -7.545 -6.990 -4.309
38 HD22 ASN 4 HD21 ASN 4 -7.493 -5.566 -5.291
39 H PHE 5 H PHE 5 -5.539 -6.720 -1.462
40 HA PHE 5 HA PHE 5 -3.306 -5.186 -0.769
41 HB2 PHE 5 HB3 PHE 5 -2.121 -6.722 -2.464
42 HB3 PHE 5 HB2 PHE 5 -2.894 -7.472 -1.075
43 HD1 PHE 5 HD2 PHE 5 -3.460 -6.670 -4.668
44 HD2 PHE 5 HD1 PHE 5 -4.434 -9.177 -1.371
45 HE1 PHE 5 HE2 PHE 5 -4.737 -8.139 -6.169
46 HE2 PHE 5 HE1 PHE 5 -5.716 -10.649 -2.867
47 HZ PHE 5 HZ PHE 5 -5.867 -10.132 -5.269
48 H LEU 6 H LEU 6 -1.739 -4.130 -2.160
49 HA LEU 6 HA LEU 6 -1.241 -2.402 -3.538
50 HB2 LEU 6 HB3 LEU 6 -2.833 -4.154 -5.415
51 HB3 LEU 6 HB2 LEU 6 -1.945 -2.742 -5.943
52 HG LEU 6 HG LEU 6 -0.664 -4.719 -6.447
53 HD11 LEU 6 HD11 LEU 6 0.619 -3.422 -4.058
54 HD12 LEU 6 HD12 LEU 6 0.516 -2.677 -5.656
55 HD13 LEU 6 HD13 LEU 6 1.409 -4.180 -5.441
56 HD21 LEU 6 HD21 LEU 6 -1.607 -6.245 -4.792
57 HD22 LEU 6 HD22 LEU 6 -0.772 -5.371 -3.506
58 HD23 LEU 6 HD23 LEU 6 0.153 -6.240 -4.733
59 H CYS 7 H CYS 7 -3.028 -1.498 -1.895
60 HA CYS 7 HA CYS 7 -4.679 0.326 -3.289
61 HB2 CYS 7 HB3 CYS 7 -6.008 -1.740 -3.667
62 HB3 CYS 7 HB2 CYS 7 -6.140 -1.952 -1.927
63 H LYS 8 H LYS 8 -4.612 -1.535 -0.240
64 HA LYS 8 HA LYS 8 -3.603 0.658 1.243
65 HB2 LYS 8 HB3 LYS 8 -6.086 1.251 1.030
66 HB3 LYS 8 HB2 LYS 8 -6.407 -0.153 2.039
67 HG2 LYS 8 HG3 LYS 8 -4.994 0.825 3.809
68 HG3 LYS 8 HG2 LYS 8 -4.755 2.252 2.801
69 HD2 LYS 8 HD3 LYS 8 -7.178 2.662 2.837
70 HD3 LYS 8 HD2 LYS 8 -7.390 1.249 3.873
71 HE2 LYS 8 HE3 LYS 8 -5.908 2.318 5.549
72 HE3 LYS 8 HE2 LYS 8 -5.852 3.753 4.531
73 HZ1 LYS 8 HZ1 LYS 8 -8.195 4.057 4.809
74 HZ2 LYS 8 HZ2 LYS 8 -7.488 3.907 6.337
75 HZ3 LYS 8 HZ3 LYS 8 -8.340 2.608 5.671
76 H LEU 9 H LEU 9 -2.962 -2.022 0.673
77 HA LEU 9 HA LEU 9 -2.814 -3.131 3.368
78 HB2 LEU 9 HB3 LEU 9 -4.013 -4.542 1.010
79 HB3 LEU 9 HB2 LEU 9 -3.124 -5.467 2.201
80 HG LEU 9 HG LEU 9 -4.738 -4.439 3.927
81 HD11 LEU 9 HD11 LEU 9 -6.314 -3.932 1.410
82 HD12 LEU 9 HD12 LEU 9 -5.694 -2.706 2.517
83 HD13 LEU 9 HD13 LEU 9 -6.936 -3.835 3.056
84 HD21 LEU 9 HD21 LEU 9 -6.387 -6.181 3.501
85 HD22 LEU 9 HD22 LEU 9 -4.747 -6.781 3.256
86 HD23 LEU 9 HD23 LEU 9 -5.758 -6.385 1.866
87 H LYS 10 H LYS 10 -2.003 -5.000 0.535
88 HA LYS 10 HA LYS 10 0.830 -4.673 1.113
89 HB2 LYS 10 HB3 LYS 10 -0.314 -6.914 0.545
90 HB3 LYS 10 HB2 LYS 10 -0.332 -6.337 -1.115
91 HG2 LYS 10 HG3 LYS 10 2.065 -6.208 -1.158
92 HG3 LYS 10 HG2 LYS 10 2.156 -6.601 0.559
93 HD2 LYS 10 HD3 LYS 10 2.657 -8.595 -0.622
94 HD3 LYS 10 HD2 LYS 10 1.020 -8.779 0.007
95 HE2 LYS 10 HE3 LYS 10 0.973 -9.572 -2.222
96 HE3 LYS 10 HE2 LYS 10 0.193 -7.991 -2.242
97 HZ1 LYS 10 HZ1 LYS 10 3.020 -8.503 -2.992
98 HZ2 LYS 10 HZ2 LYS 10 2.214 -7.020 -3.086
99 HZ3 LYS 10 HZ3 LYS 10 1.750 -8.299 -4.085
100 H GLU 11 H GLU 11 1.171 -2.607 0.499
101 HA GLU 11 HA GLU 11 -0.007 -1.348 -1.721
102 HB2 GLU 11 HB3 GLU 11 2.375 -0.343 -0.188
103 HB3 GLU 11 HB2 GLU 11 1.124 0.597 -0.991
104 HG2 GLU 11 HG3 GLU 11 0.708 -1.143 1.422
105 HG3 GLU 11 HG2 GLU 11 0.908 0.604 1.449
106 H LYS 12 H LYS 12 1.840 0.288 -2.766
107 HA LYS 12 HA LYS 12 3.704 -1.413 -4.227
108 HB2 LYS 12 HB3 LYS 12 2.601 0.125 -6.249
109 HB3 LYS 12 HB2 LYS 12 2.287 -1.578 -5.953
110 HG2 LYS 12 HG3 LYS 12 0.161 -0.692 -6.131
111 HG3 LYS 12 HG2 LYS 12 0.411 -0.754 -4.392
112 HD2 LYS 12 HD3 LYS 12 -0.624 1.327 -4.917
113 HD3 LYS 12 HD2 LYS 12 1.047 1.673 -4.480
114 HE2 LYS 12 HE3 LYS 12 0.519 2.978 -6.409
115 HE3 LYS 12 HE2 LYS 12 1.575 1.674 -6.935
116 HZ1 LYS 12 HZ1 LYS 12 -0.225 1.944 -8.478
117 HZ2 LYS 12 HZ2 LYS 12 -1.369 1.768 -7.244
118 HZ3 LYS 12 HZ3 LYS 12 -0.395 0.461 -7.685
119 H LEU 13 H LEU 13 2.545 1.814 -5.033
120 HA LEU 13 HA LEU 13 4.458 3.227 -3.537
121 HB2 LEU 13 HB3 LEU 13 5.902 4.113 -5.230
122 HB3 LEU 13 HB2 LEU 13 6.006 2.374 -5.252
123 HG LEU 13 HG LEU 13 6.152 2.982 -7.480
124 HD11 LEU 13 HD11 LEU 13 3.239 2.395 -7.106
125 HD12 LEU 13 HD12 LEU 13 4.535 1.209 -7.228
126 HD13 LEU 13 HD13 LEU 13 4.143 2.235 -8.609
127 HD21 LEU 13 HD21 LEU 13 4.726 4.602 -8.616
128 HD22 LEU 13 HD22 LEU 13 5.605 5.323 -7.267
129 HD23 LEU 13 HD23 LEU 13 3.894 4.931 -7.095
130 H ARG 14 H ARG 14 3.385 5.028 -3.001
131 HA ARG 14 HA ARG 14 2.056 6.568 -5.014
132 HB2 ARG 14 HB3 ARG 14 0.460 4.652 -4.365
133 HB3 ARG 14 HB2 ARG 14 0.238 5.529 -2.861
134 HG2 ARG 14 HG3 ARG 14 -1.520 5.982 -4.536
135 HG3 ARG 14 HG2 ARG 14 -0.648 7.429 -4.032
136 HD2 ARG 14 HD3 ARG 14 0.200 5.919 -6.473
137 HD3 ARG 14 HD2 ARG 14 -1.146 7.055 -6.548
138 HE ARG 14 HE ARG 14 0.547 8.694 -5.568
139 HH11 ARG 14 HH11 ARG 14 1.423 6.083 -7.738
140 HH12 ARG 14 HH12 ARG 14 2.807 6.916 -8.370
141 HH21 ARG 14 HH22 ARG 14 2.354 9.777 -6.390
142 HH22 ARG 14 HH21 ARG 14 3.341 9.018 -7.598
143 H THR 15 H THR 15 0.912 6.536 -1.660
144 HA THR 15 HA THR 15 2.629 8.744 -0.985
145 HB THR 15 HB THR 15 1.139 10.022 -2.245
146 HG1 THR 15 HG1 THR 15 1.622 10.862 -0.125
147 HG21 THR 15 HG21 THR 15 -1.240 8.973 -0.747
148 HG22 THR 15 HG22 THR 15 -0.704 8.313 -2.292
149 HG23 THR 15 HG23 THR 15 -1.218 9.993 -2.182
150 H VAL 16 H VAL 16 -0.651 7.867 0.233
151 HA VAL 16 HA VAL 16 0.631 7.101 2.749
152 HB VAL 16 HB VAL 16 -1.589 9.139 2.564
153 HG11 VAL 16 HG11 VAL 16 -0.543 7.514 4.839
154 HG12 VAL 16 HG12 VAL 16 -2.210 7.920 4.422
155 HG13 VAL 16 HG13 VAL 16 -1.155 9.144 5.132
156 HG21 VAL 16 HG21 VAL 16 -0.013 10.611 3.731
157 HG22 VAL 16 HG22 VAL 16 0.626 10.083 2.174
158 HG23 VAL 16 HG23 VAL 16 1.213 9.346 3.666
159 H ILE 17 H ILE 17 -2.625 7.471 1.268
160 HA ILE 17 HA ILE 17 -3.706 5.403 2.870
161 HB ILE 17 HB ILE 17 -5.073 7.204 1.855
162 HG12 ILE 17 HG13 ILE 17 -6.052 5.001 2.645
163 HG13 ILE 17 HG12 ILE 17 -7.043 5.940 1.543
164 HG21 ILE 17 HG21 ILE 17 -4.694 5.709 -0.723
165 HG22 ILE 17 HG22 ILE 17 -4.092 7.321 -0.336
166 HG23 ILE 17 HG23 ILE 17 -5.826 7.035 -0.460
167 HD11 ILE 17 HD11 ILE 17 -7.290 3.769 0.794
168 HD12 ILE 17 HD12 ILE 17 -5.590 3.373 1.060
169 HD13 ILE 17 HD13 ILE 17 -6.056 4.420 -0.285
170 H THR 18 H THR 18 -2.599 5.422 -0.529
171 HA THR 18 HA THR 18 -2.798 2.528 -0.628
172 HB THR 18 HB THR 18 -1.714 4.347 -2.773
173 HG1 THR 18 HG1 THR 18 -4.390 3.828 -1.972
174 HG21 THR 18 HG21 THR 18 -1.426 1.949 -3.128
175 HG22 THR 18 HG22 THR 18 -2.604 2.621 -4.248
176 HG23 THR 18 HG23 THR 18 -3.151 1.692 -2.857
177 H SER 19 H SER 19 -0.654 4.737 0.501
178 HA SER 19 HA SER 19 1.545 2.790 0.298
179 HB2 SER 19 HB3 SER 19 2.260 4.873 -0.629
180 HB3 SER 19 HB2 SER 19 1.534 5.787 0.687
181 HG SER 19 HG SER 19 3.119 4.592 2.050
182 H HIS 20 H HIS 20 -0.418 2.118 2.026
183 HA HIS 20 HA HIS 20 0.039 3.419 4.582
184 HB2 HIS 20 HB3 HIS 20 -2.221 2.507 3.406
185 HB3 HIS 20 HB2 HIS 20 -1.832 1.147 4.459
186 HD1 HIS 20 HD1 HIS 20 -2.877 1.345 6.693
187 HD2 HIS 20 HD2 HIS 20 -2.070 5.064 5.027
188 HE1 HIS 20 HE1 HIS 20 -3.718 3.031 8.359
189 HE2 HIS 20 HE2 HIS 20 -3.047 5.264 7.408
190 H ILE 21 H ILE 21 -0.107 -0.023 3.541
191 HA ILE 21 HA ILE 21 1.506 -0.638 5.931
192 HB ILE 21 HB ILE 21 -0.166 -2.517 4.256
193 HG12 ILE 21 HG13 ILE 21 -1.546 -0.919 5.500
194 HG13 ILE 21 HG12 ILE 21 -1.704 -2.537 6.171
195 HG21 ILE 21 HG21 ILE 21 0.199 -4.127 6.063
196 HG22 ILE 21 HG22 ILE 21 1.254 -2.972 6.878
197 HG23 ILE 21 HG23 ILE 21 1.720 -3.640 5.314
198 HD11 ILE 21 HD11 ILE 21 -1.580 -0.908 7.941
199 HD12 ILE 21 HD12 ILE 21 -0.058 -0.288 7.302
200 HD13 ILE 21 HD13 ILE 21 -0.137 -1.921 7.959
201 H ASP 22 H ASP 22 1.091 -2.127 2.738
202 HA ASP 22 HA ASP 22 2.566 -2.754 1.122
203 HB2 ASP 22 HB3 ASP 22 3.875 -0.716 1.456
204 HB3 ASP 22 HB2 ASP 22 4.712 -1.459 2.805
205 H LYS 23 H LYS 23 4.257 -4.340 0.727
206 HA LYS 23 HA LYS 23 4.219 -6.591 2.340
207 HB2 LYS 23 HB3 LYS 23 6.180 -7.329 1.080
208 HB3 LYS 23 HB2 LYS 23 5.010 -6.576 0.010
209 HG2 LYS 23 HG3 LYS 23 6.514 -4.441 0.511
210 HG3 LYS 23 HG2 LYS 23 7.727 -5.689 0.787
211 HD2 LYS 23 HD3 LYS 23 7.924 -5.117 -1.491
212 HD3 LYS 23 HD2 LYS 23 7.033 -6.641 -1.472
213 HE2 LYS 23 HE3 LYS 23 4.926 -5.397 -1.678
214 HE3 LYS 23 HE2 LYS 23 5.831 -3.885 -1.728
215 HZ1 LYS 23 HZ1 LYS 23 6.009 -6.085 -3.716
216 HZ2 LYS 23 HZ2 LYS 23 6.900 -4.646 -3.763
217 HZ3 LYS 23 HZ3 LYS 23 5.219 -4.606 -3.935
218 H VAL 24 H VAL 24 6.386 -3.791 2.357
219 HA VAL 24 HA VAL 24 6.806 -3.237 4.855
220 HB VAL 24 HB VAL 24 7.262 -5.672 5.378
221 HG11 VAL 24 HG11 VAL 24 9.877 -5.081 4.008
222 HG12 VAL 24 HG12 VAL 24 8.673 -6.281 3.536
223 HG13 VAL 24 HG13 VAL 24 9.569 -6.477 5.042
224 HG21 VAL 24 HG21 VAL 24 7.804 -3.935 6.963
225 HG22 VAL 24 HG22 VAL 24 9.346 -3.642 6.160
226 HG23 VAL 24 HG23 VAL 24 9.059 -5.174 6.984
227 H LEU 25 H LEU 25 8.327 -3.852 1.834
228 HA LEU 25 HA LEU 25 10.829 -2.595 2.502
229 HB2 LEU 25 HB3 LEU 25 9.721 -3.653 -0.083
230 HB3 LEU 25 HB2 LEU 25 11.254 -2.811 0.002
231 HG LEU 25 HG LEU 25 11.843 -4.625 1.793
232 HD11 LEU 25 HD11 LEU 25 9.582 -5.573 1.904
233 HD12 LEU 25 HD12 LEU 25 10.789 -6.764 1.421
234 HD13 LEU 25 HD13 LEU 25 9.716 -6.056 0.213
235 HD21 LEU 25 HD21 LEU 25 12.715 -6.067 0.013
236 HD22 LEU 25 HD22 LEU 25 12.985 -4.359 -0.331
237 HD23 LEU 25 HD23 LEU 25 11.694 -5.231 -1.156
238 H ARG 26 H ARG 26 8.005 -1.684 0.498
239 HA ARG 26 HA ARG 26 8.771 1.078 0.660
240 HB2 ARG 26 HB3 ARG 26 8.883 1.259 -1.919
241 HB3 ARG 26 HB2 ARG 26 10.302 0.717 -1.039
242 HG2 ARG 26 HG3 ARG 26 10.348 -0.917 -2.566
243 HG3 ARG 26 HG2 ARG 26 9.091 -1.653 -1.574
244 HD2 ARG 26 HD3 ARG 26 8.376 -1.693 -3.859
245 HD3 ARG 26 HD2 ARG 26 7.396 -0.510 -2.993
246 HE ARG 26 HE ARG 26 9.464 0.943 -4.052
247 HH11 ARG 26 HH11 ARG 26 6.969 -1.152 -5.330
248 HH12 ARG 26 HH12 ARG 26 6.918 -0.363 -6.873
249 HH21 ARG 26 HH22 ARG 26 9.390 1.991 -6.085
250 HH22 ARG 26 HH21 ARG 26 8.293 1.425 -7.302
251 HA PRO 27 HA PRO 27 4.277 0.712 0.034
252 HB2 PRO 27 HB2 PRO 27 4.151 2.996 1.839
253 HB3 PRO 27 HB3 PRO 27 3.462 1.374 2.043
254 HG2 PRO 27 HG3 PRO 27 5.538 2.313 3.533
255 HG3 PRO 27 HG2 PRO 27 5.308 0.597 3.154
256 HD2 PRO 27 HD3 PRO 27 7.160 2.586 1.899
257 HD3 PRO 27 HD2 PRO 27 7.448 0.881 2.309
258 H GLN 28 H GLN 28 6.250 3.661 0.288
259 HA GLN 28 HA GLN 28 4.442 5.043 -1.536
260 HB2 GLN 28 HB3 GLN 28 5.433 6.087 0.596
261 HB3 GLN 28 HB2 GLN 28 6.937 6.200 -0.308
262 HG2 GLN 28 HG3 GLN 28 5.791 7.546 -2.011
263 HG3 GLN 28 HG2 GLN 28 4.314 7.467 -1.056
264 HE21 GLN 28 HE22 GLN 28 4.195 8.592 0.891
265 HE22 GLN 28 HE21 GLN 28 5.286 9.881 1.266
266 H GLY 29 H GLY 29 7.143 3.126 -1.675
267 HA2 GLY 29 HA3 GLY 29 7.764 2.545 -4.003
268 HA3 GLY 29 HA2 GLY 29 7.920 4.274 -4.276
Start of MODEL 2
1 H1 ARG 1 H1 ARG 1 -10.645 3.000 3.509
2 H2 ARG 1 H2 ARG 1 -10.566 1.335 3.768
3 H3 ARG 1 H3 ARG 1 -11.574 2.287 4.727
4 HA ARG 1 HA ARG 1 -12.861 1.086 3.111
5 HB2 ARG 1 HB3 ARG 1 -12.646 4.058 2.602
6 HB3 ARG 1 HB2 ARG 1 -13.978 3.050 2.050
7 HG2 ARG 1 HG3 ARG 1 -14.603 2.549 4.320
8 HG3 ARG 1 HG2 ARG 1 -13.195 3.420 4.934
9 HD2 ARG 1 HD3 ARG 1 -15.191 4.785 5.131
10 HD3 ARG 1 HD2 ARG 1 -14.072 5.494 3.971
11 HE ARG 1 HE ARG 1 -16.187 3.803 2.897
12 HH11 ARG 1 HH12 ARG 1 -15.013 7.033 3.553
13 HH12 ARG 1 HH11 ARG 1 -16.083 7.792 2.419
14 HH21 ARG 1 HH21 ARG 1 -17.604 4.797 1.413
15 HH22 ARG 1 HH22 ARG 1 -17.555 6.517 1.196
16 H LYS 2 H LYS 2 -10.245 0.622 2.103
17 HA LYS 2 HA LYS 2 -10.825 0.874 -0.762
18 HB2 LYS 2 HB3 LYS 2 -8.112 1.270 0.512
19 HB3 LYS 2 HB2 LYS 2 -8.381 1.096 -1.215
20 HG2 LYS 2 HG3 LYS 2 -10.063 3.124 -0.687
21 HG3 LYS 2 HG2 LYS 2 -8.835 3.392 0.557
22 HD2 LYS 2 HD3 LYS 2 -7.091 3.438 -1.120
23 HD3 LYS 2 HD2 LYS 2 -8.258 3.051 -2.385
24 HE2 LYS 2 HE3 LYS 2 -7.723 5.431 -2.375
25 HE3 LYS 2 HE2 LYS 2 -9.416 5.153 -1.974
26 HZ1 LYS 2 HZ1 LYS 2 -8.471 6.809 -0.526
27 HZ2 LYS 2 HZ2 LYS 2 -7.241 5.753 -0.048
28 HZ3 LYS 2 HZ3 LYS 2 -8.845 5.426 0.373
29 H CYS 3 H CYS 3 -8.601 -0.539 -1.661
30 HA CYS 3 HA CYS 3 -9.447 -3.220 -1.094
31 HB2 CYS 3 HB3 CYS 3 -7.147 -3.245 -2.724
32 HB3 CYS 3 HB2 CYS 3 -8.824 -3.428 -3.229
33 H ASN 4 H ASN 4 -7.217 -4.747 -1.307
34 HA ASN 4 HA ASN 4 -5.770 -4.131 1.177
35 HB2 ASN 4 HB3 ASN 4 -6.393 -6.746 -0.192
36 HB3 ASN 4 HB2 ASN 4 -5.209 -6.615 1.104
37 HD21 ASN 4 HD22 ASN 4 -7.833 -7.997 0.887
38 HD22 ASN 4 HD21 ASN 4 -8.729 -7.459 2.264
39 H PHE 5 H PHE 5 -4.568 -6.536 -0.999
40 HA PHE 5 HA PHE 5 -2.011 -5.331 -0.877
41 HB2 PHE 5 HB3 PHE 5 -1.340 -7.156 -2.459
42 HB3 PHE 5 HB2 PHE 5 -2.088 -7.697 -0.968
43 HD1 PHE 5 HD2 PHE 5 -2.827 -7.059 -4.554
44 HD2 PHE 5 HD1 PHE 5 -3.927 -9.108 -0.995
45 HE1 PHE 5 HE2 PHE 5 -4.458 -8.382 -5.829
46 HE2 PHE 5 HE1 PHE 5 -5.562 -10.436 -2.263
47 HZ PHE 5 HZ PHE 5 -5.830 -10.074 -4.684
48 H LEU 6 H LEU 6 -0.811 -4.310 -2.360
49 HA LEU 6 HA LEU 6 -0.389 -2.728 -3.925
50 HB2 LEU 6 HB3 LEU 6 -2.323 -4.395 -5.539
51 HB3 LEU 6 HB2 LEU 6 -1.435 -3.040 -6.196
52 HG LEU 6 HG LEU 6 -0.266 -4.928 -6.910
53 HD11 LEU 6 HD11 LEU 6 1.189 -4.028 -4.426
54 HD12 LEU 6 HD12 LEU 6 1.193 -3.206 -5.986
55 HD13 LEU 6 HD13 LEU 6 1.892 -4.814 -5.844
56 HD21 LEU 6 HD21 LEU 6 -1.300 -6.612 -5.558
57 HD22 LEU 6 HD22 LEU 6 -0.485 -6.014 -4.110
58 HD23 LEU 6 HD23 LEU 6 0.449 -6.750 -5.415
59 H CYS 7 H CYS 7 -2.130 -1.900 -1.996
60 HA CYS 7 HA CYS 7 -3.633 0.156 -3.302
61 HB2 CYS 7 HB3 CYS 7 -5.118 -1.811 -3.699
62 HB3 CYS 7 HB2 CYS 7 -5.250 -2.024 -1.959
63 H LYS 8 H LYS 8 -3.331 -1.803 -0.424
64 HA LYS 8 HA LYS 8 -2.817 0.546 1.224
65 HB2 LYS 8 HB3 LYS 8 -5.198 0.282 1.507
66 HB3 LYS 8 HB2 LYS 8 -5.035 -1.452 1.723
67 HG2 LYS 8 HG3 LYS 8 -4.333 -1.256 3.893
68 HG3 LYS 8 HG2 LYS 8 -3.683 0.368 3.650
69 HD2 LYS 8 HD3 LYS 8 -5.816 0.158 5.039
70 HD3 LYS 8 HD2 LYS 8 -5.809 1.358 3.750
71 HE2 LYS 8 HE3 LYS 8 -7.914 0.138 3.792
72 HE3 LYS 8 HE2 LYS 8 -7.034 -0.188 2.302
73 HZ1 LYS 8 HZ1 LYS 8 -7.199 -1.967 4.675
74 HZ2 LYS 8 HZ2 LYS 8 -6.284 -2.285 3.291
75 HZ3 LYS 8 HZ3 LYS 8 -7.968 -2.208 3.189
76 H LEU 9 H LEU 9 -2.997 -2.887 0.748
77 HA LEU 9 HA LEU 9 -0.551 -3.255 2.314
78 HB2 LEU 9 HB3 LEU 9 -2.457 -5.201 1.019
79 HB3 LEU 9 HB2 LEU 9 -0.934 -5.692 1.728
80 HG LEU 9 HG LEU 9 -1.838 -4.641 3.905
81 HD11 LEU 9 HD11 LEU 9 -4.307 -4.739 4.071
82 HD12 LEU 9 HD12 LEU 9 -4.370 -4.941 2.320
83 HD13 LEU 9 HD13 LEU 9 -3.721 -3.456 3.010
84 HD21 LEU 9 HD21 LEU 9 -2.982 -6.723 4.481
85 HD22 LEU 9 HD22 LEU 9 -1.502 -7.029 3.573
86 HD23 LEU 9 HD23 LEU 9 -3.070 -7.150 2.772
87 H LYS 10 H LYS 10 0.261 -5.483 0.659
88 HA LYS 10 HA LYS 10 2.297 -5.510 -0.403
89 HB2 LYS 10 HB3 LYS 10 0.363 -6.260 -1.899
90 HB3 LYS 10 HB2 LYS 10 0.654 -4.772 -2.779
91 HG2 LYS 10 HG3 LYS 10 1.856 -6.483 -3.887
92 HG3 LYS 10 HG2 LYS 10 3.028 -5.474 -3.040
93 HD2 LYS 10 HD3 LYS 10 3.654 -7.752 -2.700
94 HD3 LYS 10 HD2 LYS 10 3.004 -7.141 -1.180
95 HE2 LYS 10 HE3 LYS 10 2.068 -9.284 -1.452
96 HE3 LYS 10 HE2 LYS 10 0.789 -8.147 -1.881
97 HZ1 LYS 10 HZ1 LYS 10 1.298 -8.514 -4.214
98 HZ2 LYS 10 HZ2 LYS 10 0.915 -9.973 -3.450
99 HZ3 LYS 10 HZ3 LYS 10 2.525 -9.598 -3.803
100 H GLU 11 H GLU 11 0.741 -2.834 -2.196
101 HA GLU 11 HA GLU 11 1.357 -0.621 -2.340
102 HB2 GLU 11 HB3 GLU 11 2.993 -1.240 -0.323
103 HB3 GLU 11 HB2 GLU 11 4.202 -1.104 -1.585
104 HG2 GLU 11 HG3 GLU 11 2.257 1.049 -0.803
105 HG3 GLU 11 HG2 GLU 11 3.934 0.942 -0.276
106 H LYS 12 H LYS 12 2.366 0.573 -4.050
107 HA LYS 12 HA LYS 12 3.954 -0.951 -5.956
108 HB2 LYS 12 HB3 LYS 12 2.437 -0.776 -7.782
109 HB3 LYS 12 HB2 LYS 12 1.543 -1.462 -6.442
110 HG2 LYS 12 HG3 LYS 12 1.416 1.471 -6.803
111 HG3 LYS 12 HG2 LYS 12 0.579 0.464 -7.980
112 HD2 LYS 12 HD3 LYS 12 -0.503 -0.685 -5.970
113 HD3 LYS 12 HD2 LYS 12 0.106 0.682 -5.017
114 HE2 LYS 12 HE3 LYS 12 -1.140 2.240 -6.291
115 HE3 LYS 12 HE2 LYS 12 -1.512 1.042 -7.527
116 HZ1 LYS 12 HZ1 LYS 12 -2.584 1.154 -4.764
117 HZ2 LYS 12 HZ2 LYS 12 -2.832 -0.151 -5.817
118 HZ3 LYS 12 HZ3 LYS 12 -3.434 1.382 -6.203
119 H LEU 13 H LEU 13 4.513 1.371 -4.386
120 HA LEU 13 HA LEU 13 5.460 3.414 -4.523
121 HB2 LEU 13 HB3 LEU 13 6.677 2.470 -6.462
122 HB3 LEU 13 HB2 LEU 13 5.383 3.000 -7.517
123 HG LEU 13 HG LEU 13 5.883 5.347 -6.937
124 HD11 LEU 13 HD11 LEU 13 6.799 5.054 -4.725
125 HD12 LEU 13 HD12 LEU 13 7.982 5.860 -5.757
126 HD13 LEU 13 HD13 LEU 13 8.164 4.147 -5.377
127 HD21 LEU 13 HD21 LEU 13 8.238 3.762 -7.949
128 HD22 LEU 13 HD22 LEU 13 8.001 5.496 -8.159
129 HD23 LEU 13 HD23 LEU 13 6.889 4.356 -8.913
130 H ARG 14 H ARG 14 2.938 3.466 -3.935
131 HA ARG 14 HA ARG 14 1.699 5.505 -5.666
132 HB2 ARG 14 HB3 ARG 14 0.458 3.350 -5.232
133 HB3 ARG 14 HB2 ARG 14 0.338 3.840 -3.549
134 HG2 ARG 14 HG3 ARG 14 -1.710 4.348 -4.742
135 HG3 ARG 14 HG2 ARG 14 -0.915 5.833 -4.215
136 HD2 ARG 14 HD3 ARG 14 -0.014 6.171 -6.440
137 HD3 ARG 14 HD2 ARG 14 -0.709 4.644 -6.979
138 HE ARG 14 HE ARG 14 -2.857 6.047 -6.092
139 HH11 ARG 14 HH11 ARG 14 -0.270 6.740 -8.338
140 HH12 ARG 14 HH12 ARG 14 -1.235 7.766 -9.347
141 HH21 ARG 14 HH22 ARG 14 -4.154 7.388 -7.433
142 HH22 ARG 14 HH21 ARG 14 -3.452 8.120 -8.841
143 H THR 15 H THR 15 3.027 4.916 -2.514
144 HA THR 15 HA THR 15 3.349 6.185 -0.717
145 HB THR 15 HB THR 15 4.036 8.475 -1.178
146 HG1 THR 15 HG1 THR 15 2.448 8.299 -3.264
147 HG21 THR 15 HG21 THR 15 5.911 7.934 -2.651
148 HG22 THR 15 HG22 THR 15 5.074 6.468 -3.162
149 HG23 THR 15 HG23 THR 15 5.607 6.642 -1.491
150 H VAL 16 H VAL 16 1.327 5.770 0.175
151 HA VAL 16 HA VAL 16 -0.077 7.944 1.162
152 HB VAL 16 HB VAL 16 -0.895 8.050 -1.236
153 HG11 VAL 16 HG11 VAL 16 -2.422 5.558 -0.531
154 HG12 VAL 16 HG12 VAL 16 -1.087 5.666 -1.679
155 HG13 VAL 16 HG13 VAL 16 -2.599 6.518 -2.001
156 HG21 VAL 16 HG21 VAL 16 -2.902 7.746 0.982
157 HG22 VAL 16 HG22 VAL 16 -3.294 8.379 -0.615
158 HG23 VAL 16 HG23 VAL 16 -2.129 9.218 0.406
159 H ILE 17 H ILE 17 -2.689 6.218 1.248
160 HA ILE 17 HA ILE 17 -1.938 4.615 3.461
161 HB ILE 17 HB ILE 17 -4.177 3.688 3.430
162 HG12 ILE 17 HG13 ILE 17 -5.067 5.273 1.099
163 HG13 ILE 17 HG12 ILE 17 -4.077 3.867 0.726
164 HG21 ILE 17 HG21 ILE 17 -5.460 5.763 3.640
165 HG22 ILE 17 HG22 ILE 17 -4.166 6.641 2.825
166 HG23 ILE 17 HG23 ILE 17 -3.872 5.895 4.397
167 HD11 ILE 17 HD11 ILE 17 -6.561 3.803 2.407
168 HD12 ILE 17 HD12 ILE 17 -5.608 2.423 1.864
169 HD13 ILE 17 HD13 ILE 17 -6.490 3.404 0.692
170 H THR 18 H THR 18 -1.739 4.129 0.123
171 HA THR 18 HA THR 18 -1.861 1.351 -0.109
172 HB THR 18 HB THR 18 -0.065 3.280 -1.591
173 HG1 THR 18 HG1 THR 18 -2.813 2.653 -1.760
174 HG21 THR 18 HG21 THR 18 0.528 0.980 -2.015
175 HG22 THR 18 HG22 THR 18 -0.294 1.649 -3.417
176 HG23 THR 18 HG23 THR 18 -1.156 0.564 -2.329
177 H SER 19 H SER 19 0.894 3.507 0.386
178 HA SER 19 HA SER 19 2.602 1.372 1.280
179 HB2 SER 19 HB3 SER 19 4.109 3.443 1.759
180 HB3 SER 19 HB2 SER 19 3.731 3.038 0.083
181 HG SER 19 HG SER 19 2.776 5.147 1.671
182 H HIS 20 H HIS 20 0.280 1.560 2.877
183 HA HIS 20 HA HIS 20 1.202 2.843 5.353
184 HB2 HIS 20 HB3 HIS 20 -1.166 3.187 4.523
185 HB3 HIS 20 HB2 HIS 20 -1.454 1.484 4.858
186 HD1 HIS 20 HD1 HIS 20 -2.448 1.054 7.081
187 HD2 HIS 20 HD2 HIS 20 -0.238 4.570 7.032
188 HE1 HIS 20 HE1 HIS 20 -2.737 2.064 9.363
189 HE2 HIS 20 HE2 HIS 20 -1.286 4.121 9.352
190 H ILE 21 H ILE 21 -0.279 -0.237 4.353
191 HA ILE 21 HA ILE 21 1.031 -1.603 6.552
192 HB ILE 21 HB ILE 21 -0.753 -2.676 4.359
193 HG12 ILE 21 HG13 ILE 21 -1.275 -2.123 7.291
194 HG13 ILE 21 HG12 ILE 21 -1.888 -1.173 5.942
195 HG21 ILE 21 HG21 ILE 21 0.750 -4.415 5.118
196 HG22 ILE 21 HG22 ILE 21 -0.864 -4.718 5.763
197 HG23 ILE 21 HG23 ILE 21 0.387 -4.036 6.801
198 HD11 ILE 21 HD11 ILE 21 -3.584 -2.655 6.860
199 HD12 ILE 21 HD12 ILE 21 -2.563 -4.049 6.508
200 HD13 ILE 21 HD13 ILE 21 -3.202 -3.068 5.189
201 H ASP 22 H ASP 22 0.941 -1.932 2.985
202 HA ASP 22 HA ASP 22 2.609 -2.332 1.466
203 HB2 ASP 22 HB3 ASP 22 3.781 -0.565 2.744
204 HB3 ASP 22 HB2 ASP 22 4.405 -1.780 3.840
205 H LYS 23 H LYS 23 4.285 -3.996 0.879
206 HA LYS 23 HA LYS 23 3.937 -6.480 2.265
207 HB2 LYS 23 HB3 LYS 23 6.120 -6.985 0.747
208 HB3 LYS 23 HB2 LYS 23 4.469 -7.090 0.163
209 HG2 LYS 23 HG3 LYS 23 5.807 -5.913 -1.432
210 HG3 LYS 23 HG2 LYS 23 4.661 -4.790 -0.704
211 HD2 LYS 23 HD3 LYS 23 6.619 -4.262 0.919
212 HD3 LYS 23 HD2 LYS 23 7.621 -4.983 -0.341
213 HE2 LYS 23 HE3 LYS 23 5.725 -2.665 -0.680
214 HE3 LYS 23 HE2 LYS 23 7.479 -2.560 -0.600
215 HZ1 LYS 23 HZ1 LYS 23 6.676 -2.461 -2.869
216 HZ2 LYS 23 HZ2 LYS 23 5.927 -3.965 -2.702
217 HZ3 LYS 23 HZ3 LYS 23 7.611 -3.844 -2.637
218 H VAL 24 H VAL 24 5.046 -4.145 3.711
219 HA VAL 24 HA VAL 24 6.426 -3.736 5.438
220 HB VAL 24 HB VAL 24 7.020 -6.691 5.524
221 HG11 VAL 24 HG11 VAL 24 6.904 -4.532 7.625
222 HG12 VAL 24 HG12 VAL 24 8.335 -5.394 7.063
223 HG13 VAL 24 HG13 VAL 24 7.090 -6.250 7.974
224 HG21 VAL 24 HG21 VAL 24 5.019 -6.927 6.935
225 HG22 VAL 24 HG22 VAL 24 4.612 -6.427 5.294
226 HG23 VAL 24 HG23 VAL 24 4.599 -5.247 6.605
227 H LEU 25 H LEU 25 7.535 -3.211 3.057
228 HA LEU 25 HA LEU 25 10.360 -3.808 3.602
229 HB2 LEU 25 HB3 LEU 25 9.027 -3.805 0.899
230 HB3 LEU 25 HB2 LEU 25 10.764 -3.751 1.122
231 HG LEU 25 HG LEU 25 8.937 -6.009 1.962
232 HD11 LEU 25 HD11 LEU 25 9.283 -5.898 -0.447
233 HD12 LEU 25 HD12 LEU 25 10.118 -7.284 0.249
234 HD13 LEU 25 HD13 LEU 25 11.027 -5.843 -0.203
235 HD21 LEU 25 HD21 LEU 25 11.016 -7.204 2.501
236 HD22 LEU 25 HD22 LEU 25 10.780 -5.790 3.525
237 HD23 LEU 25 HD23 LEU 25 11.932 -5.729 2.192
238 H ARG 26 H ARG 26 8.008 -1.568 2.105
239 HA ARG 26 HA ARG 26 9.769 0.608 2.864
240 HB2 ARG 26 HB3 ARG 26 9.663 1.589 0.520
241 HB3 ARG 26 HB2 ARG 26 10.755 0.240 0.778
242 HG2 ARG 26 HG3 ARG 26 9.832 -0.593 -1.073
243 HG3 ARG 26 HG2 ARG 26 8.499 -1.043 -0.016
244 HD2 ARG 26 HD3 ARG 26 7.756 0.108 -2.068
245 HD3 ARG 26 HD2 ARG 26 7.294 0.960 -0.597
246 HE ARG 26 HE ARG 26 9.180 2.478 -1.039
247 HH11 ARG 26 HH11 ARG 26 7.913 0.584 -3.700
248 HH12 ARG 26 HH12 ARG 26 8.507 1.669 -4.917
249 HH21 ARG 26 HH22 ARG 26 9.942 3.914 -2.635
250 HH22 ARG 26 HH21 ARG 26 9.654 3.565 -4.310
251 HA PRO 27 HA PRO 27 5.230 1.792 2.942
252 HB2 PRO 27 HB2 PRO 27 5.619 2.025 5.841
253 HB3 PRO 27 HB3 PRO 27 4.350 1.166 4.948
254 HG2 PRO 27 HG3 PRO 27 6.267 -0.138 6.318
255 HG3 PRO 27 HG2 PRO 27 5.578 -0.770 4.814
256 HD2 PRO 27 HD3 PRO 27 8.177 0.667 5.247
257 HD3 PRO 27 HD2 PRO 27 7.841 -0.773 4.259
258 H GLN 28 H GLN 28 4.525 3.954 3.420
259 HA GLN 28 HA GLN 28 6.381 5.754 4.700
260 HB2 GLN 28 HB3 GLN 28 6.629 7.296 2.862
261 HB3 GLN 28 HB2 GLN 28 7.216 5.717 2.391
262 HG2 GLN 28 HG3 GLN 28 6.118 6.513 0.511
263 HG3 GLN 28 HG2 GLN 28 4.937 5.417 1.221
264 HE21 GLN 28 HE22 GLN 28 5.800 8.749 0.665
265 HE22 GLN 28 HE21 GLN 28 4.236 9.414 0.980
266 H GLY 29 H GLY 29 3.366 4.715 4.339
267 HA2 GLY 29 HA3 GLY 29 2.165 7.390 4.641
268 HA3 GLY 29 HA2 GLY 29 1.337 6.032 3.890
Start of MODEL 3
1 H1 ARG 1 H1 ARG 1 -10.790 -0.115 4.683
2 H2 ARG 1 H2 ARG 1 -9.860 1.131 4.022
3 H3 ARG 1 H3 ARG 1 -9.627 -0.459 3.509
4 HA ARG 1 HA ARG 1 -11.781 -0.533 2.515
5 HB2 ARG 1 HB3 ARG 1 -12.022 2.345 3.420
6 HB3 ARG 1 HB2 ARG 1 -13.179 1.481 2.418
7 HG2 ARG 1 HG3 ARG 1 -12.506 0.948 5.300
8 HG3 ARG 1 HG2 ARG 1 -14.021 1.573 4.649
9 HD2 ARG 1 HD3 ARG 1 -12.877 -1.179 4.166
10 HD3 ARG 1 HD2 ARG 1 -14.224 -0.788 5.232
11 HE ARG 1 HE ARG 1 -15.102 0.162 2.895
12 HH11 ARG 1 HH12 ARG 1 -13.628 -2.908 3.708
13 HH12 ARG 1 HH11 ARG 1 -14.481 -3.784 2.476
14 HH21 ARG 1 HH21 ARG 1 -16.243 -1.001 1.286
15 HH22 ARG 1 HH22 ARG 1 -15.977 -2.707 1.117
16 H LYS 2 H LYS 2 -10.636 -0.859 0.719
17 HA LYS 2 HA LYS 2 -10.235 1.144 -1.190
18 HB2 LYS 2 HB3 LYS 2 -8.327 1.465 0.665
19 HB3 LYS 2 HB2 LYS 2 -7.566 0.174 -0.248
20 HG2 LYS 2 HG3 LYS 2 -6.757 2.311 -0.990
21 HG3 LYS 2 HG2 LYS 2 -7.685 1.559 -2.272
22 HD2 LYS 2 HD3 LYS 2 -9.602 2.961 -1.739
23 HD3 LYS 2 HD2 LYS 2 -8.718 3.679 -0.391
24 HE2 LYS 2 HE3 LYS 2 -7.089 4.615 -1.923
25 HE3 LYS 2 HE2 LYS 2 -7.885 3.834 -3.287
26 HZ1 LYS 2 HZ1 LYS 2 -8.513 6.144 -3.149
27 HZ2 LYS 2 HZ2 LYS 2 -9.056 5.946 -1.561
28 HZ3 LYS 2 HZ3 LYS 2 -9.859 5.175 -2.830
29 H CYS 3 H CYS 3 -7.984 -0.160 -2.536
30 HA CYS 3 HA CYS 3 -9.235 -2.638 -3.295
31 HB2 CYS 3 HB3 CYS 3 -6.748 -2.655 -4.487
32 HB3 CYS 3 HB2 CYS 3 -8.221 -2.004 -5.195
33 H ASN 4 H ASN 4 -7.522 -1.848 -0.688
34 HA ASN 4 HA ASN 4 -6.536 -2.987 0.983
35 HB2 ASN 4 HB3 ASN 4 -7.699 -5.263 -0.571
36 HB3 ASN 4 HB2 ASN 4 -6.626 -5.589 0.785
37 HD21 ASN 4 HD22 ASN 4 -8.230 -6.530 2.000
38 HD22 ASN 4 HD21 ASN 4 -9.512 -5.617 2.720
39 H PHE 5 H PHE 5 -5.672 -5.514 -1.291
40 HA PHE 5 HA PHE 5 -2.921 -5.189 -0.509
41 HB2 PHE 5 HB3 PHE 5 -2.628 -7.154 -2.152
42 HB3 PHE 5 HB2 PHE 5 -3.510 -7.429 -0.657
43 HD1 PHE 5 HD2 PHE 5 -3.906 -6.874 -4.293
44 HD2 PHE 5 HD1 PHE 5 -5.769 -8.083 -0.663
45 HE1 PHE 5 HE2 PHE 5 -5.845 -7.695 -5.563
46 HE2 PHE 5 HE1 PHE 5 -7.710 -8.907 -1.929
47 HZ PHE 5 HZ PHE 5 -7.750 -8.713 -4.382
48 H LEU 6 H LEU 6 -1.182 -4.833 -1.888
49 HA LEU 6 HA LEU 6 -0.079 -3.390 -3.244
50 HB2 LEU 6 HB3 LEU 6 -2.159 -4.313 -5.227
51 HB3 LEU 6 HB2 LEU 6 -0.720 -3.412 -5.645
52 HG LEU 6 HG LEU 6 -0.119 -5.562 -6.209
53 HD11 LEU 6 HD11 LEU 6 1.211 -4.468 -4.068
54 HD12 LEU 6 HD12 LEU 6 1.739 -5.850 -5.034
55 HD13 LEU 6 HD13 LEU 6 0.863 -6.116 -3.532
56 HD21 LEU 6 HD21 LEU 6 -2.100 -6.681 -5.395
57 HD22 LEU 6 HD22 LEU 6 -1.512 -6.562 -3.737
58 HD23 LEU 6 HD23 LEU 6 -0.653 -7.564 -4.907
59 H CYS 7 H CYS 7 -1.980 -2.263 -1.578
60 HA CYS 7 HA CYS 7 -2.538 0.232 -2.884
61 HB2 CYS 7 HB3 CYS 7 -4.715 -1.722 -2.264
62 HB3 CYS 7 HB2 CYS 7 -5.036 0.003 -2.117
63 H LYS 8 H LYS 8 -2.100 -1.702 -0.151
64 HA LYS 8 HA LYS 8 -1.867 0.391 1.691
65 HB2 LYS 8 HB3 LYS 8 -4.310 0.533 1.509
66 HB3 LYS 8 HB2 LYS 8 -4.451 -1.181 1.868
67 HG2 LYS 8 HG3 LYS 8 -3.488 -0.768 4.093
68 HG3 LYS 8 HG2 LYS 8 -3.432 0.956 3.727
69 HD2 LYS 8 HD3 LYS 8 -5.933 -0.727 3.764
70 HD3 LYS 8 HD2 LYS 8 -5.400 0.324 5.075
71 HE2 LYS 8 HE3 LYS 8 -6.081 1.202 2.273
72 HE3 LYS 8 HE2 LYS 8 -7.107 1.396 3.691
73 HZ1 LYS 8 HZ1 LYS 8 -5.950 3.432 3.250
74 HZ2 LYS 8 HZ2 LYS 8 -4.450 2.649 3.258
75 HZ3 LYS 8 HZ3 LYS 8 -5.353 2.773 4.685
76 H LEU 9 H LEU 9 -3.186 -2.891 1.608
77 HA LEU 9 HA LEU 9 -1.664 -3.897 3.771
78 HB2 LEU 9 HB3 LEU 9 -3.175 -5.159 1.509
79 HB3 LEU 9 HB2 LEU 9 -2.184 -6.150 2.562
80 HG LEU 9 HG LEU 9 -3.524 -5.380 4.504
81 HD11 LEU 9 HD11 LEU 9 -5.655 -4.249 4.121
82 HD12 LEU 9 HD12 LEU 9 -5.258 -4.077 2.412
83 HD13 LEU 9 HD13 LEU 9 -4.293 -3.242 3.628
84 HD21 LEU 9 HD21 LEU 9 -5.529 -6.680 3.957
85 HD22 LEU 9 HD22 LEU 9 -4.051 -7.477 3.420
86 HD23 LEU 9 HD23 LEU 9 -5.076 -6.642 2.254
87 H LYS 10 H LYS 10 -1.292 -4.533 0.271
88 HA LYS 10 HA LYS 10 1.621 -4.390 0.703
89 HB2 LYS 10 HB3 LYS 10 0.315 -5.296 -1.854
90 HB3 LYS 10 HB2 LYS 10 1.948 -5.606 -1.293
91 HG2 LYS 10 HG3 LYS 10 1.079 -7.069 0.446
92 HG3 LYS 10 HG2 LYS 10 -0.559 -6.751 -0.117
93 HD2 LYS 10 HD3 LYS 10 0.077 -7.685 -2.327
94 HD3 LYS 10 HD2 LYS 10 1.647 -8.114 -1.647
95 HE2 LYS 10 HE3 LYS 10 0.466 -9.472 0.065
96 HE3 LYS 10 HE2 LYS 10 -1.048 -9.122 -0.769
97 HZ1 LYS 10 HZ1 LYS 10 -0.176 -10.211 -2.738
98 HZ2 LYS 10 HZ2 LYS 10 -0.153 -11.265 -1.415
99 HZ3 LYS 10 HZ3 LYS 10 1.281 -10.538 -1.942
100 H GLU 11 H GLU 11 2.390 -3.592 -1.852
101 HA GLU 11 HA GLU 11 1.199 -0.901 -1.913
102 HB2 GLU 11 HB3 GLU 11 3.396 0.069 -2.103
103 HB3 GLU 11 HB2 GLU 11 3.268 -0.907 -0.646
104 HG2 GLU 11 HG3 GLU 11 5.318 -1.525 -1.409
105 HG3 GLU 11 HG2 GLU 11 4.311 -2.764 -2.136
106 H LYS 12 H LYS 12 2.084 0.386 -3.817
107 HA LYS 12 HA LYS 12 2.932 -1.050 -6.145
108 HB2 LYS 12 HB3 LYS 12 1.073 -0.701 -7.553
109 HB3 LYS 12 HB2 LYS 12 0.370 -1.295 -6.066
110 HG2 LYS 12 HG3 LYS 12 0.513 1.590 -6.843
111 HG3 LYS 12 HG2 LYS 12 -0.865 0.536 -7.152
112 HD2 LYS 12 HD3 LYS 12 -0.976 0.118 -4.685
113 HD3 LYS 12 HD2 LYS 12 0.245 1.388 -4.486
114 HE2 LYS 12 HE3 LYS 12 -1.785 2.512 -4.232
115 HE3 LYS 12 HE2 LYS 12 -1.268 2.811 -5.892
116 HZ1 LYS 12 HZ1 LYS 12 -3.659 2.242 -5.651
117 HZ2 LYS 12 HZ2 LYS 12 -3.199 0.690 -5.168
118 HZ3 LYS 12 HZ3 LYS 12 -2.809 1.247 -6.715
119 H LEU 13 H LEU 13 3.696 1.168 -4.332
120 HA LEU 13 HA LEU 13 4.425 3.308 -4.260
121 HB2 LEU 13 HB3 LEU 13 4.401 3.026 -7.264
122 HB3 LEU 13 HB2 LEU 13 5.090 4.392 -6.410
123 HG LEU 13 HG LEU 13 6.036 1.531 -6.180
124 HD11 LEU 13 HD11 LEU 13 7.275 3.906 -7.565
125 HD12 LEU 13 HD12 LEU 13 6.543 2.512 -8.358
126 HD13 LEU 13 HD13 LEU 13 8.005 2.311 -7.393
127 HD21 LEU 13 HD21 LEU 13 7.918 2.500 -4.943
128 HD22 LEU 13 HD22 LEU 13 6.383 2.776 -4.119
129 HD23 LEU 13 HD23 LEU 13 7.147 4.085 -5.020
130 H ARG 14 H ARG 14 3.264 4.978 -3.604
131 HA ARG 14 HA ARG 14 1.503 6.423 -5.251
132 HB2 ARG 14 HB3 ARG 14 0.100 4.377 -4.860
133 HB3 ARG 14 HB2 ARG 14 0.082 4.780 -3.146
134 HG2 ARG 14 HG3 ARG 14 -1.956 5.467 -4.398
135 HG3 ARG 14 HG2 ARG 14 -1.142 6.784 -3.557
136 HD2 ARG 14 HD3 ARG 14 -1.906 7.364 -5.854
137 HD3 ARG 14 HD2 ARG 14 -0.178 7.583 -5.594
138 HE ARG 14 HE ARG 14 -0.717 5.016 -6.677
139 HH11 ARG 14 HH11 ARG 14 -0.549 8.398 -7.541
140 HH12 ARG 14 HH12 ARG 14 -0.136 8.088 -9.196
141 HH21 ARG 14 HH22 ARG 14 -0.147 4.598 -8.855
142 HH22 ARG 14 HH21 ARG 14 0.097 5.929 -9.945
143 H THR 15 H THR 15 0.736 5.764 -1.880
144 HA THR 15 HA THR 15 2.306 7.835 -0.771
145 HB THR 15 HB THR 15 0.684 9.240 -2.033
146 HG1 THR 15 HG1 THR 15 1.550 10.184 -0.219
147 HG21 THR 15 HG21 THR 15 -1.357 8.079 -0.133
148 HG22 THR 15 HG22 THR 15 -1.278 7.774 -1.867
149 HG23 THR 15 HG23 THR 15 -1.631 9.395 -1.274
150 H VAL 16 H VAL 16 0.863 8.492 1.452
151 HA VAL 16 HA VAL 16 1.308 6.431 3.162
152 HB VAL 16 HB VAL 16 0.924 8.824 3.770
153 HG11 VAL 16 HG11 VAL 16 -1.969 8.005 3.600
154 HG12 VAL 16 HG12 VAL 16 -1.155 9.244 2.641
155 HG13 VAL 16 HG13 VAL 16 -1.385 9.480 4.374
156 HG21 VAL 16 HG21 VAL 16 -0.528 6.748 5.405
157 HG22 VAL 16 HG22 VAL 16 0.004 8.325 5.991
158 HG23 VAL 16 HG23 VAL 16 1.193 7.128 5.480
159 H ILE 17 H ILE 17 -1.710 6.927 1.346
160 HA ILE 17 HA ILE 17 -3.296 5.164 2.853
161 HB ILE 17 HB ILE 17 -4.237 6.656 1.112
162 HG12 ILE 17 HG13 ILE 17 -5.476 4.620 1.955
163 HG13 ILE 17 HG12 ILE 17 -6.008 5.217 0.389
164 HG21 ILE 17 HG21 ILE 17 -3.061 4.719 -0.869
165 HG22 ILE 17 HG22 ILE 17 -2.575 6.396 -0.624
166 HG23 ILE 17 HG23 ILE 17 -4.180 6.028 -1.249
167 HD11 ILE 17 HD11 ILE 17 -5.301 3.376 -0.707
168 HD12 ILE 17 HD12 ILE 17 -5.618 2.647 0.871
169 HD13 ILE 17 HD13 ILE 17 -3.971 3.077 0.406
170 H THR 18 H THR 18 -1.112 4.606 0.152
171 HA THR 18 HA THR 18 -1.488 1.740 0.190
172 HB THR 18 HB THR 18 0.546 3.418 -1.293
173 HG1 THR 18 HG1 THR 18 -2.137 2.788 -1.779
174 HG21 THR 18 HG21 THR 18 -0.418 0.619 -1.869
175 HG22 THR 18 HG22 THR 18 1.088 1.001 -1.034
176 HG23 THR 18 HG23 THR 18 0.856 1.505 -2.705
177 H SER 19 H SER 19 0.967 4.115 0.931
178 HA SER 19 HA SER 19 2.815 2.245 2.076
179 HB2 SER 19 HB3 SER 19 3.496 4.367 0.982
180 HB3 SER 19 HB2 SER 19 2.697 5.278 2.264
181 HG SER 19 HG SER 19 4.165 4.239 3.739
182 H HIS 20 H HIS 20 0.059 2.312 3.148
183 HA HIS 20 HA HIS 20 0.014 3.501 5.715
184 HB2 HIS 20 HB3 HIS 20 -1.999 2.735 4.463
185 HB3 HIS 20 HB2 HIS 20 -1.497 1.069 4.732
186 HD1 HIS 20 HD1 HIS 20 -2.582 -0.010 6.672
187 HD2 HIS 20 HD2 HIS 20 -2.387 4.121 7.107
188 HE1 HIS 20 HE1 HIS 20 -3.777 0.501 8.823
189 HE2 HIS 20 HE2 HIS 20 -3.544 2.992 9.123
190 H ILE 21 H ILE 21 1.047 0.376 4.523
191 HA ILE 21 HA ILE 21 2.708 -0.010 6.823
192 HB ILE 21 HB ILE 21 0.689 -0.893 7.792
193 HG12 ILE 21 HG13 ILE 21 1.351 -3.256 8.188
194 HG13 ILE 21 HG12 ILE 21 2.525 -3.117 6.885
195 HG21 ILE 21 HG21 ILE 21 0.454 -2.666 5.369
196 HG22 ILE 21 HG22 ILE 21 -0.596 -1.309 5.781
197 HG23 ILE 21 HG23 ILE 21 -0.567 -2.745 6.806
198 HD11 ILE 21 HD11 ILE 21 3.691 -1.372 8.137
199 HD12 ILE 21 HD12 ILE 21 3.591 -2.880 9.043
200 HD13 ILE 21 HD13 ILE 21 2.521 -1.538 9.444
201 H ASP 22 H ASP 22 1.245 -1.520 3.960
202 HA ASP 22 HA ASP 22 2.142 -2.598 2.180
203 HB2 ASP 22 HB3 ASP 22 3.661 -0.723 1.959
204 HB3 ASP 22 HB2 ASP 22 4.715 -1.371 3.197
205 H LYS 23 H LYS 23 3.739 -4.378 1.546
206 HA LYS 23 HA LYS 23 3.798 -6.458 3.424
207 HB2 LYS 23 HB3 LYS 23 5.341 -7.594 1.900
208 HB3 LYS 23 HB2 LYS 23 4.014 -6.864 1.014
209 HG2 LYS 23 HG3 LYS 23 6.252 -5.057 1.199
210 HG3 LYS 23 HG2 LYS 23 6.731 -6.600 0.496
211 HD2 LYS 23 HD3 LYS 23 5.001 -6.416 -1.181
212 HD3 LYS 23 HD2 LYS 23 4.390 -4.939 -0.432
213 HE2 LYS 23 HE3 LYS 23 5.714 -4.346 -2.347
214 HE3 LYS 23 HE2 LYS 23 6.576 -3.856 -0.889
215 HZ1 LYS 23 HZ1 LYS 23 8.063 -4.893 -2.465
216 HZ2 LYS 23 HZ2 LYS 23 7.119 -6.292 -2.504
217 HZ3 LYS 23 HZ3 LYS 23 7.933 -5.862 -1.090
218 H VAL 24 H VAL 24 6.142 -3.882 2.714
219 HA VAL 24 HA VAL 24 7.653 -4.691 5.097
220 HB VAL 24 HB VAL 24 9.830 -4.560 3.947
221 HG11 VAL 24 HG11 VAL 24 7.942 -6.636 2.857
222 HG12 VAL 24 HG12 VAL 24 8.890 -6.744 4.340
223 HG13 VAL 24 HG13 VAL 24 9.701 -6.730 2.774
224 HG21 VAL 24 HG21 VAL 24 9.155 -3.177 2.054
225 HG22 VAL 24 HG22 VAL 24 8.195 -4.510 1.414
226 HG23 VAL 24 HG23 VAL 24 9.950 -4.656 1.513
227 H LEU 25 H LEU 25 6.076 -2.324 3.798
228 HA LEU 25 HA LEU 25 6.081 -0.044 3.906
229 HB2 LEU 25 HB3 LEU 25 6.788 -0.584 6.265
230 HB3 LEU 25 HB2 LEU 25 8.448 -0.363 5.754
231 HG LEU 25 HG LEU 25 7.992 1.985 5.235
232 HD11 LEU 25 HD11 LEU 25 5.649 1.821 4.620
233 HD12 LEU 25 HD12 LEU 25 5.859 2.999 5.915
234 HD13 LEU 25 HD13 LEU 25 5.225 1.393 6.277
235 HD21 LEU 25 HD21 LEU 25 7.702 2.772 7.522
236 HD22 LEU 25 HD22 LEU 25 8.777 1.375 7.460
237 HD23 LEU 25 HD23 LEU 25 7.109 1.181 8.001
238 H ARG 26 H ARG 26 7.187 -1.090 1.702
239 HA ARG 26 HA ARG 26 9.818 0.033 1.274
240 HB2 ARG 26 HB3 ARG 26 9.603 -2.125 0.409
241 HB3 ARG 26 HB2 ARG 26 8.016 -1.800 -0.268
242 HG2 ARG 26 HG3 ARG 26 10.279 -0.234 -1.346
243 HG3 ARG 26 HG2 ARG 26 10.219 -1.952 -1.745
244 HD2 ARG 26 HD3 ARG 26 8.160 -1.747 -2.832
245 HD3 ARG 26 HD2 ARG 26 7.812 -0.195 -2.059
246 HE ARG 26 HE ARG 26 9.898 0.513 -3.470
247 HH11 ARG 26 HH11 ARG 26 7.256 -1.561 -4.492
248 HH12 ARG 26 HH12 ARG 26 7.487 -1.210 -6.174
249 HH21 ARG 26 HH22 ARG 26 10.181 0.959 -5.687
250 HH22 ARG 26 HH21 ARG 26 9.137 0.206 -6.852
251 HA PRO 27 HA PRO 27 7.149 1.994 -2.326
252 HB2 PRO 27 HB2 PRO 27 4.825 3.207 -1.495
253 HB3 PRO 27 HB3 PRO 27 4.910 1.583 -2.204
254 HG2 PRO 27 HG3 PRO 27 4.778 2.395 0.676
255 HG3 PRO 27 HG2 PRO 27 3.925 1.082 -0.159
256 HD2 PRO 27 HD3 PRO 27 6.082 0.599 1.350
257 HD3 PRO 27 HD2 PRO 27 5.790 -0.298 -0.148
258 H GLN 28 H GLN 28 5.805 3.877 0.353
259 HA GLN 28 HA GLN 28 7.690 6.029 -0.339
260 HB2 GLN 28 HB3 GLN 28 5.128 6.529 1.140
261 HB3 GLN 28 HB2 GLN 28 6.051 7.627 0.128
262 HG2 GLN 28 HG3 GLN 28 4.331 5.340 -0.802
263 HG3 GLN 28 HG2 GLN 28 3.973 7.056 -0.942
264 HE21 GLN 28 HE22 GLN 28 6.687 7.778 -1.705
265 HE22 GLN 28 HE21 GLN 28 6.884 7.233 -3.334
266 H GLY 29 H GLY 29 7.609 3.651 1.601
267 HA2 GLY 29 HA3 GLY 29 7.703 4.954 4.191
268 HA3 GLY 29 HA2 GLY 29 7.863 3.228 3.874
Start of MODEL 4
1 H1 ARG 1 H1 ARG 1 -7.736 5.081 -3.251
2 H2 ARG 1 H2 ARG 1 -8.238 5.872 -1.846
3 H3 ARG 1 H3 ARG 1 -9.094 6.089 -3.286
4 HA ARG 1 HA ARG 1 -10.297 4.616 -1.847
5 HB2 ARG 1 HB3 ARG 1 -8.981 3.226 -4.191
6 HB3 ARG 1 HB2 ARG 1 -10.384 2.606 -3.338
7 HG2 ARG 1 HG3 ARG 1 -10.287 5.242 -4.787
8 HG3 ARG 1 HG2 ARG 1 -10.938 3.745 -5.453
9 HD2 ARG 1 HD3 ARG 1 -11.946 5.130 -2.969
10 HD3 ARG 1 HD2 ARG 1 -12.692 5.230 -4.561
11 HE ARG 1 HE ARG 1 -12.394 2.528 -3.670
12 HH11 ARG 1 HH12 ARG 1 -14.401 5.387 -3.406
13 HH12 ARG 1 HH11 ARG 1 -15.826 4.503 -2.968
14 HH21 ARG 1 HH21 ARG 1 -14.273 1.360 -3.098
15 HH22 ARG 1 HH22 ARG 1 -15.757 2.209 -2.798
16 H LYS 2 H LYS 2 -10.334 2.889 -0.422
17 HA LYS 2 HA LYS 2 -7.694 2.029 0.478
18 HB2 LYS 2 HB3 LYS 2 -10.389 1.763 1.820
19 HB3 LYS 2 HB2 LYS 2 -8.871 1.204 2.502
20 HG2 LYS 2 HG3 LYS 2 -9.022 3.203 3.555
21 HG3 LYS 2 HG2 LYS 2 -8.183 3.727 2.098
22 HD2 LYS 2 HD3 LYS 2 -9.949 5.269 2.494
23 HD3 LYS 2 HD2 LYS 2 -10.414 4.280 1.111
24 HE2 LYS 2 HE3 LYS 2 -11.837 2.920 2.528
25 HE3 LYS 2 HE2 LYS 2 -11.322 3.822 3.953
26 HZ1 LYS 2 HZ1 LYS 2 -12.788 4.975 1.642
27 HZ2 LYS 2 HZ2 LYS 2 -12.346 5.795 3.053
28 HZ3 LYS 2 HZ3 LYS 2 -13.486 4.548 3.119
29 H CYS 3 H CYS 3 -7.630 0.687 -1.533
30 HA CYS 3 HA CYS 3 -9.178 -1.704 -1.603
31 HB2 CYS 3 HB3 CYS 3 -6.862 -2.231 -3.035
32 HB3 CYS 3 HB2 CYS 3 -8.358 -1.575 -3.690
33 H ASN 4 H ASN 4 -7.896 -3.891 -1.608
34 HA ASN 4 HA ASN 4 -6.962 -4.042 1.129
35 HB2 ASN 4 HB3 ASN 4 -7.709 -6.206 -0.843
36 HB3 ASN 4 HB2 ASN 4 -7.198 -6.509 0.811
37 HD21 ASN 4 HD22 ASN 4 -9.749 -7.044 -0.591
38 HD22 ASN 4 HD21 ASN 4 -10.964 -6.280 0.374
39 H PHE 5 H PHE 5 -5.818 -6.593 -0.796
40 HA PHE 5 HA PHE 5 -3.124 -6.016 -0.090
41 HB2 PHE 5 HB3 PHE 5 -2.623 -8.016 -1.577
42 HB3 PHE 5 HB2 PHE 5 -3.660 -8.305 -0.189
43 HD1 PHE 5 HD2 PHE 5 -3.563 -7.961 -3.848
44 HD2 PHE 5 HD1 PHE 5 -5.930 -8.986 -0.467
45 HE1 PHE 5 HE2 PHE 5 -5.261 -8.937 -5.334
46 HE2 PHE 5 HE1 PHE 5 -7.629 -9.965 -1.950
47 HZ PHE 5 HZ PHE 5 -7.295 -9.940 -4.385
48 H LEU 6 H LEU 6 -1.373 -5.608 -1.477
49 HA LEU 6 HA LEU 6 -0.355 -4.195 -2.898
50 HB2 LEU 6 HB3 LEU 6 -2.272 -5.645 -4.677
51 HB3 LEU 6 HB2 LEU 6 -1.343 -4.309 -5.329
52 HG LEU 6 HG LEU 6 -0.269 -6.451 -5.813
53 HD11 LEU 6 HD11 LEU 6 1.261 -4.793 -3.800
54 HD12 LEU 6 HD12 LEU 6 1.155 -4.502 -5.540
55 HD13 LEU 6 HD13 LEU 6 1.964 -5.948 -4.938
56 HD21 LEU 6 HD21 LEU 6 -1.095 -7.698 -3.866
57 HD22 LEU 6 HD22 LEU 6 -0.020 -6.761 -2.826
58 HD23 LEU 6 HD23 LEU 6 0.654 -7.838 -4.052
59 H CYS 7 H CYS 7 -1.515 -2.684 -1.366
60 HA CYS 7 HA CYS 7 -2.369 -0.415 -2.710
61 HB2 CYS 7 HB3 CYS 7 -4.431 -1.643 -3.209
62 HB3 CYS 7 HB2 CYS 7 -4.685 -1.951 -1.494
63 H LYS 8 H LYS 8 -4.032 -1.528 0.209
64 HA LYS 8 HA LYS 8 -2.502 0.480 1.699
65 HB2 LYS 8 HB3 LYS 8 -5.004 0.713 1.580
66 HB3 LYS 8 HB2 LYS 8 -5.140 -0.824 2.419
67 HG2 LYS 8 HG3 LYS 8 -4.168 0.068 4.393
68 HG3 LYS 8 HG2 LYS 8 -3.697 1.552 3.562
69 HD2 LYS 8 HD3 LYS 8 -5.587 2.253 4.661
70 HD3 LYS 8 HD2 LYS 8 -6.269 1.759 3.115
71 HE2 LYS 8 HE3 LYS 8 -6.197 0.058 5.604
72 HE3 LYS 8 HE2 LYS 8 -7.589 0.982 5.052
73 HZ1 LYS 8 HZ1 LYS 8 -7.577 -0.363 3.012
74 HZ2 LYS 8 HZ2 LYS 8 -7.810 -1.300 4.399
75 HZ3 LYS 8 HZ3 LYS 8 -6.308 -1.287 3.633
76 H LEU 9 H LEU 9 -3.206 -2.805 1.279
77 HA LEU 9 HA LEU 9 -2.055 -3.577 3.843
78 HB2 LEU 9 HB3 LEU 9 -3.489 -5.145 1.719
79 HB3 LEU 9 HB2 LEU 9 -2.785 -5.873 3.154
80 HG LEU 9 HG LEU 9 -4.927 -3.747 3.229
81 HD11 LEU 9 HD11 LEU 9 -5.147 -6.741 3.413
82 HD12 LEU 9 HD12 LEU 9 -5.846 -5.689 2.182
83 HD13 LEU 9 HD13 LEU 9 -6.433 -5.613 3.844
84 HD21 LEU 9 HD21 LEU 9 -3.826 -5.585 5.352
85 HD22 LEU 9 HD22 LEU 9 -5.183 -4.478 5.556
86 HD23 LEU 9 HD23 LEU 9 -3.569 -3.844 5.242
87 H LYS 10 H LYS 10 -1.733 -5.135 0.618
88 HA LYS 10 HA LYS 10 0.989 -5.774 1.433
89 HB2 LYS 10 HB3 LYS 10 -0.577 -7.542 0.645
90 HB3 LYS 10 HB2 LYS 10 -0.493 -6.837 -0.960
91 HG2 LYS 10 HG3 LYS 10 1.820 -7.317 -1.144
92 HG3 LYS 10 HG2 LYS 10 1.914 -7.767 0.557
93 HD2 LYS 10 HD3 LYS 10 0.400 -9.222 -1.616
94 HD3 LYS 10 HD2 LYS 10 1.896 -9.756 -0.846
95 HE2 LYS 10 HE3 LYS 10 0.683 -9.806 1.328
96 HE3 LYS 10 HE2 LYS 10 -0.802 -9.429 0.453
97 HZ1 LYS 10 HZ1 LYS 10 0.885 -11.840 0.060
98 HZ2 LYS 10 HZ2 LYS 10 -0.520 -11.473 -0.809
99 HZ3 LYS 10 HZ3 LYS 10 -0.610 -11.788 0.848
100 H GLU 11 H GLU 11 0.706 -3.177 0.764
101 HA GLU 11 HA GLU 11 1.923 -1.527 -0.166
102 HB2 GLU 11 HB3 GLU 11 3.689 -3.383 0.190
103 HB3 GLU 11 HB2 GLU 11 3.628 -3.570 -1.550
104 HG2 GLU 11 HG3 GLU 11 4.398 -1.330 -1.882
105 HG3 GLU 11 HG2 GLU 11 4.275 -0.981 -0.158
106 H LYS 12 H LYS 12 2.391 -0.352 -2.082
107 HA LYS 12 HA LYS 12 1.812 -1.242 -4.674
108 HB2 LYS 12 HB3 LYS 12 -0.475 -1.456 -3.969
109 HB3 LYS 12 HB2 LYS 12 -0.477 0.139 -3.255
110 HG2 LYS 12 HG3 LYS 12 0.086 -0.108 -6.148
111 HG3 LYS 12 HG2 LYS 12 -1.562 -0.402 -5.594
112 HD2 LYS 12 HD3 LYS 12 -1.854 1.762 -4.888
113 HD3 LYS 12 HD2 LYS 12 -0.120 2.038 -4.647
114 HE2 LYS 12 HE3 LYS 12 -0.732 3.256 -6.587
115 HE3 LYS 12 HE2 LYS 12 0.119 1.804 -7.123
116 HZ1 LYS 12 HZ1 LYS 12 -2.000 0.770 -7.609
117 HZ2 LYS 12 HZ2 LYS 12 -1.847 2.220 -8.463
118 HZ3 LYS 12 HZ3 LYS 12 -2.829 2.146 -7.086
119 H LEU 13 H LEU 13 1.868 1.360 -2.358
120 HA LEU 13 HA LEU 13 3.321 3.110 -2.260
121 HB2 LEU 13 HB3 LEU 13 4.013 2.516 -5.129
122 HB3 LEU 13 HB2 LEU 13 4.853 3.635 -4.075
123 HG LEU 13 HG LEU 13 4.668 0.670 -3.565
124 HD11 LEU 13 HD11 LEU 13 5.864 1.117 -5.639
125 HD12 LEU 13 HD12 LEU 13 6.957 0.557 -4.375
126 HD13 LEU 13 HD13 LEU 13 6.902 2.268 -4.798
127 HD21 LEU 13 HD21 LEU 13 6.391 2.833 -2.364
128 HD22 LEU 13 HD22 LEU 13 6.512 1.109 -2.013
129 HD23 LEU 13 HD23 LEU 13 5.056 1.999 -1.568
130 H ARG 14 H ARG 14 2.666 5.090 -2.194
131 HA ARG 14 HA ARG 14 1.866 6.599 -4.457
132 HB2 ARG 14 HB3 ARG 14 -0.214 5.195 -3.847
133 HB3 ARG 14 HB2 ARG 14 -0.322 6.201 -2.418
134 HG2 ARG 14 HG3 ARG 14 -0.478 7.159 -5.273
135 HG3 ARG 14 HG2 ARG 14 -1.833 6.947 -4.166
136 HD2 ARG 14 HD3 ARG 14 -0.877 8.662 -2.691
137 HD3 ARG 14 HD2 ARG 14 0.443 8.893 -3.834
138 HE ARG 14 HE ARG 14 -1.865 9.265 -5.285
139 HH11 ARG 14 HH11 ARG 14 -0.373 10.748 -2.476
140 HH12 ARG 14 HH12 ARG 14 -1.087 12.305 -2.771
141 HH21 ARG 14 HH22 ARG 14 -2.798 11.312 -5.670
142 HH22 ARG 14 HH21 ARG 14 -2.470 12.624 -4.579
143 H THR 15 H THR 15 1.014 6.544 -0.994
144 HA THR 15 HA THR 15 2.923 8.633 -0.420
145 HB THR 15 HB THR 15 -0.024 9.150 0.061
146 HG1 THR 15 HG1 THR 15 1.800 10.010 -1.918
147 HG21 THR 15 HG21 THR 15 2.400 10.882 0.551
148 HG22 THR 15 HG22 THR 15 1.419 10.103 1.790
149 HG23 THR 15 HG23 THR 15 0.721 11.369 0.782
150 H VAL 16 H VAL 16 -0.046 7.293 1.103
151 HA VAL 16 HA VAL 16 1.509 6.202 3.278
152 HB VAL 16 HB VAL 16 -0.308 8.571 3.727
153 HG11 VAL 16 HG11 VAL 16 0.586 6.475 5.693
154 HG12 VAL 16 HG12 VAL 16 -1.060 7.005 5.340
155 HG13 VAL 16 HG13 VAL 16 0.052 8.086 6.180
156 HG21 VAL 16 HG21 VAL 16 2.069 9.040 3.337
157 HG22 VAL 16 HG22 VAL 16 2.495 7.964 4.666
158 HG23 VAL 16 HG23 VAL 16 1.588 9.442 4.984
159 H ILE 17 H ILE 17 -1.734 6.856 1.919
160 HA ILE 17 HA ILE 17 -2.867 4.718 3.498
161 HB ILE 17 HB ILE 17 -4.303 6.586 2.845
162 HG12 ILE 17 HG13 ILE 17 -5.218 4.218 3.158
163 HG13 ILE 17 HG12 ILE 17 -6.258 5.380 2.348
164 HG21 ILE 17 HG21 ILE 17 -5.103 6.829 0.527
165 HG22 ILE 17 HG22 ILE 17 -3.884 5.662 0.016
166 HG23 ILE 17 HG23 ILE 17 -3.393 7.200 0.725
167 HD11 ILE 17 HD11 ILE 17 -6.445 3.304 1.211
168 HD12 ILE 17 HD12 ILE 17 -4.695 3.128 1.095
169 HD13 ILE 17 HD13 ILE 17 -5.524 4.385 0.171
170 H THR 18 H THR 18 -1.846 5.180 0.162
171 HA THR 18 HA THR 18 -2.254 2.374 -0.439
172 HB THR 18 HB THR 18 -0.878 3.854 -2.499
173 HG1 THR 18 HG1 THR 18 -3.412 4.963 -2.064
174 HG21 THR 18 HG21 THR 18 -2.227 1.868 -2.899
175 HG22 THR 18 HG22 THR 18 -2.899 3.242 -3.776
176 HG23 THR 18 HG23 THR 18 -3.660 2.692 -2.284
177 H SER 19 H SER 19 -0.067 4.068 1.146
178 HA SER 19 HA SER 19 1.833 1.873 0.889
179 HB2 SER 19 HB3 SER 19 2.744 3.876 -0.342
180 HB3 SER 19 HB2 SER 19 2.695 4.766 1.182
181 HG SER 19 HG SER 19 3.944 2.370 1.485
182 H HIS 20 H HIS 20 0.568 1.181 2.743
183 HA HIS 20 HA HIS 20 0.645 3.009 5.049
184 HB2 HIS 20 HB3 HIS 20 -1.615 2.479 4.071
185 HB3 HIS 20 HB2 HIS 20 -1.371 0.809 4.569
186 HD1 HIS 20 HD1 HIS 20 -2.634 4.008 5.758
187 HD2 HIS 20 HD2 HIS 20 -1.127 0.542 7.492
188 HE1 HIS 20 HE1 HIS 20 -3.367 4.075 8.159
189 HE2 HIS 20 HE2 HIS 20 -2.307 2.058 9.220
190 H ILE 21 H ILE 21 -0.136 -0.470 4.929
191 HA ILE 21 HA ILE 21 1.933 -0.849 6.976
192 HB ILE 21 HB ILE 21 -0.102 -1.917 7.597
193 HG12 ILE 21 HG13 ILE 21 1.869 -3.952 6.549
194 HG13 ILE 21 HG12 ILE 21 1.891 -3.185 8.132
195 HG21 ILE 21 HG21 ILE 21 -0.082 -3.305 4.927
196 HG22 ILE 21 HG22 ILE 21 -1.194 -2.036 5.440
197 HG23 ILE 21 HG23 ILE 21 -1.226 -3.610 6.236
198 HD11 ILE 21 HD11 ILE 21 -0.202 -4.306 8.695
199 HD12 ILE 21 HD12 ILE 21 1.067 -5.452 8.269
200 HD13 ILE 21 HD13 ILE 21 -0.207 -5.080 7.110
201 H ASP 22 H ASP 22 0.942 -2.028 3.827
202 HA ASP 22 HA ASP 22 2.037 -2.855 2.069
203 HB2 ASP 22 HB3 ASP 22 4.381 -1.468 3.374
204 HB3 ASP 22 HB2 ASP 22 4.328 -2.043 1.714
205 H LYS 23 H LYS 23 4.141 -4.167 1.436
206 HA LYS 23 HA LYS 23 4.220 -6.418 3.276
207 HB2 LYS 23 HB3 LYS 23 5.302 -7.627 1.450
208 HB3 LYS 23 HB2 LYS 23 3.833 -6.848 0.882
209 HG2 LYS 23 HG3 LYS 23 5.818 -4.973 0.414
210 HG3 LYS 23 HG2 LYS 23 6.561 -6.518 -0.003
211 HD2 LYS 23 HD3 LYS 23 4.714 -7.031 -1.493
212 HD3 LYS 23 HD2 LYS 23 3.903 -5.533 -1.037
213 HE2 LYS 23 HE3 LYS 23 4.949 -5.087 -3.101
214 HE3 LYS 23 HE2 LYS 23 5.965 -4.315 -1.874
215 HZ1 LYS 23 HZ1 LYS 23 6.469 -6.901 -3.256
216 HZ2 LYS 23 HZ2 LYS 23 7.393 -6.324 -1.965
217 HZ3 LYS 23 HZ3 LYS 23 7.350 -5.471 -3.424
218 H VAL 24 H VAL 24 5.733 -3.623 3.013
219 HA VAL 24 HA VAL 24 7.643 -2.701 3.771
220 HB VAL 24 HB VAL 24 8.257 -5.338 5.115
221 HG11 VAL 24 HG11 VAL 24 10.066 -3.716 5.181
222 HG12 VAL 24 HG12 VAL 24 9.359 -3.910 6.785
223 HG13 VAL 24 HG13 VAL 24 8.969 -2.489 5.817
224 HG21 VAL 24 HG21 VAL 24 6.997 -4.522 7.046
225 HG22 VAL 24 HG22 VAL 24 5.955 -4.706 5.636
226 HG23 VAL 24 HG23 VAL 24 6.499 -3.102 6.128
227 H LEU 25 H LEU 25 7.749 -3.514 1.224
228 HA LEU 25 HA LEU 25 10.356 -4.835 0.923
229 HB2 LEU 25 HB3 LEU 25 8.211 -5.357 -0.488
230 HB3 LEU 25 HB2 LEU 25 8.644 -3.903 -1.360
231 HG LEU 25 HG LEU 25 9.411 -5.975 -2.472
232 HD11 LEU 25 HD11 LEU 25 11.615 -4.166 -1.509
233 HD12 LEU 25 HD12 LEU 25 10.595 -3.924 -2.927
234 HD13 LEU 25 HD13 LEU 25 11.728 -5.275 -2.876
235 HD21 LEU 25 HD21 LEU 25 11.211 -7.285 -1.544
236 HD22 LEU 25 HD22 LEU 25 9.843 -7.280 -0.432
237 HD23 LEU 25 HD23 LEU 25 11.250 -6.269 -0.104
238 H ARG 26 H ARG 26 8.655 -2.012 -0.463
239 HA ARG 26 HA ARG 26 10.834 -0.323 0.389
240 HB2 ARG 26 HB3 ARG 26 11.015 0.651 -2.004
241 HB3 ARG 26 HB2 ARG 26 11.890 -0.815 -1.606
242 HG2 ARG 26 HG3 ARG 26 11.017 -1.346 -3.657
243 HG3 ARG 26 HG2 ARG 26 9.787 -2.007 -2.581
244 HD2 ARG 26 HD3 ARG 26 8.838 -0.764 -4.487
245 HD3 ARG 26 HD2 ARG 26 8.380 -0.080 -2.928
246 HE ARG 26 HE ARG 26 10.147 1.614 -3.327
247 HH11 ARG 26 HH11 ARG 26 8.764 -0.087 -6.065
248 HH12 ARG 26 HH12 ARG 26 9.107 1.188 -7.185
249 HH21 ARG 26 HH22 ARG 26 10.583 3.286 -4.795
250 HH22 ARG 26 HH21 ARG 26 10.139 3.108 -6.465
251 HA PRO 27 HA PRO 27 6.408 1.442 0.250
252 HB2 PRO 27 HB2 PRO 27 7.053 1.874 3.118
253 HB3 PRO 27 HB3 PRO 27 5.550 1.300 2.370
254 HG2 PRO 27 HG3 PRO 27 7.142 -0.378 3.677
255 HG3 PRO 27 HG2 PRO 27 6.322 -0.871 2.180
256 HD2 PRO 27 HD3 PRO 27 9.175 -0.035 2.602
257 HD3 PRO 27 HD2 PRO 27 8.527 -1.352 1.601
258 H GLN 28 H GLN 28 5.825 3.706 0.812
259 HA GLN 28 HA GLN 28 8.145 5.406 1.397
260 HB2 GLN 28 HB3 GLN 28 7.334 7.065 -0.276
261 HB3 GLN 28 HB2 GLN 28 7.932 5.571 -0.976
262 HG2 GLN 28 HG3 GLN 28 5.675 4.804 -1.366
263 HG3 GLN 28 HG2 GLN 28 5.022 6.236 -0.565
264 HE21 GLN 28 HE22 GLN 28 4.700 5.251 -3.331
265 HE22 GLN 28 HE21 GLN 28 5.189 6.561 -4.342
266 H GLY 29 H GLY 29 5.806 4.412 2.920
267 HA2 GLY 29 HA3 GLY 29 4.432 6.943 3.497
268 HA3 GLY 29 HA2 GLY 29 3.907 5.349 4.019
Start of MODEL 5
1 H1 ARG 1 H1 ARG 1 -8.663 1.824 -3.155
2 H2 ARG 1 H2 ARG 1 -8.205 2.845 -1.887
3 H3 ARG 1 H3 ARG 1 -9.025 3.472 -3.222
4 HA ARG 1 HA ARG 1 -10.455 3.234 -1.275
5 HB2 ARG 1 HB3 ARG 1 -11.268 3.064 -3.668
6 HB3 ARG 1 HB2 ARG 1 -11.228 1.318 -3.478
7 HG2 ARG 1 HG3 ARG 1 -12.821 1.524 -1.602
8 HG3 ARG 1 HG2 ARG 1 -12.921 3.256 -1.923
9 HD2 ARG 1 HD3 ARG 1 -13.789 2.832 -4.135
10 HD3 ARG 1 HD2 ARG 1 -13.582 1.094 -3.914
11 HE ARG 1 HE ARG 1 -15.265 2.357 -1.943
12 HH11 ARG 1 HH12 ARG 1 -15.155 0.841 -5.086
13 HH12 ARG 1 HH11 ARG 1 -16.810 0.327 -5.041
14 HH21 ARG 1 HH21 ARG 1 -17.436 1.683 -1.866
15 HH22 ARG 1 HH22 ARG 1 -18.112 0.805 -3.202
16 H LYS 2 H LYS 2 -8.178 1.418 -0.799
17 HA LYS 2 HA LYS 2 -7.642 -0.319 0.552
18 HB2 LYS 2 HB3 LYS 2 -10.511 0.057 1.411
19 HB3 LYS 2 HB2 LYS 2 -9.377 -1.010 2.226
20 HG2 LYS 2 HG3 LYS 2 -8.065 0.762 2.983
21 HG3 LYS 2 HG2 LYS 2 -8.772 1.893 1.833
22 HD2 LYS 2 HD3 LYS 2 -9.608 2.306 4.086
23 HD3 LYS 2 HD2 LYS 2 -10.909 1.768 3.024
24 HE2 LYS 2 HE3 LYS 2 -10.717 -0.492 3.932
25 HE3 LYS 2 HE2 LYS 2 -9.402 0.035 4.979
26 HZ1 LYS 2 HZ1 LYS 2 -12.195 1.034 5.072
27 HZ2 LYS 2 HZ2 LYS 2 -10.933 1.550 6.072
28 HZ3 LYS 2 HZ3 LYS 2 -11.493 -0.040 6.172
29 H CYS 3 H CYS 3 -7.946 -1.241 -1.911
30 HA CYS 3 HA CYS 3 -9.769 -3.488 -1.936
31 HB2 CYS 3 HB3 CYS 3 -8.946 -3.922 -4.164
32 HB3 CYS 3 HB2 CYS 3 -9.265 -2.203 -4.002
33 H ASN 4 H ASN 4 -8.071 -3.612 0.223
34 HA ASN 4 HA ASN 4 -6.803 -5.059 1.398
35 HB2 ASN 4 HB3 ASN 4 -7.201 -6.797 -1.035
36 HB3 ASN 4 HB2 ASN 4 -6.349 -7.338 0.405
37 HD21 ASN 4 HD22 ASN 4 -8.878 -8.182 -0.912
38 HD22 ASN 4 HD21 ASN 4 -10.067 -8.144 0.345
39 H PHE 5 H PHE 5 -5.291 -6.592 -1.234
40 HA PHE 5 HA PHE 5 -2.742 -5.530 -0.420
41 HB2 PHE 5 HB3 PHE 5 -1.922 -7.145 -2.232
42 HB3 PHE 5 HB2 PHE 5 -2.722 -7.847 -0.833
43 HD1 PHE 5 HD1 PHE 5 -4.956 -8.813 -1.034
44 HD2 PHE 5 HD2 PHE 5 -2.924 -7.225 -4.412
45 HE1 PHE 5 HE1 PHE 5 -6.535 -9.969 -2.518
46 HE2 PHE 5 HE2 PHE 5 -4.499 -8.381 -5.904
47 HZ PHE 5 HZ PHE 5 -6.333 -9.747 -4.935
48 H LEU 6 H LEU 6 -1.225 -4.528 -1.847
49 HA LEU 6 HA LEU 6 -0.699 -2.699 -3.059
50 HB2 LEU 6 HB3 LEU 6 -2.489 -4.079 -5.064
51 HB3 LEU 6 HB2 LEU 6 -1.438 -2.730 -5.439
52 HG LEU 6 HG LEU 6 -0.236 -4.565 -6.193
53 HD11 LEU 6 HD11 LEU 6 0.749 -4.193 -3.375
54 HD12 LEU 6 HD12 LEU 6 1.137 -3.158 -4.749
55 HD13 LEU 6 HD13 LEU 6 1.670 -4.838 -4.734
56 HD21 LEU 6 HD21 LEU 6 -1.582 -6.344 -5.370
57 HD22 LEU 6 HD22 LEU 6 -1.095 -6.016 -3.708
58 HD23 LEU 6 HD23 LEU 6 0.080 -6.637 -4.865
59 H CYS 7 H CYS 7 -2.643 -2.203 -1.219
60 HA CYS 7 HA CYS 7 -4.065 0.018 -2.370
61 HB2 CYS 7 HB3 CYS 7 -5.407 -2.523 -1.944
62 HB3 CYS 7 HB2 CYS 7 -6.160 -1.218 -1.036
63 H LYS 8 H LYS 8 -3.696 -2.085 0.466
64 HA LYS 8 HA LYS 8 -2.998 0.239 2.038
65 HB2 LYS 8 HB3 LYS 8 -5.449 0.145 2.324
66 HB3 LYS 8 HB2 LYS 8 -5.315 -1.521 2.875
67 HG2 LYS 8 HG3 LYS 8 -4.097 -0.837 4.829
68 HG3 LYS 8 HG2 LYS 8 -4.029 0.827 4.252
69 HD2 LYS 8 HD3 LYS 8 -5.733 0.640 5.941
70 HD3 LYS 8 HD2 LYS 8 -6.496 0.931 4.381
71 HE2 LYS 8 HE3 LYS 8 -7.702 -0.756 5.658
72 HE3 LYS 8 HE2 LYS 8 -7.024 -1.436 4.182
73 HZ1 LYS 8 HZ1 LYS 8 -5.913 -1.718 6.925
74 HZ2 LYS 8 HZ2 LYS 8 -5.188 -2.326 5.525
75 HZ3 LYS 8 HZ3 LYS 8 -6.682 -2.927 6.031
76 H LEU 9 H LEU 9 -3.444 -3.188 1.735
77 HA LEU 9 HA LEU 9 -1.921 -3.907 4.048
78 HB2 LEU 9 HB3 LEU 9 -3.088 -5.404 1.735
79 HB3 LEU 9 HB2 LEU 9 -1.904 -6.190 2.761
80 HG LEU 9 HG LEU 9 -3.376 -5.794 4.720
81 HD11 LEU 9 HD11 LEU 9 -5.722 -5.164 4.317
82 HD12 LEU 9 HD12 LEU 9 -5.311 -4.779 2.646
83 HD13 LEU 9 HD13 LEU 9 -4.596 -3.853 3.966
84 HD21 LEU 9 HD21 LEU 9 -3.431 -7.912 3.520
85 HD22 LEU 9 HD22 LEU 9 -4.660 -7.271 2.428
86 HD23 LEU 9 HD23 LEU 9 -5.027 -7.490 4.139
87 H LYS 10 H LYS 10 -1.265 -4.844 0.684
88 HA LYS 10 HA LYS 10 1.540 -4.122 1.105
89 HB2 LYS 10 HB3 LYS 10 0.189 -5.611 -1.152
90 HB3 LYS 10 HB2 LYS 10 1.894 -5.183 -1.140
91 HG2 LYS 10 HG3 LYS 10 2.147 -6.501 0.946
92 HG3 LYS 10 HG2 LYS 10 0.475 -7.010 0.762
93 HD2 LYS 10 HD3 LYS 10 2.699 -7.511 -1.210
94 HD3 LYS 10 HD2 LYS 10 2.028 -8.700 -0.097
95 HE2 LYS 10 HE3 LYS 10 -0.150 -8.491 -1.195
96 HE3 LYS 10 HE2 LYS 10 0.523 -7.300 -2.304
97 HZ1 LYS 10 HZ1 LYS 10 1.993 -8.957 -3.192
98 HZ2 LYS 10 HZ2 LYS 10 0.405 -9.537 -3.260
99 HZ3 LYS 10 HZ3 LYS 10 1.462 -10.102 -2.069
100 H GLU 11 H GLU 11 2.519 -3.150 -1.017
101 HA GLU 11 HA GLU 11 0.710 -1.185 -2.144
102 HB2 GLU 11 HB3 GLU 11 1.923 0.728 -1.508
103 HB3 GLU 11 HB2 GLU 11 1.680 -0.214 -0.049
104 HG2 GLU 11 HG3 GLU 11 3.837 0.294 0.242
105 HG3 GLU 11 HG2 GLU 11 4.068 -1.149 -0.735
106 H LYS 12 H LYS 12 2.188 0.353 -3.607
107 HA LYS 12 HA LYS 12 4.014 -1.241 -5.168
108 HB2 LYS 12 HB3 LYS 12 2.382 -0.684 -7.212
109 HB3 LYS 12 HB2 LYS 12 2.265 -2.174 -6.286
110 HG2 LYS 12 HG3 LYS 12 0.069 -1.246 -6.652
111 HG3 LYS 12 HG2 LYS 12 0.470 -1.208 -4.939
112 HD2 LYS 12 HD3 LYS 12 -0.567 0.847 -5.401
113 HD3 LYS 12 HD2 LYS 12 1.155 1.209 -5.293
114 HE2 LYS 12 HE3 LYS 12 0.266 2.383 -7.176
115 HE3 LYS 12 HE2 LYS 12 1.254 1.060 -7.787
116 HZ1 LYS 12 HZ1 LYS 12 -1.696 0.912 -7.505
117 HZ2 LYS 12 HZ2 LYS 12 -0.689 -0.193 -8.292
118 HZ3 LYS 12 HZ3 LYS 12 -0.914 1.353 -8.937
119 H LEU 13 H LEU 13 4.775 0.931 -3.950
120 HA LEU 13 HA LEU 13 5.846 2.916 -4.237
121 HB2 LEU 13 HB3 LEU 13 6.195 1.747 -6.605
122 HB3 LEU 13 HB2 LEU 13 5.159 3.052 -7.139
123 HG LEU 13 HG LEU 13 7.769 3.447 -5.671
124 HD11 LEU 13 HD11 LEU 13 8.671 4.116 -7.843
125 HD12 LEU 13 HD12 LEU 13 7.150 3.661 -8.612
126 HD13 LEU 13 HD13 LEU 13 8.152 2.430 -7.844
127 HD21 LEU 13 HD21 LEU 13 6.204 5.300 -5.394
128 HD22 LEU 13 HD22 LEU 13 6.001 5.396 -7.142
129 HD23 LEU 13 HD23 LEU 13 7.565 5.764 -6.416
130 H ARG 14 H ARG 14 3.758 3.452 -3.012
131 HA ARG 14 HA ARG 14 2.241 5.422 -4.595
132 HB2 ARG 14 HB3 ARG 14 1.366 3.491 -2.535
133 HB3 ARG 14 HB2 ARG 14 0.580 5.060 -2.554
134 HG2 ARG 14 HG3 ARG 14 0.774 3.232 -4.933
135 HG3 ARG 14 HG2 ARG 14 -0.607 3.317 -3.838
136 HD2 ARG 14 HD3 ARG 14 -0.808 5.738 -4.390
137 HD3 ARG 14 HD2 ARG 14 0.452 5.518 -5.604
138 HE ARG 14 HE ARG 14 -1.310 3.651 -6.328
139 HH11 ARG 14 HH11 ARG 14 -1.762 7.020 -5.509
140 HH12 ARG 14 HH12 ARG 14 -3.162 7.203 -6.514
141 HH21 ARG 14 HH22 ARG 14 -3.148 3.883 -7.646
142 HH22 ARG 14 HH21 ARG 14 -3.947 5.423 -7.737
143 H THR 15 H THR 15 1.918 5.236 -1.105
144 HA THR 15 HA THR 15 3.641 7.251 -0.405
145 HB THR 15 HB THR 15 2.491 8.623 -2.029
146 HG1 THR 15 HG1 THR 15 2.188 10.406 -0.664
147 HG21 THR 15 HG21 THR 15 0.035 8.256 -0.321
148 HG22 THR 15 HG22 THR 15 0.263 7.678 -1.972
149 HG23 THR 15 HG23 THR 15 0.193 9.411 -1.645
150 H VAL 16 H VAL 16 0.172 6.459 0.270
151 HA VAL 16 HA VAL 16 0.879 6.576 3.113
152 HB VAL 16 HB VAL 16 -1.435 8.125 1.944
153 HG11 VAL 16 HG11 VAL 16 -1.833 7.074 4.173
154 HG12 VAL 16 HG12 VAL 16 -1.916 8.837 4.176
155 HG13 VAL 16 HG13 VAL 16 -0.482 8.022 4.802
156 HG21 VAL 16 HG21 VAL 16 0.688 9.244 1.524
157 HG22 VAL 16 HG22 VAL 16 1.122 9.092 3.227
158 HG23 VAL 16 HG23 VAL 16 -0.235 10.114 2.750
159 H ILE 17 H ILE 17 -2.172 6.283 1.212
160 HA ILE 17 HA ILE 17 -3.227 4.496 3.167
161 HB ILE 17 HB ILE 17 -4.873 5.745 2.046
162 HG12 ILE 17 HG13 ILE 17 -6.303 4.047 0.946
163 HG13 ILE 17 HG12 ILE 17 -4.932 2.953 0.883
164 HG21 ILE 17 HG21 ILE 17 -5.207 5.761 -0.373
165 HG22 ILE 17 HG22 ILE 17 -3.785 4.739 -0.573
166 HG23 ILE 17 HG23 ILE 17 -3.614 6.371 0.071
167 HD11 ILE 17 HD11 ILE 17 -4.877 3.230 3.440
168 HD12 ILE 17 HD12 ILE 17 -6.132 2.221 2.715
169 HD13 ILE 17 HD13 ILE 17 -6.513 3.862 3.248
170 H THR 18 H THR 18 -2.059 4.049 -0.137
171 HA THR 18 HA THR 18 -2.333 1.257 -0.203
172 HB THR 18 HB THR 18 -0.170 2.751 -1.657
173 HG1 THR 18 HG1 THR 18 -2.893 2.620 -2.493
174 HG21 THR 18 HG21 THR 18 -2.008 0.524 -2.533
175 HG22 THR 18 HG22 THR 18 -0.386 0.289 -1.889
176 HG23 THR 18 HG23 THR 18 -0.611 1.155 -3.405
177 H SER 19 H SER 19 0.512 3.318 0.392
178 HA SER 19 HA SER 19 1.910 1.080 1.599
179 HB2 SER 19 HB3 SER 19 3.102 2.697 0.142
180 HB3 SER 19 HB2 SER 19 2.764 3.972 1.318
181 HG SER 19 HG SER 19 4.414 1.674 1.601
182 H HIS 20 H HIS 20 -0.227 1.332 3.048
183 HA HIS 20 HA HIS 20 0.276 3.042 5.351
184 HB2 HIS 20 HB3 HIS 20 -2.042 2.740 4.389
185 HB3 HIS 20 HB2 HIS 20 -1.985 1.071 4.939
186 HD1 HIS 20 HD1 HIS 20 -3.045 4.351 5.980
187 HD2 HIS 20 HD2 HIS 20 -1.639 0.937 7.893
188 HE1 HIS 20 HE1 HIS 20 -3.761 4.575 8.378
189 HE2 HIS 20 HE2 HIS 20 -2.730 2.599 9.548
190 H ILE 21 H ILE 21 -0.510 -0.405 4.859
191 HA ILE 21 HA ILE 21 1.108 -1.123 7.173
192 HB ILE 21 HB ILE 21 -0.380 -2.907 5.230
193 HG12 ILE 21 HG13 ILE 21 -1.176 -2.001 8.007
194 HG13 ILE 21 HG12 ILE 21 -1.866 -1.384 6.510
195 HG21 ILE 21 HG21 ILE 21 1.440 -4.064 6.356
196 HG22 ILE 21 HG22 ILE 21 -0.119 -4.636 6.949
197 HG23 ILE 21 HG23 ILE 21 0.839 -3.518 7.921
198 HD11 ILE 21 HD11 ILE 21 -2.737 -3.598 5.993
199 HD12 ILE 21 HD12 ILE 21 -3.319 -3.029 7.556
200 HD13 ILE 21 HD13 ILE 21 -2.029 -4.229 7.481
201 H ASP 22 H ASP 22 0.996 -1.429 3.705
202 HA ASP 22 HA ASP 22 2.569 -1.585 2.098
203 HB2 ASP 22 HB3 ASP 22 3.924 -0.118 3.725
204 HB3 ASP 22 HB2 ASP 22 4.729 -1.585 4.207
205 H LYS 23 H LYS 23 4.199 -3.087 1.242
206 HA LYS 23 HA LYS 23 3.683 -5.753 2.096
207 HB2 LYS 23 HB3 LYS 23 5.550 -6.249 0.360
208 HB3 LYS 23 HB2 LYS 23 3.999 -5.648 -0.195
209 HG2 LYS 23 HG3 LYS 23 5.509 -4.417 -1.435
210 HG3 LYS 23 HG2 LYS 23 5.125 -3.323 -0.109
211 HD2 LYS 23 HD3 LYS 23 7.172 -4.115 1.056
212 HD3 LYS 23 HD2 LYS 23 7.571 -5.063 -0.377
213 HE2 LYS 23 HE3 LYS 23 7.573 -2.972 -1.700
214 HE3 LYS 23 HE2 LYS 23 7.297 -2.058 -0.213
215 HZ1 LYS 23 HZ1 LYS 23 9.386 -2.940 0.649
216 HZ2 LYS 23 HZ2 LYS 23 9.640 -2.105 -0.799
217 HZ3 LYS 23 HZ3 LYS 23 9.642 -3.793 -0.788
218 H VAL 24 H VAL 24 6.273 -3.408 2.585
219 HA VAL 24 HA VAL 24 7.391 -4.962 4.747
220 HB VAL 24 HB VAL 24 9.369 -4.462 2.515
221 HG11 VAL 24 HG11 VAL 24 10.292 -4.684 4.744
222 HG12 VAL 24 HG12 VAL 24 10.739 -6.077 3.759
223 HG13 VAL 24 HG13 VAL 24 9.457 -6.222 4.962
224 HG21 VAL 24 HG21 VAL 24 9.352 -6.851 1.979
225 HG22 VAL 24 HG22 VAL 24 7.810 -6.085 1.600
226 HG23 VAL 24 HG23 VAL 24 7.969 -7.077 3.049
227 H LEU 25 H LEU 25 6.335 -2.286 3.947
228 HA LEU 25 HA LEU 25 6.569 -0.138 4.604
229 HB2 LEU 25 HB3 LEU 25 7.323 -1.075 6.735
230 HB3 LEU 25 HB2 LEU 25 8.964 -1.159 6.129
231 HG LEU 25 HG LEU 25 8.997 1.315 5.952
232 HD11 LEU 25 HD11 LEU 25 6.626 1.722 5.677
233 HD12 LEU 25 HD12 LEU 25 7.237 2.598 7.079
234 HD13 LEU 25 HD13 LEU 25 6.311 1.113 7.300
235 HD21 LEU 25 HD21 LEU 25 8.301 0.222 8.675
236 HD22 LEU 25 HD22 LEU 25 9.135 1.743 8.358
237 HD23 LEU 25 HD23 LEU 25 9.897 0.213 7.926
238 H ARG 26 H ARG 26 7.044 0.179 2.278
239 HA ARG 26 HA ARG 26 9.504 1.725 2.110
240 HB2 ARG 26 HB3 ARG 26 10.277 -0.192 1.042
241 HB3 ARG 26 HB2 ARG 26 8.705 -0.589 0.383
242 HG2 ARG 26 HG3 ARG 26 9.796 1.869 -0.719
243 HG3 ARG 26 HG2 ARG 26 10.827 0.458 -0.994
244 HD2 ARG 26 HD3 ARG 26 8.906 -0.771 -1.882
245 HD3 ARG 26 HD2 ARG 26 7.877 0.639 -1.605
246 HE ARG 26 HE ARG 26 10.076 1.362 -3.230
247 HH11 ARG 26 HH11 ARG 26 7.005 -0.309 -3.356
248 HH12 ARG 26 HH12 ARG 26 6.908 -0.266 -5.088
249 HH21 ARG 26 HH22 ARG 26 9.927 1.449 -5.518
250 HH22 ARG 26 HH21 ARG 26 8.556 0.742 -6.315
251 HA PRO 27 HA PRO 27 5.462 3.697 0.809
252 HB2 PRO 27 HB2 PRO 27 6.506 5.903 2.497
253 HB3 PRO 27 HB3 PRO 27 4.890 5.171 2.467
254 HG2 PRO 27 HG3 PRO 27 6.547 4.675 4.483
255 HG3 PRO 27 HG2 PRO 27 5.533 3.380 3.797
256 HD2 PRO 27 HD3 PRO 27 8.446 3.975 3.294
257 HD3 PRO 27 HD2 PRO 27 7.665 2.414 3.634
258 H GLN 28 H GLN 28 5.317 4.850 -0.971
259 HA GLN 28 HA GLN 28 5.621 6.457 -2.541
260 HB2 GLN 28 HB3 GLN 28 7.675 7.582 -0.630
261 HB3 GLN 28 HB2 GLN 28 7.027 8.409 -2.042
262 HG2 GLN 28 HG3 GLN 28 4.892 8.589 -1.092
263 HG3 GLN 28 HG2 GLN 28 5.264 7.410 0.168
264 HE21 GLN 28 HE22 GLN 28 4.225 10.108 0.403
265 HE22 GLN 28 HE21 GLN 28 5.351 10.974 1.393
266 H GLY 29 H GLY 29 7.506 4.021 -2.014
267 HA2 GLY 29 HA3 GLY 29 8.644 3.006 -3.839
268 HA3 GLY 29 HA2 GLY 29 9.089 4.605 -4.412
Start of MODEL 6
1 H1 ARG 1 H1 ARG 1 -11.175 0.774 4.173
2 H2 ARG 1 H2 ARG 1 -12.580 1.319 4.935
3 H3 ARG 1 H3 ARG 1 -11.632 2.396 4.043
4 HA ARG 1 HA ARG 1 -13.103 0.077 2.941
5 HB2 ARG 1 HB3 ARG 1 -13.661 3.047 2.838
6 HB3 ARG 1 HB2 ARG 1 -14.451 1.873 1.797
7 HG2 ARG 1 HG3 ARG 1 -15.478 0.805 3.676
8 HG3 ARG 1 HG2 ARG 1 -14.559 1.806 4.801
9 HD2 ARG 1 HD3 ARG 1 -16.837 2.624 4.586
10 HD3 ARG 1 HD2 ARG 1 -15.688 3.798 3.954
11 HE ARG 1 HE ARG 1 -16.768 2.051 1.940
12 HH11 ARG 1 HH12 ARG 1 -17.253 5.017 3.739
13 HH12 ARG 1 HH11 ARG 1 -18.322 5.709 2.561
14 HH21 ARG 1 HH21 ARG 1 -18.197 2.963 0.389
15 HH22 ARG 1 HH22 ARG 1 -18.866 4.538 0.668
16 H LYS 2 H LYS 2 -11.211 -0.609 1.891
17 HA LYS 2 HA LYS 2 -10.612 0.893 -0.532
18 HB2 LYS 2 HB3 LYS 2 -8.543 0.016 1.492
19 HB3 LYS 2 HB2 LYS 2 -8.142 0.390 -0.179
20 HG2 LYS 2 HG3 LYS 2 -9.517 2.340 1.651
21 HG3 LYS 2 HG2 LYS 2 -7.762 2.237 1.485
22 HD2 LYS 2 HD3 LYS 2 -7.851 2.855 -0.801
23 HD3 LYS 2 HD2 LYS 2 -9.597 2.626 -0.870
24 HE2 LYS 2 HE3 LYS 2 -8.275 4.692 0.871
25 HE3 LYS 2 HE2 LYS 2 -8.803 5.018 -0.778
26 HZ1 LYS 2 HZ1 LYS 2 -11.049 4.487 -0.150
27 HZ2 LYS 2 HZ2 LYS 2 -10.448 5.676 0.891
28 HZ3 LYS 2 HZ3 LYS 2 -10.568 4.073 1.414
29 H CYS 3 H CYS 3 -8.799 -0.662 -1.715
30 HA CYS 3 HA CYS 3 -10.285 -2.955 -2.430
31 HB2 CYS 3 HB3 CYS 3 -7.421 -2.989 -3.110
32 HB3 CYS 3 HB2 CYS 3 -8.828 -3.093 -4.161
33 H ASN 4 H ASN 4 -6.898 -3.140 -1.524
34 HA ASN 4 HA ASN 4 -6.992 -4.562 0.820
35 HB2 ASN 4 HB3 ASN 4 -6.470 -6.905 -0.048
36 HB3 ASN 4 HB2 ASN 4 -8.147 -6.398 -0.156
37 HD21 ASN 4 HD22 ASN 4 -8.483 -7.997 -1.736
38 HD22 ASN 4 HD21 ASN 4 -7.954 -7.778 -3.369
39 H PHE 5 H PHE 5 -4.994 -6.474 -0.962
40 HA PHE 5 HA PHE 5 -2.629 -5.049 -0.311
41 HB2 PHE 5 HB3 PHE 5 -1.586 -6.799 -1.879
42 HB3 PHE 5 HB2 PHE 5 -2.357 -7.371 -0.409
43 HD1 PHE 5 HD2 PHE 5 -2.748 -7.068 -4.066
44 HD2 PHE 5 HD1 PHE 5 -4.260 -8.782 -0.480
45 HE1 PHE 5 HE2 PHE 5 -4.183 -8.562 -5.389
46 HE2 PHE 5 HE1 PHE 5 -5.697 -10.278 -1.798
47 HZ PHE 5 HZ PHE 5 -5.663 -10.167 -4.254
48 H LEU 6 H LEU 6 -1.063 -4.193 -1.806
49 HA LEU 6 HA LEU 6 -0.437 -2.741 -3.429
50 HB2 LEU 6 HB3 LEU 6 -2.340 -4.480 -4.976
51 HB3 LEU 6 HB2 LEU 6 -1.588 -3.089 -5.727
52 HG LEU 6 HG LEU 6 -0.360 -5.066 -6.326
53 HD11 LEU 6 HD11 LEU 6 1.205 -3.518 -4.272
54 HD12 LEU 6 HD12 LEU 6 0.917 -3.009 -5.937
55 HD13 LEU 6 HD13 LEU 6 1.861 -4.461 -5.608
56 HD21 LEU 6 HD21 LEU 6 -0.953 -6.556 -4.543
57 HD22 LEU 6 HD22 LEU 6 -0.100 -5.557 -3.369
58 HD23 LEU 6 HD23 LEU 6 0.803 -6.421 -4.614
59 H CYS 7 H CYS 7 -2.568 -2.033 -1.607
60 HA CYS 7 HA CYS 7 -3.762 0.168 -3.043
61 HB2 CYS 7 HB3 CYS 7 -5.299 -1.635 -3.650
62 HB3 CYS 7 HB2 CYS 7 -5.515 -2.048 -1.956
63 H LYS 8 H LYS 8 -3.274 -1.648 -0.112
64 HA LYS 8 HA LYS 8 -3.077 0.671 1.509
65 HB2 LYS 8 HB3 LYS 8 -5.523 0.613 1.360
66 HB3 LYS 8 HB2 LYS 8 -5.528 -1.066 1.884
67 HG2 LYS 8 HG3 LYS 8 -4.453 -0.287 4.019
68 HG3 LYS 8 HG2 LYS 8 -4.779 1.362 3.484
69 HD2 LYS 8 HD3 LYS 8 -7.180 0.782 3.306
70 HD3 LYS 8 HD2 LYS 8 -6.812 -0.815 3.960
71 HE2 LYS 8 HE3 LYS 8 -5.869 0.315 5.975
72 HE3 LYS 8 HE2 LYS 8 -6.452 1.844 5.321
73 HZ1 LYS 8 HZ1 LYS 8 -8.704 0.954 5.370
74 HZ2 LYS 8 HZ2 LYS 8 -8.010 0.939 6.909
75 HZ3 LYS 8 HZ3 LYS 8 -8.135 -0.495 6.027
76 H LEU 9 H LEU 9 -3.754 -2.739 1.367
77 HA LEU 9 HA LEU 9 -2.619 -3.398 3.920
78 HB2 LEU 9 HB3 LEU 9 -3.742 -4.923 1.601
79 HB3 LEU 9 HB2 LEU 9 -2.862 -5.774 2.860
80 HG LEU 9 HG LEU 9 -4.481 -4.992 4.537
81 HD11 LEU 9 HD11 LEU 9 -6.589 -3.949 3.784
82 HD12 LEU 9 HD12 LEU 9 -5.877 -3.730 2.186
83 HD13 LEU 9 HD13 LEU 9 -5.185 -2.905 3.581
84 HD21 LEU 9 HD21 LEU 9 -6.381 -6.342 3.780
85 HD22 LEU 9 HD22 LEU 9 -4.838 -7.131 3.464
86 HD23 LEU 9 HD23 LEU 9 -5.714 -6.350 2.148
87 H LYS 10 H LYS 10 -1.759 -3.843 0.552
88 HA LYS 10 HA LYS 10 1.052 -3.947 1.348
89 HB2 LYS 10 HB3 LYS 10 0.337 -6.160 0.580
90 HB3 LYS 10 HB2 LYS 10 -0.310 -5.463 -0.892
91 HG2 LYS 10 HG3 LYS 10 1.772 -5.145 -1.815
92 HG3 LYS 10 HG2 LYS 10 2.575 -5.123 -0.245
93 HD2 LYS 10 HD3 LYS 10 2.977 -7.190 -1.622
94 HD3 LYS 10 HD2 LYS 10 2.348 -7.480 -0.001
95 HE2 LYS 10 HE3 LYS 10 0.104 -7.754 -0.918
96 HE3 LYS 10 HE2 LYS 10 0.715 -7.438 -2.537
97 HZ1 LYS 10 HZ1 LYS 10 1.349 -9.751 -0.796
98 HZ2 LYS 10 HZ2 LYS 10 2.170 -9.416 -2.236
99 HZ3 LYS 10 HZ3 LYS 10 0.518 -9.769 -2.267
100 H GLU 11 H GLU 11 2.461 -3.030 -0.450
101 HA GLU 11 HA GLU 11 0.972 -0.934 -1.869
102 HB2 GLU 11 HB3 GLU 11 1.955 -0.214 0.370
103 HB3 GLU 11 HB2 GLU 11 3.534 -0.454 -0.349
104 HG2 GLU 11 HG3 GLU 11 2.145 1.195 -2.131
105 HG3 GLU 11 HG2 GLU 11 1.771 1.801 -0.521
106 H LYS 12 H LYS 12 3.316 0.377 -2.832
107 HA LYS 12 HA LYS 12 4.998 -1.238 -4.345
108 HB2 LYS 12 HB3 LYS 12 3.919 -1.331 -6.492
109 HB3 LYS 12 HB2 LYS 12 2.807 -2.013 -5.327
110 HG2 LYS 12 HG3 LYS 12 2.638 0.818 -6.242
111 HG3 LYS 12 HG2 LYS 12 1.882 -0.509 -7.115
112 HD2 LYS 12 HD3 LYS 12 0.681 -1.089 -4.981
113 HD3 LYS 12 HD2 LYS 12 1.289 0.443 -4.314
114 HE2 LYS 12 HE3 LYS 12 -0.822 0.968 -5.207
115 HE3 LYS 12 HE2 LYS 12 0.377 1.512 -6.381
116 HZ1 LYS 12 HZ1 LYS 12 -1.139 -1.024 -6.585
117 HZ2 LYS 12 HZ2 LYS 12 -0.033 -0.426 -7.715
118 HZ3 LYS 12 HZ3 LYS 12 -1.490 0.386 -7.446
119 H LEU 13 H LEU 13 4.989 1.150 -2.902
120 HA LEU 13 HA LEU 13 5.463 3.306 -2.817
121 HB2 LEU 13 HB3 LEU 13 6.987 4.297 -4.344
122 HB3 LEU 13 HB2 LEU 13 7.451 2.632 -4.096
123 HG LEU 13 HG LEU 13 6.067 2.349 -6.381
124 HD11 LEU 13 HD11 LEU 13 7.231 5.126 -6.529
125 HD12 LEU 13 HD12 LEU 13 5.516 4.716 -6.571
126 HD13 LEU 13 HD13 LEU 13 6.577 4.203 -7.882
127 HD21 LEU 13 HD21 LEU 13 8.356 1.621 -5.941
128 HD22 LEU 13 HD22 LEU 13 8.926 3.272 -6.176
129 HD23 LEU 13 HD23 LEU 13 8.211 2.386 -7.522
130 H ARG 14 H ARG 14 3.844 4.602 -2.601
131 HA ARG 14 HA ARG 14 2.649 5.716 -5.013
132 HB2 ARG 14 HB3 ARG 14 1.104 3.941 -4.356
133 HB3 ARG 14 HB2 ARG 14 0.987 4.625 -2.739
134 HG2 ARG 14 HG3 ARG 14 -0.957 5.245 -4.016
135 HG3 ARG 14 HG2 ARG 14 0.020 6.679 -3.704
136 HD2 ARG 14 HD3 ARG 14 -0.592 6.878 -5.951
137 HD3 ARG 14 HD2 ARG 14 1.051 6.251 -6.007
138 HE ARG 14 HE ARG 14 -1.304 4.503 -6.286
139 HH11 ARG 14 HH11 ARG 14 1.855 5.574 -7.386
140 HH12 ARG 14 HH12 ARG 14 1.908 4.445 -8.698
141 HH21 ARG 14 HH22 ARG 14 -1.225 3.037 -8.014
142 HH22 ARG 14 HH21 ARG 14 0.166 2.990 -9.049
143 H THR 15 H THR 15 1.663 6.088 -1.573
144 HA THR 15 HA THR 15 2.714 8.753 -1.450
145 HB THR 15 HB THR 15 -0.264 8.456 -1.864
146 HG1 THR 15 HG1 THR 15 1.807 8.962 -3.552
147 HG21 THR 15 HG21 THR 15 1.392 10.901 -1.248
148 HG22 THR 15 HG22 THR 15 0.183 10.158 -0.204
149 HG23 THR 15 HG23 THR 15 -0.308 10.919 -1.714
150 H VAL 16 H VAL 16 -0.028 6.822 -0.070
151 HA VAL 16 HA VAL 16 0.779 7.390 2.617
152 HB VAL 16 HB VAL 16 -1.500 8.995 1.465
153 HG11 VAL 16 HG11 VAL 16 -2.386 7.853 3.431
154 HG12 VAL 16 HG12 VAL 16 -2.158 9.569 3.762
155 HG13 VAL 16 HG13 VAL 16 -1.002 8.392 4.382
156 HG21 VAL 16 HG21 VAL 16 0.790 9.979 1.578
157 HG22 VAL 16 HG22 VAL 16 0.736 9.785 3.328
158 HG23 VAL 16 HG23 VAL 16 -0.410 10.857 2.523
159 H ILE 17 H ILE 17 -2.381 6.849 0.940
160 HA ILE 17 HA ILE 17 -3.277 5.143 3.038
161 HB ILE 17 HB ILE 17 -5.033 6.205 1.933
162 HG12 ILE 17 HG13 ILE 17 -6.360 4.375 0.850
163 HG13 ILE 17 HG12 ILE 17 -4.922 3.367 0.896
164 HG21 ILE 17 HG21 ILE 17 -3.932 5.222 -0.688
165 HG22 ILE 17 HG22 ILE 17 -3.898 6.878 -0.084
166 HG23 ILE 17 HG23 ILE 17 -5.436 6.118 -0.482
167 HD11 ILE 17 HD11 ILE 17 -4.932 3.726 3.404
168 HD12 ILE 17 HD12 ILE 17 -6.214 2.712 2.732
169 HD13 ILE 17 HD13 ILE 17 -6.554 4.384 3.193
170 H THR 18 H THR 18 -2.415 4.401 -0.347
171 HA THR 18 HA THR 18 -2.328 1.607 -0.025
172 HB THR 18 HB THR 18 -0.625 3.301 -1.874
173 HG1 THR 18 HG1 THR 18 -3.343 2.655 -1.858
174 HG21 THR 18 HG21 THR 18 -1.629 0.465 -2.163
175 HG22 THR 18 HG22 THR 18 0.016 0.921 -1.722
176 HG23 THR 18 HG23 THR 18 -0.619 1.342 -3.310
177 H SER 19 H SER 19 -0.099 4.173 0.398
178 HA SER 19 HA SER 19 2.198 2.700 1.163
179 HB2 SER 19 HB3 SER 19 1.426 5.601 1.491
180 HB3 SER 19 HB2 SER 19 3.053 4.966 1.603
181 HG SER 19 HG SER 19 2.806 4.215 -0.572
182 H HIS 20 H HIS 20 -0.309 2.248 2.798
183 HA HIS 20 HA HIS 20 0.308 3.382 5.392
184 HB2 HIS 20 HB3 HIS 20 -2.042 3.065 4.765
185 HB3 HIS 20 HB2 HIS 20 -1.771 1.340 4.552
186 HD1 HIS 20 HD1 HIS 20 -2.750 0.082 6.430
187 HD2 HIS 20 HD2 HIS 20 -1.179 3.727 7.673
188 HE1 HIS 20 HE1 HIS 20 -3.146 0.180 8.912
189 HE2 HIS 20 HE2 HIS 20 -2.285 2.439 9.625
190 H ILE 21 H ILE 21 -0.116 0.089 4.171
191 HA ILE 21 HA ILE 21 2.384 -0.673 5.475
192 HB ILE 21 HB ILE 21 0.769 -1.511 7.027
193 HG12 ILE 21 HG13 ILE 21 1.014 -3.985 6.796
194 HG13 ILE 21 HG12 ILE 21 1.659 -3.730 5.179
195 HG21 ILE 21 HG21 ILE 21 -1.107 -2.947 6.394
196 HG22 ILE 21 HG22 ILE 21 -0.710 -2.694 4.693
197 HG23 ILE 21 HG23 ILE 21 -1.228 -1.333 5.689
198 HD11 ILE 21 HD11 ILE 21 3.430 -4.098 6.790
199 HD12 ILE 21 HD12 ILE 21 2.868 -2.724 7.742
200 HD13 ILE 21 HD13 ILE 21 3.517 -2.470 6.123
201 H ASP 22 H ASP 22 3.579 -2.129 4.238
202 HA ASP 22 HA ASP 22 2.432 -2.588 1.567
203 HB2 ASP 22 HB3 ASP 22 4.516 -2.023 0.563
204 HB3 ASP 22 HB2 ASP 22 4.217 -0.783 1.764
205 H LYS 23 H LYS 23 4.697 -3.984 0.598
206 HA LYS 23 HA LYS 23 4.282 -6.589 1.693
207 HB2 LYS 23 HB3 LYS 23 6.015 -7.296 0.032
208 HB3 LYS 23 HB2 LYS 23 4.647 -6.454 -0.672
209 HG2 LYS 23 HG3 LYS 23 7.189 -4.998 -0.026
210 HG3 LYS 23 HG2 LYS 23 7.013 -5.915 -1.521
211 HD2 LYS 23 HD3 LYS 23 4.894 -4.551 -1.919
212 HD3 LYS 23 HD2 LYS 23 5.444 -3.513 -0.610
213 HE2 LYS 23 HE3 LYS 23 6.116 -2.557 -2.702
214 HE3 LYS 23 HE2 LYS 23 7.540 -3.118 -1.830
215 HZ1 LYS 23 HZ1 LYS 23 7.598 -3.691 -4.197
216 HZ2 LYS 23 HZ2 LYS 23 6.187 -4.604 -4.019
217 HZ3 LYS 23 HZ3 LYS 23 7.603 -5.073 -3.226
218 H VAL 24 H VAL 24 5.618 -4.259 3.172
219 HA VAL 24 HA VAL 24 7.114 -3.992 4.831
220 HB VAL 24 HB VAL 24 7.636 -6.966 4.721
221 HG11 VAL 24 HG11 VAL 24 7.892 -4.913 6.916
222 HG12 VAL 24 HG12 VAL 24 9.206 -5.774 6.112
223 HG13 VAL 24 HG13 VAL 24 8.078 -6.652 7.144
224 HG21 VAL 24 HG21 VAL 24 5.851 -7.181 6.403
225 HG22 VAL 24 HG22 VAL 24 5.236 -6.613 4.852
226 HG23 VAL 24 HG23 VAL 24 5.455 -5.479 6.183
227 H LEU 25 H LEU 25 7.900 -3.376 2.386
228 HA LEU 25 HA LEU 25 10.769 -4.031 2.448
229 HB2 LEU 25 HB3 LEU 25 9.564 -5.025 0.489
230 HB3 LEU 25 HB2 LEU 25 9.137 -3.402 -0.014
231 HG LEU 25 HG LEU 25 11.553 -2.879 -0.254
232 HD11 LEU 25 HD11 LEU 25 12.473 -4.475 1.311
233 HD12 LEU 25 HD12 LEU 25 13.150 -4.745 -0.295
234 HD13 LEU 25 HD13 LEU 25 11.892 -5.814 0.323
235 HD21 LEU 25 HD21 LEU 25 10.234 -3.564 -2.182
236 HD22 LEU 25 HD22 LEU 25 10.570 -5.258 -1.826
237 HD23 LEU 25 HD23 LEU 25 11.882 -4.179 -2.301
238 H ARG 26 H ARG 26 8.334 -1.675 1.325
239 HA ARG 26 HA ARG 26 9.320 0.477 2.763
240 HB2 ARG 26 HB3 ARG 26 10.615 1.795 1.300
241 HB3 ARG 26 HB2 ARG 26 11.297 0.186 1.193
242 HG2 ARG 26 HG3 ARG 26 9.557 1.570 -0.836
243 HG3 ARG 26 HG2 ARG 26 11.263 1.160 -0.987
244 HD2 ARG 26 HD3 ARG 26 10.659 -1.232 -0.888
245 HD3 ARG 26 HD2 ARG 26 8.955 -0.777 -0.815
246 HE ARG 26 HE ARG 26 10.701 -0.693 -3.134
247 HH11 ARG 26 HH11 ARG 26 7.665 0.350 -1.717
248 HH12 ARG 26 HH12 ARG 26 6.867 0.505 -3.249
249 HH21 ARG 26 HH22 ARG 26 9.641 -0.519 -5.146
250 HH22 ARG 26 HH21 ARG 26 7.984 -0.013 -5.205
251 HA PRO 27 HA PRO 27 5.582 1.976 0.754
252 HB2 PRO 27 HB2 PRO 27 4.375 2.908 2.964
253 HB3 PRO 27 HB3 PRO 27 4.364 1.182 2.556
254 HG2 PRO 27 HG3 PRO 27 5.878 2.617 4.651
255 HG3 PRO 27 HG2 PRO 27 5.358 0.927 4.589
256 HD2 PRO 27 HD3 PRO 27 7.945 2.000 3.962
257 HD3 PRO 27 HD2 PRO 27 7.413 0.314 3.850
258 H GLN 28 H GLN 28 4.897 4.140 0.366
259 HA GLN 28 HA GLN 28 6.981 6.100 0.765
260 HB2 GLN 28 HB3 GLN 28 4.319 6.258 -0.645
261 HB3 GLN 28 HB2 GLN 28 5.483 7.574 -0.591
262 HG2 GLN 28 HG3 GLN 28 6.033 4.854 -1.740
263 HG3 GLN 28 HG2 GLN 28 5.542 6.260 -2.680
264 HE21 GLN 28 HE22 GLN 28 7.407 6.301 -3.889
265 HE22 GLN 28 HE21 GLN 28 8.945 6.756 -3.236
266 H GLY 29 H GLY 29 4.778 5.106 2.863
267 HA2 GLY 29 HA3 GLY 29 4.715 7.662 4.225
268 HA3 GLY 29 HA2 GLY 29 3.142 7.024 3.761
Start of MODEL 7
1 H1 ARG 1 H1 ARG 1 -10.074 5.606 -1.074
2 H2 ARG 1 H2 ARG 1 -8.649 5.002 -0.403
3 H3 ARG 1 H3 ARG 1 -10.122 4.761 0.388
4 HA ARG 1 HA ARG 1 -10.908 3.354 -1.373
5 HB2 ARG 1 HB3 ARG 1 -8.158 3.764 -2.575
6 HB3 ARG 1 HB2 ARG 1 -9.412 2.705 -3.202
7 HG2 ARG 1 HG3 ARG 1 -9.594 5.705 -3.012
8 HG3 ARG 1 HG2 ARG 1 -9.234 4.785 -4.472
9 HD2 ARG 1 HD3 ARG 1 -11.767 4.541 -2.860
10 HD3 ARG 1 HD2 ARG 1 -11.596 5.511 -4.320
11 HE ARG 1 HE ARG 1 -10.790 2.955 -4.996
12 HH11 ARG 1 HH12 ARG 1 -13.701 4.456 -3.766
13 HH12 ARG 1 HH11 ARG 1 -14.769 3.366 -4.589
14 HH21 ARG 1 HH21 ARG 1 -12.198 1.482 -6.055
15 HH22 ARG 1 HH22 ARG 1 -13.915 1.667 -5.879
16 H LYS 2 H LYS 2 -10.891 1.318 -0.609
17 HA LYS 2 HA LYS 2 -8.404 0.361 0.654
18 HB2 LYS 2 HB3 LYS 2 -11.222 -0.391 1.460
19 HB3 LYS 2 HB2 LYS 2 -9.742 -0.985 2.189
20 HG2 LYS 2 HG3 LYS 2 -10.523 0.617 3.682
21 HG3 LYS 2 HG2 LYS 2 -9.250 1.443 2.786
22 HD2 LYS 2 HD3 LYS 2 -11.138 2.923 3.013
23 HD3 LYS 2 HD2 LYS 2 -11.000 2.436 1.325
24 HE2 LYS 2 HE3 LYS 2 -12.740 0.721 1.723
25 HE3 LYS 2 HE2 LYS 2 -12.914 1.321 3.371
26 HZ1 LYS 2 HZ1 LYS 2 -13.457 2.827 0.873
27 HZ2 LYS 2 HZ2 LYS 2 -13.528 3.488 2.428
28 HZ3 LYS 2 HZ3 LYS 2 -14.601 2.262 1.985
29 H CYS 3 H CYS 3 -7.954 -0.367 -1.539
30 HA CYS 3 HA CYS 3 -9.546 -2.477 -2.678
31 HB2 CYS 3 HB3 CYS 3 -6.807 -2.170 -3.676
32 HB3 CYS 3 HB2 CYS 3 -8.335 -2.078 -4.541
33 H ASN 4 H ASN 4 -8.411 -2.876 0.019
34 HA ASN 4 HA ASN 4 -7.385 -4.435 1.292
35 HB2 ASN 4 HB3 ASN 4 -7.765 -6.043 -1.233
36 HB3 ASN 4 HB2 ASN 4 -7.091 -6.735 0.237
37 HD21 ASN 4 HD22 ASN 4 -9.588 -7.254 -1.274
38 HD22 ASN 4 HD21 ASN 4 -10.854 -7.119 -0.105
39 H PHE 5 H PHE 5 -5.800 -6.100 -1.219
40 HA PHE 5 HA PHE 5 -3.242 -5.348 -0.130
41 HB2 PHE 5 HB3 PHE 5 -2.400 -7.026 -1.829
42 HB3 PHE 5 HB2 PHE 5 -3.492 -7.656 -0.604
43 HD1 PHE 5 HD2 PHE 5 -3.255 -6.638 -4.148
44 HD2 PHE 5 HD1 PHE 5 -5.572 -8.611 -1.174
45 HE1 PHE 5 HE2 PHE 5 -4.720 -7.549 -5.899
46 HE2 PHE 5 HE1 PHE 5 -7.039 -9.526 -2.921
47 HZ PHE 5 HZ PHE 5 -6.616 -8.994 -5.288
48 H LEU 6 H LEU 6 -1.492 -4.544 -1.363
49 HA LEU 6 HA LEU 6 -0.556 -2.892 -2.584
50 HB2 LEU 6 HB3 LEU 6 -2.326 -4.184 -4.646
51 HB3 LEU 6 HB2 LEU 6 -1.258 -2.856 -5.045
52 HG LEU 6 HG LEU 6 -0.142 -4.839 -5.691
53 HD11 LEU 6 HD11 LEU 6 1.012 -4.036 -3.030
54 HD12 LEU 6 HD12 LEU 6 1.254 -3.181 -4.552
55 HD13 LEU 6 HD13 LEU 6 1.863 -4.823 -4.358
56 HD21 LEU 6 HD21 LEU 6 -1.381 -6.508 -4.512
57 HD22 LEU 6 HD22 LEU 6 -0.787 -5.923 -2.958
58 HD23 LEU 6 HD23 LEU 6 0.322 -6.685 -4.097
59 H CYS 7 H CYS 7 -2.729 -2.124 -0.959
60 HA CYS 7 HA CYS 7 -3.446 0.340 -2.258
61 HB2 CYS 7 HB3 CYS 7 -5.154 -1.275 -3.090
62 HB3 CYS 7 HB2 CYS 7 -5.673 -1.521 -1.428
63 H LYS 8 H LYS 8 -3.941 -1.788 0.586
64 HA LYS 8 HA LYS 8 -3.141 0.482 2.230
65 HB2 LYS 8 HB3 LYS 8 -5.585 0.688 2.208
66 HB3 LYS 8 HB2 LYS 8 -5.745 -0.986 2.722
67 HG2 LYS 8 HG3 LYS 8 -4.620 -0.449 4.828
68 HG3 LYS 8 HG2 LYS 8 -4.470 1.231 4.315
69 HD2 LYS 8 HD3 LYS 8 -6.351 0.927 5.847
70 HD3 LYS 8 HD2 LYS 8 -6.899 1.438 4.253
71 HE2 LYS 8 HE3 LYS 8 -7.661 -0.734 3.715
72 HE3 LYS 8 HE2 LYS 8 -6.831 -1.444 5.096
73 HZ1 LYS 8 HZ1 LYS 8 -8.334 -0.303 6.570
74 HZ2 LYS 8 HZ2 LYS 8 -9.222 -1.217 5.462
75 HZ3 LYS 8 HZ3 LYS 8 -9.101 0.459 5.274
76 H LEU 9 H LEU 9 -3.991 -2.908 2.002
77 HA LEU 9 HA LEU 9 -2.826 -3.675 4.505
78 HB2 LEU 9 HB3 LEU 9 -3.667 -5.246 2.074
79 HB3 LEU 9 HB2 LEU 9 -3.121 -5.981 3.576
80 HG LEU 9 HG LEU 9 -5.524 -4.165 3.390
81 HD11 LEU 9 HD11 LEU 9 -5.396 -7.174 3.366
82 HD12 LEU 9 HD12 LEU 9 -5.891 -6.130 2.029
83 HD13 LEU 9 HD13 LEU 9 -6.864 -6.206 3.500
84 HD21 LEU 9 HD21 LEU 9 -4.569 -6.063 5.529
85 HD22 LEU 9 HD22 LEU 9 -6.077 -5.151 5.565
86 HD23 LEU 9 HD23 LEU 9 -4.532 -4.302 5.606
87 H LYS 10 H LYS 10 -1.926 -4.873 1.267
88 HA LYS 10 HA LYS 10 0.816 -4.021 1.800
89 HB2 LYS 10 HB3 LYS 10 -0.433 -5.694 -0.370
90 HB3 LYS 10 HB2 LYS 10 1.165 -4.987 -0.580
91 HG2 LYS 10 HG3 LYS 10 1.953 -6.156 1.401
92 HG3 LYS 10 HG2 LYS 10 0.352 -6.840 1.633
93 HD2 LYS 10 HD3 LYS 10 2.077 -7.292 -0.794
94 HD3 LYS 10 HD2 LYS 10 1.950 -8.408 0.563
95 HE2 LYS 10 HE3 LYS 10 -0.479 -8.595 0.121
96 HE3 LYS 10 HE2 LYS 10 -0.266 -7.570 -1.299
97 HZ1 LYS 10 HZ1 LYS 10 -0.278 -9.915 -1.877
98 HZ2 LYS 10 HZ2 LYS 10 1.042 -10.200 -0.860
99 HZ3 LYS 10 HZ3 LYS 10 1.220 -9.221 -2.229
100 H GLU 11 H GLU 11 1.815 -2.753 -0.119
101 HA GLU 11 HA GLU 11 -0.214 -1.102 -1.422
102 HB2 GLU 11 HB3 GLU 11 0.830 0.988 -0.727
103 HB3 GLU 11 HB2 GLU 11 0.235 0.077 0.653
104 HG2 GLU 11 HG3 GLU 11 2.289 -0.244 1.496
105 HG3 GLU 11 HG2 GLU 11 3.037 -0.384 -0.097
106 H LYS 12 H LYS 12 1.197 0.781 -2.602
107 HA LYS 12 HA LYS 12 3.230 -0.614 -4.158
108 HB2 LYS 12 HB3 LYS 12 1.947 0.276 -6.241
109 HB3 LYS 12 HB2 LYS 12 1.416 -1.208 -5.465
110 HG2 LYS 12 HG3 LYS 12 -0.526 0.044 -5.957
111 HG3 LYS 12 HG2 LYS 12 -0.281 0.149 -4.218
112 HD2 LYS 12 HD3 LYS 12 -0.899 2.316 -4.966
113 HD3 LYS 12 HD2 LYS 12 0.828 2.378 -4.611
114 HE2 LYS 12 HE3 LYS 12 0.369 3.539 -6.686
115 HE3 LYS 12 HE2 LYS 12 1.296 2.077 -7.019
116 HZ1 LYS 12 HZ1 LYS 12 -0.732 0.969 -7.692
117 HZ2 LYS 12 HZ2 LYS 12 -0.522 2.384 -8.592
118 HZ3 LYS 12 HZ3 LYS 12 -1.645 2.345 -7.331
119 H LEU 13 H LEU 13 3.114 1.744 -2.314
120 HA LEU 13 HA LEU 13 4.209 3.718 -2.106
121 HB2 LEU 13 HB3 LEU 13 5.870 2.497 -3.618
122 HB3 LEU 13 HB2 LEU 13 5.171 3.396 -4.946
123 HG LEU 13 HG LEU 13 6.375 4.791 -2.561
124 HD11 LEU 13 HD11 LEU 13 8.440 4.993 -3.860
125 HD12 LEU 13 HD12 LEU 13 7.762 3.938 -5.100
126 HD13 LEU 13 HD13 LEU 13 8.076 3.309 -3.482
127 HD21 LEU 13 HD21 LEU 13 4.941 6.118 -4.059
128 HD22 LEU 13 HD22 LEU 13 5.959 5.654 -5.423
129 HD23 LEU 13 HD23 LEU 13 6.625 6.639 -4.119
130 H ARG 14 H ARG 14 2.323 4.892 -1.928
131 HA ARG 14 HA ARG 14 1.825 6.672 -4.201
132 HB2 ARG 14 HB3 ARG 14 0.132 4.812 -4.234
133 HB3 ARG 14 HB2 ARG 14 -0.435 5.379 -2.675
134 HG2 ARG 14 HG3 ARG 14 -1.893 6.213 -4.367
135 HG3 ARG 14 HG2 ARG 14 -0.972 7.564 -3.705
136 HD2 ARG 14 HD3 ARG 14 -0.282 6.103 -6.257
137 HD3 ARG 14 HD2 ARG 14 -1.200 7.602 -6.186
138 HE ARG 14 HE ARG 14 0.959 8.407 -4.955
139 HH11 ARG 14 HH11 ARG 14 0.731 6.334 -7.771
140 HH12 ARG 14 HH12 ARG 14 2.282 6.800 -8.391
141 HH21 ARG 14 HH22 ARG 14 3.004 9.015 -5.780
142 HH22 ARG 14 HH21 ARG 14 3.573 8.319 -7.264
143 H THR 15 H THR 15 2.530 6.269 -1.020
144 HA THR 15 HA THR 15 2.642 7.605 0.791
145 HB THR 15 HB THR 15 4.338 8.651 -0.523
146 HG1 THR 15 HG1 THR 15 3.807 10.994 0.231
147 HG21 THR 15 HG21 THR 15 2.968 9.167 -2.536
148 HG22 THR 15 HG22 THR 15 3.997 10.498 -2.017
149 HG23 THR 15 HG23 THR 15 2.272 10.532 -1.662
150 H VAL 16 H VAL 16 0.538 7.241 1.426
151 HA VAL 16 HA VAL 16 -1.115 9.330 2.086
152 HB VAL 16 HB VAL 16 -1.342 9.474 -0.447
153 HG11 VAL 16 HG11 VAL 16 -2.634 6.818 -0.041
154 HG12 VAL 16 HG12 VAL 16 -1.411 7.302 -1.216
155 HG13 VAL 16 HG13 VAL 16 -3.077 7.857 -1.394
156 HG21 VAL 16 HG21 VAL 16 -3.670 10.019 -0.433
157 HG22 VAL 16 HG22 VAL 16 -2.974 10.481 1.117
158 HG23 VAL 16 HG23 VAL 16 -3.954 9.023 0.986
159 H ILE 17 H ILE 17 -3.657 7.727 1.703
160 HA ILE 17 HA ILE 17 -3.477 5.986 3.875
161 HB ILE 17 HB ILE 17 -5.609 6.867 3.167
162 HG12 ILE 17 HG13 ILE 17 -5.349 4.453 4.195
163 HG13 ILE 17 HG12 ILE 17 -6.922 5.048 3.686
164 HG21 ILE 17 HG21 ILE 17 -5.253 5.244 0.663
165 HG22 ILE 17 HG22 ILE 17 -5.273 7.002 0.798
166 HG23 ILE 17 HG23 ILE 17 -6.737 6.076 1.127
167 HD11 ILE 17 HD11 ILE 17 -6.786 2.838 2.915
168 HD12 ILE 17 HD12 ILE 17 -5.147 3.056 2.300
169 HD13 ILE 17 HD13 ILE 17 -6.506 3.841 1.495
170 H THR 18 H THR 18 -3.062 5.411 0.427
171 HA THR 18 HA THR 18 -2.816 2.689 0.270
172 HB THR 18 HB THR 18 -0.834 4.551 -1.045
173 HG1 THR 18 HG1 THR 18 -3.613 4.173 -1.588
174 HG21 THR 18 HG21 THR 18 -2.250 2.062 -2.024
175 HG22 THR 18 HG22 THR 18 -0.602 2.124 -1.405
176 HG23 THR 18 HG23 THR 18 -1.014 2.976 -2.890
177 H SER 19 H SER 19 -0.151 4.963 0.796
178 HA SER 19 HA SER 19 1.615 2.936 1.731
179 HB2 SER 19 HB3 SER 19 1.852 5.949 1.757
180 HB3 SER 19 HB2 SER 19 3.158 4.832 2.157
181 HG SER 19 HG SER 19 2.713 3.892 -0.004
182 H HIS 20 H HIS 20 -0.189 2.326 3.297
183 HA HIS 20 HA HIS 20 0.168 3.769 5.843
184 HB2 HIS 20 HB3 HIS 20 -2.172 3.381 5.057
185 HB3 HIS 20 HB2 HIS 20 -1.882 1.648 5.162
186 HD1 HIS 20 HD1 HIS 20 -2.264 4.707 7.335
187 HD2 HIS 20 HD2 HIS 20 -2.072 0.568 7.701
188 HE1 HIS 20 HE1 HIS 20 -2.918 4.204 9.712
189 HE2 HIS 20 HE2 HIS 20 -2.659 1.709 9.945
190 H ILE 21 H ILE 21 -0.108 0.431 4.643
191 HA ILE 21 HA ILE 21 2.301 -0.259 6.101
192 HB ILE 21 HB ILE 21 0.508 -0.770 7.721
193 HG12 ILE 21 HG13 ILE 21 1.781 -3.238 6.515
194 HG13 ILE 21 HG12 ILE 21 2.531 -2.160 7.686
195 HG21 ILE 21 HG21 ILE 21 -1.326 -1.162 6.188
196 HG22 ILE 21 HG22 ILE 21 -1.112 -2.549 7.257
197 HG23 ILE 21 HG23 ILE 21 -0.541 -2.623 5.591
198 HD11 ILE 21 HD11 ILE 21 0.094 -3.859 8.158
199 HD12 ILE 21 HD12 ILE 21 0.843 -2.780 9.334
200 HD13 ILE 21 HD13 ILE 21 1.725 -4.187 8.742
201 H ASP 22 H ASP 22 3.275 -2.203 5.253
202 HA ASP 22 HA ASP 22 2.099 -3.141 2.733
203 HB2 ASP 22 HB3 ASP 22 3.769 -1.361 2.241
204 HB3 ASP 22 HB2 ASP 22 4.991 -2.299 3.071
205 H LYS 23 H LYS 23 3.636 -5.004 1.863
206 HA LYS 23 HA LYS 23 3.830 -7.052 3.780
207 HB2 LYS 23 HB3 LYS 23 5.064 -8.300 2.068
208 HB3 LYS 23 HB2 LYS 23 3.648 -7.527 1.378
209 HG2 LYS 23 HG3 LYS 23 6.069 -5.910 1.186
210 HG3 LYS 23 HG2 LYS 23 6.175 -7.450 0.337
211 HD2 LYS 23 HD3 LYS 23 4.196 -6.927 -0.939
212 HD3 LYS 23 HD2 LYS 23 3.942 -5.450 -0.007
213 HE2 LYS 23 HE3 LYS 23 4.929 -4.927 -2.163
214 HE3 LYS 23 HE2 LYS 23 6.072 -4.544 -0.871
215 HZ1 LYS 23 HZ1 LYS 23 6.108 -6.959 -2.612
216 HZ2 LYS 23 HZ2 LYS 23 7.178 -6.680 -1.336
217 HZ3 LYS 23 HZ3 LYS 23 7.183 -5.661 -2.683
218 H VAL 24 H VAL 24 6.138 -4.662 2.559
219 HA VAL 24 HA VAL 24 7.955 -5.182 4.754
220 HB VAL 24 HB VAL 24 9.955 -5.547 3.281
221 HG11 VAL 24 HG11 VAL 24 9.589 -7.945 2.914
222 HG12 VAL 24 HG12 VAL 24 7.866 -7.713 3.207
223 HG13 VAL 24 HG13 VAL 24 9.030 -7.417 4.500
224 HG21 VAL 24 HG21 VAL 24 7.922 -6.198 1.159
225 HG22 VAL 24 HG22 VAL 24 9.670 -6.356 1.025
226 HG23 VAL 24 HG23 VAL 24 8.937 -4.759 1.185
227 H LEU 25 H LEU 25 10.202 -3.944 3.816
228 HA LEU 25 HA LEU 25 9.369 -1.193 3.543
229 HB2 LEU 25 HB3 LEU 25 11.975 -0.920 3.486
230 HB3 LEU 25 HB2 LEU 25 11.137 -1.274 4.981
231 HG LEU 25 HG LEU 25 11.717 -3.697 4.641
232 HD11 LEU 25 HD11 LEU 25 13.550 -4.237 3.121
233 HD12 LEU 25 HD12 LEU 25 13.503 -2.594 2.480
234 HD13 LEU 25 HD13 LEU 25 12.126 -3.673 2.246
235 HD21 LEU 25 HD21 LEU 25 14.011 -3.444 5.400
236 HD22 LEU 25 HD22 LEU 25 12.960 -2.256 6.165
237 HD23 LEU 25 HD23 LEU 25 14.022 -1.772 4.845
238 H ARG 26 H ARG 26 8.517 -2.487 1.309
239 HA ARG 26 HA ARG 26 10.468 -2.021 -0.779
240 HB2 ARG 26 HB3 ARG 26 9.243 -3.980 -1.156
241 HB3 ARG 26 HB2 ARG 26 7.724 -3.235 -0.692
242 HG2 ARG 26 HG3 ARG 26 9.047 -2.076 -3.052
243 HG3 ARG 26 HG2 ARG 26 8.442 -3.725 -3.229
244 HD2 ARG 26 HD3 ARG 26 6.239 -3.079 -2.675
245 HD3 ARG 26 HD2 ARG 26 6.773 -1.500 -2.090
246 HE ARG 26 HE ARG 26 7.443 -1.171 -4.553
247 HH11 ARG 26 HH11 ARG 26 4.640 -2.975 -3.473
248 HH12 ARG 26 HH12 ARG 26 3.772 -2.753 -4.956
249 HH21 ARG 26 HH22 ARG 26 6.285 -0.862 -6.500
250 HH22 ARG 26 HH21 ARG 26 4.703 -1.560 -6.676
251 HA PRO 27 HA PRO 27 7.364 1.413 -1.840
252 HB2 PRO 27 HB2 PRO 27 5.276 1.987 -0.328
253 HB3 PRO 27 HB3 PRO 27 5.244 0.543 -1.368
254 HG2 PRO 27 HG3 PRO 27 5.897 0.741 1.563
255 HG3 PRO 27 HG2 PRO 27 4.750 -0.353 0.762
256 HD2 PRO 27 HD3 PRO 27 7.299 -1.074 1.401
257 HD3 PRO 27 HD2 PRO 27 6.434 -1.739 0.000
258 H GLN 28 H GLN 28 8.275 3.388 -1.516
259 HA GLN 28 HA GLN 28 9.265 5.179 -0.509
260 HB2 GLN 28 HB3 GLN 28 7.496 4.389 1.820
261 HB3 GLN 28 HB2 GLN 28 8.363 5.910 1.686
262 HG2 GLN 28 HG3 GLN 28 6.273 4.998 -0.273
263 HG3 GLN 28 HG2 GLN 28 5.931 6.012 1.126
264 HE21 GLN 28 HE22 GLN 28 8.501 7.434 0.863
265 HE22 GLN 28 HE21 GLN 28 8.283 8.523 -0.462
266 H GLY 29 H GLY 29 10.371 2.452 -0.265
267 HA2 GLY 29 HA3 GLY 29 11.935 2.785 2.216
268 HA3 GLY 29 HA2 GLY 29 11.450 1.207 1.595
Start of MODEL 8
1 H1 ARG 1 H1 ARG 1 -6.316 -0.531 7.038
2 H2 ARG 1 H2 ARG 1 -5.584 -0.833 5.545
3 H3 ARG 1 H3 ARG 1 -5.619 -2.042 6.732
4 HA ARG 1 HA ARG 1 -7.236 -2.472 5.007
5 HB2 ARG 1 HB3 ARG 1 -9.193 -2.783 6.433
6 HB3 ARG 1 HB2 ARG 1 -7.730 -3.209 7.305
7 HG2 ARG 1 HG3 ARG 1 -7.795 -1.137 8.527
8 HG3 ARG 1 HG2 ARG 1 -9.173 -0.582 7.574
9 HD2 ARG 1 HD3 ARG 1 -9.156 -3.001 9.375
10 HD3 ARG 1 HD2 ARG 1 -9.831 -1.427 9.790
11 HE ARG 1 HE ARG 1 -11.039 -2.232 7.421
12 HH11 ARG 1 HH12 ARG 1 -10.871 -3.288 10.752
13 HH12 ARG 1 HH11 ARG 1 -12.442 -4.023 10.732
14 HH21 ARG 1 HH21 ARG 1 -13.118 -3.182 7.392
15 HH22 ARG 1 HH22 ARG 1 -13.725 -3.955 8.823
16 H LYS 2 H LYS 2 -8.930 -1.823 3.751
17 HA LYS 2 HA LYS 2 -10.485 0.431 3.837
18 HB2 LYS 2 HB3 LYS 2 -8.170 1.556 3.864
19 HB3 LYS 2 HB2 LYS 2 -8.016 1.033 2.198
20 HG2 LYS 2 HG3 LYS 2 -10.361 2.678 3.059
21 HG3 LYS 2 HG2 LYS 2 -8.799 3.434 2.733
22 HD2 LYS 2 HD3 LYS 2 -8.838 2.363 0.477
23 HD3 LYS 2 HD2 LYS 2 -10.477 1.805 0.823
24 HE2 LYS 2 HE3 LYS 2 -11.229 4.101 1.076
25 HE3 LYS 2 HE2 LYS 2 -9.586 4.687 0.820
26 HZ1 LYS 2 HZ1 LYS 2 -10.912 4.872 -1.185
27 HZ2 LYS 2 HZ2 LYS 2 -11.222 3.210 -1.170
28 HZ3 LYS 2 HZ3 LYS 2 -9.648 3.776 -1.416
29 H CYS 3 H CYS 3 -8.460 -1.681 1.964
30 HA CYS 3 HA CYS 3 -10.587 -2.399 0.194
31 HB2 CYS 3 HB3 CYS 3 -9.100 -1.761 -1.848
32 HB3 CYS 3 HB2 CYS 3 -10.063 -0.512 -1.070
33 H ASN 4 H ASN 4 -8.502 -3.263 -1.853
34 HA ASN 4 HA ASN 4 -7.697 -5.669 -0.390
35 HB2 ASN 4 HB3 ASN 4 -8.230 -5.088 -3.288
36 HB3 ASN 4 HB2 ASN 4 -7.300 -6.505 -2.820
37 HD21 ASN 4 HD22 ASN 4 -8.936 -7.789 -3.741
38 HD22 ASN 4 HD21 ASN 4 -10.413 -8.093 -2.894
39 H PHE 5 H PHE 5 -5.753 -6.670 -2.010
40 HA PHE 5 HA PHE 5 -3.424 -5.369 -1.151
41 HB2 PHE 5 HB3 PHE 5 -2.300 -6.916 -2.851
42 HB3 PHE 5 HB2 PHE 5 -3.219 -7.669 -1.557
43 HD1 PHE 5 HD2 PHE 5 -3.454 -6.621 -5.109
44 HD2 PHE 5 HD1 PHE 5 -4.895 -9.209 -2.059
45 HE1 PHE 5 HE2 PHE 5 -4.773 -7.852 -6.782
46 HE2 PHE 5 HE1 PHE 5 -6.220 -10.440 -3.722
47 HZ PHE 5 HZ PHE 5 -6.089 -9.839 -6.087
48 H LEU 6 H LEU 6 -1.693 -4.474 -2.493
49 HA LEU 6 HA LEU 6 -1.009 -2.644 -3.650
50 HB2 LEU 6 HB3 LEU 6 -2.711 -3.991 -5.749
51 HB3 LEU 6 HB2 LEU 6 -1.683 -2.614 -6.082
52 HG LEU 6 HG LEU 6 -0.464 -4.466 -6.822
53 HD11 LEU 6 HD11 LEU 6 0.562 -3.920 -4.045
54 HD12 LEU 6 HD12 LEU 6 0.874 -2.943 -5.480
55 HD13 LEU 6 HD13 LEU 6 1.476 -4.596 -5.394
56 HD21 LEU 6 HD21 LEU 6 -1.718 -6.271 -5.902
57 HD22 LEU 6 HD22 LEU 6 -1.216 -5.853 -4.264
58 HD23 LEU 6 HD23 LEU 6 -0.035 -6.468 -5.419
59 H CYS 7 H CYS 7 -2.684 -1.744 -1.949
60 HA CYS 7 HA CYS 7 -4.122 0.373 -3.124
61 HB2 CYS 7 HB3 CYS 7 -5.682 -1.468 -3.700
62 HB3 CYS 7 HB2 CYS 7 -5.833 -1.851 -1.989
63 H LYS 8 H LYS 8 -4.078 -1.776 -0.255
64 HA LYS 8 HA LYS 8 -2.784 0.242 1.287
65 HB2 LYS 8 HB3 LYS 8 -5.292 0.907 1.334
66 HB3 LYS 8 HB2 LYS 8 -5.496 -0.500 2.370
67 HG2 LYS 8 HG3 LYS 8 -3.755 0.463 3.889
68 HG3 LYS 8 HG2 LYS 8 -3.792 1.927 2.906
69 HD2 LYS 8 HD3 LYS 8 -6.315 1.931 3.359
70 HD3 LYS 8 HD2 LYS 8 -5.954 0.770 4.638
71 HE2 LYS 8 HE3 LYS 8 -4.344 2.411 5.587
72 HE3 LYS 8 HE2 LYS 8 -4.867 3.563 4.361
73 HZ1 LYS 8 HZ1 LYS 8 -5.975 3.884 6.507
74 HZ2 LYS 8 HZ2 LYS 8 -6.660 2.344 6.386
75 HZ3 LYS 8 HZ3 LYS 8 -7.070 3.546 5.267
76 H LEU 9 H LEU 9 -2.491 -2.512 0.494
77 HA LEU 9 HA LEU 9 -2.345 -3.827 3.095
78 HB2 LEU 9 HB3 LEU 9 -3.899 -4.818 0.739
79 HB3 LEU 9 HB2 LEU 9 -3.108 -5.978 1.784
80 HG LEU 9 HG LEU 9 -4.396 -4.887 3.708
81 HD11 LEU 9 HD11 LEU 9 -6.448 -3.737 3.118
82 HD12 LEU 9 HD12 LEU 9 -6.018 -3.808 1.411
83 HD13 LEU 9 HD13 LEU 9 -5.047 -2.848 2.526
84 HD21 LEU 9 HD21 LEU 9 -6.394 -6.209 3.237
85 HD22 LEU 9 HD22 LEU 9 -4.927 -7.085 2.805
86 HD23 LEU 9 HD23 LEU 9 -5.911 -6.340 1.546
87 H LYS 10 H LYS 10 -1.756 -4.466 -0.372
88 HA LYS 10 HA LYS 10 0.692 -5.861 0.303
89 HB2 LYS 10 HB3 LYS 10 -0.861 -6.601 -1.542
90 HB3 LYS 10 HB2 LYS 10 -0.329 -5.197 -2.450
91 HG2 LYS 10 HG3 LYS 10 0.880 -7.112 -3.205
92 HG3 LYS 10 HG2 LYS 10 1.984 -6.038 -2.347
93 HD2 LYS 10 HD3 LYS 10 2.290 -8.445 -1.799
94 HD3 LYS 10 HD2 LYS 10 1.926 -7.438 -0.397
95 HE2 LYS 10 HE3 LYS 10 -0.312 -8.197 -0.316
96 HE3 LYS 10 HE2 LYS 10 -0.194 -8.946 -1.905
97 HZ1 LYS 10 HZ1 LYS 10 1.322 -10.568 -1.010
98 HZ2 LYS 10 HZ2 LYS 10 -0.089 -10.559 -0.081
99 HZ3 LYS 10 HZ3 LYS 10 1.314 -9.816 0.502
100 H GLU 11 H GLU 11 -0.276 -2.816 -1.177
101 HA GLU 11 HA GLU 11 0.826 -0.839 -1.415
102 HB2 GLU 11 HB3 GLU 11 1.902 -1.875 0.807
103 HB3 GLU 11 HB2 GLU 11 3.329 -1.894 -0.210
104 HG2 GLU 11 HG3 GLU 11 1.681 0.544 0.412
105 HG3 GLU 11 HG2 GLU 11 3.172 0.092 1.232
106 H LYS 12 H LYS 12 2.782 0.120 -2.520
107 HA LYS 12 HA LYS 12 4.392 -1.517 -4.176
108 HB2 LYS 12 HB3 LYS 12 3.280 -0.377 -6.318
109 HB3 LYS 12 HB2 LYS 12 2.771 -1.942 -5.713
110 HG2 LYS 12 HG3 LYS 12 0.733 -0.999 -5.967
111 HG3 LYS 12 HG2 LYS 12 1.071 -0.449 -4.330
112 HD2 LYS 12 HD3 LYS 12 0.160 1.349 -5.686
113 HD3 LYS 12 HD2 LYS 12 1.819 1.715 -5.225
114 HE2 LYS 12 HE3 LYS 12 1.407 2.284 -7.563
115 HE3 LYS 12 HE2 LYS 12 2.586 0.983 -7.439
116 HZ1 LYS 12 HZ1 LYS 12 -0.295 0.640 -8.056
117 HZ2 LYS 12 HZ2 LYS 12 0.844 -0.604 -7.959
118 HZ3 LYS 12 HZ3 LYS 12 0.962 0.560 -9.176
119 H LEU 13 H LEU 13 2.827 1.644 -4.040
120 HA LEU 13 HA LEU 13 4.572 3.306 -3.049
121 HB2 LEU 13 HB3 LEU 13 6.173 4.143 -4.518
122 HB3 LEU 13 HB2 LEU 13 6.267 2.417 -4.772
123 HG LEU 13 HG LEU 13 4.718 4.244 -6.603
124 HD11 LEU 13 HD11 LEU 13 6.667 4.144 -8.091
125 HD12 LEU 13 HD12 LEU 13 7.576 3.315 -6.828
126 HD13 LEU 13 HD13 LEU 13 7.030 4.973 -6.577
127 HD21 LEU 13 HD21 LEU 13 5.863 1.488 -7.029
128 HD22 LEU 13 HD22 LEU 13 4.903 2.420 -8.176
129 HD23 LEU 13 HD23 LEU 13 4.172 1.839 -6.682
130 H ARG 14 H ARG 14 3.563 5.267 -2.971
131 HA ARG 14 HA ARG 14 2.344 6.430 -5.249
132 HB2 ARG 14 HB3 ARG 14 0.648 4.697 -4.775
133 HB3 ARG 14 HB2 ARG 14 0.425 5.376 -3.170
134 HG2 ARG 14 HG3 ARG 14 -1.341 6.087 -4.681
135 HG3 ARG 14 HG2 ARG 14 -0.373 7.461 -4.144
136 HD2 ARG 14 HD3 ARG 14 0.896 7.346 -6.261
137 HD3 ARG 14 HD2 ARG 14 -0.155 6.037 -6.794
138 HE ARG 14 HE ARG 14 -1.753 8.222 -6.084
139 HH11 ARG 14 HH11 ARG 14 0.593 7.317 -8.512
140 HH12 ARG 14 HH12 ARG 14 -0.055 8.370 -9.725
141 HH21 ARG 14 HH22 ARG 14 -2.620 9.619 -7.676
142 HH22 ARG 14 HH21 ARG 14 -1.882 9.692 -9.244
143 H THR 15 H THR 15 1.082 6.626 -1.936
144 HA THR 15 HA THR 15 2.192 9.274 -1.600
145 HB THR 15 HB THR 15 -0.219 10.104 -1.167
146 HG1 THR 15 HG1 THR 15 -1.713 9.028 -2.670
147 HG21 THR 15 HG21 THR 15 -0.463 10.860 -3.468
148 HG22 THR 15 HG22 THR 15 0.675 9.625 -4.008
149 HG23 THR 15 HG23 THR 15 1.228 10.942 -2.976
150 H VAL 16 H VAL 16 -0.570 7.374 -0.401
151 HA VAL 16 HA VAL 16 0.552 7.157 2.252
152 HB VAL 16 HB VAL 16 -2.031 8.709 1.936
153 HG11 VAL 16 HG11 VAL 16 -1.817 7.140 3.884
154 HG12 VAL 16 HG12 VAL 16 -2.097 8.833 4.301
155 HG13 VAL 16 HG13 VAL 16 -0.479 8.144 4.448
156 HG21 VAL 16 HG21 VAL 16 -0.131 10.134 1.389
157 HG22 VAL 16 HG22 VAL 16 0.665 9.667 2.892
158 HG23 VAL 16 HG23 VAL 16 -0.831 10.598 2.940
159 H ILE 17 H ILE 17 -2.671 7.095 0.684
160 HA ILE 17 HA ILE 17 -3.603 4.905 2.189
161 HB ILE 17 HB ILE 17 -5.288 6.232 1.261
162 HG12 ILE 17 HG13 ILE 17 -6.597 4.732 -0.223
163 HG13 ILE 17 HG12 ILE 17 -5.167 3.732 -0.441
164 HG21 ILE 17 HG21 ILE 17 -5.542 6.752 -1.100
165 HG22 ILE 17 HG22 ILE 17 -4.094 5.819 -1.473
166 HG23 ILE 17 HG23 ILE 17 -3.972 7.283 -0.502
167 HD11 ILE 17 HD11 ILE 17 -6.219 4.239 2.299
168 HD12 ILE 17 HD12 ILE 17 -5.281 2.864 1.699
169 HD13 ILE 17 HD13 ILE 17 -6.988 3.043 1.260
170 H THR 18 H THR 18 -2.564 4.984 -1.224
171 HA THR 18 HA THR 18 -2.805 2.175 -1.575
172 HB THR 18 HB THR 18 -1.085 4.025 -3.231
173 HG1 THR 18 HG1 THR 18 -3.912 3.770 -3.112
174 HG21 THR 18 HG21 THR 18 -1.734 2.550 -5.064
175 HG22 THR 18 HG22 THR 18 -2.751 1.613 -3.971
176 HG23 THR 18 HG23 THR 18 -1.001 1.617 -3.760
177 H SER 19 H SER 19 -0.578 4.226 -0.174
178 HA SER 19 HA SER 19 1.604 2.290 -0.326
179 HB2 SER 19 HB3 SER 19 3.098 4.127 -0.514
180 HB3 SER 19 HB2 SER 19 1.738 4.509 -1.580
181 HG SER 19 HG SER 19 1.894 5.409 1.087
182 H HIS 20 H HIS 20 -0.029 1.765 1.676
183 HA HIS 20 HA HIS 20 0.966 3.211 4.029
184 HB2 HIS 20 HB3 HIS 20 -1.526 3.291 3.484
185 HB3 HIS 20 HB2 HIS 20 -1.572 1.586 3.916
186 HD1 HIS 20 HD1 HIS 20 -2.074 4.816 5.337
187 HD2 HIS 20 HD2 HIS 20 -0.506 1.222 6.715
188 HE1 HIS 20 HE1 HIS 20 -2.154 4.956 7.848
189 HE2 HIS 20 HE2 HIS 20 -1.096 2.823 8.656
190 H ILE 21 H ILE 21 -0.602 0.036 3.643
191 HA ILE 21 HA ILE 21 1.353 -1.133 5.440
192 HB ILE 21 HB ILE 21 -1.007 -2.423 4.047
193 HG12 ILE 21 HG13 ILE 21 -0.692 -1.441 6.893
194 HG13 ILE 21 HG12 ILE 21 -1.671 -0.674 5.648
195 HG21 ILE 21 HG21 ILE 21 -0.694 -4.248 5.655
196 HG22 ILE 21 HG22 ILE 21 0.747 -3.445 6.280
197 HG23 ILE 21 HG23 ILE 21 0.721 -4.043 4.622
198 HD11 ILE 21 HD11 ILE 21 -2.117 -3.420 6.793
199 HD12 ILE 21 HD12 ILE 21 -3.107 -2.637 5.561
200 HD13 ILE 21 HD13 ILE 21 -3.033 -1.965 7.190
201 H ASP 22 H ASP 22 3.249 -1.621 4.571
202 HA ASP 22 HA ASP 22 3.500 -2.143 1.758
203 HB2 ASP 22 HB3 ASP 22 5.921 -2.262 2.215
204 HB3 ASP 22 HB2 ASP 22 5.201 -0.800 2.860
205 H LYS 23 H LYS 23 4.258 -3.937 0.775
206 HA LYS 23 HA LYS 23 3.662 -6.464 1.774
207 HB2 LYS 23 HB3 LYS 23 4.981 -7.331 -0.148
208 HB3 LYS 23 HB2 LYS 23 3.799 -6.118 -0.601
209 HG2 LYS 23 HG3 LYS 23 6.635 -5.312 -0.107
210 HG3 LYS 23 HG2 LYS 23 6.185 -6.074 -1.631
211 HD2 LYS 23 HD3 LYS 23 4.452 -4.311 -1.935
212 HD3 LYS 23 HD2 LYS 23 5.053 -3.523 -0.480
213 HE2 LYS 23 HE3 LYS 23 5.963 -2.474 -2.473
214 HE3 LYS 23 HE2 LYS 23 7.233 -3.232 -1.516
215 HZ1 LYS 23 HZ1 LYS 23 5.975 -4.407 -3.940
216 HZ2 LYS 23 HZ2 LYS 23 7.230 -5.100 -3.044
217 HZ3 LYS 23 HZ3 LYS 23 7.489 -3.662 -3.893
218 H VAL 24 H VAL 24 6.542 -4.520 2.153
219 HA VAL 24 HA VAL 24 7.704 -5.934 4.172
220 HB VAL 24 HB VAL 24 7.836 -7.894 2.699
221 HG11 VAL 24 HG11 VAL 24 8.072 -6.803 0.545
222 HG12 VAL 24 HG12 VAL 24 9.382 -7.955 0.803
223 HG13 VAL 24 HG13 VAL 24 9.678 -6.226 0.994
224 HG21 VAL 24 HG21 VAL 24 9.471 -7.694 4.457
225 HG22 VAL 24 HG22 VAL 24 10.514 -6.719 3.421
226 HG23 VAL 24 HG23 VAL 24 10.221 -8.415 3.034
227 H LEU 25 H LEU 25 8.438 -4.269 1.148
228 HA LEU 25 HA LEU 25 11.037 -3.433 1.941
229 HB2 LEU 25 HB3 LEU 25 9.227 -2.347 -0.214
230 HB3 LEU 25 HB2 LEU 25 10.923 -1.950 -0.028
231 HG LEU 25 HG LEU 25 9.871 -4.718 -0.609
232 HD11 LEU 25 HD11 LEU 25 9.436 -3.245 -2.478
233 HD12 LEU 25 HD12 LEU 25 10.766 -4.334 -2.869
234 HD13 LEU 25 HD13 LEU 25 11.097 -2.659 -2.436
235 HD21 LEU 25 HD21 LEU 25 12.214 -5.223 -1.116
236 HD22 LEU 25 HD22 LEU 25 12.007 -4.724 0.563
237 HD23 LEU 25 HD23 LEU 25 12.671 -3.594 -0.616
238 H ARG 26 H ARG 26 8.265 -1.356 1.183
239 HA ARG 26 HA ARG 26 8.419 0.251 3.509
240 HB2 ARG 26 HB3 ARG 26 9.566 2.158 2.751
241 HB3 ARG 26 HB2 ARG 26 10.569 0.844 2.163
242 HG2 ARG 26 HG3 ARG 26 8.625 2.507 0.570
243 HG3 ARG 26 HG2 ARG 26 10.383 2.503 0.445
244 HD2 ARG 26 HD3 ARG 26 10.284 0.151 -0.315
245 HD3 ARG 26 HD2 ARG 26 8.520 0.228 -0.249
246 HE ARG 26 HE ARG 26 10.232 1.703 -2.133
247 HH11 ARG 26 HH11 ARG 26 7.050 0.638 -1.103
248 HH12 ARG 26 HH12 ARG 26 6.349 0.813 -2.680
249 HH21 ARG 26 HH22 ARG 26 9.295 1.937 -4.207
250 HH22 ARG 26 HH21 ARG 26 7.627 1.527 -4.448
251 HA PRO 27 HA PRO 27 4.775 1.543 1.258
252 HB2 PRO 27 HB2 PRO 27 3.920 3.532 2.972
253 HB3 PRO 27 HB3 PRO 27 3.678 1.796 3.227
254 HG2 PRO 27 HG3 PRO 27 5.343 3.599 4.726
255 HG3 PRO 27 HG2 PRO 27 5.049 1.877 5.006
256 HD2 PRO 27 HD3 PRO 27 7.334 3.201 3.683
257 HD3 PRO 27 HD2 PRO 27 7.234 1.587 4.416
258 H GLN 28 H GLN 28 5.381 4.699 2.659
259 HA GLN 28 HA GLN 28 6.701 6.110 0.740
260 HB2 GLN 28 HB3 GLN 28 5.031 5.241 -0.884
261 HB3 GLN 28 HB2 GLN 28 3.752 5.996 0.051
262 HG2 GLN 28 HG3 GLN 28 4.350 7.257 -1.961
263 HG3 GLN 28 HG2 GLN 28 4.575 8.185 -0.484
264 HE21 GLN 28 HE22 GLN 28 6.651 8.762 0.136
265 HE22 GLN 28 HE21 GLN 28 8.019 8.592 -0.912
266 H GLY 29 H GLY 29 3.786 5.994 2.695
267 HA2 GLY 29 HA3 GLY 29 4.440 8.688 3.704
268 HA3 GLY 29 HA2 GLY 29 2.795 8.075 3.583
Start of MODEL 9
1 H1 ARG 1 H1 ARG 1 -11.060 2.996 2.699
2 H2 ARG 1 H2 ARG 1 -9.727 2.262 1.974
3 H3 ARG 1 H3 ARG 1 -10.106 1.921 3.587
4 HA ARG 1 HA ARG 1 -12.208 0.936 2.886
5 HB2 ARG 1 HB3 ARG 1 -11.049 1.335 0.119
6 HB3 ARG 1 HB2 ARG 1 -12.498 0.412 0.489
7 HG2 ARG 1 HG3 ARG 1 -13.576 2.431 1.331
8 HG3 ARG 1 HG2 ARG 1 -12.123 3.359 0.970
9 HD2 ARG 1 HD3 ARG 1 -12.371 2.760 -1.409
10 HD3 ARG 1 HD2 ARG 1 -13.866 1.913 -1.018
11 HE ARG 1 HE ARG 1 -13.993 4.573 -0.077
12 HH11 ARG 1 HH12 ARG 1 -14.083 2.732 -3.048
13 HH12 ARG 1 HH11 ARG 1 -15.053 3.893 -3.891
14 HH21 ARG 1 HH21 ARG 1 -15.258 6.119 -1.186
15 HH22 ARG 1 HH22 ARG 1 -15.716 5.829 -2.832
16 H LYS 2 H LYS 2 -8.863 0.636 2.134
17 HA LYS 2 HA LYS 2 -7.393 -1.026 2.499
18 HB2 LYS 2 HB3 LYS 2 -9.811 -2.301 3.685
19 HB3 LYS 2 HB2 LYS 2 -8.359 -3.256 3.419
20 HG2 LYS 2 HG3 LYS 2 -7.132 -2.082 4.976
21 HG3 LYS 2 HG2 LYS 2 -8.177 -0.662 4.894
22 HD2 LYS 2 HD3 LYS 2 -9.946 -1.871 6.040
23 HD3 LYS 2 HD2 LYS 2 -8.981 -3.346 6.030
24 HE2 LYS 2 HE3 LYS 2 -8.131 -0.800 7.389
25 HE3 LYS 2 HE2 LYS 2 -9.009 -2.091 8.205
26 HZ1 LYS 2 HZ1 LYS 2 -7.189 -3.599 7.665
27 HZ2 LYS 2 HZ2 LYS 2 -6.644 -2.287 8.581
28 HZ3 LYS 2 HZ3 LYS 2 -6.341 -2.340 6.921
29 H CYS 3 H CYS 3 -10.353 -2.579 1.259
30 HA CYS 3 HA CYS 3 -10.692 -4.088 -0.419
31 HB2 CYS 3 HB3 CYS 3 -8.126 -3.194 -1.710
32 HB3 CYS 3 HB2 CYS 3 -9.577 -3.797 -2.481
33 H ASN 4 H ASN 4 -8.582 -5.374 -1.987
34 HA ASN 4 HA ASN 4 -7.382 -7.097 0.048
35 HB2 ASN 4 HB3 ASN 4 -7.730 -7.350 -2.943
36 HB3 ASN 4 HB2 ASN 4 -6.658 -8.417 -2.045
37 HD21 ASN 4 HD22 ASN 4 -9.969 -7.451 -2.552
38 HD22 ASN 4 HD21 ASN 4 -10.690 -8.849 -1.838
39 H PHE 5 H PHE 5 -5.115 -7.883 -1.447
40 HA PHE 5 HA PHE 5 -3.205 -5.926 -0.976
41 HB2 PHE 5 HB3 PHE 5 -1.836 -7.251 -2.693
42 HB3 PHE 5 HB2 PHE 5 -2.444 -8.143 -1.306
43 HD1 PHE 5 HD2 PHE 5 -2.936 -7.502 -4.903
44 HD2 PHE 5 HD1 PHE 5 -3.955 -9.948 -1.578
45 HE1 PHE 5 HE2 PHE 5 -3.999 -9.117 -6.420
46 HE2 PHE 5 HE1 PHE 5 -5.022 -11.567 -3.089
47 HZ PHE 5 HZ PHE 5 -5.022 -11.177 -5.502
48 H LEU 6 H LEU 6 -2.075 -4.479 -2.387
49 HA LEU 6 HA LEU 6 -2.056 -2.698 -3.755
50 HB2 LEU 6 HB3 LEU 6 -3.428 -4.655 -5.587
51 HB3 LEU 6 HB2 LEU 6 -2.954 -3.048 -6.093
52 HG LEU 6 HG LEU 6 -1.209 -4.353 -6.868
53 HD11 LEU 6 HD11 LEU 6 -0.131 -3.700 -4.136
54 HD12 LEU 6 HD12 LEU 6 -0.474 -2.477 -5.363
55 HD13 LEU 6 HD13 LEU 6 0.718 -3.734 -5.686
56 HD21 LEU 6 HD21 LEU 6 -1.778 -6.468 -5.954
57 HD22 LEU 6 HD22 LEU 6 -1.394 -5.930 -4.317
58 HD23 LEU 6 HD23 LEU 6 -0.107 -6.126 -5.507
59 H CYS 7 H CYS 7 -3.455 -1.784 -2.133
60 HA CYS 7 HA CYS 7 -5.330 -0.074 -3.273
61 HB2 CYS 7 HB3 CYS 7 -6.925 -1.915 -3.324
62 HB3 CYS 7 HB2 CYS 7 -6.594 -2.280 -1.633
63 H LYS 8 H LYS 8 -3.999 -1.676 -0.539
64 HA LYS 8 HA LYS 8 -3.315 0.643 0.883
65 HB2 LYS 8 HB3 LYS 8 -5.726 0.760 1.351
66 HB3 LYS 8 HB2 LYS 8 -5.694 -0.885 1.958
67 HG2 LYS 8 HG3 LYS 8 -4.405 -0.240 3.856
68 HG3 LYS 8 HG2 LYS 8 -4.160 1.377 3.202
69 HD2 LYS 8 HD3 LYS 8 -6.518 1.865 3.406
70 HD3 LYS 8 HD2 LYS 8 -6.835 0.218 3.947
71 HE2 LYS 8 HE3 LYS 8 -5.582 0.571 5.956
72 HE3 LYS 8 HE2 LYS 8 -5.037 2.145 5.391
73 HZ1 LYS 8 HZ1 LYS 8 -6.852 2.273 7.019
74 HZ2 LYS 8 HZ2 LYS 8 -7.870 1.455 5.943
75 HZ3 LYS 8 HZ3 LYS 8 -7.262 2.980 5.538
76 H LEU 9 H LEU 9 -3.719 -2.749 0.585
77 HA LEU 9 HA LEU 9 -2.394 -3.429 3.053
78 HB2 LEU 9 HB3 LEU 9 -3.765 -4.968 0.896
79 HB3 LEU 9 HB2 LEU 9 -2.684 -5.804 1.994
80 HG LEU 9 HG LEU 9 -4.074 -4.971 3.900
81 HD11 LEU 9 HD11 LEU 9 -6.310 -4.133 3.440
82 HD12 LEU 9 HD12 LEU 9 -5.958 -4.115 1.713
83 HD13 LEU 9 HD13 LEU 9 -5.081 -3.042 2.804
84 HD21 LEU 9 HD21 LEU 9 -4.345 -7.221 3.018
85 HD22 LEU 9 HD22 LEU 9 -5.499 -6.626 1.825
86 HD23 LEU 9 HD23 LEU 9 -5.893 -6.559 3.543
87 H LYS 10 H LYS 10 -1.815 -5.113 -0.001
88 HA LYS 10 HA LYS 10 0.890 -5.573 0.660
89 HB2 LYS 10 HB3 LYS 10 -0.458 -7.046 -0.821
90 HB3 LYS 10 HB2 LYS 10 -0.407 -5.803 -2.061
91 HG2 LYS 10 HG3 LYS 10 1.224 -7.511 -2.543
92 HG3 LYS 10 HG2 LYS 10 2.043 -6.002 -2.142
93 HD2 LYS 10 HD3 LYS 10 3.205 -7.773 -1.040
94 HD3 LYS 10 HD2 LYS 10 2.322 -6.872 0.191
95 HE2 LYS 10 HE3 LYS 10 1.970 -9.136 0.716
96 HE3 LYS 10 HE2 LYS 10 0.487 -8.612 -0.078
97 HZ1 LYS 10 HZ1 LYS 10 2.688 -10.171 -1.314
98 HZ2 LYS 10 HZ2 LYS 10 1.334 -9.593 -2.149
99 HZ3 LYS 10 HZ3 LYS 10 1.144 -10.737 -0.923
100 H GLU 11 H GLU 11 -0.648 -3.290 -1.509
101 HA GLU 11 HA GLU 11 0.108 -1.585 -2.762
102 HB2 GLU 11 HB3 GLU 11 1.533 -1.175 -0.153
103 HB3 GLU 11 HB2 GLU 11 1.532 0.029 -1.436
104 HG2 GLU 11 HG3 GLU 11 -0.613 -0.776 0.390
105 HG3 GLU 11 HG2 GLU 11 -0.324 0.768 -0.424
106 H LYS 12 H LYS 12 2.681 -0.225 -2.547
107 HA LYS 12 HA LYS 12 4.573 -1.874 -3.802
108 HB2 LYS 12 HB3 LYS 12 4.130 -1.327 -6.161
109 HB3 LYS 12 HB2 LYS 12 2.795 -2.213 -5.440
110 HG2 LYS 12 HG3 LYS 12 2.821 0.772 -5.846
111 HG3 LYS 12 HG2 LYS 12 2.130 -0.385 -6.982
112 HD2 LYS 12 HD3 LYS 12 0.798 -1.214 -4.915
113 HD3 LYS 12 HD2 LYS 12 1.211 0.358 -4.236
114 HE2 LYS 12 HE3 LYS 12 0.082 1.504 -5.948
115 HE3 LYS 12 HE2 LYS 12 -0.041 0.045 -6.933
116 HZ1 LYS 12 HZ1 LYS 12 -2.127 0.722 -5.758
117 HZ2 LYS 12 HZ2 LYS 12 -1.372 0.341 -4.286
118 HZ3 LYS 12 HZ3 LYS 12 -1.631 -0.861 -5.455
119 H LEU 13 H LEU 13 3.100 1.356 -4.268
120 HA LEU 13 HA LEU 13 5.084 2.851 -3.056
121 HB2 LEU 13 HB3 LEU 13 6.471 1.862 -4.945
122 HB3 LEU 13 HB2 LEU 13 5.487 2.797 -6.051
123 HG LEU 13 HG LEU 13 7.014 4.156 -3.844
124 HD11 LEU 13 HD11 LEU 13 8.059 3.438 -6.578
125 HD12 LEU 13 HD12 LEU 13 8.627 2.781 -5.042
126 HD13 LEU 13 HD13 LEU 13 8.859 4.491 -5.410
127 HD21 LEU 13 HD21 LEU 13 6.114 5.055 -6.580
128 HD22 LEU 13 HD22 LEU 13 6.971 6.040 -5.395
129 HD23 LEU 13 HD23 LEU 13 5.339 5.468 -5.050
130 H ARG 14 H ARG 14 3.997 4.664 -2.595
131 HA ARG 14 HA ARG 14 3.170 6.374 -4.681
132 HB2 ARG 14 HB3 ARG 14 1.204 4.836 -4.625
133 HB3 ARG 14 HB2 ARG 14 0.918 5.330 -2.963
134 HG2 ARG 14 HG3 ARG 14 -0.541 6.498 -4.546
135 HG3 ARG 14 HG2 ARG 14 0.514 7.610 -3.673
136 HD2 ARG 14 HD3 ARG 14 2.012 7.705 -5.595
137 HD3 ARG 14 HD2 ARG 14 0.987 6.566 -6.464
138 HE ARG 14 HE ARG 14 -0.763 8.484 -5.974
139 HH11 ARG 14 HH11 ARG 14 2.561 8.756 -7.030
140 HH12 ARG 14 HH12 ARG 14 2.288 10.200 -7.949
141 HH21 ARG 14 HH22 ARG 14 -1.128 10.397 -7.173
142 HH22 ARG 14 HH21 ARG 14 0.187 11.136 -8.031
143 H THR 15 H THR 15 1.431 6.336 -1.630
144 HA THR 15 HA THR 15 3.206 8.358 -0.531
145 HB THR 15 HB THR 15 0.270 8.973 -0.835
146 HG1 THR 15 HG1 THR 15 2.428 9.934 -2.444
147 HG21 THR 15 HG21 THR 15 2.645 10.741 -0.250
148 HG22 THR 15 HG22 THR 15 1.518 10.125 0.954
149 HG23 THR 15 HG23 THR 15 0.952 11.234 -0.291
150 H VAL 16 H VAL 16 -0.145 7.181 0.101
151 HA VAL 16 HA VAL 16 0.712 6.286 2.732
152 HB VAL 16 HB VAL 16 -1.425 8.400 2.401
153 HG11 VAL 16 HG11 VAL 16 -0.651 6.778 4.823
154 HG12 VAL 16 HG12 VAL 16 -2.203 6.762 3.986
155 HG13 VAL 16 HG13 VAL 16 -1.689 8.205 4.861
156 HG21 VAL 16 HG21 VAL 16 -0.051 9.728 3.902
157 HG22 VAL 16 HG22 VAL 16 0.872 9.264 2.476
158 HG23 VAL 16 HG23 VAL 16 1.132 8.425 4.001
159 H ILE 17 H ILE 17 -2.423 6.957 1.081
160 HA ILE 17 HA ILE 17 -3.558 4.587 2.160
161 HB ILE 17 HB ILE 17 -4.980 6.473 1.551
162 HG12 ILE 17 HG13 ILE 17 -6.784 5.256 0.484
163 HG13 ILE 17 HG12 ILE 17 -5.652 4.075 -0.162
164 HG21 ILE 17 HG21 ILE 17 -5.501 6.959 -0.802
165 HG22 ILE 17 HG22 ILE 17 -4.241 5.829 -1.298
166 HG23 ILE 17 HG23 ILE 17 -3.816 7.287 -0.403
167 HD11 ILE 17 HD11 ILE 17 -5.878 4.472 2.786
168 HD12 ILE 17 HD12 ILE 17 -5.349 3.046 1.884
169 HD13 ILE 17 HD13 ILE 17 -7.061 3.493 1.920
170 H THR 18 H THR 18 -1.800 5.277 -0.746
171 HA THR 18 HA THR 18 -2.308 2.564 -1.738
172 HB THR 18 HB THR 18 -0.833 4.659 -3.295
173 HG1 THR 18 HG1 THR 18 -3.572 4.615 -2.645
174 HG21 THR 18 HG21 THR 18 -2.777 2.509 -4.120
175 HG22 THR 18 HG22 THR 18 -1.023 2.345 -4.120
176 HG23 THR 18 HG23 THR 18 -1.797 3.513 -5.189
177 H SER 19 H SER 19 -0.439 3.862 0.384
178 HA SER 19 HA SER 19 1.746 2.024 -0.069
179 HB2 SER 19 HB3 SER 19 2.460 4.017 -1.323
180 HB3 SER 19 HB2 SER 19 2.202 5.017 0.104
181 HG SER 19 HG SER 19 3.828 3.631 1.130
182 H HIS 20 H HIS 20 0.060 1.577 1.869
183 HA HIS 20 HA HIS 20 0.908 3.098 4.240
184 HB2 HIS 20 HB3 HIS 20 -1.565 2.992 3.530
185 HB3 HIS 20 HB2 HIS 20 -1.531 1.344 4.153
186 HD1 HIS 20 HD1 HIS 20 -0.220 4.640 5.560
187 HD2 HIS 20 HD2 HIS 20 -2.609 1.409 6.632
188 HE1 HIS 20 HE1 HIS 20 -0.930 5.079 7.932
189 HE2 HIS 20 HE2 HIS 20 -2.314 3.077 8.588
190 H ILE 21 H ILE 21 -0.478 -0.173 3.941
191 HA ILE 21 HA ILE 21 1.224 -1.161 6.013
192 HB ILE 21 HB ILE 21 -0.624 -2.565 4.074
193 HG12 ILE 21 HG13 ILE 21 -1.798 -3.138 6.273
194 HG13 ILE 21 HG12 ILE 21 -0.751 -1.941 7.024
195 HG21 ILE 21 HG21 ILE 21 -0.254 -4.622 5.382
196 HG22 ILE 21 HG22 ILE 21 1.044 -3.807 6.255
197 HG23 ILE 21 HG23 ILE 21 1.189 -4.090 4.520
198 HD11 ILE 21 HD11 ILE 21 -1.684 -0.217 5.587
199 HD12 ILE 21 HD12 ILE 21 -2.941 -1.028 6.521
200 HD13 ILE 21 HD13 ILE 21 -2.720 -1.415 4.814
201 H ASP 22 H ASP 22 0.926 -2.000 2.600
202 HA ASP 22 HA ASP 22 2.404 -2.388 0.962
203 HB2 ASP 22 HB3 ASP 22 3.547 -0.342 1.704
204 HB3 ASP 22 HB2 ASP 22 4.465 -1.262 2.874
205 H LYS 23 H LYS 23 4.129 -3.805 0.294
206 HA LYS 23 HA LYS 23 4.453 -6.274 1.302
207 HB2 LYS 23 HB3 LYS 23 6.730 -4.590 0.229
208 HB3 LYS 23 HB2 LYS 23 6.711 -6.342 0.320
209 HG2 LYS 23 HG3 LYS 23 6.153 -6.093 -1.857
210 HG3 LYS 23 HG2 LYS 23 4.538 -6.033 -1.157
211 HD2 LYS 23 HD3 LYS 23 4.712 -4.262 -2.751
212 HD3 LYS 23 HD2 LYS 23 4.717 -3.537 -1.148
213 HE2 LYS 23 HE3 LYS 23 6.368 -2.556 -2.739
214 HE3 LYS 23 HE2 LYS 23 7.085 -3.157 -1.247
215 HZ1 LYS 23 HZ1 LYS 23 7.681 -5.200 -2.459
216 HZ2 LYS 23 HZ2 LYS 23 8.401 -3.829 -3.132
217 HZ3 LYS 23 HZ3 LYS 23 7.062 -4.531 -3.882
218 H VAL 24 H VAL 24 6.216 -3.377 2.384
219 HA VAL 24 HA VAL 24 6.604 -4.292 5.017
220 HB VAL 24 HB VAL 24 8.034 -5.976 3.879
221 HG11 VAL 24 HG11 VAL 24 9.749 -3.615 3.135
222 HG12 VAL 24 HG12 VAL 24 8.831 -4.632 2.025
223 HG13 VAL 24 HG13 VAL 24 10.184 -5.311 2.928
224 HG21 VAL 24 HG21 VAL 24 8.471 -5.418 6.193
225 HG22 VAL 24 HG22 VAL 24 9.504 -4.077 5.699
226 HG23 VAL 24 HG23 VAL 24 9.985 -5.736 5.347
227 H LEU 25 H LEU 25 5.910 -1.920 3.632
228 HA LEU 25 HA LEU 25 6.325 0.303 3.436
229 HB2 LEU 25 HB3 LEU 25 7.950 -0.331 5.892
230 HB3 LEU 25 HB2 LEU 25 7.789 1.299 5.273
231 HG LEU 25 HG LEU 25 5.260 0.960 5.507
232 HD11 LEU 25 HD11 LEU 25 4.566 -0.671 7.185
233 HD12 LEU 25 HD12 LEU 25 6.210 -1.302 7.252
234 HD13 LEU 25 HD13 LEU 25 5.267 -1.456 5.770
235 HD21 LEU 25 HD21 LEU 25 5.314 1.570 7.869
236 HD22 LEU 25 HD22 LEU 25 6.570 2.410 6.960
237 HD23 LEU 25 HD23 LEU 25 6.989 1.029 7.974
238 H ARG 26 H ARG 26 7.564 -0.957 1.559
239 HA ARG 26 HA ARG 26 10.391 -0.413 1.547
240 HB2 ARG 26 HB3 ARG 26 9.883 -2.387 0.433
241 HB3 ARG 26 HB2 ARG 26 8.457 -1.708 -0.337
242 HG2 ARG 26 HG3 ARG 26 11.035 -0.502 -1.098
243 HG3 ARG 26 HG2 ARG 26 10.767 -2.167 -1.613
244 HD2 ARG 26 HD3 ARG 26 8.832 -1.592 -2.825
245 HD3 ARG 26 HD2 ARG 26 8.719 -0.011 -2.046
246 HE ARG 26 HE ARG 26 11.152 -0.091 -3.391
247 HH11 ARG 26 HH11 ARG 26 7.745 -0.206 -4.229
248 HH12 ARG 26 HH12 ARG 26 7.989 0.473 -5.806
249 HH21 ARG 26 HH22 ARG 26 11.460 0.802 -5.462
250 HH22 ARG 26 HH21 ARG 26 10.098 1.043 -6.509
251 HA PRO 27 HA PRO 27 8.990 2.665 -1.904
252 HB2 PRO 27 HB2 PRO 27 6.488 3.731 -1.661
253 HB3 PRO 27 HB3 PRO 27 6.875 2.321 -2.668
254 HG2 PRO 27 HG3 PRO 27 5.721 2.419 0.093
255 HG3 PRO 27 HG2 PRO 27 5.238 1.409 -1.281
256 HD2 PRO 27 HD3 PRO 27 6.770 0.456 0.704
257 HD3 PRO 27 HD2 PRO 27 6.999 -0.059 -0.978
258 H GLN 28 H GLN 28 6.836 3.619 0.774
259 HA GLN 28 HA GLN 28 8.475 6.040 1.127
260 HB2 GLN 28 HB3 GLN 28 5.551 5.568 1.762
261 HB3 GLN 28 HB2 GLN 28 6.423 7.059 2.081
262 HG2 GLN 28 HG3 GLN 28 6.109 5.884 -0.668
263 HG3 GLN 28 HG2 GLN 28 4.987 7.053 0.025
264 HE21 GLN 28 HE22 GLN 28 5.447 8.548 -1.590
265 HE22 GLN 28 HE21 GLN 28 6.933 9.435 -1.625
266 H GLY 29 H GLY 29 9.540 3.954 2.317
267 HA2 GLY 29 HA3 GLY 29 9.115 4.432 5.145
268 HA3 GLY 29 HA2 GLY 29 8.761 2.800 4.587
Start of MODEL 10
1 H1 ARG 1 H1 ARG 1 -11.743 1.353 0.638
2 H2 ARG 1 H2 ARG 1 -10.300 1.938 1.289
3 H3 ARG 1 H3 ARG 1 -11.542 1.424 2.314
4 HA ARG 1 HA ARG 1 -9.792 -0.194 2.224
5 HB2 ARG 1 HB3 ARG 1 -11.148 -2.158 1.629
6 HB3 ARG 1 HB2 ARG 1 -12.056 -1.002 2.588
7 HG2 ARG 1 HG3 ARG 1 -13.124 -0.175 0.531
8 HG3 ARG 1 HG2 ARG 1 -12.254 -1.402 -0.388
9 HD2 ARG 1 HD3 ARG 1 -14.158 -1.983 1.875
10 HD3 ARG 1 HD2 ARG 1 -14.589 -2.033 0.168
11 HE ARG 1 HE ARG 1 -12.413 -3.697 0.435
12 HH11 ARG 1 HH12 ARG 1 -15.631 -3.510 1.786
13 HH12 ARG 1 HH11 ARG 1 -15.802 -5.227 1.962
14 HH21 ARG 1 HH21 ARG 1 -12.635 -5.972 0.643
15 HH22 ARG 1 HH22 ARG 1 -14.096 -6.629 1.310
16 H LYS 2 H LYS 2 -11.124 0.600 -0.943
17 HA LYS 2 HA LYS 2 -10.181 0.663 -2.990
18 HB2 LYS 2 HB3 LYS 2 -7.641 0.089 -1.472
19 HB3 LYS 2 HB2 LYS 2 -7.705 0.503 -3.181
20 HG2 LYS 2 HG3 LYS 2 -8.807 2.294 -1.039
21 HG3 LYS 2 HG2 LYS 2 -7.124 2.360 -1.558
22 HD2 LYS 2 HD3 LYS 2 -9.483 2.671 -3.414
23 HD3 LYS 2 HD2 LYS 2 -8.620 4.022 -2.676
24 HE2 LYS 2 HE3 LYS 2 -6.558 3.316 -3.765
25 HE3 LYS 2 HE2 LYS 2 -7.389 1.934 -4.474
26 HZ1 LYS 2 HZ1 LYS 2 -7.981 4.789 -5.020
27 HZ2 LYS 2 HZ2 LYS 2 -8.823 3.476 -5.673
28 HZ3 LYS 2 HZ3 LYS 2 -7.196 3.715 -6.063
29 H CYS 3 H CYS 3 -7.998 -1.819 -1.699
30 HA CYS 3 HA CYS 3 -9.503 -4.036 -2.606
31 HB2 CYS 3 HB3 CYS 3 -8.411 -4.688 -4.576
32 HB3 CYS 3 HB2 CYS 3 -8.619 -2.956 -4.788
33 H ASN 4 H ASN 4 -7.802 -2.952 -0.394
34 HA ASN 4 HA ASN 4 -6.149 -3.512 1.060
35 HB2 ASN 4 HB3 ASN 4 -7.061 -6.214 0.120
36 HB3 ASN 4 HB2 ASN 4 -5.758 -6.052 1.293
37 HD21 ASN 4 HD22 ASN 4 -6.860 -6.940 2.995
38 HD22 ASN 4 HD21 ASN 4 -8.224 -6.179 3.740
39 H PHE 5 H PHE 5 -5.051 -6.286 -0.702
40 HA PHE 5 HA PHE 5 -2.447 -5.172 -0.601
41 HB2 PHE 5 HB3 PHE 5 -1.712 -7.244 -1.724
42 HB3 PHE 5 HB2 PHE 5 -2.699 -7.538 -0.305
43 HD1 PHE 5 HD1 PHE 5 -5.152 -8.135 -0.653
44 HD2 PHE 5 HD2 PHE 5 -2.275 -8.186 -3.782
45 HE1 PHE 5 HE1 PHE 5 -6.614 -9.612 -1.967
46 HE2 PHE 5 HE2 PHE 5 -3.733 -9.656 -5.107
47 HZ PHE 5 HZ PHE 5 -5.904 -10.372 -4.198
48 H LEU 6 H LEU 6 -1.273 -4.168 -2.002
49 HA LEU 6 HA LEU 6 -0.629 -2.944 -3.780
50 HB2 LEU 6 HB3 LEU 6 -2.561 -4.696 -5.289
51 HB3 LEU 6 HB2 LEU 6 -1.626 -3.430 -6.055
52 HG LEU 6 HG LEU 6 -0.462 -5.410 -6.504
53 HD11 LEU 6 HD11 LEU 6 0.878 -4.150 -4.115
54 HD12 LEU 6 HD12 LEU 6 1.015 -3.636 -5.796
55 HD13 LEU 6 HD13 LEU 6 1.653 -5.201 -5.301
56 HD21 LEU 6 HD21 LEU 6 -1.602 -6.863 -4.933
57 HD22 LEU 6 HD22 LEU 6 -0.704 -6.149 -3.588
58 HD23 LEU 6 HD23 LEU 6 0.145 -7.075 -4.834
59 H CYS 7 H CYS 7 -2.685 -2.138 -1.988
60 HA CYS 7 HA CYS 7 -3.820 0.050 -3.511
61 HB2 CYS 7 HB3 CYS 7 -5.511 -2.104 -2.283
62 HB3 CYS 7 HB2 CYS 7 -6.108 -0.465 -2.433
63 H LYS 8 H LYS 8 -3.790 -1.671 -0.443
64 HA LYS 8 HA LYS 8 -3.045 0.792 0.950
65 HB2 LYS 8 HB3 LYS 8 -5.456 0.571 1.355
66 HB3 LYS 8 HB2 LYS 8 -5.234 -1.097 1.864
67 HG2 LYS 8 HG3 LYS 8 -3.880 -0.324 3.762
68 HG3 LYS 8 HG2 LYS 8 -4.155 1.345 3.262
69 HD2 LYS 8 HD3 LYS 8 -6.322 -0.612 4.015
70 HD3 LYS 8 HD2 LYS 8 -5.653 0.614 5.091
71 HE2 LYS 8 HE3 LYS 8 -6.391 2.361 3.528
72 HE3 LYS 8 HE2 LYS 8 -7.087 1.122 2.484
73 HZ1 LYS 8 HZ1 LYS 8 -8.571 0.495 4.287
74 HZ2 LYS 8 HZ2 LYS 8 -8.762 2.130 3.898
75 HZ3 LYS 8 HZ3 LYS 8 -7.903 1.686 5.284
76 H LEU 9 H LEU 9 -3.470 -2.646 0.892
77 HA LEU 9 HA LEU 9 -1.102 -3.091 2.531
78 HB2 LEU 9 HB3 LEU 9 -3.117 -4.981 1.295
79 HB3 LEU 9 HB2 LEU 9 -1.665 -5.528 2.105
80 HG LEU 9 HG LEU 9 -2.519 -4.386 4.188
81 HD11 LEU 9 HD11 LEU 9 -5.118 -4.321 2.676
82 HD12 LEU 9 HD12 LEU 9 -4.114 -2.908 2.998
83 HD13 LEU 9 HD13 LEU 9 -4.832 -3.804 4.339
84 HD21 LEU 9 HD21 LEU 9 -4.201 -6.591 3.020
85 HD22 LEU 9 HD22 LEU 9 -4.059 -6.192 4.730
86 HD23 LEU 9 HD23 LEU 9 -2.659 -6.798 3.847
87 H LYS 10 H LYS 10 -0.142 -5.313 1.233
88 HA LYS 10 HA LYS 10 1.884 -5.448 0.176
89 HB2 LYS 10 HB3 LYS 10 -0.006 -6.369 -1.282
90 HB3 LYS 10 HB2 LYS 10 0.273 -4.959 -2.292
91 HG2 LYS 10 HG3 LYS 10 1.544 -6.692 -3.244
92 HG3 LYS 10 HG2 LYS 10 2.689 -5.657 -2.391
93 HD2 LYS 10 HD3 LYS 10 3.274 -7.919 -1.906
94 HD3 LYS 10 HD2 LYS 10 2.546 -7.235 -0.453
95 HE2 LYS 10 HE3 LYS 10 1.623 -9.399 -0.708
96 HE3 LYS 10 HE2 LYS 10 0.370 -8.258 -1.193
97 HZ1 LYS 10 HZ1 LYS 10 2.113 -9.848 -2.991
98 HZ2 LYS 10 HZ2 LYS 10 1.037 -8.658 -3.522
99 HZ3 LYS 10 HZ3 LYS 10 0.451 -10.045 -2.756
100 H GLU 11 H GLU 11 0.203 -2.881 -1.603
101 HA GLU 11 HA GLU 11 0.728 -0.816 -2.214
102 HB2 GLU 11 HB3 GLU 11 2.178 0.479 -1.066
103 HB3 GLU 11 HB2 GLU 11 2.060 -0.863 0.052
104 HG2 GLU 11 HG3 GLU 11 4.298 -0.439 0.005
105 HG3 GLU 11 HG2 GLU 11 4.155 -1.750 -1.157
106 H LYS 12 H LYS 12 2.458 0.430 -3.532
107 HA LYS 12 HA LYS 12 3.983 -1.111 -5.350
108 HB2 LYS 12 HB3 LYS 12 2.347 -0.652 -7.318
109 HB3 LYS 12 HB2 LYS 12 2.080 -2.045 -6.288
110 HG2 LYS 12 HG3 LYS 12 -0.031 -1.025 -6.697
111 HG3 LYS 12 HG2 LYS 12 0.398 -0.710 -5.019
112 HD2 LYS 12 HD3 LYS 12 -0.553 1.282 -5.994
113 HD3 LYS 12 HD2 LYS 12 1.162 1.556 -5.678
114 HE2 LYS 12 HE3 LYS 12 1.605 0.996 -8.076
115 HE3 LYS 12 HE2 LYS 12 -0.136 0.927 -8.334
116 HZ1 LYS 12 HZ1 LYS 12 -0.305 3.239 -7.722
117 HZ2 LYS 12 HZ2 LYS 12 0.829 3.068 -8.963
118 HZ3 LYS 12 HZ3 LYS 12 1.352 3.314 -7.374
119 H LEU 13 H LEU 13 4.157 1.351 -3.864
120 HA LEU 13 HA LEU 13 4.925 3.467 -4.066
121 HB2 LEU 13 HB3 LEU 13 6.331 2.708 -5.892
122 HB3 LEU 13 HB2 LEU 13 5.000 2.857 -7.021
123 HG LEU 13 HG LEU 13 5.002 5.323 -6.602
124 HD11 LEU 13 HD11 LEU 13 7.004 6.306 -5.576
125 HD12 LEU 13 HD12 LEU 13 7.544 4.691 -5.113
126 HD13 LEU 13 HD13 LEU 13 6.062 5.356 -4.426
127 HD21 LEU 13 HD21 LEU 13 6.083 4.376 -8.557
128 HD22 LEU 13 HD22 LEU 13 7.561 4.111 -7.633
129 HD23 LEU 13 HD23 LEU 13 7.001 5.753 -7.949
130 H ARG 14 H ARG 14 3.563 4.994 -3.518
131 HA ARG 14 HA ARG 14 1.708 6.107 -5.404
132 HB2 ARG 14 HB3 ARG 14 0.777 4.023 -3.718
133 HB3 ARG 14 HB2 ARG 14 0.072 5.523 -3.133
134 HG2 ARG 14 HG3 ARG 14 -0.122 4.432 -5.933
135 HG3 ARG 14 HG2 ARG 14 -1.400 4.445 -4.717
136 HD2 ARG 14 HD3 ARG 14 -1.302 6.913 -4.696
137 HD3 ARG 14 HD2 ARG 14 -0.101 6.851 -5.984
138 HE ARG 14 HE ARG 14 -2.279 5.407 -6.886
139 HH11 ARG 14 HH11 ARG 14 -1.575 8.701 -5.935
140 HH12 ARG 14 HH12 ARG 14 -2.824 9.391 -6.916
141 HH21 ARG 14 HH22 ARG 14 -3.923 6.319 -8.196
142 HH22 ARG 14 HH21 ARG 14 -4.165 8.036 -8.196
143 H THR 15 H THR 15 1.447 5.964 -1.862
144 HA THR 15 HA THR 15 2.750 8.447 -1.448
145 HB THR 15 HB THR 15 0.873 9.480 -2.429
146 HG1 THR 15 HG1 THR 15 -0.065 10.570 -0.543
147 HG21 THR 15 HG21 THR 15 -1.430 9.106 -1.826
148 HG22 THR 15 HG22 THR 15 -0.953 7.951 -0.583
149 HG23 THR 15 HG23 THR 15 -0.697 7.569 -2.284
150 H VAL 16 H VAL 16 -0.053 6.777 0.060
151 HA VAL 16 HA VAL 16 1.430 5.763 2.216
152 HB VAL 16 HB VAL 16 1.472 8.286 2.698
153 HG11 VAL 16 HG11 VAL 16 -1.405 7.652 3.266
154 HG12 VAL 16 HG12 VAL 16 -0.755 8.913 2.210
155 HG13 VAL 16 HG13 VAL 16 -0.573 9.047 3.961
156 HG21 VAL 16 HG21 VAL 16 1.188 7.922 5.109
157 HG22 VAL 16 HG22 VAL 16 2.084 6.607 4.349
158 HG23 VAL 16 HG23 VAL 16 0.388 6.385 4.778
159 H ILE 17 H ILE 17 -1.671 6.742 0.853
160 HA ILE 17 HA ILE 17 -3.253 5.121 2.563
161 HB ILE 17 HB ILE 17 -4.166 6.931 1.099
162 HG12 ILE 17 HG13 ILE 17 -5.566 5.020 2.073
163 HG13 ILE 17 HG12 ILE 17 -6.276 5.961 0.774
164 HG21 ILE 17 HG21 ILE 17 -3.741 4.957 -1.131
165 HG22 ILE 17 HG22 ILE 17 -2.933 6.512 -0.926
166 HG23 ILE 17 HG23 ILE 17 -4.666 6.454 -1.252
167 HD11 ILE 17 HD11 ILE 17 -6.843 3.792 0.233
168 HD12 ILE 17 HD12 ILE 17 -5.284 3.138 0.740
169 HD13 ILE 17 HD13 ILE 17 -5.410 4.069 -0.755
170 H THR 18 H THR 18 -1.550 4.585 -0.446
171 HA THR 18 HA THR 18 -2.218 1.773 -0.498
172 HB THR 18 HB THR 18 -0.327 3.362 -2.239
173 HG1 THR 18 HG1 THR 18 -3.086 2.835 -2.327
174 HG21 THR 18 HG21 THR 18 -1.474 0.589 -2.566
175 HG22 THR 18 HG22 THR 18 0.219 1.007 -2.302
176 HG23 THR 18 HG23 THR 18 -0.576 1.460 -3.808
177 H SER 19 H SER 19 0.622 3.831 -0.048
178 HA SER 19 HA SER 19 2.220 1.643 0.953
179 HB2 SER 19 HB3 SER 19 3.161 3.554 -0.357
180 HB3 SER 19 HB2 SER 19 2.773 4.622 0.990
181 HG SER 19 HG SER 19 4.287 2.324 1.541
182 H HIS 20 H HIS 20 -0.030 1.700 2.400
183 HA HIS 20 HA HIS 20 0.409 3.151 4.884
184 HB2 HIS 20 HB3 HIS 20 -1.863 3.013 3.822
185 HB3 HIS 20 HB2 HIS 20 -1.851 1.281 4.135
186 HD1 HIS 20 HD1 HIS 20 -2.076 4.592 5.903
187 HD2 HIS 20 HD2 HIS 20 -2.473 0.538 6.737
188 HE1 HIS 20 HE1 HIS 20 -3.074 4.469 8.207
189 HE2 HIS 20 HE2 HIS 20 -3.209 2.009 8.732
190 H ILE 21 H ILE 21 -0.335 -0.205 3.952
191 HA ILE 21 HA ILE 21 1.636 -1.085 5.933
192 HB ILE 21 HB ILE 21 0.135 -3.170 6.211
193 HG12 ILE 21 HG13 ILE 21 -1.910 -1.126 5.318
194 HG13 ILE 21 HG12 ILE 21 -1.514 -2.629 4.493
195 HG21 ILE 21 HG21 ILE 21 -1.013 -2.119 8.102
196 HG22 ILE 21 HG22 ILE 21 -0.604 -0.530 7.459
197 HG23 ILE 21 HG23 ILE 21 0.674 -1.619 7.996
198 HD11 ILE 21 HD11 ILE 21 -3.590 -2.815 5.740
199 HD12 ILE 21 HD12 ILE 21 -2.745 -2.395 7.228
200 HD13 ILE 21 HD13 ILE 21 -2.362 -3.899 6.391
201 H ASP 22 H ASP 22 3.024 -1.101 4.213
202 HA ASP 22 HA ASP 22 2.569 -2.269 1.710
203 HB2 ASP 22 HB3 ASP 22 5.322 -2.071 2.890
204 HB3 ASP 22 HB2 ASP 22 4.799 -1.739 1.248
205 H LYS 23 H LYS 23 4.039 -4.001 0.794
206 HA LYS 23 HA LYS 23 3.830 -6.495 1.978
207 HB2 LYS 23 HB3 LYS 23 6.070 -6.851 0.501
208 HB3 LYS 23 HB2 LYS 23 4.454 -6.808 -0.180
209 HG2 LYS 23 HG3 LYS 23 5.950 -5.459 -1.509
210 HG3 LYS 23 HG2 LYS 23 4.763 -4.422 -0.720
211 HD2 LYS 23 HD3 LYS 23 6.581 -4.159 1.102
212 HD3 LYS 23 HD2 LYS 23 7.680 -4.755 -0.134
213 HE2 LYS 23 HE3 LYS 23 5.822 -2.472 -0.669
214 HE3 LYS 23 HE2 LYS 23 7.367 -2.207 0.135
215 HZ1 LYS 23 HZ1 LYS 23 6.991 -3.461 -2.539
216 HZ2 LYS 23 HZ2 LYS 23 8.478 -3.179 -1.784
217 HZ3 LYS 23 HZ3 LYS 23 7.510 -1.878 -2.266
218 H VAL 24 H VAL 24 6.151 -4.000 2.558
219 HA VAL 24 HA VAL 24 7.382 -5.509 4.708
220 HB VAL 24 HB VAL 24 9.655 -5.064 4.022
221 HG11 VAL 24 HG11 VAL 24 8.135 -6.351 1.769
222 HG12 VAL 24 HG12 VAL 24 8.774 -7.149 3.205
223 HG13 VAL 24 HG13 VAL 24 9.876 -6.461 2.014
224 HG21 VAL 24 HG21 VAL 24 9.360 -2.955 2.880
225 HG22 VAL 24 HG22 VAL 24 8.508 -3.759 1.563
226 HG23 VAL 24 HG23 VAL 24 10.218 -4.089 1.837
227 H LEU 25 H LEU 25 9.271 -3.735 5.517
228 HA LEU 25 HA LEU 25 7.639 -1.455 6.239
229 HB2 LEU 25 HB3 LEU 25 10.403 -2.307 7.099
230 HB3 LEU 25 HB2 LEU 25 9.632 -0.838 7.657
231 HG LEU 25 HG LEU 25 9.341 -2.414 9.381
232 HD11 LEU 25 HD11 LEU 25 7.335 -1.116 8.873
233 HD12 LEU 25 HD12 LEU 25 6.938 -2.706 9.525
234 HD13 LEU 25 HD13 LEU 25 6.780 -2.399 7.797
235 HD21 LEU 25 HD21 LEU 25 8.423 -4.647 9.068
236 HD22 LEU 25 HD22 LEU 25 9.898 -4.429 8.126
237 HD23 LEU 25 HD23 LEU 25 8.326 -4.373 7.328
238 H ARG 26 H ARG 26 7.704 -0.908 3.804
239 HA ARG 26 HA ARG 26 9.975 0.898 3.344
240 HB2 ARG 26 HB3 ARG 26 10.166 -0.906 1.838
241 HB3 ARG 26 HB2 ARG 26 8.445 -0.944 1.521
242 HG2 ARG 26 HG3 ARG 26 9.713 1.544 0.694
243 HG3 ARG 26 HG2 ARG 26 10.358 0.110 -0.112
244 HD2 ARG 26 HD3 ARG 26 8.294 -0.469 -1.010
245 HD3 ARG 26 HD2 ARG 26 7.397 0.503 0.161
246 HE ARG 26 HE ARG 26 9.009 1.645 -2.042
247 HH11 ARG 26 HH11 ARG 26 6.241 1.724 0.101
248 HH12 ARG 26 HH12 ARG 26 5.483 3.039 -0.723
249 HH21 ARG 26 HH22 ARG 26 8.035 3.418 -3.099
250 HH22 ARG 26 HH21 ARG 26 6.508 4.022 -2.533
251 HA PRO 27 HA PRO 27 5.506 2.865 2.937
252 HB2 PRO 27 HB2 PRO 27 6.088 4.220 5.517
253 HB3 PRO 27 HB3 PRO 27 4.571 3.508 4.928
254 HG2 PRO 27 HG3 PRO 27 5.976 2.274 6.808
255 HG3 PRO 27 HG2 PRO 27 5.218 1.351 5.488
256 HD2 PRO 27 HD3 PRO 27 8.083 2.215 5.786
257 HD3 PRO 27 HD2 PRO 27 7.437 0.628 5.314
258 H GLN 28 H GLN 28 5.452 4.682 1.790
259 HA GLN 28 HA GLN 28 7.823 6.402 1.844
260 HB2 GLN 28 HB3 GLN 28 7.128 7.160 -0.354
261 HB3 GLN 28 HB2 GLN 28 7.167 5.404 -0.310
262 HG2 GLN 28 HG3 GLN 28 4.726 5.390 0.015
263 HG3 GLN 28 HG2 GLN 28 4.723 7.147 -0.136
264 HE21 GLN 28 HE22 GLN 28 5.203 8.077 -2.138
265 HE22 GLN 28 HE21 GLN 28 5.089 7.177 -3.610
266 H GLY 29 H GLY 29 5.271 6.417 3.602
267 HA2 GLY 29 HA3 GLY 29 4.642 9.272 3.218
268 HA3 GLY 29 HA2 GLY 29 3.560 8.111 3.979
Start of MODEL 11
1 H1 ARG 1 H1 ARG 1 -11.417 0.039 2.968
2 H2 ARG 1 H2 ARG 1 -11.600 0.993 4.348
3 H3 ARG 1 H3 ARG 1 -10.328 1.295 3.275
4 HA ARG 1 HA ARG 1 -13.220 1.643 2.741
5 HB2 ARG 1 HB3 ARG 1 -12.154 3.397 4.144
6 HB3 ARG 1 HB2 ARG 1 -10.974 3.666 2.870
7 HG2 ARG 1 HG3 ARG 1 -12.830 4.301 1.356
8 HG3 ARG 1 HG2 ARG 1 -13.939 4.150 2.721
9 HD2 ARG 1 HD3 ARG 1 -12.581 5.841 3.934
10 HD3 ARG 1 HD2 ARG 1 -11.608 6.046 2.479
11 HE ARG 1 HE ARG 1 -14.370 6.402 1.922
12 HH11 ARG 1 HH12 ARG 1 -11.601 7.994 3.353
13 HH12 ARG 1 HH11 ARG 1 -12.201 9.592 3.053
14 HH21 ARG 1 HH21 ARG 1 -15.165 8.502 1.521
15 HH22 ARG 1 HH22 ARG 1 -14.227 9.883 2.001
16 H LYS 2 H LYS 2 -9.932 1.651 1.505
17 HA LYS 2 HA LYS 2 -10.802 2.234 -1.196
18 HB2 LYS 2 HB3 LYS 2 -8.495 2.718 0.199
19 HB3 LYS 2 HB2 LYS 2 -8.048 1.293 -0.722
20 HG2 LYS 2 HG3 LYS 2 -9.065 3.893 -1.846
21 HG3 LYS 2 HG2 LYS 2 -7.400 3.316 -1.878
22 HD2 LYS 2 HD3 LYS 2 -8.116 1.397 -3.247
23 HD3 LYS 2 HD2 LYS 2 -9.761 2.041 -3.254
24 HE2 LYS 2 HE3 LYS 2 -8.962 4.066 -4.360
25 HE3 LYS 2 HE2 LYS 2 -7.318 3.436 -4.337
26 HZ1 LYS 2 HZ1 LYS 2 -8.036 1.614 -5.749
27 HZ2 LYS 2 HZ2 LYS 2 -8.358 3.104 -6.482
28 HZ3 LYS 2 HZ3 LYS 2 -9.611 2.222 -5.774
29 H CYS 3 H CYS 3 -8.613 -0.263 0.017
30 HA CYS 3 HA CYS 3 -10.195 -2.494 -0.570
31 HB2 CYS 3 HB3 CYS 3 -8.349 -3.182 -2.471
32 HB3 CYS 3 HB2 CYS 3 -9.968 -2.600 -2.819
33 H ASN 4 H ASN 4 -8.089 -4.338 -1.175
34 HA ASN 4 HA ASN 4 -6.764 -4.226 1.438
35 HB2 ASN 4 HB3 ASN 4 -7.259 -6.539 -0.437
36 HB3 ASN 4 HB2 ASN 4 -6.308 -6.662 1.038
37 HD21 ASN 4 HD22 ASN 4 -9.474 -6.336 -0.310
38 HD22 ASN 4 HD21 ASN 4 -10.350 -6.585 1.159
39 H PHE 5 H PHE 5 -5.434 -6.264 -1.001
40 HA PHE 5 HA PHE 5 -2.876 -5.143 -0.487
41 HB2 PHE 5 HB3 PHE 5 -2.166 -6.774 -2.321
42 HB3 PHE 5 HB2 PHE 5 -2.875 -7.448 -0.865
43 HD1 PHE 5 HD2 PHE 5 -3.708 -6.496 -4.359
44 HD2 PHE 5 HD1 PHE 5 -4.727 -8.836 -0.960
45 HE1 PHE 5 HE2 PHE 5 -5.389 -7.688 -5.693
46 HE2 PHE 5 HE1 PHE 5 -6.412 -10.034 -2.288
47 HZ PHE 5 HZ PHE 5 -6.746 -9.463 -4.658
48 H LEU 6 H LEU 6 -1.496 -4.047 -1.838
49 HA LEU 6 HA LEU 6 -0.947 -2.298 -3.178
50 HB2 LEU 6 HB3 LEU 6 -2.961 -3.588 -5.018
51 HB3 LEU 6 HB2 LEU 6 -1.911 -2.266 -5.483
52 HG LEU 6 HG LEU 6 -0.885 -4.170 -6.368
53 HD11 LEU 6 HD11 LEU 6 0.493 -3.752 -3.718
54 HD12 LEU 6 HD12 LEU 6 0.672 -2.722 -5.142
55 HD13 LEU 6 HD13 LEU 6 1.203 -4.401 -5.199
56 HD21 LEU 6 HD21 LEU 6 -2.205 -5.846 -5.207
57 HD22 LEU 6 HD22 LEU 6 -1.292 -5.559 -3.721
58 HD23 LEU 6 HD23 LEU 6 -0.489 -6.234 -5.146
59 H CYS 7 H CYS 7 -2.821 -1.804 -1.188
60 HA CYS 7 HA CYS 7 -4.466 0.335 -2.265
61 HB2 CYS 7 HB3 CYS 7 -5.580 -2.316 -1.447
62 HB3 CYS 7 HB2 CYS 7 -6.544 -0.868 -1.188
63 H LYS 8 H LYS 8 -3.575 -1.733 0.354
64 HA LYS 8 HA LYS 8 -3.202 0.355 2.241
65 HB2 LYS 8 HB3 LYS 8 -5.631 0.233 2.475
66 HB3 LYS 8 HB2 LYS 8 -5.573 -1.513 2.593
67 HG2 LYS 8 HG3 LYS 8 -4.325 -1.291 4.713
68 HG3 LYS 8 HG2 LYS 8 -4.560 0.460 4.612
69 HD2 LYS 8 HD3 LYS 8 -6.950 0.191 4.652
70 HD3 LYS 8 HD2 LYS 8 -6.796 -1.562 4.563
71 HE2 LYS 8 HE3 LYS 8 -5.866 0.182 6.836
72 HE3 LYS 8 HE2 LYS 8 -7.320 -0.808 6.808
73 HZ1 LYS 8 HZ1 LYS 8 -4.524 -1.787 6.695
74 HZ2 LYS 8 HZ2 LYS 8 -5.890 -2.769 6.524
75 HZ3 LYS 8 HZ3 LYS 8 -5.608 -1.962 7.977
76 H LEU 9 H LEU 9 -4.012 -2.988 1.720
77 HA LEU 9 HA LEU 9 -1.634 -3.961 3.054
78 HB2 LEU 9 HB3 LEU 9 -3.817 -5.285 1.445
79 HB3 LEU 9 HB2 LEU 9 -2.382 -6.153 1.957
80 HG LEU 9 HG LEU 9 -2.998 -5.672 4.331
81 HD11 LEU 9 HD11 LEU 9 -5.638 -4.783 3.199
82 HD12 LEU 9 HD12 LEU 9 -4.395 -3.686 3.796
83 HD13 LEU 9 HD13 LEU 9 -5.155 -4.838 4.895
84 HD21 LEU 9 HD21 LEU 9 -5.064 -7.145 2.703
85 HD22 LEU 9 HD22 LEU 9 -4.792 -7.324 4.437
86 HD23 LEU 9 HD23 LEU 9 -3.540 -7.808 3.292
87 H LYS 10 H LYS 10 -0.746 -5.820 1.160
88 HA LYS 10 HA LYS 10 1.474 -5.312 0.445
89 HB2 LYS 10 HB3 LYS 10 -0.220 -6.337 -1.305
90 HB3 LYS 10 HB2 LYS 10 0.055 -4.808 -2.131
91 HG2 LYS 10 HG3 LYS 10 2.435 -5.225 -2.200
92 HG3 LYS 10 HG2 LYS 10 2.226 -6.698 -1.261
93 HD2 LYS 10 HD3 LYS 10 1.119 -6.204 -4.018
94 HD3 LYS 10 HD2 LYS 10 2.546 -7.169 -3.639
95 HE2 LYS 10 HE3 LYS 10 1.079 -8.620 -2.223
96 HE3 LYS 10 HE2 LYS 10 -0.306 -7.724 -2.849
97 HZ1 LYS 10 HZ1 LYS 10 1.627 -9.303 -4.462
98 HZ2 LYS 10 HZ2 LYS 10 0.329 -8.417 -5.089
99 HZ3 LYS 10 HZ3 LYS 10 0.040 -9.751 -4.092
100 H GLU 11 H GLU 11 1.748 -3.568 -2.111
101 HA GLU 11 HA GLU 11 0.855 -0.978 -1.461
102 HB2 GLU 11 HB3 GLU 11 2.766 0.114 -0.630
103 HB3 GLU 11 HB2 GLU 11 2.588 -1.337 0.344
104 HG2 GLU 11 HG3 GLU 11 4.448 -1.097 -1.999
105 HG3 GLU 11 HG2 GLU 11 4.899 -0.806 -0.331
106 H LYS 12 H LYS 12 1.947 0.728 -2.729
107 HA LYS 12 HA LYS 12 3.637 -0.078 -4.911
108 HB2 LYS 12 HB3 LYS 12 2.196 0.563 -6.700
109 HB3 LYS 12 HB2 LYS 12 1.273 -0.544 -5.699
110 HG2 LYS 12 HG3 LYS 12 0.704 1.995 -4.697
111 HG3 LYS 12 HG2 LYS 12 0.690 2.164 -6.452
112 HD2 LYS 12 HD3 LYS 12 -0.771 0.079 -6.488
113 HD3 LYS 12 HD2 LYS 12 -0.943 0.309 -4.744
114 HE2 LYS 12 HE3 LYS 12 -1.906 2.498 -5.089
115 HE3 LYS 12 HE2 LYS 12 -1.642 2.368 -6.827
116 HZ1 LYS 12 HZ1 LYS 12 -3.215 0.592 -6.945
117 HZ2 LYS 12 HZ2 LYS 12 -3.948 1.884 -6.135
118 HZ3 LYS 12 HZ3 LYS 12 -3.387 0.543 -5.264
119 H LEU 13 H LEU 13 4.388 1.852 -6.106
120 HA LEU 13 HA LEU 13 5.090 3.903 -4.302
121 HB2 LEU 13 HB3 LEU 13 5.291 3.925 -7.313
122 HB3 LEU 13 HB2 LEU 13 6.166 4.969 -6.209
123 HG LEU 13 HG LEU 13 6.506 1.983 -6.497
124 HD11 LEU 13 HD11 LEU 13 8.335 4.285 -7.158
125 HD12 LEU 13 HD12 LEU 13 7.493 3.256 -8.316
126 HD13 LEU 13 HD13 LEU 13 8.745 2.574 -7.279
127 HD21 LEU 13 HD21 LEU 13 6.788 2.624 -4.176
128 HD22 LEU 13 HD22 LEU 13 7.887 3.922 -4.648
129 HD23 LEU 13 HD23 LEU 13 8.351 2.239 -4.897
130 H ARG 14 H ARG 14 3.317 4.916 -3.487
131 HA ARG 14 HA ARG 14 2.009 6.836 -5.230
132 HB2 ARG 14 HB3 ARG 14 0.492 4.925 -5.316
133 HB3 ARG 14 HB2 ARG 14 0.459 4.851 -3.558
134 HG2 ARG 14 HG3 ARG 14 -1.551 5.912 -4.395
135 HG3 ARG 14 HG2 ARG 14 -0.571 7.074 -3.489
136 HD2 ARG 14 HD3 ARG 14 0.370 7.862 -5.651
137 HD3 ARG 14 HD2 ARG 14 -0.767 6.806 -6.484
138 HE ARG 14 HE ARG 14 -2.497 8.189 -5.153
139 HH11 ARG 14 HH11 ARG 14 0.502 9.393 -6.498
140 HH12 ARG 14 HH12 ARG 14 -0.089 11.009 -6.712
141 HH21 ARG 14 HH22 ARG 14 -3.293 10.311 -5.462
142 HH22 ARG 14 HH21 ARG 14 -2.257 11.530 -6.135
143 H THR 15 H THR 15 2.213 5.513 -1.934
144 HA THR 15 HA THR 15 2.614 6.544 0.069
145 HB THR 15 HB THR 15 2.693 9.133 -1.420
146 HG1 THR 15 HG1 THR 15 5.096 8.648 -1.226
147 HG21 THR 15 HG21 THR 15 4.139 9.868 0.430
148 HG22 THR 15 HG22 THR 15 3.955 8.286 1.186
149 HG23 THR 15 HG23 THR 15 2.558 9.347 1.011
150 H VAL 16 H VAL 16 0.514 6.018 0.705
151 HA VAL 16 HA VAL 16 -1.167 8.035 1.592
152 HB VAL 16 HB VAL 16 -1.496 8.275 -0.937
153 HG11 VAL 16 HG11 VAL 16 -2.975 5.694 -0.564
154 HG12 VAL 16 HG12 VAL 16 -1.625 6.027 -1.649
155 HG13 VAL 16 HG13 VAL 16 -3.196 6.769 -1.944
156 HG21 VAL 16 HG21 VAL 16 -2.986 9.383 0.550
157 HG22 VAL 16 HG22 VAL 16 -3.894 7.905 0.846
158 HG23 VAL 16 HG23 VAL 16 -3.940 8.659 -0.742
159 H ILE 17 H ILE 17 -3.686 6.463 1.252
160 HA ILE 17 HA ILE 17 -3.530 4.634 3.301
161 HB ILE 17 HB ILE 17 -5.672 5.414 2.542
162 HG12 ILE 17 HG13 ILE 17 -6.926 3.287 2.309
163 HG13 ILE 17 HG12 ILE 17 -5.407 2.444 2.030
164 HG21 ILE 17 HG21 ILE 17 -5.125 3.968 -0.045
165 HG22 ILE 17 HG22 ILE 17 -5.185 5.714 0.188
166 HG23 ILE 17 HG23 ILE 17 -6.646 4.749 0.391
167 HD11 ILE 17 HD11 ILE 17 -4.665 3.177 4.283
168 HD12 ILE 17 HD12 ILE 17 -6.063 2.101 4.289
169 HD13 ILE 17 HD13 ILE 17 -6.280 3.833 4.547
170 H THR 18 H THR 18 -2.811 4.197 -0.104
171 HA THR 18 HA THR 18 -2.631 1.454 -0.298
172 HB THR 18 HB THR 18 -0.758 3.459 -1.566
173 HG1 THR 18 HG1 THR 18 -3.453 3.011 -1.897
174 HG21 THR 18 HG21 THR 18 -0.038 1.175 -1.863
175 HG22 THR 18 HG22 THR 18 -0.693 1.798 -3.373
176 HG23 THR 18 HG23 THR 18 -1.655 0.700 -2.388
177 H SER 19 H SER 19 0.117 3.679 0.242
178 HA SER 19 HA SER 19 1.724 1.538 1.300
179 HB2 SER 19 HB3 SER 19 3.375 3.420 1.646
180 HB3 SER 19 HB2 SER 19 2.807 3.231 -0.012
181 HG SER 19 HG SER 19 2.169 5.210 1.879
182 H HIS 20 H HIS 20 -0.358 1.432 2.910
183 HA HIS 20 HA HIS 20 0.117 3.117 5.234
184 HB2 HIS 20 HB3 HIS 20 -2.210 2.491 4.340
185 HB3 HIS 20 HB2 HIS 20 -1.926 0.919 5.081
186 HD1 HIS 20 HD1 HIS 20 -0.885 4.184 6.669
187 HD2 HIS 20 HD2 HIS 20 -3.745 1.199 7.133
188 HE1 HIS 20 HE1 HIS 20 -2.005 4.652 8.871
189 HE2 HIS 20 HE2 HIS 20 -3.669 2.786 9.172
190 H ILE 21 H ILE 21 -0.443 -0.413 4.955
191 HA ILE 21 HA ILE 21 1.566 -0.746 7.077
192 HB ILE 21 HB ILE 21 -0.661 -1.696 7.566
193 HG12 ILE 21 HG13 ILE 21 0.088 -3.960 8.223
194 HG13 ILE 21 HG12 ILE 21 1.507 -3.771 7.198
195 HG21 ILE 21 HG21 ILE 21 -1.416 -3.711 6.364
196 HG22 ILE 21 HG22 ILE 21 -0.114 -3.472 5.197
197 HG23 ILE 21 HG23 ILE 21 -1.398 -2.271 5.347
198 HD11 ILE 21 HD11 ILE 21 0.843 -2.064 9.582
199 HD12 ILE 21 HD12 ILE 21 2.291 -1.948 8.583
200 HD13 ILE 21 HD13 ILE 21 2.005 -3.389 9.557
201 H ASP 22 H ASP 22 0.921 -1.265 3.797
202 HA ASP 22 HA ASP 22 2.029 -2.149 2.055
203 HB2 ASP 22 HB3 ASP 22 4.540 -2.380 3.678
204 HB3 ASP 22 HB2 ASP 22 4.342 -1.922 1.997
205 H LYS 23 H LYS 23 3.684 -4.076 1.453
206 HA LYS 23 HA LYS 23 3.032 -6.351 3.203
207 HB2 LYS 23 HB3 LYS 23 4.105 -7.743 1.414
208 HB3 LYS 23 HB2 LYS 23 2.679 -6.867 0.892
209 HG2 LYS 23 HG3 LYS 23 4.079 -6.544 -0.880
210 HG3 LYS 23 HG2 LYS 23 4.406 -5.100 0.074
211 HD2 LYS 23 HD3 LYS 23 6.360 -6.299 1.062
212 HD3 LYS 23 HD2 LYS 23 6.063 -7.609 -0.083
213 HE2 LYS 23 HE3 LYS 23 6.207 -5.847 -1.906
214 HE3 LYS 23 HE2 LYS 23 6.848 -4.752 -0.664
215 HZ1 LYS 23 HZ1 LYS 23 8.634 -5.830 -1.882
216 HZ2 LYS 23 HZ2 LYS 23 8.029 -7.362 -1.498
217 HZ3 LYS 23 HZ3 LYS 23 8.640 -6.366 -0.279
218 H VAL 24 H VAL 24 5.403 -4.090 2.507
219 HA VAL 24 HA VAL 24 6.905 -4.638 4.784
220 HB VAL 24 HB VAL 24 7.664 -6.546 3.152
221 HG11 VAL 24 HG11 VAL 24 9.545 -5.946 1.717
222 HG12 VAL 24 HG12 VAL 24 9.277 -4.241 2.084
223 HG13 VAL 24 HG13 VAL 24 8.054 -5.157 1.205
224 HG21 VAL 24 HG21 VAL 24 9.651 -4.803 4.594
225 HG22 VAL 24 HG22 VAL 24 9.937 -6.462 4.072
226 HG23 VAL 24 HG23 VAL 24 8.708 -6.121 5.288
227 H LEU 25 H LEU 25 8.930 -3.153 4.746
228 HA LEU 25 HA LEU 25 7.942 -0.653 3.752
229 HB2 LEU 25 HB3 LEU 25 10.217 0.154 4.840
230 HB3 LEU 25 HB2 LEU 25 8.782 -0.172 5.780
231 HG LEU 25 HG LEU 25 10.962 -0.991 6.741
232 HD11 LEU 25 HD11 LEU 25 8.917 -1.824 7.627
233 HD12 LEU 25 HD12 LEU 25 10.036 -3.177 7.462
234 HD13 LEU 25 HD13 LEU 25 8.732 -2.960 6.296
235 HD21 LEU 25 HD21 LEU 25 11.828 -3.138 5.911
236 HD22 LEU 25 HD22 LEU 25 12.032 -1.827 4.750
237 HD23 LEU 25 HD23 LEU 25 10.750 -3.014 4.521
238 H ARG 26 H ARG 26 8.313 -1.835 1.509
239 HA ARG 26 HA ARG 26 10.849 -0.800 0.472
240 HB2 ARG 26 HB3 ARG 26 10.295 -2.084 -1.599
241 HB3 ARG 26 HB2 ARG 26 10.575 -3.054 -0.165
242 HG2 ARG 26 HG3 ARG 26 8.753 -4.048 -1.216
243 HG3 ARG 26 HG2 ARG 26 8.053 -3.116 0.104
244 HD2 ARG 26 HD3 ARG 26 6.718 -2.858 -1.893
245 HD3 ARG 26 HD2 ARG 26 7.486 -1.326 -1.486
246 HE ARG 26 HE ARG 26 9.209 -2.365 -3.265
247 HH11 ARG 26 HH11 ARG 26 5.719 -2.061 -3.338
248 HH12 ARG 26 HH12 ARG 26 5.651 -1.817 -5.056
249 HH21 ARG 26 HH22 ARG 26 9.111 -2.078 -5.534
250 HH22 ARG 26 HH21 ARG 26 7.573 -1.860 -6.305
251 HA PRO 27 HA PRO 27 7.340 1.197 -2.233
252 HB2 PRO 27 HB2 PRO 27 5.506 2.599 -0.780
253 HB3 PRO 27 HB3 PRO 27 5.240 0.939 -1.345
254 HG2 PRO 27 HG3 PRO 27 6.108 1.912 1.349
255 HG3 PRO 27 HG2 PRO 27 4.949 0.637 0.942
256 HD2 PRO 27 HD3 PRO 27 7.486 0.101 1.701
257 HD3 PRO 27 HD2 PRO 27 6.608 -0.917 0.545
258 H GLN 28 H GLN 28 7.287 3.000 0.820
259 HA GLN 28 HA GLN 28 8.967 5.067 -0.424
260 HB2 GLN 28 HB3 GLN 28 6.913 5.566 1.733
261 HB3 GLN 28 HB2 GLN 28 7.740 6.754 0.739
262 HG2 GLN 28 HG3 GLN 28 5.641 4.793 -0.163
263 HG3 GLN 28 HG2 GLN 28 5.451 6.536 0.024
264 HE21 GLN 28 HE22 GLN 28 8.053 7.147 -1.129
265 HE22 GLN 28 HE21 GLN 28 7.904 6.874 -2.829
266 H GLY 29 H GLY 29 9.435 2.626 1.311
267 HA2 GLY 29 HA3 GLY 29 10.473 3.839 3.764
268 HA3 GLY 29 HA2 GLY 29 10.299 2.115 3.450
Start of MODEL 12
1 H1 ARG 1 H1 ARG 1 -11.951 3.067 1.398
2 H2 ARG 1 H2 ARG 1 -12.625 3.922 0.106
3 H3 ARG 1 H3 ARG 1 -11.023 3.394 0.023
4 HA ARG 1 HA ARG 1 -13.425 1.670 0.131
5 HB2 ARG 1 HB3 ARG 1 -12.958 1.113 -2.171
6 HB3 ARG 1 HB2 ARG 1 -13.083 2.859 -2.029
7 HG2 ARG 1 HG3 ARG 1 -10.590 2.948 -1.956
8 HG3 ARG 1 HG2 ARG 1 -10.577 1.222 -2.317
9 HD2 ARG 1 HD3 ARG 1 -10.276 2.392 -4.367
10 HD3 ARG 1 HD2 ARG 1 -11.913 1.733 -4.367
11 HE ARG 1 HE ARG 1 -12.237 4.240 -3.382
12 HH11 ARG 1 HH12 ARG 1 -10.757 2.933 -6.273
13 HH12 ARG 1 HH11 ARG 1 -11.054 4.358 -7.223
14 HH21 ARG 1 HH21 ARG 1 -12.634 6.113 -4.622
15 HH22 ARG 1 HH22 ARG 1 -12.118 6.170 -6.277
16 H LYS 2 H LYS 2 -9.897 1.914 0.039
17 HA LYS 2 HA LYS 2 -8.236 0.470 0.569
18 HB2 LYS 2 HB3 LYS 2 -10.352 -0.917 2.223
19 HB3 LYS 2 HB2 LYS 2 -8.607 -1.057 2.417
20 HG2 LYS 2 HG3 LYS 2 -8.438 1.209 3.148
21 HG3 LYS 2 HG2 LYS 2 -10.124 1.519 2.755
22 HD2 LYS 2 HD3 LYS 2 -10.799 -0.134 4.454
23 HD3 LYS 2 HD2 LYS 2 -9.101 -0.362 4.876
24 HE2 LYS 2 HE3 LYS 2 -10.153 1.157 6.444
25 HE3 LYS 2 HE2 LYS 2 -8.949 2.013 5.485
26 HZ1 LYS 2 HZ1 LYS 2 -11.883 2.065 5.025
27 HZ2 LYS 2 HZ2 LYS 2 -10.729 2.886 4.100
28 HZ3 LYS 2 HZ3 LYS 2 -10.970 3.306 5.719
29 H CYS 3 H CYS 3 -7.980 -0.393 -1.518
30 HA CYS 3 HA CYS 3 -9.418 -2.679 -2.439
31 HB2 CYS 3 HB3 CYS 3 -6.738 -2.374 -3.554
32 HB3 CYS 3 HB2 CYS 3 -8.300 -2.308 -4.360
33 H ASN 4 H ASN 4 -7.346 -2.353 0.030
34 HA ASN 4 HA ASN 4 -6.245 -3.739 1.396
35 HB2 ASN 4 HB3 ASN 4 -7.428 -5.885 -0.365
36 HB3 ASN 4 HB2 ASN 4 -6.468 -6.228 1.070
37 HD21 ASN 4 HD22 ASN 4 -9.217 -6.920 0.560
38 HD22 ASN 4 HD21 ASN 4 -10.158 -6.158 1.801
39 H PHE 5 H PHE 5 -5.534 -6.186 -0.903
40 HA PHE 5 HA PHE 5 -2.768 -5.736 -0.599
41 HB2 PHE 5 HB3 PHE 5 -2.518 -7.478 -2.365
42 HB3 PHE 5 HB2 PHE 5 -3.517 -7.957 -1.002
43 HD1 PHE 5 HD1 PHE 5 -5.979 -8.109 -1.272
44 HD2 PHE 5 HD2 PHE 5 -3.404 -7.324 -4.566
45 HE1 PHE 5 HE1 PHE 5 -7.790 -8.700 -2.827
46 HE2 PHE 5 HE2 PHE 5 -5.209 -7.913 -6.125
47 HZ PHE 5 HZ PHE 5 -7.407 -8.601 -5.256
48 H LEU 6 H LEU 6 -1.258 -4.958 -1.945
49 HA LEU 6 HA LEU 6 -0.390 -3.315 -3.244
50 HB2 LEU 6 HB3 LEU 6 -2.273 -4.635 -5.191
51 HB3 LEU 6 HB2 LEU 6 -1.121 -3.406 -5.664
52 HG LEU 6 HG LEU 6 -0.197 -5.508 -6.253
53 HD11 LEU 6 HD11 LEU 6 1.112 -4.398 -3.778
54 HD12 LEU 6 HD12 LEU 6 1.503 -4.087 -5.473
55 HD13 LEU 6 HD13 LEU 6 1.826 -5.672 -4.772
56 HD21 LEU 6 HD21 LEU 6 -1.514 -6.996 -4.929
57 HD22 LEU 6 HD22 LEU 6 -0.779 -6.403 -3.441
58 HD23 LEU 6 HD23 LEU 6 0.189 -7.308 -4.602
59 H CYS 7 H CYS 7 -1.954 -2.049 -1.590
60 HA CYS 7 HA CYS 7 -2.984 0.188 -2.940
61 HB2 CYS 7 HB3 CYS 7 -4.768 -1.221 -3.767
62 HB3 CYS 7 HB2 CYS 7 -5.102 -1.822 -2.147
63 H LYS 8 H LYS 8 -3.120 -1.860 -0.124
64 HA LYS 8 HA LYS 8 -2.632 0.409 1.595
65 HB2 LYS 8 HB3 LYS 8 -5.053 0.456 1.509
66 HB3 LYS 8 HB2 LYS 8 -5.139 -1.266 1.843
67 HG2 LYS 8 HG3 LYS 8 -4.336 -0.928 4.080
68 HG3 LYS 8 HG2 LYS 8 -4.047 0.784 3.757
69 HD2 LYS 8 HD3 LYS 8 -6.399 1.173 3.452
70 HD3 LYS 8 HD2 LYS 8 -6.743 -0.549 3.592
71 HE2 LYS 8 HE3 LYS 8 -5.501 1.097 5.780
72 HE3 LYS 8 HE2 LYS 8 -7.237 0.817 5.629
73 HZ1 LYS 8 HZ1 LYS 8 -6.238 -0.734 7.171
74 HZ2 LYS 8 HZ2 LYS 8 -5.157 -1.275 5.990
75 HZ3 LYS 8 HZ3 LYS 8 -6.812 -1.563 5.813
76 H LEU 9 H LEU 9 -3.019 -2.979 1.037
77 HA LEU 9 HA LEU 9 -1.722 -3.705 3.540
78 HB2 LEU 9 HB3 LEU 9 -3.375 -5.059 1.517
79 HB3 LEU 9 HB2 LEU 9 -2.151 -6.049 2.296
80 HG LEU 9 HG LEU 9 -3.099 -5.528 4.499
81 HD11 LEU 9 HD11 LEU 9 -5.235 -4.377 4.694
82 HD12 LEU 9 HD12 LEU 9 -5.217 -4.036 2.966
83 HD13 LEU 9 HD13 LEU 9 -3.998 -3.318 4.017
84 HD21 LEU 9 HD21 LEU 9 -5.109 -6.565 2.509
85 HD22 LEU 9 HD22 LEU 9 -5.190 -6.785 4.257
86 HD23 LEU 9 HD23 LEU 9 -3.870 -7.508 3.337
87 H LYS 10 H LYS 10 -1.329 -4.980 0.190
88 HA LYS 10 HA LYS 10 1.327 -5.762 0.735
89 HB2 LYS 10 HB3 LYS 10 -0.236 -6.658 -1.088
90 HB3 LYS 10 HB2 LYS 10 0.317 -5.300 -2.048
91 HG2 LYS 10 HG3 LYS 10 1.637 -7.163 -2.650
92 HG3 LYS 10 HG2 LYS 10 2.654 -6.084 -1.695
93 HD2 LYS 10 HD3 LYS 10 3.041 -8.354 -0.989
94 HD3 LYS 10 HD2 LYS 10 2.192 -7.493 0.297
95 HE2 LYS 10 HE3 LYS 10 1.172 -9.632 0.089
96 HE3 LYS 10 HE2 LYS 10 0.057 -8.449 -0.596
97 HZ1 LYS 10 HZ1 LYS 10 0.153 -10.320 -2.037
98 HZ2 LYS 10 HZ2 LYS 10 1.843 -10.289 -2.087
99 HZ3 LYS 10 HZ3 LYS 10 0.956 -9.051 -2.813
100 H GLU 11 H GLU 11 0.623 -3.496 -1.956
101 HA GLU 11 HA GLU 11 1.806 -1.218 -0.991
102 HB2 GLU 11 HB3 GLU 11 4.098 -1.272 -1.822
103 HB3 GLU 11 HB2 GLU 11 3.863 -2.641 -0.740
104 HG2 GLU 11 HG3 GLU 11 3.449 -4.061 -2.751
105 HG3 GLU 11 HG2 GLU 11 3.903 -2.685 -3.749
106 H LYS 12 H LYS 12 2.737 0.192 -2.784
107 HA LYS 12 HA LYS 12 2.989 -0.263 -5.393
108 HB2 LYS 12 HB3 LYS 12 0.970 0.356 -6.579
109 HB3 LYS 12 HB2 LYS 12 0.668 -1.045 -5.578
110 HG2 LYS 12 HG3 LYS 12 -1.240 0.164 -5.255
111 HG3 LYS 12 HG2 LYS 12 -0.267 0.699 -3.888
112 HD2 LYS 12 HD3 LYS 12 -1.418 2.561 -5.022
113 HD3 LYS 12 HD2 LYS 12 0.337 2.730 -5.061
114 HE2 LYS 12 HE3 LYS 12 -0.751 3.306 -7.210
115 HE3 LYS 12 HE2 LYS 12 0.399 1.983 -7.358
116 HZ1 LYS 12 HZ1 LYS 12 -1.415 0.419 -7.383
117 HZ2 LYS 12 HZ2 LYS 12 -1.670 1.584 -8.579
118 HZ3 LYS 12 HZ3 LYS 12 -2.545 1.652 -7.137
119 H LEU 13 H LEU 13 3.121 1.654 -6.714
120 HA LEU 13 HA LEU 13 4.321 3.752 -5.286
121 HB2 LEU 13 HB3 LEU 13 3.481 3.448 -8.157
122 HB3 LEU 13 HB2 LEU 13 4.196 4.934 -7.574
123 HG LEU 13 HG LEU 13 5.871 3.594 -8.676
124 HD11 LEU 13 HD11 LEU 13 6.624 4.924 -6.812
125 HD12 LEU 13 HD12 LEU 13 7.531 3.413 -6.879
126 HD13 LEU 13 HD13 LEU 13 6.246 3.619 -5.692
127 HD21 LEU 13 HD21 LEU 13 5.201 1.440 -6.677
128 HD22 LEU 13 HD22 LEU 13 6.551 1.403 -7.812
129 HD23 LEU 13 HD23 LEU 13 4.894 1.393 -8.414
130 H ARG 14 H ARG 14 3.077 4.919 -3.898
131 HA ARG 14 HA ARG 14 1.370 6.886 -5.069
132 HB2 ARG 14 HB3 ARG 14 -0.182 4.948 -4.949
133 HB3 ARG 14 HB2 ARG 14 0.050 4.906 -3.207
134 HG2 ARG 14 HG3 ARG 14 -2.039 6.024 -3.882
135 HG3 ARG 14 HG2 ARG 14 -0.959 7.074 -2.965
136 HD2 ARG 14 HD3 ARG 14 -1.978 8.221 -4.889
137 HD3 ARG 14 HD2 ARG 14 -0.222 8.157 -4.995
138 HE ARG 14 HE ARG 14 -1.723 6.087 -6.396
139 HH11 ARG 14 HH11 ARG 14 0.065 9.094 -6.555
140 HH12 ARG 14 HH12 ARG 14 0.355 8.980 -8.262
141 HH21 ARG 14 HH22 ARG 14 -1.362 5.935 -8.643
142 HH22 ARG 14 HH21 ARG 14 -0.452 7.171 -9.452
143 H THR 15 H THR 15 2.255 5.265 -2.034
144 HA THR 15 HA THR 15 2.674 6.009 0.044
145 HB THR 15 HB THR 15 3.682 8.415 -1.471
146 HG1 THR 15 HG1 THR 15 5.706 7.318 -1.018
147 HG21 THR 15 HG21 THR 15 4.463 7.613 1.316
148 HG22 THR 15 HG22 THR 15 3.128 8.721 1.005
149 HG23 THR 15 HG23 THR 15 4.757 9.139 0.482
150 H VAL 16 H VAL 16 0.904 6.182 1.164
151 HA VAL 16 HA VAL 16 -0.300 8.405 2.120
152 HB VAL 16 HB VAL 16 -0.854 8.907 -0.286
153 HG11 VAL 16 HG11 VAL 16 -2.783 6.615 -0.064
154 HG12 VAL 16 HG12 VAL 16 -1.330 6.656 -1.059
155 HG13 VAL 16 HG13 VAL 16 -2.665 7.757 -1.401
156 HG21 VAL 16 HG21 VAL 16 -2.082 10.069 1.352
157 HG22 VAL 16 HG22 VAL 16 -3.100 8.673 1.694
158 HG23 VAL 16 HG23 VAL 16 -3.250 9.512 0.154
159 H ILE 17 H ILE 17 -3.152 7.123 1.661
160 HA ILE 17 HA ILE 17 -3.241 5.254 3.703
161 HB ILE 17 HB ILE 17 -5.301 6.144 2.972
162 HG12 ILE 17 HG13 ILE 17 -5.140 3.529 3.422
163 HG13 ILE 17 HG12 ILE 17 -6.656 4.291 2.962
164 HG21 ILE 17 HG21 ILE 17 -6.205 5.834 0.693
165 HG22 ILE 17 HG22 ILE 17 -4.665 5.116 0.218
166 HG23 ILE 17 HG23 ILE 17 -4.729 6.798 0.744
167 HD11 ILE 17 HD11 ILE 17 -6.410 3.543 0.696
168 HD12 ILE 17 HD12 ILE 17 -6.190 2.164 1.773
169 HD13 ILE 17 HD13 ILE 17 -4.789 2.935 1.029
170 H THR 18 H THR 18 -2.325 4.903 0.373
171 HA THR 18 HA THR 18 -2.394 2.140 0.074
172 HB THR 18 HB THR 18 -0.451 4.116 -1.125
173 HG1 THR 18 HG1 THR 18 -3.082 3.306 -1.730
174 HG21 THR 18 HG21 THR 18 -1.237 1.350 -2.040
175 HG22 THR 18 HG22 THR 18 0.317 1.797 -1.339
176 HG23 THR 18 HG23 THR 18 -0.170 2.461 -2.898
177 H SER 19 H SER 19 0.443 4.136 0.838
178 HA SER 19 HA SER 19 1.950 1.823 1.644
179 HB2 SER 19 HB3 SER 19 3.745 3.519 2.029
180 HB3 SER 19 HB2 SER 19 3.055 3.591 0.412
181 HG SER 19 HG SER 19 3.011 5.452 2.422
182 H HIS 20 H HIS 20 -0.344 2.206 3.182
183 HA HIS 20 HA HIS 20 0.227 3.412 5.708
184 HB2 HIS 20 HB3 HIS 20 -2.083 2.909 4.784
185 HB3 HIS 20 HB2 HIS 20 -1.765 1.209 5.101
186 HD1 HIS 20 HD1 HIS 20 -2.254 4.480 6.922
187 HD2 HIS 20 HD2 HIS 20 -2.212 0.396 7.687
188 HE1 HIS 20 HE1 HIS 20 -3.085 4.228 9.279
189 HE2 HIS 20 HE2 HIS 20 -3.167 1.742 9.679
190 H ILE 21 H ILE 21 -0.161 0.030 4.737
191 HA ILE 21 HA ILE 21 2.281 -0.612 6.231
192 HB ILE 21 HB ILE 21 1.388 -2.854 6.736
193 HG12 ILE 21 HG13 ILE 21 -1.301 -1.791 5.854
194 HG13 ILE 21 HG12 ILE 21 -0.295 -2.845 4.866
195 HG21 ILE 21 HG21 ILE 21 -0.165 -2.206 8.532
196 HG22 ILE 21 HG22 ILE 21 -0.295 -0.599 7.817
197 HG23 ILE 21 HG23 ILE 21 1.251 -1.157 8.453
198 HD11 ILE 21 HD11 ILE 21 -1.436 -3.526 7.565
199 HD12 ILE 21 HD12 ILE 21 -0.440 -4.582 6.564
200 HD13 ILE 21 HD13 ILE 21 -2.039 -4.089 6.006
201 H ASP 22 H ASP 22 3.509 -2.311 5.206
202 HA ASP 22 HA ASP 22 2.745 -2.675 2.388
203 HB2 ASP 22 HB3 ASP 22 5.573 -2.388 3.427
204 HB3 ASP 22 HB2 ASP 22 5.077 -2.533 1.747
205 H LYS 23 H LYS 23 4.249 -4.467 1.410
206 HA LYS 23 HA LYS 23 3.832 -6.950 2.463
207 HB2 LYS 23 HB3 LYS 23 5.702 -7.770 1.121
208 HB3 LYS 23 HB2 LYS 23 4.756 -6.602 0.220
209 HG2 LYS 23 HG3 LYS 23 7.439 -6.128 1.513
210 HG3 LYS 23 HG2 LYS 23 7.109 -6.285 -0.212
211 HD2 LYS 23 HD3 LYS 23 5.572 -4.280 0.061
212 HD3 LYS 23 HD2 LYS 23 6.302 -4.070 1.649
213 HE2 LYS 23 HE3 LYS 23 7.619 -3.900 -1.038
214 HE3 LYS 23 HE2 LYS 23 7.425 -2.631 0.167
215 HZ1 LYS 23 HZ1 LYS 23 9.674 -3.487 0.145
216 HZ2 LYS 23 HZ2 LYS 23 9.121 -5.052 0.448
217 HZ3 LYS 23 HZ3 LYS 23 8.939 -3.845 1.619
218 H VAL 24 H VAL 24 6.501 -4.775 3.200
219 HA VAL 24 HA VAL 24 6.732 -6.147 5.775
220 HB VAL 24 HB VAL 24 9.074 -5.008 4.236
221 HG11 VAL 24 HG11 VAL 24 9.295 -4.612 6.622
222 HG12 VAL 24 HG12 VAL 24 10.432 -5.855 6.100
223 HG13 VAL 24 HG13 VAL 24 8.957 -6.311 6.952
224 HG21 VAL 24 HG21 VAL 24 9.911 -7.315 4.214
225 HG22 VAL 24 HG22 VAL 24 8.380 -7.164 3.352
226 HG23 VAL 24 HG23 VAL 24 8.413 -7.856 4.973
227 H LEU 25 H LEU 25 8.275 -3.242 4.384
228 HA LEU 25 HA LEU 25 6.438 -1.372 5.380
229 HB2 LEU 25 HB3 LEU 25 7.336 -2.190 7.568
230 HB3 LEU 25 HB2 LEU 25 8.922 -1.625 7.081
231 HG LEU 25 HG LEU 25 7.954 0.688 6.903
232 HD11 LEU 25 HD11 LEU 25 5.614 0.074 6.663
233 HD12 LEU 25 HD12 LEU 25 5.850 1.127 8.058
234 HD13 LEU 25 HD13 LEU 25 5.614 -0.605 8.293
235 HD21 LEU 25 HD21 LEU 25 7.953 1.072 9.320
236 HD22 LEU 25 HD22 LEU 25 9.270 0.011 8.825
237 HD23 LEU 25 HD23 LEU 25 7.833 -0.665 9.592
238 H ARG 26 H ARG 26 6.899 -0.577 3.248
239 HA ARG 26 HA ARG 26 9.072 1.280 3.197
240 HB2 ARG 26 HB3 ARG 26 10.373 -0.547 2.468
241 HB3 ARG 26 HB2 ARG 26 9.076 -1.196 1.482
242 HG2 ARG 26 HG3 ARG 26 10.070 1.469 0.716
243 HG3 ARG 26 HG2 ARG 26 11.184 0.116 0.491
244 HD2 ARG 26 HD3 ARG 26 9.656 -1.030 -0.904
245 HD3 ARG 26 HD2 ARG 26 8.329 0.054 -0.454
246 HE ARG 26 HE ARG 26 10.051 1.751 -1.609
247 HH11 ARG 26 HH11 ARG 26 8.918 -1.390 -2.648
248 HH12 ARG 26 HH12 ARG 26 9.061 -1.024 -4.334
249 HH21 ARG 26 HH22 ARG 26 10.245 2.234 -3.844
250 HH22 ARG 26 HH21 ARG 26 9.806 1.030 -5.015
251 HA PRO 27 HA PRO 27 5.477 3.037 0.949
252 HB2 PRO 27 HB2 PRO 27 7.132 5.415 1.684
253 HB3 PRO 27 HB3 PRO 27 5.372 5.188 1.782
254 HG2 PRO 27 HG3 PRO 27 6.811 5.098 3.995
255 HG3 PRO 27 HG2 PRO 27 5.517 3.904 3.730
256 HD2 PRO 27 HD3 PRO 27 8.491 3.585 3.377
257 HD3 PRO 27 HD2 PRO 27 7.327 2.482 4.144
258 H GLN 28 H GLN 28 5.669 4.757 -0.897
259 HA GLN 28 HA GLN 28 8.007 4.703 -2.454
260 HB2 GLN 28 HB3 GLN 28 7.172 2.997 -4.137
261 HB3 GLN 28 HB2 GLN 28 7.774 2.354 -2.619
262 HG2 GLN 28 HG3 GLN 28 5.372 2.287 -1.838
263 HG3 GLN 28 HG2 GLN 28 4.916 2.616 -3.509
264 HE21 GLN 28 HE22 GLN 28 6.221 0.310 -1.285
265 HE22 GLN 28 HE21 GLN 28 6.170 -1.063 -2.352
266 H GLY 29 H GLY 29 7.372 6.788 -2.818
267 HA2 GLY 29 HA3 GLY 29 6.453 7.683 -5.079
268 HA3 GLY 29 HA2 GLY 29 4.915 7.220 -4.361
Start of MODEL 13
1 H1 ARG 1 H1 ARG 1 -9.164 4.116 1.317
2 H2 ARG 1 H2 ARG 1 -10.632 3.330 1.620
3 H3 ARG 1 H3 ARG 1 -10.582 4.654 0.572
4 HA ARG 1 HA ARG 1 -10.764 2.534 -0.593
5 HB2 ARG 1 HB3 ARG 1 -8.252 4.163 -0.986
6 HB3 ARG 1 HB2 ARG 1 -8.762 2.906 -2.104
7 HG2 ARG 1 HG3 ARG 1 -10.368 5.353 -1.394
8 HG3 ARG 1 HG2 ARG 1 -9.404 5.148 -2.856
9 HD2 ARG 1 HD3 ARG 1 -10.791 3.319 -3.576
10 HD3 ARG 1 HD2 ARG 1 -11.681 3.341 -2.058
11 HE ARG 1 HE ARG 1 -11.859 5.854 -3.361
12 HH11 ARG 1 HH12 ARG 1 -13.055 2.569 -3.532
13 HH12 ARG 1 HH11 ARG 1 -14.566 3.017 -4.252
14 HH21 ARG 1 HH21 ARG 1 -13.865 6.453 -4.307
15 HH22 ARG 1 HH22 ARG 1 -15.028 5.222 -4.686
16 H LYS 2 H LYS 2 -10.624 0.590 0.360
17 HA LYS 2 HA LYS 2 -7.927 -0.370 1.049
18 HB2 LYS 2 HB3 LYS 2 -10.590 -1.218 2.205
19 HB3 LYS 2 HB2 LYS 2 -9.029 -1.920 2.615
20 HG2 LYS 2 HG3 LYS 2 -8.309 0.030 3.692
21 HG3 LYS 2 HG2 LYS 2 -9.598 1.004 2.989
22 HD2 LYS 2 HD3 LYS 2 -10.090 0.564 5.311
23 HD3 LYS 2 HD2 LYS 2 -11.240 -0.307 4.299
24 HE2 LYS 2 HE3 LYS 2 -9.996 -2.364 4.614
25 HE3 LYS 2 HE2 LYS 2 -8.770 -1.507 5.547
26 HZ1 LYS 2 HZ1 LYS 2 -11.624 -1.792 6.319
27 HZ2 LYS 2 HZ2 LYS 2 -10.424 -1.012 7.219
28 HZ3 LYS 2 HZ3 LYS 2 -10.342 -2.678 6.969
29 H CYS 3 H CYS 3 -7.798 -0.851 -1.252
30 HA CYS 3 HA CYS 3 -9.429 -2.996 -2.303
31 HB2 CYS 3 HB3 CYS 3 -6.973 -2.343 -3.761
32 HB3 CYS 3 HB2 CYS 3 -8.641 -2.340 -4.318
33 H ASN 4 H ASN 4 -7.945 -3.597 0.071
34 HA ASN 4 HA ASN 4 -6.628 -5.175 0.998
35 HB2 ASN 4 HB3 ASN 4 -6.948 -6.482 -1.713
36 HB3 ASN 4 HB2 ASN 4 -6.220 -7.268 -0.317
37 HD21 ASN 4 HD22 ASN 4 -7.513 -7.929 1.374
38 HD22 ASN 4 HD21 ASN 4 -9.235 -8.002 1.251
39 H PHE 5 H PHE 5 -4.932 -6.561 -1.438
40 HA PHE 5 HA PHE 5 -2.514 -5.244 -0.651
41 HB2 PHE 5 HB3 PHE 5 -1.547 -6.852 -2.424
42 HB3 PHE 5 HB2 PHE 5 -2.236 -7.533 -0.958
43 HD1 PHE 5 HD2 PHE 5 -2.789 -6.989 -4.558
44 HD2 PHE 5 HD1 PHE 5 -4.182 -8.902 -1.024
45 HE1 PHE 5 HE2 PHE 5 -4.299 -8.377 -5.909
46 HE2 PHE 5 HE1 PHE 5 -5.694 -10.294 -2.371
47 HZ PHE 5 HZ PHE 5 -5.756 -10.033 -4.818
48 H LEU 6 H LEU 6 -1.017 -4.199 -2.058
49 HA LEU 6 HA LEU 6 -0.470 -2.545 -3.479
50 HB2 LEU 6 HB3 LEU 6 -2.380 -4.032 -5.280
51 HB3 LEU 6 HB2 LEU 6 -1.466 -2.636 -5.807
52 HG LEU 6 HG LEU 6 -0.216 -4.410 -6.613
53 HD11 LEU 6 HD11 LEU 6 1.023 -3.923 -3.913
54 HD12 LEU 6 HD12 LEU 6 1.161 -2.849 -5.306
55 HD13 LEU 6 HD13 LEU 6 1.839 -4.474 -5.377
56 HD21 LEU 6 HD21 LEU 6 -1.367 -6.244 -5.616
57 HD22 LEU 6 HD22 LEU 6 -0.738 -5.838 -4.019
58 HD23 LEU 6 HD23 LEU 6 0.353 -6.419 -5.276
59 H CYS 7 H CYS 7 -2.391 -2.019 -1.538
60 HA CYS 7 HA CYS 7 -3.557 0.360 -2.568
61 HB2 CYS 7 HB3 CYS 7 -5.201 -1.248 -3.463
62 HB3 CYS 7 HB2 CYS 7 -5.523 -1.812 -1.826
63 H LYS 8 H LYS 8 -3.494 -2.033 0.066
64 HA LYS 8 HA LYS 8 -2.776 0.143 1.848
65 HB2 LYS 8 HB3 LYS 8 -5.257 0.020 1.983
66 HB3 LYS 8 HB2 LYS 8 -5.128 -1.668 2.446
67 HG2 LYS 8 HG3 LYS 8 -4.021 -1.056 4.508
68 HG3 LYS 8 HG2 LYS 8 -4.027 0.645 4.029
69 HD2 LYS 8 HD3 LYS 8 -6.483 0.602 3.973
70 HD3 LYS 8 HD2 LYS 8 -6.458 -1.078 4.501
71 HE2 LYS 8 HE3 LYS 8 -5.307 1.231 6.056
72 HE3 LYS 8 HE2 LYS 8 -6.905 0.541 6.325
73 HZ1 LYS 8 HZ1 LYS 8 -4.307 -0.852 6.653
74 HZ2 LYS 8 HZ2 LYS 8 -5.822 -1.590 6.813
75 HZ3 LYS 8 HZ3 LYS 8 -5.357 -0.370 7.886
76 H LEU 9 H LEU 9 -3.482 -3.255 1.399
77 HA LEU 9 HA LEU 9 -1.874 -4.183 3.584
78 HB2 LEU 9 HB3 LEU 9 -3.221 -5.504 1.251
79 HB3 LEU 9 HB2 LEU 9 -2.325 -6.409 2.467
80 HG LEU 9 HG LEU 9 -4.684 -4.641 3.110
81 HD11 LEU 9 HD11 LEU 9 -4.607 -7.626 2.720
82 HD12 LEU 9 HD12 LEU 9 -5.331 -6.453 1.616
83 HD13 LEU 9 HD13 LEU 9 -6.000 -6.670 3.235
84 HD21 LEU 9 HD21 LEU 9 -3.238 -6.767 4.689
85 HD22 LEU 9 HD22 LEU 9 -4.695 -5.921 5.208
86 HD23 LEU 9 HD23 LEU 9 -3.191 -5.029 4.985
87 H LYS 10 H LYS 10 -1.490 -4.017 0.077
88 HA LYS 10 HA LYS 10 1.393 -4.267 0.546
89 HB2 LYS 10 HB3 LYS 10 0.111 -6.191 -0.768
90 HB3 LYS 10 HB2 LYS 10 0.251 -5.058 -2.103
91 HG2 LYS 10 HG3 LYS 10 2.663 -5.013 -1.840
92 HG3 LYS 10 HG2 LYS 10 2.536 -6.129 -0.480
93 HD2 LYS 10 HD3 LYS 10 1.793 -6.673 -3.352
94 HD3 LYS 10 HD2 LYS 10 3.151 -7.361 -2.460
95 HE2 LYS 10 HE3 LYS 10 1.523 -8.407 -0.904
96 HE3 LYS 10 HE2 LYS 10 0.219 -7.805 -1.927
97 HZ1 LYS 10 HZ1 LYS 10 2.325 -9.752 -2.689
98 HZ2 LYS 10 HZ2 LYS 10 1.207 -9.092 -3.773
99 HZ3 LYS 10 HZ3 LYS 10 0.677 -10.062 -2.497
100 H GLU 11 H GLU 11 2.569 -3.204 -1.433
101 HA GLU 11 HA GLU 11 1.120 -0.754 -2.147
102 HB2 GLU 11 HB3 GLU 11 2.783 -0.854 0.005
103 HB3 GLU 11 HB2 GLU 11 3.921 -0.464 -1.259
104 HG2 GLU 11 HG3 GLU 11 1.473 1.129 -0.557
105 HG3 GLU 11 HG2 GLU 11 3.115 1.505 -0.069
106 H LYS 12 H LYS 12 2.416 0.517 -3.750
107 HA LYS 12 HA LYS 12 4.229 -1.137 -5.340
108 HB2 LYS 12 HB3 LYS 12 3.077 -0.418 -7.424
109 HB3 LYS 12 HB2 LYS 12 2.096 -1.456 -6.414
110 HG2 LYS 12 HG3 LYS 12 1.836 1.525 -6.434
111 HG3 LYS 12 HG2 LYS 12 0.955 0.473 -7.537
112 HD2 LYS 12 HD3 LYS 12 0.163 -0.739 -5.400
113 HD3 LYS 12 HD2 LYS 12 0.701 0.724 -4.555
114 HE2 LYS 12 HE3 LYS 12 -1.466 1.294 -5.013
115 HE3 LYS 12 HE2 LYS 12 -0.634 1.904 -6.444
116 HZ1 LYS 12 HZ1 LYS 12 -2.139 -0.639 -6.244
117 HZ2 LYS 12 HZ2 LYS 12 -1.234 -0.160 -7.592
118 HZ3 LYS 12 HZ3 LYS 12 -2.586 0.736 -7.117
119 H LEU 13 H LEU 13 2.765 2.100 -5.045
120 HA LEU 13 HA LEU 13 5.120 3.511 -4.673
121 HB2 LEU 13 HB3 LEU 13 5.497 2.645 -7.063
122 HB3 LEU 13 HB2 LEU 13 4.229 3.754 -7.544
123 HG LEU 13 HG LEU 13 5.573 5.646 -6.705
124 HD11 LEU 13 HD11 LEU 13 7.941 5.259 -6.145
125 HD12 LEU 13 HD12 LEU 13 7.651 3.521 -6.185
126 HD13 LEU 13 HD13 LEU 13 6.845 4.523 -4.978
127 HD21 LEU 13 HD21 LEU 13 7.259 5.603 -8.466
128 HD22 LEU 13 HD22 LEU 13 5.718 4.976 -9.052
129 HD23 LEU 13 HD23 LEU 13 7.028 3.865 -8.657
130 H ARG 14 H ARG 14 2.417 3.464 -3.807
131 HA ARG 14 HA ARG 14 1.018 5.664 -5.057
132 HB2 ARG 14 HB3 ARG 14 0.389 3.578 -3.101
133 HB3 ARG 14 HB2 ARG 14 -0.393 5.119 -2.792
134 HG2 ARG 14 HG3 ARG 14 -0.580 3.506 -5.321
135 HG3 ARG 14 HG2 ARG 14 -1.821 3.671 -4.076
136 HD2 ARG 14 HD3 ARG 14 -1.956 6.066 -4.527
137 HD3 ARG 14 HD2 ARG 14 -0.722 5.907 -5.774
138 HE ARG 14 HE ARG 14 -2.700 4.141 -6.487
139 HH11 ARG 14 HH11 ARG 14 -2.485 7.576 -5.881
140 HH12 ARG 14 HH12 ARG 14 -3.741 7.989 -7.002
141 HH21 ARG 14 HH22 ARG 14 -4.348 4.672 -7.988
142 HH22 ARG 14 HH21 ARG 14 -4.800 6.333 -8.207
143 H THR 15 H THR 15 2.730 5.080 -2.028
144 HA THR 15 HA THR 15 3.221 6.375 -0.257
145 HB THR 15 HB THR 15 4.895 7.227 -1.745
146 HG1 THR 15 HG1 THR 15 4.429 8.303 0.364
147 HG21 THR 15 HG21 THR 15 3.339 8.032 -3.548
148 HG22 THR 15 HG22 THR 15 4.678 9.109 -3.165
149 HG23 THR 15 HG23 THR 15 3.062 9.470 -2.565
150 H VAL 16 H VAL 16 1.113 6.176 0.468
151 HA VAL 16 HA VAL 16 -0.315 8.484 1.139
152 HB VAL 16 HB VAL 16 -0.702 8.336 -1.393
153 HG11 VAL 16 HG11 VAL 16 -1.173 5.766 -1.099
154 HG12 VAL 16 HG12 VAL 16 -1.951 6.715 -2.370
155 HG13 VAL 16 HG13 VAL 16 -2.831 6.335 -0.891
156 HG21 VAL 16 HG21 VAL 16 -2.050 9.765 0.002
157 HG22 VAL 16 HG22 VAL 16 -3.100 8.418 0.431
158 HG23 VAL 16 HG23 VAL 16 -3.058 9.006 -1.228
159 H ILE 17 H ILE 17 -2.963 6.948 0.958
160 HA ILE 17 HA ILE 17 -2.828 5.599 3.408
161 HB ILE 17 HB ILE 17 -4.928 6.467 2.562
162 HG12 ILE 17 HG13 ILE 17 -4.819 4.309 4.033
163 HG13 ILE 17 HG12 ILE 17 -6.356 4.818 3.351
164 HG21 ILE 17 HG21 ILE 17 -4.697 4.405 0.385
165 HG22 ILE 17 HG22 ILE 17 -4.641 6.159 0.206
166 HG23 ILE 17 HG23 ILE 17 -6.134 5.371 0.711
167 HD11 ILE 17 HD11 ILE 17 -6.118 2.440 3.149
168 HD12 ILE 17 HD12 ILE 17 -4.572 2.620 2.318
169 HD13 ILE 17 HD13 ILE 17 -6.061 3.166 1.545
170 H THR 18 H THR 18 -2.405 4.508 0.114
171 HA THR 18 HA THR 18 -2.407 1.759 0.409
172 HB THR 18 HB THR 18 -0.485 3.317 -1.335
173 HG1 THR 18 HG1 THR 18 -2.715 2.668 -2.647
174 HG21 THR 18 HG21 THR 18 -1.875 0.658 -1.716
175 HG22 THR 18 HG22 THR 18 -0.182 0.884 -1.302
176 HG23 THR 18 HG23 THR 18 -0.782 1.428 -2.866
177 H SER 19 H SER 19 0.332 3.985 0.598
178 HA SER 19 HA SER 19 2.183 2.016 1.473
179 HB2 SER 19 HB3 SER 19 2.495 5.006 1.680
180 HB3 SER 19 HB2 SER 19 3.751 3.798 1.446
181 HG SER 19 HG SER 19 3.105 3.483 -0.621
182 H HIS 20 H HIS 20 0.195 1.709 3.252
183 HA HIS 20 HA HIS 20 1.194 3.026 5.693
184 HB2 HIS 20 HB3 HIS 20 -1.486 1.924 4.964
185 HB3 HIS 20 HB2 HIS 20 -1.001 1.936 6.656
186 HD1 HIS 20 HD1 HIS 20 -2.728 3.727 7.320
187 HD2 HIS 20 HD2 HIS 20 -0.087 4.953 4.353
188 HE1 HIS 20 HE1 HIS 20 -3.055 6.210 7.106
189 HE2 HIS 20 HE2 HIS 20 -1.310 6.949 5.443
190 H ILE 21 H ILE 21 -0.220 -0.158 4.844
191 HA ILE 21 HA ILE 21 1.914 -1.348 6.486
192 HB ILE 21 HB ILE 21 0.263 -3.237 6.933
193 HG12 ILE 21 HG13 ILE 21 -1.742 -1.084 6.216
194 HG13 ILE 21 HG12 ILE 21 -1.415 -2.512 5.241
195 HG21 ILE 21 HG21 ILE 21 0.994 -1.724 8.664
196 HG22 ILE 21 HG22 ILE 21 -0.730 -2.046 8.851
197 HG23 ILE 21 HG23 ILE 21 -0.189 -0.519 8.155
198 HD11 ILE 21 HD11 ILE 21 -2.548 -2.470 8.027
199 HD12 ILE 21 HD12 ILE 21 -2.167 -3.923 7.104
200 HD13 ILE 21 HD13 ILE 21 -3.422 -2.822 6.537
201 H ASP 22 H ASP 22 3.011 -1.369 4.416
202 HA ASP 22 HA ASP 22 1.951 -2.808 2.189
203 HB2 ASP 22 HB3 ASP 22 3.985 -2.265 1.078
204 HB3 ASP 22 HB2 ASP 22 3.602 -0.891 2.096
205 H LYS 23 H LYS 23 4.148 -4.213 1.250
206 HA LYS 23 HA LYS 23 3.983 -6.651 2.734
207 HB2 LYS 23 HB3 LYS 23 5.903 -7.229 0.972
208 HB3 LYS 23 HB2 LYS 23 4.200 -7.224 0.548
209 HG2 LYS 23 HG3 LYS 23 5.532 -6.111 -1.146
210 HG3 LYS 23 HG2 LYS 23 4.427 -4.976 -0.374
211 HD2 LYS 23 HD3 LYS 23 6.338 -4.276 1.097
212 HD3 LYS 23 HD2 LYS 23 7.389 -5.262 0.076
213 HE2 LYS 23 HE3 LYS 23 5.617 -3.083 -0.996
214 HE3 LYS 23 HE2 LYS 23 7.276 -2.796 -0.482
215 HZ1 LYS 23 HZ1 LYS 23 7.979 -4.481 -2.126
216 HZ2 LYS 23 HZ2 LYS 23 7.204 -3.160 -2.843
217 HZ3 LYS 23 HZ3 LYS 23 6.380 -4.621 -2.648
218 H VAL 24 H VAL 24 5.363 -4.112 3.777
219 HA VAL 24 HA VAL 24 6.873 -3.752 5.424
220 HB VAL 24 HB VAL 24 7.644 -6.672 5.255
221 HG11 VAL 24 HG11 VAL 24 9.241 -5.308 6.484
222 HG12 VAL 24 HG12 VAL 24 8.350 -6.360 7.585
223 HG13 VAL 24 HG13 VAL 24 7.939 -4.650 7.475
224 HG21 VAL 24 HG21 VAL 24 5.528 -5.358 6.958
225 HG22 VAL 24 HG22 VAL 24 6.062 -7.033 7.097
226 HG23 VAL 24 HG23 VAL 24 5.248 -6.485 5.631
227 H LEU 25 H LEU 25 7.573 -2.845 3.114
228 HA LEU 25 HA LEU 25 10.466 -3.342 3.079
229 HB2 LEU 25 HB3 LEU 25 8.852 -4.149 1.074
230 HB3 LEU 25 HB2 LEU 25 9.197 -2.515 0.548
231 HG LEU 25 HG LEU 25 11.276 -4.619 1.145
232 HD11 LEU 25 HD11 LEU 25 9.786 -5.003 -0.826
233 HD12 LEU 25 HD12 LEU 25 11.508 -4.877 -1.192
234 HD13 LEU 25 HD13 LEU 25 10.433 -3.515 -1.519
235 HD21 LEU 25 HD21 LEU 25 11.550 -1.881 -0.098
236 HD22 LEU 25 HD22 LEU 25 12.840 -3.065 0.108
237 HD23 LEU 25 HD23 LEU 25 12.083 -2.331 1.523
238 H ARG 26 H ARG 26 8.001 -1.107 1.734
239 HA ARG 26 HA ARG 26 9.360 1.126 2.947
240 HB2 ARG 26 HB3 ARG 26 9.439 2.230 0.532
241 HB3 ARG 26 HB2 ARG 26 10.785 1.319 1.192
242 HG2 ARG 26 HG3 ARG 26 10.598 0.534 -0.983
243 HG3 ARG 26 HG2 ARG 26 9.778 -0.697 -0.031
244 HD2 ARG 26 HD3 ARG 26 8.520 -0.197 -2.043
245 HD3 ARG 26 HD2 ARG 26 7.611 0.308 -0.619
246 HE ARG 26 HE ARG 26 9.206 2.399 -1.792
247 HH11 ARG 26 HH11 ARG 26 6.146 0.731 -1.916
248 HH12 ARG 26 HH12 ARG 26 5.266 2.100 -2.529
249 HH21 ARG 26 HH22 ARG 26 8.093 4.195 -2.639
250 HH22 ARG 26 HH21 ARG 26 6.398 4.061 -2.988
251 HA PRO 27 HA PRO 27 4.927 2.086 2.257
252 HB2 PRO 27 HB2 PRO 27 4.127 2.197 4.824
253 HB3 PRO 27 HB3 PRO 27 4.173 0.670 3.920
254 HG2 PRO 27 HG3 PRO 27 6.061 1.720 5.970
255 HG3 PRO 27 HG2 PRO 27 5.532 0.058 5.664
256 HD2 PRO 27 HD3 PRO 27 7.943 1.178 4.816
257 HD3 PRO 27 HD2 PRO 27 7.211 -0.300 4.166
258 H GLN 28 H GLN 28 6.027 4.036 1.553
259 HA GLN 28 HA GLN 28 6.860 5.976 3.527
260 HB2 GLN 28 HB3 GLN 28 7.445 7.363 1.549
261 HB3 GLN 28 HB2 GLN 28 8.202 5.776 1.530
262 HG2 GLN 28 HG3 GLN 28 6.641 4.983 -0.102
263 HG3 GLN 28 HG2 GLN 28 5.699 6.468 0.016
264 HE21 GLN 28 HE22 GLN 28 6.517 8.363 -0.880
265 HE22 GLN 28 HE21 GLN 28 7.772 8.341 -2.070
266 H GLY 29 H GLY 29 4.230 5.407 3.879
267 HA2 GLY 29 HA3 GLY 29 3.024 8.012 3.203
268 HA3 GLY 29 HA2 GLY 29 2.091 6.534 3.009
Start of MODEL 14
1 H1 ARG 1 H1 ARG 1 -9.797 3.906 3.087
2 H2 ARG 1 H2 ARG 1 -9.780 3.416 4.704
3 H3 ARG 1 H3 ARG 1 -11.172 4.111 4.047
4 HA ARG 1 HA ARG 1 -11.387 1.710 4.268
5 HB2 ARG 1 HB3 ARG 1 -12.518 3.004 2.426
6 HB3 ARG 1 HB2 ARG 1 -11.176 2.581 1.374
7 HG2 ARG 1 HG3 ARG 1 -12.920 1.073 0.884
8 HG3 ARG 1 HG2 ARG 1 -11.727 0.168 1.819
9 HD2 ARG 1 HD3 ARG 1 -13.109 0.648 3.861
10 HD3 ARG 1 HD2 ARG 1 -14.344 1.304 2.790
11 HE ARG 1 HE ARG 1 -13.641 -1.290 1.945
12 HH11 ARG 1 HH12 ARG 1 -15.371 0.362 4.496
13 HH12 ARG 1 HH11 ARG 1 -16.397 -0.992 4.851
14 HH21 ARG 1 HH21 ARG 1 -14.977 -3.087 2.424
15 HH22 ARG 1 HH22 ARG 1 -16.171 -2.953 3.677
16 H LYS 2 H LYS 2 -10.511 -0.344 3.949
17 HA LYS 2 HA LYS 2 -7.821 -0.407 2.786
18 HB2 LYS 2 HB3 LYS 2 -9.269 -2.594 4.292
19 HB3 LYS 2 HB2 LYS 2 -7.595 -2.633 3.758
20 HG2 LYS 2 HG3 LYS 2 -7.238 -2.046 5.907
21 HG3 LYS 2 HG2 LYS 2 -7.488 -0.429 5.247
22 HD2 LYS 2 HD3 LYS 2 -8.826 -0.474 7.160
23 HD3 LYS 2 HD2 LYS 2 -9.956 -0.771 5.843
24 HE2 LYS 2 HE3 LYS 2 -8.712 -2.912 7.567
25 HE3 LYS 2 HE2 LYS 2 -10.316 -2.234 7.816
26 HZ1 LYS 2 HZ1 LYS 2 -9.387 -3.827 5.493
27 HZ2 LYS 2 HZ2 LYS 2 -10.884 -3.043 5.556
28 HZ3 LYS 2 HZ3 LYS 2 -10.530 -4.275 6.651
29 H CYS 3 H CYS 3 -7.296 -2.138 1.278
30 HA CYS 3 HA CYS 3 -9.598 -3.110 -0.247
31 HB2 CYS 3 HB3 CYS 3 -7.495 -2.353 -2.049
32 HB3 CYS 3 HB2 CYS 3 -9.166 -1.801 -2.010
33 H ASN 4 H ASN 4 -8.325 -4.354 -2.291
34 HA ASN 4 HA ASN 4 -7.345 -6.650 -0.795
35 HB2 ASN 4 HB3 ASN 4 -8.177 -6.368 -3.689
36 HB3 ASN 4 HB2 ASN 4 -7.677 -7.877 -2.934
37 HD21 ASN 4 HD22 ASN 4 -10.170 -5.495 -3.206
38 HD22 ASN 4 HD21 ASN 4 -11.395 -6.392 -2.381
39 H PHE 5 H PHE 5 -5.341 -5.365 -0.424
40 HA PHE 5 HA PHE 5 -3.175 -4.922 -0.709
41 HB2 PHE 5 HB3 PHE 5 -3.218 -7.074 -2.802
42 HB3 PHE 5 HB2 PHE 5 -1.862 -6.530 -1.852
43 HD1 PHE 5 HD1 PHE 5 -1.668 -7.108 0.516
44 HD2 PHE 5 HD2 PHE 5 -4.799 -8.636 -1.921
45 HE1 PHE 5 HE1 PHE 5 -2.127 -8.836 2.199
46 HE2 PHE 5 HE2 PHE 5 -5.266 -10.370 -0.241
47 HZ PHE 5 HZ PHE 5 -3.949 -10.462 1.827
48 H LEU 6 H LEU 6 -1.443 -4.357 -2.363
49 HA LEU 6 HA LEU 6 -0.750 -2.744 -3.798
50 HB2 LEU 6 HB3 LEU 6 -2.834 -4.016 -5.577
51 HB3 LEU 6 HB2 LEU 6 -1.550 -2.956 -6.118
52 HG LEU 6 HG LEU 6 -0.782 -5.074 -6.667
53 HD11 LEU 6 HD11 LEU 6 0.419 -4.470 -3.960
54 HD12 LEU 6 HD12 LEU 6 0.952 -3.857 -5.531
55 HD13 LEU 6 HD13 LEU 6 1.087 -5.576 -5.168
56 HD21 LEU 6 HD21 LEU 6 -2.443 -6.405 -5.550
57 HD22 LEU 6 HD22 LEU 6 -1.726 -6.042 -3.981
58 HD23 LEU 6 HD23 LEU 6 -0.836 -7.011 -5.152
59 H CYS 7 H CYS 7 -2.563 -1.827 -1.954
60 HA CYS 7 HA CYS 7 -3.740 0.430 -3.253
61 HB2 CYS 7 HB3 CYS 7 -5.463 -1.197 -3.809
62 HB3 CYS 7 HB2 CYS 7 -5.602 -1.682 -2.121
63 H LYS 8 H LYS 8 -3.316 -1.538 -0.396
64 HA LYS 8 HA LYS 8 -2.616 0.744 1.155
65 HB2 LYS 8 HB3 LYS 8 -5.097 0.845 1.321
66 HB3 LYS 8 HB2 LYS 8 -5.097 -0.783 1.988
67 HG2 LYS 8 HG3 LYS 8 -3.965 -0.069 3.948
68 HG3 LYS 8 HG2 LYS 8 -3.640 1.518 3.255
69 HD2 LYS 8 HD3 LYS 8 -6.110 1.894 3.164
70 HD3 LYS 8 HD2 LYS 8 -6.306 0.389 4.063
71 HE2 LYS 8 HE3 LYS 8 -5.034 1.277 5.910
72 HE3 LYS 8 HE2 LYS 8 -4.682 2.745 5.003
73 HZ1 LYS 8 HZ1 LYS 8 -7.079 3.211 4.980
74 HZ2 LYS 8 HZ2 LYS 8 -6.443 3.157 6.546
75 HZ3 LYS 8 HZ3 LYS 8 -7.345 1.856 5.957
76 H LEU 9 H LEU 9 -3.551 -2.615 1.059
77 HA LEU 9 HA LEU 9 -1.931 -3.433 3.260
78 HB2 LEU 9 HB3 LEU 9 -3.454 -4.873 1.120
79 HB3 LEU 9 HB2 LEU 9 -2.372 -5.752 2.183
80 HG LEU 9 HG LEU 9 -3.695 -4.950 4.131
81 HD11 LEU 9 HD11 LEU 9 -5.585 -3.897 2.036
82 HD12 LEU 9 HD12 LEU 9 -4.620 -2.921 3.143
83 HD13 LEU 9 HD13 LEU 9 -5.891 -3.970 3.772
84 HD21 LEU 9 HD21 LEU 9 -5.256 -6.424 2.019
85 HD22 LEU 9 HD22 LEU 9 -5.615 -6.410 3.745
86 HD23 LEU 9 HD23 LEU 9 -4.119 -7.139 3.162
87 H LYS 10 H LYS 10 -1.621 -4.926 0.038
88 HA LYS 10 HA LYS 10 1.263 -4.683 0.203
89 HB2 LYS 10 HB3 LYS 10 -0.141 -6.611 -0.843
90 HB3 LYS 10 HB2 LYS 10 -0.262 -5.554 -2.239
91 HG2 LYS 10 HG3 LYS 10 1.829 -5.981 -2.894
92 HG3 LYS 10 HG2 LYS 10 2.464 -5.911 -1.247
93 HD2 LYS 10 HD3 LYS 10 2.716 -8.153 -2.163
94 HD3 LYS 10 HD2 LYS 10 1.581 -8.157 -0.815
95 HE2 LYS 10 HE3 LYS 10 0.579 -9.512 -2.444
96 HE3 LYS 10 HE2 LYS 10 -0.259 -7.964 -2.574
97 HZ1 LYS 10 HZ1 LYS 10 0.330 -8.893 -4.743
98 HZ2 LYS 10 HZ2 LYS 10 1.969 -8.867 -4.327
99 HZ3 LYS 10 HZ3 LYS 10 1.113 -7.419 -4.482
100 H GLU 11 H GLU 11 2.403 -3.715 -1.891
101 HA GLU 11 HA GLU 11 1.034 -1.156 -2.357
102 HB2 GLU 11 HB3 GLU 11 3.118 0.020 -2.083
103 HB3 GLU 11 HB2 GLU 11 2.772 -0.937 -0.651
104 HG2 GLU 11 HG3 GLU 11 5.005 -1.310 -0.969
105 HG3 GLU 11 HG2 GLU 11 4.285 -2.706 -1.754
106 H LYS 12 H LYS 12 1.935 0.140 -4.087
107 HA LYS 12 HA LYS 12 3.437 -1.152 -6.167
108 HB2 LYS 12 HB3 LYS 12 1.569 -0.431 -7.854
109 HB3 LYS 12 HB2 LYS 12 1.446 -1.972 -7.026
110 HG2 LYS 12 HG3 LYS 12 -0.706 -0.951 -7.018
111 HG3 LYS 12 HG2 LYS 12 -0.075 -0.903 -5.373
112 HD2 LYS 12 HD3 LYS 12 -1.136 1.194 -5.874
113 HD3 LYS 12 HD2 LYS 12 0.604 1.458 -5.750
114 HE2 LYS 12 HE3 LYS 12 0.733 1.334 -8.234
115 HE3 LYS 12 HE2 LYS 12 -1.023 1.212 -8.283
116 HZ1 LYS 12 HZ1 LYS 12 -1.163 3.375 -7.213
117 HZ2 LYS 12 HZ2 LYS 12 -0.287 3.472 -8.659
118 HZ3 LYS 12 HZ3 LYS 12 0.526 3.487 -7.176
119 H LEU 13 H LEU 13 3.929 0.954 -4.443
120 HA LEU 13 HA LEU 13 4.423 3.117 -4.153
121 HB2 LEU 13 HB3 LEU 13 5.575 4.238 -5.819
122 HB3 LEU 13 HB2 LEU 13 5.803 2.552 -6.219
123 HG LEU 13 HG LEU 13 3.777 2.991 -7.855
124 HD11 LEU 13 HD11 LEU 13 3.824 5.243 -8.795
125 HD12 LEU 13 HD12 LEU 13 4.966 5.746 -7.550
126 HD13 LEU 13 HD13 LEU 13 3.328 5.270 -7.103
127 HD21 LEU 13 HD21 LEU 13 6.007 2.291 -8.523
128 HD22 LEU 13 HD22 LEU 13 6.587 3.949 -8.377
129 HD23 LEU 13 HD23 LEU 13 5.394 3.537 -9.609
130 H ARG 14 H ARG 14 3.468 5.041 -3.789
131 HA ARG 14 HA ARG 14 1.403 6.095 -5.418
132 HB2 ARG 14 HB3 ARG 14 0.181 4.206 -4.325
133 HB3 ARG 14 HB2 ARG 14 0.480 4.975 -2.773
134 HG2 ARG 14 HG3 ARG 14 -1.776 5.418 -3.628
135 HG3 ARG 14 HG2 ARG 14 -0.832 6.893 -3.422
136 HD2 ARG 14 HD3 ARG 14 -0.420 7.038 -5.772
137 HD3 ARG 14 HD2 ARG 14 -1.129 5.448 -6.048
138 HE ARG 14 HE ARG 14 -3.246 6.583 -5.141
139 HH11 ARG 14 HH11 ARG 14 -0.794 8.192 -7.062
140 HH12 ARG 14 HH12 ARG 14 -1.909 9.322 -7.758
141 HH21 ARG 14 HH22 ARG 14 -4.714 8.056 -6.077
142 HH22 ARG 14 HH21 ARG 14 -4.137 9.242 -7.204
143 H THR 15 H THR 15 1.627 6.152 -1.839
144 HA THR 15 HA THR 15 3.062 8.535 -1.659
145 HB THR 15 HB THR 15 1.139 9.447 -2.915
146 HG1 THR 15 HG1 THR 15 2.408 10.637 -1.198
147 HG21 THR 15 HG21 THR 15 -1.015 9.787 -1.853
148 HG22 THR 15 HG22 THR 15 -0.467 8.913 -0.423
149 HG23 THR 15 HG23 THR 15 -0.649 8.067 -1.956
150 H VAL 16 H VAL 16 0.318 6.792 -0.220
151 HA VAL 16 HA VAL 16 1.415 6.747 2.403
152 HB VAL 16 HB VAL 16 -0.853 8.706 1.926
153 HG11 VAL 16 HG11 VAL 16 -1.348 7.237 3.833
154 HG12 VAL 16 HG12 VAL 16 -1.052 8.900 4.339
155 HG13 VAL 16 HG13 VAL 16 0.198 7.676 4.559
156 HG21 VAL 16 HG21 VAL 16 0.553 10.312 3.096
157 HG22 VAL 16 HG22 VAL 16 1.396 9.664 1.688
158 HG23 VAL 16 HG23 VAL 16 1.804 9.085 3.303
159 H ILE 17 H ILE 17 -1.772 6.949 0.792
160 HA ILE 17 HA ILE 17 -3.092 5.089 2.366
161 HB ILE 17 HB ILE 17 -4.437 6.424 0.975
162 HG12 ILE 17 HG13 ILE 17 -5.813 4.842 -0.287
163 HG13 ILE 17 HG12 ILE 17 -4.508 3.663 -0.260
164 HG21 ILE 17 HG21 ILE 17 -2.736 6.876 -0.753
165 HG22 ILE 17 HG22 ILE 17 -4.331 6.539 -1.422
166 HG23 ILE 17 HG23 ILE 17 -3.079 5.300 -1.464
167 HD11 ILE 17 HD11 ILE 17 -5.757 4.718 2.251
168 HD12 ILE 17 HD12 ILE 17 -4.769 3.272 2.035
169 HD13 ILE 17 HD13 ILE 17 -6.405 3.330 1.377
170 H THR 18 H THR 18 -1.755 4.417 -0.891
171 HA THR 18 HA THR 18 -2.000 1.618 -0.585
172 HB THR 18 HB THR 18 -0.178 3.128 -2.460
173 HG1 THR 18 HG1 THR 18 -2.932 2.756 -2.387
174 HG21 THR 18 HG21 THR 18 -1.358 0.354 -2.621
175 HG22 THR 18 HG22 THR 18 0.334 0.746 -2.307
176 HG23 THR 18 HG23 THR 18 -0.386 1.133 -3.869
177 H SER 19 H SER 19 0.641 3.908 -0.145
178 HA SER 19 HA SER 19 2.492 1.859 0.698
179 HB2 SER 19 HB3 SER 19 4.075 3.637 0.833
180 HB3 SER 19 HB2 SER 19 3.033 4.035 -0.537
181 HG SER 19 HG SER 19 2.597 5.032 2.068
182 H HIS 20 H HIS 20 0.271 1.637 2.325
183 HA HIS 20 HA HIS 20 0.726 3.272 4.696
184 HB2 HIS 20 HB3 HIS 20 -1.597 2.845 3.761
185 HB3 HIS 20 HB2 HIS 20 -1.440 1.199 4.369
186 HD1 HIS 20 HD1 HIS 20 -2.389 0.889 6.641
187 HD2 HIS 20 HD2 HIS 20 -1.124 4.794 6.005
188 HE1 HIS 20 HE1 HIS 20 -2.975 2.137 8.740
189 HE2 HIS 20 HE2 HIS 20 -2.019 4.444 8.405
190 H ILE 21 H ILE 21 -0.261 -0.153 4.615
191 HA ILE 21 HA ILE 21 1.697 -0.662 6.706
192 HB ILE 21 HB ILE 21 -0.508 -1.653 7.025
193 HG12 ILE 21 HG13 ILE 21 1.593 -3.755 6.457
194 HG13 ILE 21 HG12 ILE 21 1.467 -2.809 7.937
195 HG21 ILE 21 HG21 ILE 21 -1.180 -1.939 4.717
196 HG22 ILE 21 HG22 ILE 21 -1.319 -3.465 5.592
197 HG23 ILE 21 HG23 ILE 21 0.038 -3.197 4.498
198 HD11 ILE 21 HD11 ILE 21 -0.569 -4.777 6.918
199 HD12 ILE 21 HD12 ILE 21 -0.703 -3.828 8.398
200 HD13 ILE 21 HD13 ILE 21 0.569 -5.039 8.240
201 H ASP 22 H ASP 22 1.017 -1.479 3.378
202 HA ASP 22 HA ASP 22 2.435 -1.831 1.640
203 HB2 ASP 22 HB3 ASP 22 3.846 -0.197 3.127
204 HB3 ASP 22 HB2 ASP 22 4.798 -1.629 3.476
205 H LYS 23 H LYS 23 4.178 -3.416 0.861
206 HA LYS 23 HA LYS 23 3.988 -5.908 2.307
207 HB2 LYS 23 HB3 LYS 23 5.658 -6.662 0.483
208 HB3 LYS 23 HB2 LYS 23 4.006 -6.296 0.022
209 HG2 LYS 23 HG3 LYS 23 5.200 -5.264 -1.638
210 HG3 LYS 23 HG2 LYS 23 4.956 -3.940 -0.506
211 HD2 LYS 23 HD3 LYS 23 7.182 -4.235 0.379
212 HD3 LYS 23 HD2 LYS 23 7.435 -5.645 -0.652
213 HE2 LYS 23 HE3 LYS 23 6.894 -4.010 -2.583
214 HE3 LYS 23 HE2 LYS 23 7.252 -2.746 -1.403
215 HZ1 LYS 23 HZ1 LYS 23 9.451 -3.653 -1.120
216 HZ2 LYS 23 HZ2 LYS 23 9.181 -3.400 -2.772
217 HZ3 LYS 23 HZ3 LYS 23 9.102 -4.961 -2.131
218 H VAL 24 H VAL 24 6.157 -3.230 2.093
219 HA VAL 24 HA VAL 24 7.354 -3.719 4.521
220 HB VAL 24 HB VAL 24 8.447 -5.678 3.533
221 HG11 VAL 24 HG11 VAL 24 9.666 -3.730 1.594
222 HG12 VAL 24 HG12 VAL 24 8.654 -5.131 1.237
223 HG13 VAL 24 HG13 VAL 24 10.281 -5.358 1.871
224 HG21 VAL 24 HG21 VAL 24 10.768 -5.149 4.177
225 HG22 VAL 24 HG22 VAL 24 9.579 -4.552 5.336
226 HG23 VAL 24 HG23 VAL 24 10.345 -3.437 4.205
227 H LEU 25 H LEU 25 6.428 -1.582 3.911
228 HA LEU 25 HA LEU 25 6.573 0.583 3.131
229 HB2 LEU 25 HB3 LEU 25 8.282 1.792 4.642
230 HB3 LEU 25 HB2 LEU 25 6.887 1.012 5.335
231 HG LEU 25 HG LEU 25 8.928 0.753 6.685
232 HD11 LEU 25 HD11 LEU 25 7.196 -0.888 6.935
233 HD12 LEU 25 HD12 LEU 25 8.774 -1.665 7.065
234 HD13 LEU 25 HD13 LEU 25 7.833 -1.819 5.581
235 HD21 LEU 25 HD21 LEU 25 9.974 -0.860 4.371
236 HD22 LEU 25 HD22 LEU 25 10.712 -0.755 5.970
237 HD23 LEU 25 HD23 LEU 25 10.606 0.680 4.952
238 H ARG 26 H ARG 26 7.473 -0.337 0.985
239 HA ARG 26 HA ARG 26 10.247 0.358 0.531
240 HB2 ARG 26 HB3 ARG 26 9.771 -1.644 -0.497
241 HB3 ARG 26 HB2 ARG 26 8.156 -1.146 -0.962
242 HG2 ARG 26 HG3 ARG 26 10.281 0.382 -2.262
243 HG3 ARG 26 HG2 ARG 26 10.289 -1.343 -2.642
244 HD2 ARG 26 HD3 ARG 26 8.005 -1.255 -3.371
245 HD3 ARG 26 HD2 ARG 26 7.842 0.408 -2.811
246 HE ARG 26 HE ARG 26 9.883 0.475 -4.635
247 HH11 ARG 26 HH11 ARG 26 6.513 -0.519 -4.701
248 HH12 ARG 26 HH12 ARG 26 6.338 -0.185 -6.398
249 HH21 ARG 26 HH22 ARG 26 9.614 0.944 -6.846
250 HH22 ARG 26 HH21 ARG 26 8.086 0.640 -7.614
251 HA PRO 27 HA PRO 27 8.251 3.232 -2.720
252 HB2 PRO 27 HB2 PRO 27 5.659 3.980 -2.467
253 HB3 PRO 27 HB3 PRO 27 6.159 2.528 -3.359
254 HG2 PRO 27 HG3 PRO 27 5.125 2.772 -0.559
255 HG3 PRO 27 HG2 PRO 27 4.681 1.598 -1.810
256 HD2 PRO 27 HD3 PRO 27 6.419 1.014 0.173
257 HD3 PRO 27 HD2 PRO 27 6.565 0.317 -1.450
258 H GLN 28 H GLN 28 6.643 3.630 0.420
259 HA GLN 28 HA GLN 28 8.016 6.174 0.819
260 HB2 GLN 28 HB3 GLN 28 5.021 5.805 0.954
261 HB3 GLN 28 HB2 GLN 28 5.849 7.141 1.735
262 HG2 GLN 28 HG3 GLN 28 6.020 6.577 -1.211
263 HG3 GLN 28 HG2 GLN 28 4.826 7.653 -0.488
264 HE21 GLN 28 HE22 GLN 28 8.167 7.187 -1.268
265 HE22 GLN 28 HE21 GLN 28 8.672 8.819 -0.990
266 H GLY 29 H GLY 29 5.304 4.687 2.538
267 HA2 GLY 29 HA3 GLY 29 5.244 3.566 4.564
268 HA3 GLY 29 HA2 GLY 29 7.001 3.608 4.606
Start of MODEL 15
1 H1 ARG 1 H1 ARG 1 -10.819 3.725 2.576
2 H2 ARG 1 H2 ARG 1 -12.365 3.868 3.250
3 H3 ARG 1 H3 ARG 1 -12.064 4.457 1.694
4 HA ARG 1 HA ARG 1 -11.955 1.620 2.517
5 HB2 ARG 1 HB3 ARG 1 -14.251 2.463 2.436
6 HB3 ARG 1 HB2 ARG 1 -13.970 3.131 0.837
7 HG2 ARG 1 HG3 ARG 1 -15.230 1.094 0.651
8 HG3 ARG 1 HG2 ARG 1 -13.622 0.852 -0.030
9 HD2 ARG 1 HD3 ARG 1 -14.272 -1.068 1.300
10 HD3 ARG 1 HD2 ARG 1 -12.916 -0.234 2.054
11 HE ARG 1 HE ARG 1 -15.429 0.655 3.082
12 HH11 ARG 1 HH12 ARG 1 -13.061 -1.911 3.296
13 HH12 ARG 1 HH11 ARG 1 -13.477 -2.332 4.925
14 HH21 ARG 1 HH21 ARG 1 -15.990 0.090 5.220
15 HH22 ARG 1 HH22 ARG 1 -15.142 -1.197 6.019
16 H LYS 2 H LYS 2 -10.479 0.596 1.367
17 HA LYS 2 HA LYS 2 -9.993 1.476 -1.406
18 HB2 LYS 2 HB3 LYS 2 -7.951 0.349 0.524
19 HB3 LYS 2 HB2 LYS 2 -7.643 0.868 -1.125
20 HG2 LYS 2 HG3 LYS 2 -8.540 2.651 1.128
21 HG3 LYS 2 HG2 LYS 2 -6.891 2.512 0.524
22 HD2 LYS 2 HD3 LYS 2 -9.264 3.418 -1.102
23 HD3 LYS 2 HD2 LYS 2 -8.081 4.493 -0.358
24 HE2 LYS 2 HE3 LYS 2 -6.312 3.476 -1.713
25 HE3 LYS 2 HE2 LYS 2 -7.496 2.400 -2.452
26 HZ1 LYS 2 HZ1 LYS 2 -8.638 4.349 -3.336
27 HZ2 LYS 2 HZ2 LYS 2 -7.036 4.279 -3.878
28 HZ3 LYS 2 HZ3 LYS 2 -7.467 5.360 -2.654
29 H CYS 3 H CYS 3 -8.493 -0.483 -2.389
30 HA CYS 3 HA CYS 3 -10.264 -2.675 -2.637
31 HB2 CYS 3 HB3 CYS 3 -7.814 -3.537 -3.621
32 HB3 CYS 3 HB2 CYS 3 -9.088 -2.746 -4.542
33 H ASN 4 H ASN 4 -6.847 -3.230 -1.925
34 HA ASN 4 HA ASN 4 -7.106 -4.027 0.745
35 HB2 ASN 4 HB3 ASN 4 -8.483 -5.861 -0.268
36 HB3 ASN 4 HB2 ASN 4 -7.062 -6.381 -1.164
37 HD21 ASN 4 HD22 ASN 4 -8.612 -6.231 1.921
38 HD22 ASN 4 HD21 ASN 4 -7.525 -7.291 2.752
39 H PHE 5 H PHE 5 -5.425 -6.074 -1.542
40 HA PHE 5 HA PHE 5 -2.897 -5.215 -0.419
41 HB2 PHE 5 HB3 PHE 5 -1.986 -7.133 -1.812
42 HB3 PHE 5 HB2 PHE 5 -3.105 -7.572 -0.531
43 HD1 PHE 5 HD1 PHE 5 -5.586 -7.896 -1.237
44 HD2 PHE 5 HD2 PHE 5 -2.313 -7.941 -3.951
45 HE1 PHE 5 HE1 PHE 5 -6.951 -9.144 -2.856
46 HE2 PHE 5 HE2 PHE 5 -3.676 -9.179 -5.579
47 HZ PHE 5 HZ PHE 5 -5.997 -9.786 -5.032
48 H LEU 6 H LEU 6 -1.198 -4.364 -1.594
49 HA LEU 6 HA LEU 6 -0.254 -2.888 -3.024
50 HB2 LEU 6 HB3 LEU 6 -2.125 -4.141 -5.047
51 HB3 LEU 6 HB2 LEU 6 -0.899 -2.961 -5.450
52 HG LEU 6 HG LEU 6 -0.092 -5.101 -6.087
53 HD11 LEU 6 HD11 LEU 6 1.244 -3.963 -3.662
54 HD12 LEU 6 HD12 LEU 6 1.744 -3.944 -5.360
55 HD13 LEU 6 HD13 LEU 6 1.853 -5.435 -4.429
56 HD21 LEU 6 HD21 LEU 6 -1.493 -6.533 -4.806
57 HD22 LEU 6 HD22 LEU 6 -0.723 -6.027 -3.303
58 HD23 LEU 6 HD23 LEU 6 0.190 -6.953 -4.494
59 H CYS 7 H CYS 7 -2.193 -2.005 -1.333
60 HA CYS 7 HA CYS 7 -3.474 0.171 -2.772
61 HB2 CYS 7 HB3 CYS 7 -5.124 -1.875 -1.268
62 HB3 CYS 7 HB2 CYS 7 -5.734 -0.349 -1.889
63 H LYS 8 H LYS 8 -2.816 -1.506 0.230
64 HA LYS 8 HA LYS 8 -2.505 0.812 1.820
65 HB2 LYS 8 HB3 LYS 8 -4.974 0.910 1.508
66 HB3 LYS 8 HB2 LYS 8 -5.105 -0.707 2.180
67 HG2 LYS 8 HG3 LYS 8 -4.273 0.102 4.320
68 HG3 LYS 8 HG2 LYS 8 -4.100 1.724 3.647
69 HD2 LYS 8 HD3 LYS 8 -6.150 1.689 4.858
70 HD3 LYS 8 HD2 LYS 8 -6.565 1.666 3.148
71 HE2 LYS 8 HE3 LYS 8 -7.979 0.105 4.262
72 HE3 LYS 8 HE2 LYS 8 -6.814 -0.809 3.310
73 HZ1 LYS 8 HZ1 LYS 8 -6.706 -0.325 6.237
74 HZ2 LYS 8 HZ2 LYS 8 -5.511 -1.130 5.352
75 HZ3 LYS 8 HZ3 LYS 8 -7.060 -1.789 5.475
76 H LEU 9 H LEU 9 -3.458 -2.553 1.658
77 HA LEU 9 HA LEU 9 -2.097 -3.301 4.088
78 HB2 LEU 9 HB3 LEU 9 -3.463 -4.817 1.890
79 HB3 LEU 9 HB2 LEU 9 -2.524 -5.657 3.114
80 HG LEU 9 HG LEU 9 -4.016 -4.537 4.843
81 HD11 LEU 9 HD11 LEU 9 -6.217 -3.814 4.074
82 HD12 LEU 9 HD12 LEU 9 -5.690 -3.986 2.401
83 HD13 LEU 9 HD13 LEU 9 -4.937 -2.780 3.444
84 HD21 LEU 9 HD21 LEU 9 -4.211 -6.885 4.256
85 HD22 LEU 9 HD22 LEU 9 -5.252 -6.472 2.895
86 HD23 LEU 9 HD23 LEU 9 -5.800 -6.178 4.544
87 H LYS 10 H LYS 10 -1.623 -4.416 0.723
88 HA LYS 10 HA LYS 10 1.269 -4.256 1.177
89 HB2 LYS 10 HB3 LYS 10 0.085 -6.286 0.031
90 HB3 LYS 10 HB2 LYS 10 0.022 -5.243 -1.378
91 HG2 LYS 10 HG3 LYS 10 2.459 -5.005 -1.305
92 HG3 LYS 10 HG2 LYS 10 2.509 -6.093 0.081
93 HD2 LYS 10 HD3 LYS 10 1.531 -6.767 -2.691
94 HD3 LYS 10 HD2 LYS 10 3.049 -7.291 -1.963
95 HE2 LYS 10 HE3 LYS 10 1.693 -8.423 -0.181
96 HE3 LYS 10 HE2 LYS 10 0.253 -8.037 -1.124
97 HZ1 LYS 10 HZ1 LYS 10 1.173 -9.312 -2.964
98 HZ2 LYS 10 HZ2 LYS 10 1.012 -10.270 -1.584
99 HZ3 LYS 10 HZ3 LYS 10 2.536 -9.700 -2.044
100 H GLU 11 H GLU 11 2.358 -3.361 -1.100
101 HA GLU 11 HA GLU 11 1.249 -0.670 -0.925
102 HB2 GLU 11 HB3 GLU 11 3.678 0.016 -1.342
103 HB3 GLU 11 HB2 GLU 11 3.221 -0.617 0.230
104 HG2 GLU 11 HG3 GLU 11 5.346 -1.507 -0.530
105 HG3 GLU 11 HG2 GLU 11 4.147 -2.773 -0.317
106 H LYS 12 H LYS 12 2.430 0.804 -2.530
107 HA LYS 12 HA LYS 12 3.217 0.220 -5.051
108 HB2 LYS 12 HB3 LYS 12 1.437 -0.170 -6.401
109 HB3 LYS 12 HB2 LYS 12 0.580 -0.583 -4.937
110 HG2 LYS 12 HG3 LYS 12 0.604 2.208 -5.976
111 HG3 LYS 12 HG2 LYS 12 -0.489 0.993 -6.634
112 HD2 LYS 12 HD3 LYS 12 -1.072 0.585 -4.125
113 HD3 LYS 12 HD2 LYS 12 -0.419 2.217 -3.922
114 HE2 LYS 12 HE3 LYS 12 -2.681 2.591 -4.320
115 HE3 LYS 12 HE2 LYS 12 -1.903 2.827 -5.889
116 HZ1 LYS 12 HZ1 LYS 12 -3.972 1.459 -5.930
117 HZ2 LYS 12 HZ2 LYS 12 -3.131 0.261 -5.084
118 HZ3 LYS 12 HZ3 LYS 12 -2.617 0.727 -6.627
119 H LEU 13 H LEU 13 2.950 2.252 -6.485
120 HA LEU 13 HA LEU 13 3.927 4.366 -4.911
121 HB2 LEU 13 HB3 LEU 13 4.616 3.988 -7.227
122 HB3 LEU 13 HB2 LEU 13 3.003 4.389 -7.783
123 HG LEU 13 HG LEU 13 3.293 6.691 -6.943
124 HD11 LEU 13 HD11 LEU 13 6.101 5.797 -6.317
125 HD12 LEU 13 HD12 LEU 13 4.867 6.259 -5.145
126 HD13 LEU 13 HD13 LEU 13 5.515 7.459 -6.262
127 HD21 LEU 13 HD21 LEU 13 4.904 7.414 -8.638
128 HD22 LEU 13 HD22 LEU 13 3.814 6.177 -9.262
129 HD23 LEU 13 HD23 LEU 13 5.464 5.751 -8.811
130 H ARG 14 H ARG 14 2.447 5.051 -3.393
131 HA ARG 14 HA ARG 14 0.533 6.956 -4.485
132 HB2 ARG 14 HB3 ARG 14 -0.293 4.516 -3.248
133 HB3 ARG 14 HB2 ARG 14 -0.731 5.854 -2.193
134 HG2 ARG 14 HG3 ARG 14 -1.472 5.579 -5.100
135 HG3 ARG 14 HG2 ARG 14 -2.541 5.308 -3.722
136 HD2 ARG 14 HD3 ARG 14 -2.321 7.637 -3.065
137 HD3 ARG 14 HD2 ARG 14 -1.185 7.924 -4.379
138 HE ARG 14 HE ARG 14 -3.675 6.913 -5.329
139 HH11 ARG 14 HH11 ARG 14 -2.064 9.819 -4.228
140 HH12 ARG 14 HH12 ARG 14 -3.114 10.886 -5.100
141 HH21 ARG 14 HH22 ARG 14 -5.050 8.316 -6.496
142 HH22 ARG 14 HH21 ARG 14 -4.805 10.033 -6.395
143 H THR 15 H THR 15 2.448 5.758 -1.823
144 HA THR 15 HA THR 15 3.831 6.909 -0.454
145 HB THR 15 HB THR 15 2.780 9.443 -1.682
146 HG1 THR 15 HG1 THR 15 5.114 8.428 -2.724
147 HG21 THR 15 HG21 THR 15 5.033 10.291 -1.195
148 HG22 THR 15 HG22 THR 15 5.465 8.734 -0.487
149 HG23 THR 15 HG23 THR 15 4.232 9.737 0.275
150 H VAL 16 H VAL 16 0.447 7.396 -0.379
151 HA VAL 16 HA VAL 16 0.709 8.450 2.356
152 HB VAL 16 HB VAL 16 -1.508 9.183 0.438
153 HG11 VAL 16 HG11 VAL 16 -2.065 8.932 2.894
154 HG12 VAL 16 HG12 VAL 16 -2.419 10.507 2.169
155 HG13 VAL 16 HG13 VAL 16 -0.986 10.304 3.181
156 HG21 VAL 16 HG21 VAL 16 0.736 10.869 1.553
157 HG22 VAL 16 HG22 VAL 16 -0.586 11.447 0.540
158 HG23 VAL 16 HG23 VAL 16 0.594 10.311 -0.113
159 H ILE 17 H ILE 17 -2.210 7.469 0.587
160 HA ILE 17 HA ILE 17 -3.274 6.010 2.706
161 HB ILE 17 HB ILE 17 -4.838 6.624 1.088
162 HG12 ILE 17 HG13 ILE 17 -5.798 4.524 0.191
163 HG13 ILE 17 HG12 ILE 17 -4.303 3.687 0.587
164 HG21 ILE 17 HG21 ILE 17 -4.686 6.105 -1.294
165 HG22 ILE 17 HG22 ILE 17 -3.138 5.307 -1.022
166 HG23 ILE 17 HG23 ILE 17 -3.296 7.040 -0.744
167 HD11 ILE 17 HD11 ILE 17 -4.754 4.424 2.993
168 HD12 ILE 17 HD12 ILE 17 -5.755 3.137 2.309
169 HD13 ILE 17 HD13 ILE 17 -6.388 4.784 2.431
170 H THR 18 H THR 18 -1.550 4.838 -0.157
171 HA THR 18 HA THR 18 -1.674 2.123 0.660
172 HB THR 18 HB THR 18 0.147 3.360 -1.403
173 HG1 THR 18 HG1 THR 18 -2.570 2.514 -1.486
174 HG21 THR 18 HG21 THR 18 0.118 1.132 -2.387
175 HG22 THR 18 HG22 THR 18 -0.947 0.563 -1.101
176 HG23 THR 18 HG23 THR 18 0.699 1.067 -0.725
177 H SER 19 H SER 19 0.428 4.753 1.390
178 HA SER 19 HA SER 19 2.673 3.073 2.031
179 HB2 SER 19 HB3 SER 19 3.827 5.063 2.578
180 HB3 SER 19 HB2 SER 19 2.790 5.490 1.228
181 HG SER 19 HG SER 19 2.750 7.014 2.984
182 H HIS 20 H HIS 20 -0.141 3.117 3.384
183 HA HIS 20 HA HIS 20 0.277 3.597 6.141
184 HB2 HIS 20 HB3 HIS 20 -1.958 3.437 5.061
185 HB3 HIS 20 HB2 HIS 20 -1.690 1.719 4.805
186 HD1 HIS 20 HD1 HIS 20 -2.792 0.308 6.492
187 HD2 HIS 20 HD2 HIS 20 -1.754 4.026 8.042
188 HE1 HIS 20 HE1 HIS 20 -3.635 0.315 8.857
189 HE2 HIS 20 HE2 HIS 20 -2.841 2.499 9.825
190 H ILE 21 H ILE 21 -0.051 0.491 4.430
191 HA ILE 21 HA ILE 21 2.086 -0.630 6.098
192 HB ILE 21 HB ILE 21 -0.571 -1.996 5.563
193 HG12 ILE 21 HG13 ILE 21 0.683 -1.029 8.142
194 HG13 ILE 21 HG12 ILE 21 -0.722 -0.329 7.345
195 HG21 ILE 21 HG21 ILE 21 1.861 -3.020 7.024
196 HG22 ILE 21 HG22 ILE 21 1.269 -3.585 5.462
197 HG23 ILE 21 HG23 ILE 21 0.305 -3.842 6.916
198 HD11 ILE 21 HD11 ILE 21 -0.549 -3.070 8.573
199 HD12 ILE 21 HD12 ILE 21 -1.953 -2.417 7.729
200 HD13 ILE 21 HD13 ILE 21 -1.401 -1.672 9.228
201 H ASP 22 H ASP 22 3.193 -2.422 5.004
202 HA ASP 22 HA ASP 22 2.550 -2.707 2.181
203 HB2 ASP 22 HB3 ASP 22 4.516 -1.785 1.362
204 HB3 ASP 22 HB2 ASP 22 4.101 -0.694 2.667
205 H LYS 23 H LYS 23 4.816 -3.929 1.286
206 HA LYS 23 HA LYS 23 4.668 -6.555 2.374
207 HB2 LYS 23 HB3 LYS 23 6.299 -7.135 0.716
208 HB3 LYS 23 HB2 LYS 23 5.204 -5.964 -0.009
209 HG2 LYS 23 HG3 LYS 23 6.837 -4.186 0.410
210 HG3 LYS 23 HG2 LYS 23 7.936 -5.372 1.109
211 HD2 LYS 23 HD3 LYS 23 8.680 -5.068 -1.098
212 HD3 LYS 23 HD2 LYS 23 7.779 -6.585 -1.126
213 HE2 LYS 23 HE3 LYS 23 5.802 -5.349 -1.934
214 HE3 LYS 23 HE2 LYS 23 6.778 -3.877 -1.976
215 HZ1 LYS 23 HZ1 LYS 23 7.271 -6.340 -3.563
216 HZ2 LYS 23 HZ2 LYS 23 8.225 -4.946 -3.601
217 HZ3 LYS 23 HZ3 LYS 23 6.631 -4.895 -4.157
218 H VAL 24 H VAL 24 6.013 -3.967 3.741
219 HA VAL 24 HA VAL 24 7.436 -3.634 5.460
220 HB VAL 24 HB VAL 24 8.265 -6.540 5.319
221 HG11 VAL 24 HG11 VAL 24 8.461 -4.424 7.449
222 HG12 VAL 24 HG12 VAL 24 9.785 -5.255 6.633
223 HG13 VAL 24 HG13 VAL 24 8.742 -6.139 7.747
224 HG21 VAL 24 HG21 VAL 24 5.833 -6.380 5.576
225 HG22 VAL 24 HG22 VAL 24 6.049 -5.288 6.942
226 HG23 VAL 24 HG23 VAL 24 6.596 -6.959 7.056
227 H LEU 25 H LEU 25 8.040 -3.141 2.815
228 HA LEU 25 HA LEU 25 10.965 -3.024 3.038
229 HB2 LEU 25 HB3 LEU 25 9.377 -3.890 0.660
230 HB3 LEU 25 HB2 LEU 25 10.822 -2.941 0.393
231 HG LEU 25 HG LEU 25 12.034 -4.719 1.802
232 HD11 LEU 25 HD11 LEU 25 9.975 -5.779 2.672
233 HD12 LEU 25 HD12 LEU 25 11.068 -6.908 1.871
234 HD13 LEU 25 HD13 LEU 25 9.621 -6.345 1.039
235 HD21 LEU 25 HD21 LEU 25 10.920 -5.417 -0.908
236 HD22 LEU 25 HD22 LEU 25 12.332 -6.157 -0.153
237 HD23 LEU 25 HD23 LEU 25 12.358 -4.448 -0.585
238 H ARG 26 H ARG 26 8.406 -1.753 0.865
239 HA ARG 26 HA ARG 26 8.933 0.923 1.859
240 HB2 ARG 26 HB3 ARG 26 8.949 1.538 -0.784
241 HB3 ARG 26 HB2 ARG 26 10.381 1.408 0.220
242 HG2 ARG 26 HG3 ARG 26 10.791 0.243 -1.806
243 HG3 ARG 26 HG2 ARG 26 10.616 -0.952 -0.525
244 HD2 ARG 26 HD3 ARG 26 8.364 -1.459 -1.260
245 HD3 ARG 26 HD2 ARG 26 8.439 -0.183 -2.481
246 HE ARG 26 HE ARG 26 10.534 -2.157 -2.690
247 HH11 ARG 26 HH11 ARG 26 7.226 -1.420 -3.617
248 HH12 ARG 26 HH12 ARG 26 7.321 -2.331 -5.091
249 HH21 ARG 26 HH22 ARG 26 10.623 -3.382 -4.600
250 HH22 ARG 26 HH21 ARG 26 9.245 -3.446 -5.648
251 HA PRO 27 HA PRO 27 4.457 0.591 1.284
252 HB2 PRO 27 HB2 PRO 27 4.586 3.152 2.750
253 HB3 PRO 27 HB3 PRO 27 3.667 1.680 3.122
254 HG2 PRO 27 HG3 PRO 27 5.804 2.393 4.555
255 HG3 PRO 27 HG2 PRO 27 5.435 0.695 4.202
256 HD2 PRO 27 HD3 PRO 27 7.461 2.501 2.935
257 HD3 PRO 27 HD2 PRO 27 7.602 0.786 3.371
258 H GLN 28 H GLN 28 6.681 3.050 0.362
259 HA GLN 28 HA GLN 28 4.737 4.702 -0.966
260 HB2 GLN 28 HB3 GLN 28 7.757 4.687 -1.052
261 HB3 GLN 28 HB2 GLN 28 6.762 5.851 -1.915
262 HG2 GLN 28 HG3 GLN 28 7.474 6.917 0.061
263 HG3 GLN 28 HG2 GLN 28 5.780 6.502 0.307
264 HE21 GLN 28 HE22 GLN 28 5.981 6.569 2.537
265 HE22 GLN 28 HE21 GLN 28 6.816 5.346 3.431
266 H GLY 29 H GLY 29 6.140 1.763 -1.642
267 HA2 GLY 29 HA3 GLY 29 5.889 0.395 -3.471
268 HA3 GLY 29 HA2 GLY 29 4.979 1.681 -4.248
Start of MODEL 16
1 H1 ARG 1 H1 ARG 1 -9.678 4.199 2.847
2 H2 ARG 1 H2 ARG 1 -11.034 3.207 3.011
3 H3 ARG 1 H3 ARG 1 -11.100 4.564 2.003
4 HA ARG 1 HA ARG 1 -10.891 2.590 0.688
5 HB2 ARG 1 HB3 ARG 1 -8.341 4.217 0.827
6 HB3 ARG 1 HB2 ARG 1 -8.761 3.135 -0.492
7 HG2 ARG 1 HG3 ARG 1 -10.623 4.499 -1.107
8 HG3 ARG 1 HG2 ARG 1 -10.415 5.509 0.326
9 HD2 ARG 1 HD3 ARG 1 -9.524 6.601 -1.667
10 HD3 ARG 1 HD2 ARG 1 -8.251 6.256 -0.497
11 HE ARG 1 HE ARG 1 -8.255 4.105 -2.200
12 HH11 ARG 1 HH12 ARG 1 -7.855 7.563 -2.539
13 HH12 ARG 1 HH11 ARG 1 -6.840 7.438 -3.939
14 HH21 ARG 1 HH21 ARG 1 -6.899 3.930 -4.020
15 HH22 ARG 1 HH22 ARG 1 -6.293 5.369 -4.784
16 H LYS 2 H LYS 2 -10.209 0.534 0.562
17 HA LYS 2 HA LYS 2 -7.764 -0.417 1.597
18 HB2 LYS 2 HB3 LYS 2 -9.273 0.040 3.692
19 HB3 LYS 2 HB2 LYS 2 -10.094 -1.427 3.191
20 HG2 LYS 2 HG3 LYS 2 -7.942 -2.640 3.333
21 HG3 LYS 2 HG2 LYS 2 -7.191 -1.158 3.937
22 HD2 LYS 2 HD3 LYS 2 -8.736 -1.164 5.841
23 HD3 LYS 2 HD2 LYS 2 -9.447 -2.668 5.252
24 HE2 LYS 2 HE3 LYS 2 -7.313 -3.799 5.502
25 HE3 LYS 2 HE2 LYS 2 -6.553 -2.295 6.013
26 HZ1 LYS 2 HZ1 LYS 2 -7.130 -3.772 7.870
27 HZ2 LYS 2 HZ2 LYS 2 -8.765 -3.636 7.465
28 HZ3 LYS 2 HZ3 LYS 2 -7.904 -2.273 7.975
29 H CYS 3 H CYS 3 -8.780 -0.662 -0.812
30 HA CYS 3 HA CYS 3 -10.519 -2.919 -1.112
31 HB2 CYS 3 HB3 CYS 3 -10.332 -2.501 -3.510
32 HB3 CYS 3 HB2 CYS 3 -10.713 -1.035 -2.632
33 H ASN 4 H ASN 4 -8.772 -4.127 0.206
34 HA ASN 4 HA ASN 4 -7.601 -6.071 0.248
35 HB2 ASN 4 HB3 ASN 4 -7.873 -6.030 -2.768
36 HB3 ASN 4 HB2 ASN 4 -7.341 -7.403 -1.803
37 HD21 ASN 4 HD22 ASN 4 -9.623 -7.066 -3.616
38 HD22 ASN 4 HD21 ASN 4 -11.022 -7.476 -2.685
39 H PHE 5 H PHE 5 -5.620 -7.067 -1.439
40 HA PHE 5 HA PHE 5 -3.426 -5.494 -0.649
41 HB2 PHE 5 HB3 PHE 5 -2.194 -7.089 -2.304
42 HB3 PHE 5 HB2 PHE 5 -2.872 -7.719 -0.809
43 HD1 PHE 5 HD2 PHE 5 -3.482 -7.384 -4.442
44 HD2 PHE 5 HD1 PHE 5 -4.502 -9.417 -0.848
45 HE1 PHE 5 HE2 PHE 5 -4.780 -9.019 -5.740
46 HE2 PHE 5 HE1 PHE 5 -5.807 -11.054 -2.139
47 HZ PHE 5 HZ PHE 5 -5.928 -10.892 -4.562
48 H LEU 6 H LEU 6 -1.747 -4.670 -2.073
49 HA LEU 6 HA LEU 6 -1.103 -2.979 -3.422
50 HB2 LEU 6 HB3 LEU 6 -2.969 -4.434 -5.281
51 HB3 LEU 6 HB2 LEU 6 -2.069 -3.021 -5.786
52 HG LEU 6 HG LEU 6 -0.858 -4.883 -6.569
53 HD11 LEU 6 HD11 LEU 6 0.515 -4.074 -4.011
54 HD12 LEU 6 HD12 LEU 6 0.497 -3.125 -5.501
55 HD13 LEU 6 HD13 LEU 6 1.263 -4.711 -5.478
56 HD21 LEU 6 HD21 LEU 6 -1.875 -6.642 -5.283
57 HD22 LEU 6 HD22 LEU 6 -1.101 -6.061 -3.810
58 HD23 LEU 6 HD23 LEU 6 -0.123 -6.732 -5.114
59 H CYS 7 H CYS 7 -3.138 -2.414 -1.570
60 HA CYS 7 HA CYS 7 -4.358 -0.084 -2.749
61 HB2 CYS 7 HB3 CYS 7 -5.952 -1.941 -3.284
62 HB3 CYS 7 HB2 CYS 7 -6.123 -2.240 -1.560
63 H LYS 8 H LYS 8 -4.903 -2.205 0.085
64 HA LYS 8 HA LYS 8 -3.254 -0.518 1.733
65 HB2 LYS 8 HB3 LYS 8 -5.449 0.675 1.768
66 HB3 LYS 8 HB2 LYS 8 -6.191 -0.779 2.410
67 HG2 LYS 8 HG3 LYS 8 -4.920 -0.619 4.431
68 HG3 LYS 8 HG2 LYS 8 -3.983 0.729 3.782
69 HD2 LYS 8 HD3 LYS 8 -5.819 2.187 3.869
70 HD3 LYS 8 HD2 LYS 8 -6.971 0.863 4.049
71 HE2 LYS 8 HE3 LYS 8 -6.220 0.422 6.268
72 HE3 LYS 8 HE2 LYS 8 -4.878 1.543 6.090
73 HZ1 LYS 8 HZ1 LYS 8 -6.438 3.362 5.949
74 HZ2 LYS 8 HZ2 LYS 8 -6.700 2.493 7.374
75 HZ3 LYS 8 HZ3 LYS 8 -7.747 2.297 6.062
76 H LEU 9 H LEU 9 -2.858 -3.029 0.962
77 HA LEU 9 HA LEU 9 -2.998 -4.555 3.432
78 HB2 LEU 9 HB3 LEU 9 -4.439 -5.348 0.966
79 HB3 LEU 9 HB2 LEU 9 -3.536 -6.611 1.774
80 HG LEU 9 HG LEU 9 -4.868 -5.824 3.888
81 HD11 LEU 9 HD11 LEU 9 -6.686 -4.904 1.670
82 HD12 LEU 9 HD12 LEU 9 -5.871 -3.859 2.831
83 HD13 LEU 9 HD13 LEU 9 -7.095 -5.003 3.382
84 HD21 LEU 9 HD21 LEU 9 -5.033 -8.024 2.863
85 HD22 LEU 9 HD22 LEU 9 -6.141 -7.387 1.648
86 HD23 LEU 9 HD23 LEU 9 -6.625 -7.435 3.343
87 H LYS 10 H LYS 10 -1.813 -4.235 0.128
88 HA LYS 10 HA LYS 10 0.674 -5.593 0.961
89 HB2 LYS 10 HB3 LYS 10 -0.667 -6.988 -0.626
90 HB3 LYS 10 HB2 LYS 10 -0.513 -5.706 -1.814
91 HG2 LYS 10 HG3 LYS 10 1.115 -7.321 -2.358
92 HG3 LYS 10 HG2 LYS 10 1.980 -5.968 -1.625
93 HD2 LYS 10 HD3 LYS 10 2.894 -7.946 -0.685
94 HD3 LYS 10 HD2 LYS 10 1.867 -7.229 0.556
95 HE2 LYS 10 HE3 LYS 10 1.402 -9.551 0.569
96 HE3 LYS 10 HE2 LYS 10 0.035 -8.773 -0.231
97 HZ1 LYS 10 HZ1 LYS 10 0.756 -10.761 -1.405
98 HZ2 LYS 10 HZ2 LYS 10 2.302 -10.108 -1.609
99 HZ3 LYS 10 HZ3 LYS 10 0.973 -9.388 -2.364
100 H GLU 11 H GLU 11 -0.680 -3.489 -1.544
101 HA GLU 11 HA GLU 11 -0.078 -1.519 -2.417
102 HB2 GLU 11 HB3 GLU 11 1.459 -1.410 0.148
103 HB3 GLU 11 HB2 GLU 11 1.560 -0.111 -1.032
104 HG2 GLU 11 HG3 GLU 11 -0.083 0.476 0.573
105 HG3 GLU 11 HG2 GLU 11 -0.908 0.091 -0.932
106 H LYS 12 H LYS 12 2.029 -0.094 -2.856
107 HA LYS 12 HA LYS 12 4.151 -1.776 -3.843
108 HB2 LYS 12 HB3 LYS 12 3.835 -1.185 -6.189
109 HB3 LYS 12 HB2 LYS 12 2.444 -2.048 -5.565
110 HG2 LYS 12 HG3 LYS 12 2.510 0.945 -5.773
111 HG3 LYS 12 HG2 LYS 12 2.038 -0.082 -7.121
112 HD2 LYS 12 HD3 LYS 12 0.341 -1.114 -5.488
113 HD3 LYS 12 HD2 LYS 12 0.665 0.302 -4.469
114 HE2 LYS 12 HE3 LYS 12 -0.140 1.786 -6.088
115 HE3 LYS 12 HE2 LYS 12 -0.023 0.585 -7.371
116 HZ1 LYS 12 HZ1 LYS 12 -1.877 -0.595 -6.442
117 HZ2 LYS 12 HZ2 LYS 12 -2.321 1.020 -6.656
118 HZ3 LYS 12 HZ3 LYS 12 -1.948 0.443 -5.114
119 H LEU 13 H LEU 13 2.706 1.461 -4.137
120 HA LEU 13 HA LEU 13 4.610 2.959 -2.878
121 HB2 LEU 13 HB3 LEU 13 6.112 1.973 -4.709
122 HB3 LEU 13 HB2 LEU 13 5.211 2.960 -5.840
123 HG LEU 13 HG LEU 13 6.600 4.215 -3.489
124 HD11 LEU 13 HD11 LEU 13 8.554 4.578 -4.908
125 HD12 LEU 13 HD12 LEU 13 7.824 3.591 -6.173
126 HD13 LEU 13 HD13 LEU 13 8.275 2.859 -4.634
127 HD21 LEU 13 HD21 LEU 13 6.696 6.146 -5.005
128 HD22 LEU 13 HD22 LEU 13 5.040 5.608 -4.728
129 HD23 LEU 13 HD23 LEU 13 5.856 5.209 -6.238
130 H ARG 14 H ARG 14 3.627 4.904 -2.616
131 HA ARG 14 HA ARG 14 2.442 6.286 -4.806
132 HB2 ARG 14 HB3 ARG 14 0.728 4.473 -3.843
133 HB3 ARG 14 HB2 ARG 14 0.406 5.766 -2.701
134 HG2 ARG 14 HG3 ARG 14 0.157 5.927 -5.696
135 HG3 ARG 14 HG2 ARG 14 -1.164 5.846 -4.531
136 HD2 ARG 14 HD3 ARG 14 -0.445 7.997 -3.591
137 HD3 ARG 14 HD2 ARG 14 0.846 8.077 -4.788
138 HE ARG 14 HE ARG 14 -1.559 7.738 -6.155
139 HH11 ARG 14 HH11 ARG 14 -0.002 10.138 -4.124
140 HH12 ARG 14 HH12 ARG 14 -0.825 11.475 -4.869
141 HH21 ARG 14 HH22 ARG 14 -2.663 9.494 -7.106
142 HH22 ARG 14 HH21 ARG 14 -2.338 11.111 -6.557
143 H THR 15 H THR 15 1.207 6.501 -1.508
144 HA THR 15 HA THR 15 2.914 8.758 -0.918
145 HB THR 15 HB THR 15 -0.079 9.169 -1.074
146 HG1 THR 15 HG1 THR 15 2.032 9.955 -2.831
147 HG21 THR 15 HG21 THR 15 2.170 11.138 -0.640
148 HG22 THR 15 HG22 THR 15 1.120 10.507 0.627
149 HG23 THR 15 HG23 THR 15 0.446 11.500 -0.661
150 H VAL 16 H VAL 16 -0.135 7.144 0.133
151 HA VAL 16 HA VAL 16 0.988 6.755 2.775
152 HB VAL 16 HB VAL 16 -1.503 8.447 2.436
153 HG11 VAL 16 HG11 VAL 16 -1.594 6.670 4.232
154 HG12 VAL 16 HG12 VAL 16 -1.815 8.333 4.786
155 HG13 VAL 16 HG13 VAL 16 -0.266 7.523 5.023
156 HG21 VAL 16 HG21 VAL 16 -0.283 10.125 3.726
157 HG22 VAL 16 HG22 VAL 16 0.573 9.727 2.239
158 HG23 VAL 16 HG23 VAL 16 1.129 9.070 3.777
159 H ILE 17 H ILE 17 -2.286 6.840 1.317
160 HA ILE 17 HA ILE 17 -3.035 4.514 2.787
161 HB ILE 17 HB ILE 17 -4.579 6.400 2.089
162 HG12 ILE 17 HG13 ILE 17 -5.321 4.146 2.984
163 HG13 ILE 17 HG12 ILE 17 -6.518 5.048 2.071
164 HG21 ILE 17 HG21 ILE 17 -3.975 6.584 -0.242
165 HG22 ILE 17 HG22 ILE 17 -5.694 6.230 -0.083
166 HG23 ILE 17 HG23 ILE 17 -4.570 4.956 -0.550
167 HD11 ILE 17 HD11 ILE 17 -6.683 2.767 1.455
168 HD12 ILE 17 HD12 ILE 17 -4.948 2.655 1.163
169 HD13 ILE 17 HD13 ILE 17 -5.960 3.630 0.098
170 H THR 18 H THR 18 -2.074 5.132 -0.539
171 HA THR 18 HA THR 18 -2.542 2.380 -1.319
172 HB THR 18 HB THR 18 -1.190 4.486 -2.998
173 HG1 THR 18 HG1 THR 18 -3.938 4.202 -2.337
174 HG21 THR 18 HG21 THR 18 -2.986 2.157 -3.679
175 HG22 THR 18 HG22 THR 18 -1.234 2.200 -3.861
176 HG23 THR 18 HG23 THR 18 -2.247 3.263 -4.838
177 H SER 19 H SER 19 -0.357 3.821 0.469
178 HA SER 19 HA SER 19 1.581 1.702 0.002
179 HB2 SER 19 HB3 SER 19 2.399 3.707 -1.235
180 HB3 SER 19 HB2 SER 19 2.364 4.618 0.272
181 HG SER 19 HG SER 19 3.835 2.213 0.056
182 H HIS 20 H HIS 20 0.011 1.247 1.933
183 HA HIS 20 HA HIS 20 0.854 2.697 4.341
184 HB2 HIS 20 HB3 HIS 20 -1.513 3.075 3.594
185 HB3 HIS 20 HB2 HIS 20 -1.812 1.360 3.863
186 HD1 HIS 20 HD1 HIS 20 -0.447 4.268 5.922
187 HD2 HIS 20 HD2 HIS 20 -2.831 0.884 6.310
188 HE1 HIS 20 HE1 HIS 20 -1.249 4.275 8.304
189 HE2 HIS 20 HE2 HIS 20 -2.743 2.257 8.499
190 H ILE 21 H ILE 21 -0.839 -0.375 3.639
191 HA ILE 21 HA ILE 21 0.793 -1.648 5.710
192 HB ILE 21 HB ILE 21 -1.515 -2.887 4.190
193 HG12 ILE 21 HG13 ILE 21 -1.518 -1.403 6.831
194 HG13 ILE 21 HG12 ILE 21 -2.329 -0.905 5.352
195 HG21 ILE 21 HG21 ILE 21 -0.021 -4.481 5.287
196 HG22 ILE 21 HG22 ILE 21 -1.587 -4.433 6.096
197 HG23 ILE 21 HG23 ILE 21 -0.200 -3.612 6.812
198 HD11 ILE 21 HD11 ILE 21 -3.899 -1.830 6.952
199 HD12 ILE 21 HD12 ILE 21 -2.989 -3.340 6.991
200 HD13 ILE 21 HD13 ILE 21 -3.806 -2.841 5.510
201 H ASP 22 H ASP 22 2.193 -0.851 3.667
202 HA ASP 22 HA ASP 22 2.511 -2.420 1.406
203 HB2 ASP 22 HB3 ASP 22 3.556 -0.210 1.784
204 HB3 ASP 22 HB2 ASP 22 4.599 -0.928 2.993
205 H LYS 23 H LYS 23 4.143 -3.934 0.894
206 HA LYS 23 HA LYS 23 4.477 -6.076 2.691
207 HB2 LYS 23 HB3 LYS 23 6.129 -6.917 0.979
208 HB3 LYS 23 HB2 LYS 23 4.526 -6.551 0.358
209 HG2 LYS 23 HG3 LYS 23 6.563 -4.403 0.218
210 HG3 LYS 23 HG2 LYS 23 6.748 -5.776 -0.872
211 HD2 LYS 23 HD3 LYS 23 4.592 -5.401 -1.827
212 HD3 LYS 23 HD2 LYS 23 4.194 -4.194 -0.612
213 HE2 LYS 23 HE3 LYS 23 4.754 -3.099 -2.672
214 HE3 LYS 23 HE2 LYS 23 6.009 -2.759 -1.480
215 HZ1 LYS 23 HZ1 LYS 23 7.415 -4.388 -2.520
216 HZ2 LYS 23 HZ2 LYS 23 6.880 -3.312 -3.706
217 HZ3 LYS 23 HZ3 LYS 23 6.194 -4.852 -3.585
218 H VAL 24 H VAL 24 5.756 -3.202 3.097
219 HA VAL 24 HA VAL 24 7.368 -2.361 4.427
220 HB VAL 24 HB VAL 24 8.261 -5.185 5.040
221 HG11 VAL 24 HG11 VAL 24 8.540 -2.575 6.525
222 HG12 VAL 24 HG12 VAL 24 9.831 -3.515 5.778
223 HG13 VAL 24 HG13 VAL 24 8.977 -4.152 7.183
224 HG21 VAL 24 HG21 VAL 24 6.136 -3.551 6.429
225 HG22 VAL 24 HG22 VAL 24 6.758 -5.109 6.973
226 HG23 VAL 24 HG23 VAL 24 5.862 -4.997 5.458
227 H LEU 25 H LEU 25 7.768 -2.376 1.808
228 HA LEU 25 HA LEU 25 10.665 -2.881 1.588
229 HB2 LEU 25 HB3 LEU 25 8.473 -3.399 -0.333
230 HB3 LEU 25 HB2 LEU 25 9.951 -2.740 -1.000
231 HG LEU 25 HG LEU 25 11.200 -4.641 0.037
232 HD11 LEU 25 HD11 LEU 25 8.431 -5.684 0.589
233 HD12 LEU 25 HD12 LEU 25 9.641 -5.234 1.790
234 HD13 LEU 25 HD13 LEU 25 9.923 -6.609 0.726
235 HD21 LEU 25 HD21 LEU 25 10.578 -4.667 -2.307
236 HD22 LEU 25 HD22 LEU 25 9.007 -5.355 -1.900
237 HD23 LEU 25 HD23 LEU 25 10.477 -6.287 -1.618
238 H ARG 26 H ARG 26 7.979 -0.750 0.604
239 HA ARG 26 HA ARG 26 9.752 1.507 0.929
240 HB2 ARG 26 HB3 ARG 26 9.315 2.465 -1.319
241 HB3 ARG 26 HB2 ARG 26 10.290 1.005 -1.360
242 HG2 ARG 26 HG3 ARG 26 7.363 0.699 -1.710
243 HG3 ARG 26 HG2 ARG 26 8.278 1.423 -3.033
244 HD2 ARG 26 HD3 ARG 26 9.136 -1.144 -1.745
245 HD3 ARG 26 HD2 ARG 26 7.939 -1.120 -3.037
246 HE ARG 26 HE ARG 26 9.624 -0.179 -4.487
247 HH11 ARG 26 HH11 ARG 26 10.852 -1.392 -1.442
248 HH12 ARG 26 HH12 ARG 26 12.423 -1.745 -2.072
249 HH21 ARG 26 HH22 ARG 26 11.703 -0.616 -5.303
250 HH22 ARG 26 HH21 ARG 26 12.911 -1.295 -4.256
251 HA PRO 27 HA PRO 27 5.167 2.330 1.849
252 HB2 PRO 27 HB2 PRO 27 6.359 2.887 4.520
253 HB3 PRO 27 HB3 PRO 27 4.828 2.082 4.110
254 HG2 PRO 27 HG3 PRO 27 6.892 0.661 4.982
255 HG3 PRO 27 HG2 PRO 27 5.862 0.064 3.665
256 HD2 PRO 27 HD3 PRO 27 8.575 1.351 3.509
257 HD3 PRO 27 HD2 PRO 27 7.959 -0.074 2.641
258 H GLN 28 H GLN 28 4.769 4.329 1.143
259 HA GLN 28 HA GLN 28 6.816 6.361 1.302
260 HB2 GLN 28 HB3 GLN 28 4.056 6.450 0.075
261 HB3 GLN 28 HB2 GLN 28 5.306 7.674 -0.127
262 HG2 GLN 28 HG3 GLN 28 5.498 4.802 -1.007
263 HG3 GLN 28 HG2 GLN 28 5.180 6.188 -2.052
264 HE21 GLN 28 HE22 GLN 28 7.409 4.181 -1.907
265 HE22 GLN 28 HE21 GLN 28 8.848 5.144 -1.873
266 H GLY 29 H GLY 29 3.953 5.542 3.020
267 HA2 GLY 29 HA3 GLY 29 3.834 8.215 4.232
268 HA3 GLY 29 HA2 GLY 29 2.597 6.973 4.366
Start of MODEL 17
1 H1 ARG 1 H1 ARG 1 -11.549 1.930 3.916
2 H2 ARG 1 H2 ARG 1 -11.252 2.824 2.516
3 H3 ARG 1 H3 ARG 1 -10.097 1.727 3.073
4 HA ARG 1 HA ARG 1 -11.609 -0.108 2.660
5 HB2 ARG 1 HB3 ARG 1 -13.356 1.996 1.361
6 HB3 ARG 1 HB2 ARG 1 -13.670 0.268 1.416
7 HG2 ARG 1 HG3 ARG 1 -13.595 2.113 3.789
8 HG3 ARG 1 HG2 ARG 1 -15.045 1.497 3.005
9 HD2 ARG 1 HD3 ARG 1 -14.442 -0.770 3.608
10 HD3 ARG 1 HD2 ARG 1 -12.929 -0.205 4.313
11 HE ARG 1 HE ARG 1 -15.219 1.052 5.478
12 HH11 ARG 1 HH12 ARG 1 -13.244 -1.840 5.554
13 HH12 ARG 1 HH11 ARG 1 -13.636 -2.212 7.203
14 HH21 ARG 1 HH21 ARG 1 -15.743 0.548 7.647
15 HH22 ARG 1 HH22 ARG 1 -15.060 -0.865 8.385
16 H LYS 2 H LYS 2 -9.722 -0.542 1.505
17 HA LYS 2 HA LYS 2 -9.722 0.413 -1.279
18 HB2 LYS 2 HB3 LYS 2 -7.293 -0.220 0.410
19 HB3 LYS 2 HB2 LYS 2 -7.284 0.345 -1.252
20 HG2 LYS 2 HG3 LYS 2 -8.271 1.898 1.128
21 HG3 LYS 2 HG2 LYS 2 -6.731 2.130 0.301
22 HD2 LYS 2 HD3 LYS 2 -7.934 2.726 -1.754
23 HD3 LYS 2 HD2 LYS 2 -9.470 2.509 -0.911
24 HE2 LYS 2 HE3 LYS 2 -8.798 4.273 0.684
25 HE3 LYS 2 HE2 LYS 2 -7.326 4.524 -0.253
26 HZ1 LYS 2 HZ1 LYS 2 -8.696 5.129 -2.153
27 HZ2 LYS 2 HZ2 LYS 2 -9.007 6.136 -0.832
28 HZ3 LYS 2 HZ3 LYS 2 -10.097 4.911 -1.238
29 H CYS 3 H CYS 3 -8.160 -1.137 -2.586
30 HA CYS 3 HA CYS 3 -9.383 -3.728 -2.409
31 HB2 CYS 3 HB3 CYS 3 -7.621 -3.997 -4.430
32 HB3 CYS 3 HB2 CYS 3 -9.200 -3.241 -4.611
33 H ASN 4 H ASN 4 -7.645 -3.094 -0.222
34 HA ASN 4 HA ASN 4 -6.085 -4.037 1.120
35 HB2 ASN 4 HB3 ASN 4 -7.482 -6.052 0.676
36 HB3 ASN 4 HB2 ASN 4 -6.404 -6.469 -0.651
37 HD21 ASN 4 HD22 ASN 4 -6.769 -6.269 2.796
38 HD22 ASN 4 HD21 ASN 4 -5.367 -7.195 3.201
39 H PHE 5 H PHE 5 -4.854 -6.078 -1.412
40 HA PHE 5 HA PHE 5 -2.261 -4.998 -0.868
41 HB2 PHE 5 HB3 PHE 5 -1.543 -6.762 -2.552
42 HB3 PHE 5 HB2 PHE 5 -2.317 -7.330 -1.082
43 HD1 PHE 5 HD2 PHE 5 -2.821 -6.761 -4.685
44 HD2 PHE 5 HD1 PHE 5 -4.388 -8.507 -1.142
45 HE1 PHE 5 HE2 PHE 5 -4.468 -7.999 -6.028
46 HE2 PHE 5 HE1 PHE 5 -6.039 -9.749 -2.474
47 HZ PHE 5 HZ PHE 5 -6.120 -9.490 -4.876
48 H LEU 6 H LEU 6 -0.865 -4.014 -2.251
49 HA LEU 6 HA LEU 6 -0.296 -2.290 -3.615
50 HB2 LEU 6 HB3 LEU 6 -2.168 -3.671 -5.539
51 HB3 LEU 6 HB2 LEU 6 -1.072 -2.378 -5.971
52 HG LEU 6 HG LEU 6 0.008 -4.294 -6.709
53 HD11 LEU 6 HD11 LEU 6 1.127 -3.826 -3.953
54 HD12 LEU 6 HD12 LEU 6 1.497 -2.882 -5.395
55 HD13 LEU 6 HD13 LEU 6 1.965 -4.579 -5.309
56 HD21 LEU 6 HD21 LEU 6 -1.536 -5.843 -5.538
57 HD22 LEU 6 HD22 LEU 6 -0.538 -5.678 -4.091
58 HD23 LEU 6 HD23 LEU 6 0.139 -6.372 -5.575
59 H CYS 7 H CYS 7 -2.365 -1.730 -1.791
60 HA CYS 7 HA CYS 7 -3.866 0.347 -3.156
61 HB2 CYS 7 HB3 CYS 7 -5.299 -2.007 -1.906
62 HB3 CYS 7 HB2 CYS 7 -6.083 -0.526 -2.434
63 H LYS 8 H LYS 8 -3.903 -1.585 -0.193
64 HA LYS 8 HA LYS 8 -3.141 0.843 1.284
65 HB2 LYS 8 HB3 LYS 8 -5.434 0.384 1.942
66 HB3 LYS 8 HB2 LYS 8 -5.066 -1.319 2.189
67 HG2 LYS 8 HG3 LYS 8 -3.505 -0.652 4.010
68 HG3 LYS 8 HG2 LYS 8 -4.061 1.009 3.814
69 HD2 LYS 8 HD3 LYS 8 -5.943 -1.267 4.384
70 HD3 LYS 8 HD2 LYS 8 -5.137 -0.364 5.665
71 HE2 LYS 8 HE3 LYS 8 -6.128 1.713 4.786
72 HE3 LYS 8 HE2 LYS 8 -6.977 0.767 3.563
73 HZ1 LYS 8 HZ1 LYS 8 -8.400 1.263 5.453
74 HZ2 LYS 8 HZ2 LYS 8 -7.322 0.490 6.503
75 HZ3 LYS 8 HZ3 LYS 8 -8.142 -0.402 5.326
76 H LEU 9 H LEU 9 -2.994 -2.531 0.716
77 HA LEU 9 HA LEU 9 -0.629 -2.861 2.403
78 HB2 LEU 9 HB3 LEU 9 -2.589 -4.879 1.302
79 HB3 LEU 9 HB2 LEU 9 -1.100 -5.317 2.112
80 HG LEU 9 HG LEU 9 -2.020 -4.010 4.126
81 HD11 LEU 9 HD11 LEU 9 -4.466 -3.932 4.263
82 HD12 LEU 9 HD12 LEU 9 -4.564 -4.409 2.568
83 HD13 LEU 9 HD13 LEU 9 -3.838 -2.864 3.007
84 HD21 LEU 9 HD21 LEU 9 -3.328 -6.569 3.228
85 HD22 LEU 9 HD22 LEU 9 -3.276 -5.967 4.883
86 HD23 LEU 9 HD23 LEU 9 -1.783 -6.425 4.066
87 H LYS 10 H LYS 10 -0.100 -5.386 0.809
88 HA LYS 10 HA LYS 10 2.105 -5.505 0.044
89 HB2 LYS 10 HB3 LYS 10 0.469 -6.512 -1.518
90 HB3 LYS 10 HB2 LYS 10 0.521 -5.030 -2.465
91 HG2 LYS 10 HG3 LYS 10 2.780 -5.349 -3.045
92 HG3 LYS 10 HG2 LYS 10 2.998 -6.597 -1.825
93 HD2 LYS 10 HD3 LYS 10 1.431 -6.783 -4.381
94 HD3 LYS 10 HD2 LYS 10 2.890 -7.666 -3.950
95 HE2 LYS 10 HE3 LYS 10 1.591 -8.692 -2.063
96 HE3 LYS 10 HE2 LYS 10 0.144 -7.949 -2.754
97 HZ1 LYS 10 HZ1 LYS 10 1.914 -9.909 -4.116
98 HZ2 LYS 10 HZ2 LYS 10 0.544 -9.189 -4.797
99 HZ3 LYS 10 HZ3 LYS 10 0.383 -10.234 -3.480
100 H GLU 11 H GLU 11 0.777 -3.030 -2.127
101 HA GLU 11 HA GLU 11 1.305 -0.845 -2.385
102 HB2 GLU 11 HB3 GLU 11 2.555 -1.349 0.020
103 HB3 GLU 11 HB2 GLU 11 3.884 -0.807 -0.992
104 HG2 GLU 11 HG3 GLU 11 1.318 0.688 -0.538
105 HG3 GLU 11 HG2 GLU 11 2.850 1.003 0.276
106 H LYS 12 H LYS 12 2.877 0.424 -3.584
107 HA LYS 12 HA LYS 12 4.973 -1.029 -4.944
108 HB2 LYS 12 HB3 LYS 12 4.083 -0.838 -7.158
109 HB3 LYS 12 HB2 LYS 12 2.864 -1.617 -6.175
110 HG2 LYS 12 HG3 LYS 12 2.828 1.314 -6.811
111 HG3 LYS 12 HG2 LYS 12 2.086 0.099 -7.845
112 HD2 LYS 12 HD3 LYS 12 0.738 -0.614 -5.822
113 HD3 LYS 12 HD2 LYS 12 1.333 0.853 -5.021
114 HE2 LYS 12 HE3 LYS 12 0.351 2.248 -6.670
115 HE3 LYS 12 HE2 LYS 12 0.000 0.872 -7.709
116 HZ1 LYS 12 HZ1 LYS 12 -1.626 0.104 -6.106
117 HZ2 LYS 12 HZ2 LYS 12 -1.976 1.692 -6.570
118 HZ3 LYS 12 HZ3 LYS 12 -1.261 1.391 -5.072
119 H LEU 13 H LEU 13 2.986 1.906 -4.896
120 HA LEU 13 HA LEU 13 4.845 3.820 -4.426
121 HB2 LEU 13 HB3 LEU 13 5.845 2.813 -6.617
122 HB3 LEU 13 HB2 LEU 13 4.556 3.683 -7.417
123 HG LEU 13 HG LEU 13 6.609 5.026 -5.656
124 HD11 LEU 13 HD11 LEU 13 7.728 3.967 -7.535
125 HD12 LEU 13 HD12 LEU 13 7.704 5.718 -7.731
126 HD13 LEU 13 HD13 LEU 13 6.587 4.713 -8.654
127 HD21 LEU 13 HD21 LEU 13 4.714 6.135 -7.725
128 HD22 LEU 13 HD22 LEU 13 5.884 7.059 -6.782
129 HD23 LEU 13 HD23 LEU 13 4.522 6.276 -5.978
130 H ARG 14 H ARG 14 3.493 5.376 -3.798
131 HA ARG 14 HA ARG 14 1.693 6.651 -5.570
132 HB2 ARG 14 HB3 ARG 14 0.360 4.594 -5.025
133 HB3 ARG 14 HB2 ARG 14 0.370 5.093 -3.339
134 HG2 ARG 14 HG3 ARG 14 -1.725 5.693 -4.402
135 HG3 ARG 14 HG2 ARG 14 -0.828 7.142 -3.942
136 HD2 ARG 14 HD3 ARG 14 -0.038 7.391 -6.237
137 HD3 ARG 14 HD2 ARG 14 -0.899 5.927 -6.701
138 HE ARG 14 HE ARG 14 -2.737 7.701 -5.567
139 HH11 ARG 14 HH11 ARG 14 -0.709 7.434 -8.407
140 HH12 ARG 14 HH12 ARG 14 -1.761 8.384 -9.404
141 HH21 ARG 14 HH22 ARG 14 -4.110 8.980 -6.874
142 HH22 ARG 14 HH21 ARG 14 -3.691 9.264 -8.532
143 H THR 15 H THR 15 2.383 5.937 -2.170
144 HA THR 15 HA THR 15 3.049 7.299 -0.472
145 HB THR 15 HB THR 15 3.016 9.538 -2.491
146 HG1 THR 15 HG1 THR 15 5.426 8.415 -1.689
147 HG21 THR 15 HG21 THR 15 4.620 10.612 -0.951
148 HG22 THR 15 HG22 THR 15 4.402 9.276 0.179
149 HG23 THR 15 HG23 THR 15 3.051 10.347 -0.191
150 H VAL 16 H VAL 16 0.959 6.824 0.360
151 HA VAL 16 HA VAL 16 -0.379 8.897 1.500
152 HB VAL 16 HB VAL 16 -1.036 9.355 -0.940
153 HG11 VAL 16 HG11 VAL 16 -2.828 6.988 -0.503
154 HG12 VAL 16 HG12 VAL 16 -1.517 7.123 -1.674
155 HG13 VAL 16 HG13 VAL 16 -2.953 8.134 -1.838
156 HG21 VAL 16 HG21 VAL 16 -3.339 10.017 -0.366
157 HG22 VAL 16 HG22 VAL 16 -2.152 10.483 0.852
158 HG23 VAL 16 HG23 VAL 16 -3.205 9.102 1.131
159 H ILE 17 H ILE 17 -3.101 7.606 1.420
160 HA ILE 17 HA ILE 17 -2.772 5.646 3.369
161 HB ILE 17 HB ILE 17 -4.879 6.869 2.967
162 HG12 ILE 17 HG13 ILE 17 -4.667 4.457 4.058
163 HG13 ILE 17 HG12 ILE 17 -6.227 5.235 3.850
164 HG21 ILE 17 HG21 ILE 17 -4.935 6.843 0.560
165 HG22 ILE 17 HG22 ILE 17 -6.420 6.141 1.203
166 HG23 ILE 17 HG23 ILE 17 -5.159 5.094 0.553
167 HD11 ILE 17 HD11 ILE 17 -6.480 2.987 3.194
168 HD12 ILE 17 HD12 ILE 17 -5.031 3.026 2.193
169 HD13 ILE 17 HD13 ILE 17 -6.461 3.936 1.711
170 H THR 18 H THR 18 -2.799 5.405 -0.115
171 HA THR 18 HA THR 18 -2.896 2.660 -0.486
172 HB THR 18 HB THR 18 -1.104 4.591 -1.990
173 HG1 THR 18 HG1 THR 18 -3.743 3.882 -2.770
174 HG21 THR 18 HG21 THR 18 -2.436 2.009 -2.842
175 HG22 THR 18 HG22 THR 18 -0.722 2.219 -2.486
176 HG23 THR 18 HG23 THR 18 -1.444 3.049 -3.864
177 H SER 19 H SER 19 0.020 4.658 -0.381
178 HA SER 19 HA SER 19 1.719 2.496 0.312
179 HB2 SER 19 HB3 SER 19 2.224 5.468 0.434
180 HB3 SER 19 HB2 SER 19 3.448 4.199 0.411
181 HG SER 19 HG SER 19 2.817 3.645 -1.666
182 H HIS 20 H HIS 20 -0.158 2.329 2.249
183 HA HIS 20 HA HIS 20 1.084 3.590 4.600
184 HB2 HIS 20 HB3 HIS 20 -1.413 3.848 4.234
185 HB3 HIS 20 HB2 HIS 20 -1.552 2.121 4.559
186 HD1 HIS 20 HD1 HIS 20 -1.870 1.503 6.955
187 HD2 HIS 20 HD2 HIS 20 -0.174 5.271 6.523
188 HE1 HIS 20 HE1 HIS 20 -1.664 2.424 9.284
189 HE2 HIS 20 HE2 HIS 20 -0.738 4.747 8.987
190 H ILE 21 H ILE 21 -0.348 0.457 3.674
191 HA ILE 21 HA ILE 21 1.513 -0.864 5.531
192 HB ILE 21 HB ILE 21 -0.928 -2.033 4.176
193 HG12 ILE 21 HG13 ILE 21 -0.593 -1.057 7.019
194 HG13 ILE 21 HG12 ILE 21 -1.583 -0.300 5.776
195 HG21 ILE 21 HG21 ILE 21 -0.656 -3.870 5.778
196 HG22 ILE 21 HG22 ILE 21 0.811 -3.109 6.392
197 HG23 ILE 21 HG23 ILE 21 0.754 -3.698 4.732
198 HD11 ILE 21 HD11 ILE 21 -3.023 -2.249 5.707
199 HD12 ILE 21 HD12 ILE 21 -2.919 -1.608 7.345
200 HD13 ILE 21 HD13 ILE 21 -2.014 -3.055 6.906
201 H ASP 22 H ASP 22 2.854 -2.510 4.759
202 HA ASP 22 HA ASP 22 3.072 -2.614 1.822
203 HB2 ASP 22 HB3 ASP 22 4.864 -1.289 3.038
204 HB3 ASP 22 HB2 ASP 22 5.361 -2.785 3.801
205 H LYS 23 H LYS 23 3.951 -4.587 0.957
206 HA LYS 23 HA LYS 23 3.144 -6.970 2.207
207 HB2 LYS 23 HB3 LYS 23 4.794 -8.014 0.478
208 HB3 LYS 23 HB2 LYS 23 3.342 -7.204 -0.077
209 HG2 LYS 23 HG3 LYS 23 5.030 -6.463 -1.508
210 HG3 LYS 23 HG2 LYS 23 4.801 -5.135 -0.372
211 HD2 LYS 23 HD3 LYS 23 6.723 -6.081 0.946
212 HD3 LYS 23 HD2 LYS 23 7.006 -7.179 -0.405
213 HE2 LYS 23 HE3 LYS 23 7.184 -5.166 -1.886
214 HE3 LYS 23 HE2 LYS 23 7.122 -4.163 -0.427
215 HZ1 LYS 23 HZ1 LYS 23 9.164 -6.253 -0.981
216 HZ2 LYS 23 HZ2 LYS 23 9.119 -5.226 0.363
217 HZ3 LYS 23 HZ3 LYS 23 9.395 -4.591 -1.178
218 H VAL 24 H VAL 24 6.049 -5.099 2.494
219 HA VAL 24 HA VAL 24 6.922 -6.955 4.595
220 HB VAL 24 HB VAL 24 8.804 -5.752 2.548
221 HG11 VAL 24 HG11 VAL 24 9.396 -7.356 5.033
222 HG12 VAL 24 HG12 VAL 24 9.803 -5.663 4.754
223 HG13 VAL 24 HG13 VAL 24 10.579 -6.926 3.798
224 HG21 VAL 24 HG21 VAL 24 8.160 -8.631 3.176
225 HG22 VAL 24 HG22 VAL 24 9.374 -8.075 2.025
226 HG23 VAL 24 HG23 VAL 24 7.666 -7.749 1.730
227 H LEU 25 H LEU 25 8.411 -4.018 3.253
228 HA LEU 25 HA LEU 25 7.221 -2.169 4.950
229 HB2 LEU 25 HB3 LEU 25 8.702 -3.735 6.527
230 HB3 LEU 25 HB2 LEU 25 9.968 -2.645 6.001
231 HG LEU 25 HG LEU 25 9.011 -1.981 8.163
232 HD11 LEU 25 HD11 LEU 25 8.390 -0.044 5.943
233 HD12 LEU 25 HD12 LEU 25 9.945 -0.245 6.753
234 HD13 LEU 25 HD13 LEU 25 8.554 0.365 7.650
235 HD21 LEU 25 HD21 LEU 25 6.744 -2.836 7.798
236 HD22 LEU 25 HD22 LEU 25 6.450 -1.540 6.639
237 HD23 LEU 25 HD23 LEU 25 6.743 -1.158 8.335
238 H ARG 26 H ARG 26 7.609 -1.622 2.456
239 HA ARG 26 HA ARG 26 9.493 0.560 2.833
240 HB2 ARG 26 HB3 ARG 26 10.845 0.199 1.056
241 HB3 ARG 26 HB2 ARG 26 10.412 -1.462 1.374
242 HG2 ARG 26 HG3 ARG 26 9.245 0.302 -0.769
243 HG3 ARG 26 HG2 ARG 26 10.434 -0.974 -0.997
244 HD2 ARG 26 HD3 ARG 26 8.742 -2.598 -0.145
245 HD3 ARG 26 HD2 ARG 26 7.564 -1.281 -0.136
246 HE ARG 26 HE ARG 26 8.961 -1.815 -2.641
247 HH11 ARG 26 HH11 ARG 26 6.013 -2.081 -0.748
248 HH12 ARG 26 HH12 ARG 26 5.027 -2.441 -2.140
249 HH21 ARG 26 HH22 ARG 26 7.659 -2.269 -4.448
250 HH22 ARG 26 HH21 ARG 26 5.961 -2.560 -4.231
251 HA PRO 27 HA PRO 27 5.302 1.513 0.829
252 HB2 PRO 27 HB2 PRO 27 4.041 2.752 2.888
253 HB3 PRO 27 HB3 PRO 27 3.959 0.996 2.635
254 HG2 PRO 27 HG3 PRO 27 5.647 2.565 4.540
255 HG3 PRO 27 HG2 PRO 27 4.797 1.030 4.794
256 HD2 PRO 27 HD3 PRO 27 7.475 1.211 4.280
257 HD3 PRO 27 HD2 PRO 27 6.488 -0.200 3.858
258 H GLN 28 H GLN 28 4.992 3.472 -0.160
259 HA GLN 28 HA GLN 28 7.139 5.336 0.131
260 HB2 GLN 28 HB3 GLN 28 4.674 5.529 -1.592
261 HB3 GLN 28 HB2 GLN 28 6.124 6.506 -1.752
262 HG2 GLN 28 HG3 GLN 28 5.905 3.538 -2.183
263 HG3 GLN 28 HG2 GLN 28 6.086 4.782 -3.417
264 HE21 GLN 28 HE22 GLN 28 7.683 2.925 -0.961
265 HE22 GLN 28 HE21 GLN 28 9.294 3.390 -1.377
266 H GLY 29 H GLY 29 4.279 5.137 1.851
267 HA2 GLY 29 HA3 GLY 29 4.277 8.063 2.273
268 HA3 GLY 29 HA2 GLY 29 2.798 7.107 2.302
Start of MODEL 18
1 H1 ARG 1 H1 ARG 1 -9.451 3.255 3.649
2 H2 ARG 1 H2 ARG 1 -10.736 3.256 4.746
3 H3 ARG 1 H3 ARG 1 -10.912 3.994 3.237
4 HA ARG 1 HA ARG 1 -10.455 1.109 3.679
5 HB2 ARG 1 HB3 ARG 1 -12.822 0.891 2.877
6 HB3 ARG 1 HB2 ARG 1 -12.650 1.630 4.461
7 HG2 ARG 1 HG3 ARG 1 -12.815 3.866 3.276
8 HG3 ARG 1 HG2 ARG 1 -13.336 2.953 1.859
9 HD2 ARG 1 HD3 ARG 1 -15.254 3.752 3.118
10 HD3 ARG 1 HD2 ARG 1 -15.170 1.993 3.160
11 HE ARG 1 HE ARG 1 -14.021 3.499 5.389
12 HH11 ARG 1 HH12 ARG 1 -16.542 1.408 4.169
13 HH12 ARG 1 HH11 ARG 1 -17.140 0.998 5.743
14 HH21 ARG 1 HH21 ARG 1 -14.800 2.967 7.463
15 HH22 ARG 1 HH22 ARG 1 -16.150 1.891 7.619
16 H LYS 2 H LYS 2 -9.875 0.007 1.934
17 HA LYS 2 HA LYS 2 -10.156 1.159 -0.727
18 HB2 LYS 2 HB3 LYS 2 -7.514 0.530 0.594
19 HB3 LYS 2 HB2 LYS 2 -7.694 0.678 -1.145
20 HG2 LYS 2 HG3 LYS 2 -8.369 2.860 0.805
21 HG3 LYS 2 HG2 LYS 2 -6.816 2.702 -0.015
22 HD2 LYS 2 HD3 LYS 2 -7.994 2.836 -2.187
23 HD3 LYS 2 HD2 LYS 2 -9.511 3.083 -1.323
24 HE2 LYS 2 HE3 LYS 2 -8.565 5.115 -0.300
25 HE3 LYS 2 HE2 LYS 2 -7.090 4.878 -1.235
26 HZ1 LYS 2 HZ1 LYS 2 -8.535 6.471 -2.305
27 HZ2 LYS 2 HZ2 LYS 2 -9.800 5.349 -2.353
28 HZ3 LYS 2 HZ3 LYS 2 -8.402 5.086 -3.263
29 H CYS 3 H CYS 3 -8.300 -0.634 -1.921
30 HA CYS 3 HA CYS 3 -9.820 -3.053 -2.012
31 HB2 CYS 3 HB3 CYS 3 -7.153 -3.135 -3.212
32 HB3 CYS 3 HB2 CYS 3 -8.728 -3.370 -3.963
33 H ASN 4 H ASN 4 -7.801 -4.979 -2.319
34 HA ASN 4 HA ASN 4 -7.018 -5.347 0.467
35 HB2 ASN 4 HB3 ASN 4 -8.229 -7.181 -0.649
36 HB3 ASN 4 HB2 ASN 4 -6.950 -7.296 -1.851
37 HD21 ASN 4 HD22 ASN 4 -6.516 -9.430 -1.330
38 HD22 ASN 4 HD21 ASN 4 -5.703 -9.876 0.127
39 H PHE 5 H PHE 5 -5.369 -6.462 -2.470
40 HA PHE 5 HA PHE 5 -2.866 -5.635 -1.212
41 HB2 PHE 5 HB3 PHE 5 -1.850 -7.091 -3.044
42 HB3 PHE 5 HB2 PHE 5 -2.752 -7.899 -1.775
43 HD1 PHE 5 HD2 PHE 5 -2.923 -6.742 -5.279
44 HD2 PHE 5 HD1 PHE 5 -4.656 -9.207 -2.278
45 HE1 PHE 5 HE2 PHE 5 -4.329 -7.821 -6.981
46 HE2 PHE 5 HE1 PHE 5 -6.066 -10.290 -3.974
47 HZ PHE 5 HZ PHE 5 -5.908 -9.610 -6.320
48 H LEU 6 H LEU 6 -1.195 -4.690 -2.469
49 HA LEU 6 HA LEU 6 -0.450 -2.815 -3.516
50 HB2 LEU 6 HB3 LEU 6 -2.102 -4.017 -5.743
51 HB3 LEU 6 HB2 LEU 6 -0.988 -2.685 -5.960
52 HG LEU 6 HG LEU 6 0.234 -4.494 -6.707
53 HD11 LEU 6 HD11 LEU 6 0.946 -4.283 -3.787
54 HD12 LEU 6 HD12 LEU 6 1.547 -3.270 -5.100
55 HD13 LEU 6 HD13 LEU 6 1.958 -4.983 -5.050
56 HD21 LEU 6 HD21 LEU 6 -1.256 -6.268 -6.143
57 HD22 LEU 6 HD22 LEU 6 -0.887 -6.098 -4.428
58 HD23 LEU 6 HD23 LEU 6 0.351 -6.671 -5.542
59 H CYS 7 H CYS 7 -2.420 -2.131 -1.840
60 HA CYS 7 HA CYS 7 -3.682 0.096 -3.117
61 HB2 CYS 7 HB3 CYS 7 -5.142 -1.875 -3.758
62 HB3 CYS 7 HB2 CYS 7 -5.557 -2.025 -2.055
63 H LYS 8 H LYS 8 -2.874 -1.769 -0.378
64 HA LYS 8 HA LYS 8 -2.643 0.402 1.343
65 HB2 LYS 8 HB3 LYS 8 -5.076 0.479 1.394
66 HB3 LYS 8 HB2 LYS 8 -5.154 -1.234 1.773
67 HG2 LYS 8 HG3 LYS 8 -4.379 -0.904 3.957
68 HG3 LYS 8 HG2 LYS 8 -3.782 0.714 3.593
69 HD2 LYS 8 HD3 LYS 8 -5.825 0.805 4.924
70 HD3 LYS 8 HD2 LYS 8 -6.075 1.506 3.330
71 HE2 LYS 8 HE3 LYS 8 -7.981 0.175 3.878
72 HE3 LYS 8 HE2 LYS 8 -7.081 -0.642 2.601
73 HZ1 LYS 8 HZ1 LYS 8 -7.804 -2.185 4.314
74 HZ2 LYS 8 HZ2 LYS 8 -6.976 -1.309 5.497
75 HZ3 LYS 8 HZ3 LYS 8 -6.119 -2.102 4.278
76 H LEU 9 H LEU 9 -2.819 -2.953 0.737
77 HA LEU 9 HA LEU 9 -1.690 -3.629 3.339
78 HB2 LEU 9 HB3 LEU 9 -3.278 -5.151 1.340
79 HB3 LEU 9 HB2 LEU 9 -2.244 -6.022 2.464
80 HG LEU 9 HG LEU 9 -3.469 -4.760 4.324
81 HD11 LEU 9 HD11 LEU 9 -5.439 -4.298 2.096
82 HD12 LEU 9 HD12 LEU 9 -4.502 -3.054 2.925
83 HD13 LEU 9 HD13 LEU 9 -5.708 -3.985 3.810
84 HD21 LEU 9 HD21 LEU 9 -4.960 -6.761 2.638
85 HD22 LEU 9 HD22 LEU 9 -5.324 -6.357 4.317
86 HD23 LEU 9 HD23 LEU 9 -3.788 -7.123 3.908
87 H LYS 10 H LYS 10 -1.323 -4.853 -0.024
88 HA LYS 10 HA LYS 10 1.288 -5.824 0.603
89 HB2 LYS 10 HB3 LYS 10 -0.148 -6.933 -1.053
90 HB3 LYS 10 HB2 LYS 10 -0.017 -5.531 -2.097
91 HG2 LYS 10 HG3 LYS 10 2.209 -5.913 -2.573
92 HG3 LYS 10 HG2 LYS 10 2.418 -6.955 -1.172
93 HD2 LYS 10 HD3 LYS 10 0.827 -7.599 -3.653
94 HD3 LYS 10 HD2 LYS 10 2.408 -8.257 -3.235
95 HE2 LYS 10 HE3 LYS 10 1.298 -9.119 -1.105
96 HE3 LYS 10 HE2 LYS 10 -0.235 -8.739 -1.892
97 HZ1 LYS 10 HZ1 LYS 10 1.838 -10.599 -2.918
98 HZ2 LYS 10 HZ2 LYS 10 0.400 -10.210 -3.716
99 HZ3 LYS 10 HZ3 LYS 10 0.350 -11.038 -2.244
100 H GLU 11 H GLU 11 0.053 -2.903 -0.732
101 HA GLU 11 HA GLU 11 0.992 -0.848 -0.950
102 HB2 GLU 11 HB3 GLU 11 2.436 -1.422 0.957
103 HB3 GLU 11 HB2 GLU 11 3.571 -2.205 -0.127
104 HG2 GLU 11 HG3 GLU 11 2.912 0.668 -0.534
105 HG3 GLU 11 HG2 GLU 11 3.997 0.207 0.770
106 H LYS 12 H LYS 12 1.868 0.345 -2.625
107 HA LYS 12 HA LYS 12 3.089 -1.183 -4.823
108 HB2 LYS 12 HB3 LYS 12 1.537 -0.089 -6.393
109 HB3 LYS 12 HB2 LYS 12 0.682 -1.078 -5.212
110 HG2 LYS 12 HG3 LYS 12 0.382 1.060 -3.872
111 HG3 LYS 12 HG2 LYS 12 0.911 1.910 -5.322
112 HD2 LYS 12 HD3 LYS 12 -1.426 0.016 -5.185
113 HD3 LYS 12 HD2 LYS 12 -1.538 1.775 -5.098
114 HE2 LYS 12 HE3 LYS 12 -0.630 1.979 -7.329
115 HE3 LYS 12 HE2 LYS 12 -0.360 0.239 -7.411
116 HZ1 LYS 12 HZ1 LYS 12 -2.364 0.888 -8.595
117 HZ2 LYS 12 HZ2 LYS 12 -3.011 1.557 -7.182
118 HZ3 LYS 12 HZ3 LYS 12 -2.742 -0.108 -7.285
119 H LEU 13 H LEU 13 3.986 0.979 -2.848
120 HA LEU 13 HA LEU 13 4.961 3.020 -2.728
121 HB2 LEU 13 HB3 LEU 13 5.911 1.912 -5.325
122 HB3 LEU 13 HB2 LEU 13 6.320 3.566 -4.921
123 HG LEU 13 HG LEU 13 7.021 1.135 -3.268
124 HD11 LEU 13 HD11 LEU 13 8.281 1.282 -5.365
125 HD12 LEU 13 HD12 LEU 13 9.306 1.577 -3.962
126 HD13 LEU 13 HD13 LEU 13 8.762 2.928 -4.956
127 HD21 LEU 13 HD21 LEU 13 8.397 2.716 -1.978
128 HD22 LEU 13 HD22 LEU 13 6.679 3.090 -1.869
129 HD23 LEU 13 HD23 LEU 13 7.725 4.048 -2.916
130 H ARG 14 H ARG 14 2.497 3.610 -2.963
131 HA ARG 14 HA ARG 14 2.023 5.195 -5.350
132 HB2 ARG 14 HB3 ARG 14 0.234 3.733 -4.381
133 HB3 ARG 14 HB2 ARG 14 0.186 4.805 -2.989
134 HG2 ARG 14 HG3 ARG 14 -1.604 5.298 -4.574
135 HG3 ARG 14 HG2 ARG 14 -0.492 6.658 -4.406
136 HD2 ARG 14 HD3 ARG 14 0.624 6.021 -6.471
137 HD3 ARG 14 HD2 ARG 14 -0.430 4.620 -6.630
138 HE ARG 14 HE ARG 14 -2.236 6.540 -6.613
139 HH11 ARG 14 HH11 ARG 14 0.864 6.455 -8.244
140 HH12 ARG 14 HH12 ARG 14 0.349 7.469 -9.555
141 HH21 ARG 14 HH22 ARG 14 -2.923 7.868 -8.349
142 HH22 ARG 14 HH21 ARG 14 -1.808 8.259 -9.621
143 H THR 15 H THR 15 1.274 5.974 -1.940
144 HA THR 15 HA THR 15 2.957 8.303 -2.022
145 HB THR 15 HB THR 15 0.018 8.822 -1.625
146 HG1 THR 15 HG1 THR 15 1.507 8.692 -4.023
147 HG21 THR 15 HG21 THR 15 2.255 10.669 -2.435
148 HG22 THR 15 HG22 THR 15 1.757 10.402 -0.765
149 HG23 THR 15 HG23 THR 15 0.627 11.112 -1.916
150 H VAL 16 H VAL 16 0.138 6.878 -0.297
151 HA VAL 16 HA VAL 16 1.507 7.207 2.242
152 HB VAL 16 HB VAL 16 -1.103 8.664 1.763
153 HG11 VAL 16 HG11 VAL 16 -0.996 7.695 3.990
154 HG12 VAL 16 HG12 VAL 16 -0.853 9.451 4.067
155 HG13 VAL 16 HG13 VAL 16 0.580 8.441 4.254
156 HG21 VAL 16 HG21 VAL 16 1.638 9.768 2.351
157 HG22 VAL 16 HG22 VAL 16 0.149 10.704 2.222
158 HG23 VAL 16 HG23 VAL 16 0.789 9.867 0.810
159 H ILE 17 H ILE 17 -1.943 6.888 1.299
160 HA ILE 17 HA ILE 17 -2.253 4.853 3.324
161 HB ILE 17 HB ILE 17 -3.982 6.565 3.036
162 HG12 ILE 17 HG13 ILE 17 -4.493 4.178 3.849
163 HG13 ILE 17 HG12 ILE 17 -5.848 5.201 3.397
164 HG21 ILE 17 HG21 ILE 17 -4.491 5.302 0.352
165 HG22 ILE 17 HG22 ILE 17 -3.862 6.920 0.656
166 HG23 ILE 17 HG23 ILE 17 -5.513 6.517 1.121
167 HD11 ILE 17 HD11 ILE 17 -6.390 3.162 2.462
168 HD12 ILE 17 HD12 ILE 17 -4.724 2.808 1.976
169 HD13 ILE 17 HD13 ILE 17 -5.670 4.025 1.106
170 H THR 18 H THR 18 -2.409 5.013 -0.204
171 HA THR 18 HA THR 18 -3.044 2.289 -0.608
172 HB THR 18 HB THR 18 -1.422 3.816 -2.598
173 HG1 THR 18 HG1 THR 18 -4.058 4.475 -2.749
174 HG21 THR 18 HG21 THR 18 -2.306 1.627 -3.191
175 HG22 THR 18 HG22 THR 18 -3.084 2.889 -4.142
176 HG23 THR 18 HG23 THR 18 -3.938 2.162 -2.785
177 H SER 19 H SER 19 -0.352 3.875 0.515
178 HA SER 19 HA SER 19 1.358 1.529 0.131
179 HB2 SER 19 HB3 SER 19 3.253 3.000 -0.017
180 HB3 SER 19 HB2 SER 19 2.022 3.656 -1.098
181 HG SER 19 HG SER 19 2.480 4.531 1.557
182 H HIS 20 H HIS 20 -0.553 1.962 2.272
183 HA HIS 20 HA HIS 20 0.803 3.037 4.554
184 HB2 HIS 20 HB3 HIS 20 -1.651 3.114 4.362
185 HB3 HIS 20 HB2 HIS 20 -1.710 1.357 4.418
186 HD1 HIS 20 HD1 HIS 20 -2.778 0.854 6.612
187 HD2 HIS 20 HD2 HIS 20 0.185 3.753 6.946
188 HE1 HIS 20 HE1 HIS 20 -2.554 1.316 9.071
189 HE2 HIS 20 HE2 HIS 20 -0.724 3.034 9.259
190 H ILE 21 H ILE 21 -0.576 -0.219 4.225
191 HA ILE 21 HA ILE 21 1.593 -1.302 5.827
192 HB ILE 21 HB ILE 21 -0.709 -2.790 4.560
193 HG12 ILE 21 HG13 ILE 21 -0.547 -1.693 7.370
194 HG13 ILE 21 HG12 ILE 21 -1.472 -0.951 6.068
195 HG21 ILE 21 HG21 ILE 21 1.114 -3.492 6.856
196 HG22 ILE 21 HG22 ILE 21 1.129 -4.222 5.249
197 HG23 ILE 21 HG23 ILE 21 -0.259 -4.456 6.311
198 HD11 ILE 21 HD11 ILE 21 -1.920 -3.705 7.187
199 HD12 ILE 21 HD12 ILE 21 -2.863 -2.936 5.911
200 HD13 ILE 21 HD13 ILE 21 -2.881 -2.272 7.546
201 H ASP 22 H ASP 22 2.876 -3.114 4.985
202 HA ASP 22 HA ASP 22 3.219 -2.999 2.076
203 HB2 ASP 22 HB3 ASP 22 4.547 -1.186 3.235
204 HB3 ASP 22 HB2 ASP 22 5.447 -2.437 4.052
205 H LYS 23 H LYS 23 4.306 -4.776 1.214
206 HA LYS 23 HA LYS 23 4.344 -7.150 2.814
207 HB2 LYS 23 HB3 LYS 23 5.524 -8.027 0.588
208 HB3 LYS 23 HB2 LYS 23 3.789 -7.799 0.718
209 HG2 LYS 23 HG3 LYS 23 4.641 -6.941 -1.385
210 HG3 LYS 23 HG2 LYS 23 3.966 -5.648 -0.400
211 HD2 LYS 23 HD3 LYS 23 6.645 -5.690 0.301
212 HD3 LYS 23 HD2 LYS 23 6.653 -5.989 -1.440
213 HE2 LYS 23 HE3 LYS 23 5.139 -3.748 -0.117
214 HE3 LYS 23 HE2 LYS 23 6.755 -3.558 -0.780
215 HZ1 LYS 23 HZ1 LYS 23 4.324 -4.340 -2.300
216 HZ2 LYS 23 HZ2 LYS 23 5.870 -4.141 -2.956
217 HZ3 LYS 23 HZ3 LYS 23 5.048 -2.809 -2.306
218 H VAL 24 H VAL 24 6.648 -4.709 2.452
219 HA VAL 24 HA VAL 24 8.690 -6.460 3.614
220 HB VAL 24 HB VAL 24 9.008 -6.618 1.139
221 HG11 VAL 24 HG11 VAL 24 9.750 -3.708 1.371
222 HG12 VAL 24 HG12 VAL 24 8.350 -4.361 0.522
223 HG13 VAL 24 HG13 VAL 24 9.978 -4.720 -0.055
224 HG21 VAL 24 HG21 VAL 24 10.853 -7.066 2.637
225 HG22 VAL 24 HG22 VAL 24 11.250 -5.349 2.704
226 HG23 VAL 24 HG23 VAL 24 11.437 -6.239 1.193
227 H LEU 25 H LEU 25 7.266 -3.467 3.128
228 HA LEU 25 HA LEU 25 7.300 -1.564 4.344
229 HB2 LEU 25 HB3 LEU 25 8.160 -2.910 6.260
230 HB3 LEU 25 HB2 LEU 25 9.791 -2.574 5.714
231 HG LEU 25 HG LEU 25 9.394 -0.158 6.065
232 HD11 LEU 25 HD11 LEU 25 6.996 -0.091 5.748
233 HD12 LEU 25 HD12 LEU 25 7.409 0.536 7.344
234 HD13 LEU 25 HD13 LEU 25 6.754 -1.092 7.179
235 HD21 LEU 25 HD21 LEU 25 8.832 -1.887 8.469
236 HD22 LEU 25 HD22 LEU 25 9.428 -0.230 8.504
237 HD23 LEU 25 HD23 LEU 25 10.425 -1.510 7.817
238 H ARG 26 H ARG 26 7.837 -1.107 1.990
239 HA ARG 26 HA ARG 26 10.406 0.372 1.890
240 HB2 ARG 26 HB3 ARG 26 10.412 0.001 -0.474
241 HB3 ARG 26 HB2 ARG 26 10.049 -1.552 0.279
242 HG2 ARG 26 HG3 ARG 26 7.564 -0.658 0.000
243 HG3 ARG 26 HG2 ARG 26 8.313 0.234 -1.321
244 HD2 ARG 26 HD3 ARG 26 8.817 -2.685 -1.053
245 HD3 ARG 26 HD2 ARG 26 7.277 -2.119 -1.690
246 HE ARG 26 HE ARG 26 9.905 -1.778 -2.928
247 HH11 ARG 26 HH11 ARG 26 6.446 -1.220 -3.010
248 HH12 ARG 26 HH12 ARG 26 6.390 -1.068 -4.741
249 HH21 ARG 26 HH22 ARG 26 9.845 -1.540 -5.199
250 HH22 ARG 26 HH21 ARG 26 8.332 -1.233 -5.987
251 HA PRO 27 HA PRO 27 6.324 2.510 0.277
252 HB2 PRO 27 HB2 PRO 27 4.946 3.639 2.310
253 HB3 PRO 27 HB3 PRO 27 4.702 1.959 1.798
254 HG2 PRO 27 HG3 PRO 27 6.277 3.033 4.101
255 HG3 PRO 27 HG2 PRO 27 5.212 1.617 4.032
256 HD2 PRO 27 HD3 PRO 27 7.932 1.467 3.883
257 HD3 PRO 27 HD2 PRO 27 6.843 0.282 3.135
258 H GLN 28 H GLN 28 5.800 4.783 -0.022
259 HA GLN 28 HA GLN 28 8.041 6.489 0.786
260 HB2 GLN 28 HB3 GLN 28 7.378 7.931 -1.109
261 HB3 GLN 28 HB2 GLN 28 7.766 6.292 -1.608
262 HG2 GLN 28 HG3 GLN 28 5.417 5.761 -1.816
263 HG3 GLN 28 HG2 GLN 28 4.975 7.358 -1.213
264 HE21 GLN 28 HE22 GLN 28 5.280 9.162 -2.540
265 HE22 GLN 28 HE21 GLN 28 5.507 9.007 -4.247
266 H GLY 29 H GLY 29 5.754 5.919 2.518
267 HA2 GLY 29 HA3 GLY 29 4.242 8.414 2.549
268 HA3 GLY 29 HA2 GLY 29 3.963 7.013 3.576
Start of MODEL 19
1 H1 ARG 1 H1 ARG 1 -8.490 5.383 1.359
2 H2 ARG 1 H2 ARG 1 -8.908 6.368 0.055
3 H3 ARG 1 H3 ARG 1 -7.452 5.515 0.031
4 HA ARG 1 HA ARG 1 -10.157 4.317 0.013
5 HB2 ARG 1 HB3 ARG 1 -9.343 5.523 -2.087
6 HB3 ARG 1 HB2 ARG 1 -8.094 4.292 -2.190
7 HG2 ARG 1 HG3 ARG 1 -9.757 3.542 -3.629
8 HG3 ARG 1 HG2 ARG 1 -10.012 2.602 -2.159
9 HD2 ARG 1 HD3 ARG 1 -11.506 5.140 -2.782
10 HD3 ARG 1 HD2 ARG 1 -12.089 3.545 -3.240
11 HE ARG 1 HE ARG 1 -11.834 3.136 -0.680
12 HH11 ARG 1 HH12 ARG 1 -12.958 6.064 -2.238
13 HH12 ARG 1 HH11 ARG 1 -14.028 6.497 -0.942
14 HH21 ARG 1 HH21 ARG 1 -13.241 3.703 1.030
15 HH22 ARG 1 HH22 ARG 1 -14.199 5.145 0.915
16 H LYS 2 H LYS 2 -9.666 2.834 1.659
17 HA LYS 2 HA LYS 2 -7.365 1.073 1.302
18 HB2 LYS 2 HB3 LYS 2 -9.557 0.921 3.386
19 HB3 LYS 2 HB2 LYS 2 -8.077 -0.017 3.367
20 HG2 LYS 2 HG3 LYS 2 -7.700 1.609 4.973
21 HG3 LYS 2 HG2 LYS 2 -6.865 2.223 3.555
22 HD2 LYS 2 HD3 LYS 2 -8.085 3.998 4.685
23 HD3 LYS 2 HD2 LYS 2 -8.755 3.702 3.082
24 HE2 LYS 2 HE3 LYS 2 -10.496 4.028 4.793
25 HE3 LYS 2 HE2 LYS 2 -10.583 2.443 4.034
26 HZ1 LYS 2 HZ1 LYS 2 -10.882 2.351 6.443
27 HZ2 LYS 2 HZ2 LYS 2 -9.336 2.993 6.673
28 HZ3 LYS 2 HZ3 LYS 2 -9.526 1.474 5.954
29 H CYS 3 H CYS 3 -7.507 -1.003 0.518
30 HA CYS 3 HA CYS 3 -10.158 -2.139 0.227
31 HB2 CYS 3 HB3 CYS 3 -9.808 -2.743 -2.130
32 HB3 CYS 3 HB2 CYS 3 -9.878 -1.011 -1.874
33 H ASN 4 H ASN 4 -7.086 -3.243 -1.231
34 HA ASN 4 HA ASN 4 -7.004 -5.410 0.721
35 HB2 ASN 4 HB3 ASN 4 -6.995 -7.157 -1.004
36 HB3 ASN 4 HB2 ASN 4 -8.499 -6.247 -1.026
37 HD21 ASN 4 HD22 ASN 4 -7.403 -7.854 -3.108
38 HD22 ASN 4 HD21 ASN 4 -7.147 -6.820 -4.471
39 H PHE 5 H PHE 5 -5.236 -6.905 -1.261
40 HA PHE 5 HA PHE 5 -2.765 -5.778 -0.440
41 HB2 PHE 5 HB3 PHE 5 -1.847 -7.489 -2.158
42 HB3 PHE 5 HB2 PHE 5 -2.637 -8.073 -0.702
43 HD1 PHE 5 HD2 PHE 5 -3.182 -7.428 -4.312
44 HD2 PHE 5 HD1 PHE 5 -4.494 -9.478 -0.824
45 HE1 PHE 5 HE2 PHE 5 -4.718 -8.769 -5.682
46 HE2 PHE 5 HE1 PHE 5 -6.034 -10.824 -2.188
47 HZ PHE 5 HZ PHE 5 -6.146 -10.468 -4.621
48 H LEU 6 H LEU 6 -1.096 -4.928 -1.739
49 HA LEU 6 HA LEU 6 -0.334 -3.209 -2.998
50 HB2 LEU 6 HB3 LEU 6 -2.198 -4.333 -5.102
51 HB3 LEU 6 HB2 LEU 6 -0.914 -3.184 -5.393
52 HG LEU 6 HG LEU 6 0.055 -5.123 -6.130
53 HD11 LEU 6 HD11 LEU 6 1.206 -4.101 -3.942
54 HD12 LEU 6 HD12 LEU 6 1.863 -5.464 -4.847
55 HD13 LEU 6 HD13 LEU 6 0.921 -5.753 -3.390
56 HD21 LEU 6 HD21 LEU 6 -1.742 -6.621 -5.613
57 HD22 LEU 6 HD22 LEU 6 -1.314 -6.601 -3.902
58 HD23 LEU 6 HD23 LEU 6 -0.217 -7.327 -5.076
59 H CYS 7 H CYS 7 -1.800 -2.105 -1.287
60 HA CYS 7 HA CYS 7 -3.518 -0.151 -2.433
61 HB2 CYS 7 HB3 CYS 7 -4.947 -2.106 -2.811
62 HB3 CYS 7 HB2 CYS 7 -4.844 -2.530 -1.110
63 H LYS 8 H LYS 8 -3.212 -2.177 0.451
64 HA LYS 8 HA LYS 8 -2.100 0.001 1.975
65 HB2 LYS 8 HB3 LYS 8 -4.491 0.361 2.413
66 HB3 LYS 8 HB2 LYS 8 -4.683 -1.333 2.844
67 HG2 LYS 8 HG3 LYS 8 -3.308 -1.058 4.791
68 HG3 LYS 8 HG2 LYS 8 -2.900 0.592 4.321
69 HD2 LYS 8 HD3 LYS 8 -4.564 0.679 6.044
70 HD3 LYS 8 HD2 LYS 8 -5.305 1.185 4.527
71 HE2 LYS 8 HE3 LYS 8 -6.857 -0.247 5.594
72 HE3 LYS 8 HE2 LYS 8 -6.146 -1.174 4.278
73 HZ1 LYS 8 HZ1 LYS 8 -6.326 -2.465 6.314
74 HZ2 LYS 8 HZ2 LYS 8 -5.352 -1.352 7.132
75 HZ3 LYS 8 HZ3 LYS 8 -4.707 -2.274 5.870
76 H LEU 9 H LEU 9 -3.415 -3.233 1.864
77 HA LEU 9 HA LEU 9 -1.882 -4.457 3.856
78 HB2 LEU 9 HB3 LEU 9 -3.134 -5.458 1.319
79 HB3 LEU 9 HB2 LEU 9 -2.205 -6.535 2.345
80 HG LEU 9 HG LEU 9 -3.792 -6.002 4.217
81 HD11 LEU 9 HD11 LEU 9 -5.969 -5.035 3.620
82 HD12 LEU 9 HD12 LEU 9 -5.349 -4.657 2.014
83 HD13 LEU 9 HD13 LEU 9 -4.653 -3.879 3.433
84 HD21 LEU 9 HD21 LEU 9 -4.987 -7.195 1.720
85 HD22 LEU 9 HD22 LEU 9 -5.580 -7.429 3.365
86 HD23 LEU 9 HD23 LEU 9 -3.992 -8.042 2.903
87 H LYS 10 H LYS 10 -1.313 -4.748 0.342
88 HA LYS 10 HA LYS 10 1.572 -4.599 0.901
89 HB2 LYS 10 HB3 LYS 10 0.298 -5.548 -1.664
90 HB3 LYS 10 HB2 LYS 10 1.985 -5.672 -1.209
91 HG2 LYS 10 HG3 LYS 10 1.400 -7.239 0.558
92 HG3 LYS 10 HG2 LYS 10 -0.300 -7.098 0.112
93 HD2 LYS 10 HD3 LYS 10 0.319 -7.902 -2.175
94 HD3 LYS 10 HD2 LYS 10 1.941 -8.217 -1.558
95 HE2 LYS 10 HE3 LYS 10 1.007 -9.749 0.104
96 HE3 LYS 10 HE2 LYS 10 -0.610 -9.428 -0.517
97 HZ1 LYS 10 HZ1 LYS 10 0.067 -10.363 -2.644
98 HZ2 LYS 10 HZ2 LYS 10 0.269 -11.489 -1.398
99 HZ3 LYS 10 HZ3 LYS 10 1.611 -10.682 -2.036
100 H GLU 11 H GLU 11 2.381 -3.796 -1.711
101 HA GLU 11 HA GLU 11 1.777 -0.977 -1.164
102 HB2 GLU 11 HB3 GLU 11 3.929 -0.452 -1.919
103 HB3 GLU 11 HB2 GLU 11 4.108 -1.900 -0.938
104 HG2 GLU 11 HG3 GLU 11 3.799 -2.094 -3.898
105 HG3 GLU 11 HG2 GLU 11 5.349 -1.682 -3.187
106 H LYS 12 H LYS 12 1.881 0.581 -2.822
107 HA LYS 12 HA LYS 12 2.045 -0.137 -5.596
108 HB2 LYS 12 HB3 LYS 12 -0.079 0.778 -6.265
109 HB3 LYS 12 HB2 LYS 12 -0.406 -0.417 -5.013
110 HG2 LYS 12 HG3 LYS 12 -0.271 1.612 -3.410
111 HG3 LYS 12 HG2 LYS 12 -0.541 2.554 -4.873
112 HD2 LYS 12 HD3 LYS 12 -2.317 0.252 -4.193
113 HD3 LYS 12 HD2 LYS 12 -2.534 1.828 -3.429
114 HE2 LYS 12 HE3 LYS 12 -2.792 2.864 -5.627
115 HE3 LYS 12 HE2 LYS 12 -2.498 1.312 -6.407
116 HZ1 LYS 12 HZ1 LYS 12 -4.859 1.873 -6.298
117 HZ2 LYS 12 HZ2 LYS 12 -4.786 1.907 -4.610
118 HZ3 LYS 12 HZ3 LYS 12 -4.518 0.459 -5.442
119 H LEU 13 H LEU 13 1.660 2.140 -6.827
120 HA LEU 13 HA LEU 13 3.531 3.948 -5.614
121 HB2 LEU 13 HB3 LEU 13 3.018 3.346 -8.155
122 HB3 LEU 13 HB2 LEU 13 1.927 4.705 -8.010
123 HG LEU 13 HG LEU 13 4.895 4.834 -7.463
124 HD11 LEU 13 HD11 LEU 13 4.437 4.369 -9.812
125 HD12 LEU 13 HD12 LEU 13 5.043 6.010 -9.593
126 HD13 LEU 13 HD13 LEU 13 3.325 5.736 -9.872
127 HD21 LEU 13 HD21 LEU 13 3.606 6.512 -6.243
128 HD22 LEU 13 HD22 LEU 13 2.827 7.011 -7.744
129 HD23 LEU 13 HD23 LEU 13 4.560 7.252 -7.527
130 H ARG 14 H ARG 14 2.322 4.482 -3.679
131 HA ARG 14 HA ARG 14 0.356 6.593 -4.190
132 HB2 ARG 14 HB3 ARG 14 -0.077 4.117 -2.691
133 HB3 ARG 14 HB2 ARG 14 -0.554 5.571 -1.826
134 HG2 ARG 14 HG3 ARG 14 -1.516 4.713 -4.549
135 HG3 ARG 14 HG2 ARG 14 -2.434 4.669 -3.040
136 HD2 ARG 14 HD3 ARG 14 -2.031 7.170 -2.898
137 HD3 ARG 14 HD2 ARG 14 -1.471 7.077 -4.564
138 HE ARG 14 HE ARG 14 -3.999 5.870 -4.377
139 HH11 ARG 14 HH11 ARG 14 -2.465 9.011 -4.255
140 HH12 ARG 14 HH12 ARG 14 -3.889 9.872 -4.742
141 HH21 ARG 14 HH22 ARG 14 -5.885 6.998 -5.022
142 HH22 ARG 14 HH21 ARG 14 -5.834 8.723 -5.191
143 H THR 15 H THR 15 2.416 5.141 -1.651
144 HA THR 15 HA THR 15 3.924 6.100 -0.274
145 HB THR 15 HB THR 15 3.276 8.741 -1.572
146 HG1 THR 15 HG1 THR 15 5.358 7.912 -2.758
147 HG21 THR 15 HG21 THR 15 5.590 9.300 -0.990
148 HG22 THR 15 HG22 THR 15 5.794 7.711 -0.252
149 HG23 THR 15 HG23 THR 15 4.669 8.873 0.453
150 H VAL 16 H VAL 16 0.657 6.811 -0.288
151 HA VAL 16 HA VAL 16 0.893 7.859 2.449
152 HB VAL 16 HB VAL 16 -1.334 8.546 0.533
153 HG11 VAL 16 HG11 VAL 16 -1.937 8.338 2.951
154 HG12 VAL 16 HG12 VAL 16 -2.194 9.946 2.264
155 HG13 VAL 16 HG13 VAL 16 -0.789 9.639 3.285
156 HG21 VAL 16 HG21 VAL 16 0.898 10.268 1.603
157 HG22 VAL 16 HG22 VAL 16 -0.437 10.816 0.593
158 HG23 VAL 16 HG23 VAL 16 0.750 9.684 -0.053
159 H ILE 17 H ILE 17 -2.035 6.818 0.691
160 HA ILE 17 HA ILE 17 -3.070 5.477 2.919
161 HB ILE 17 HB ILE 17 -4.395 6.315 0.958
162 HG12 ILE 17 HG13 ILE 17 -5.348 4.766 2.685
163 HG13 ILE 17 HG12 ILE 17 -6.157 4.715 1.128
164 HG21 ILE 17 HG21 ILE 17 -3.050 5.408 -0.844
165 HG22 ILE 17 HG22 ILE 17 -4.728 4.881 -0.978
166 HG23 ILE 17 HG23 ILE 17 -3.499 3.771 -0.372
167 HD11 ILE 17 HD11 ILE 17 -4.385 2.662 2.394
168 HD12 ILE 17 HD12 ILE 17 -4.712 2.644 0.661
169 HD13 ILE 17 HD13 ILE 17 -6.037 2.499 1.806
170 H THR 18 H THR 18 -1.276 4.239 0.154
171 HA THR 18 HA THR 18 -1.547 1.507 0.974
172 HB THR 18 HB THR 18 0.400 2.620 -1.033
173 HG1 THR 18 HG1 THR 18 -2.391 2.083 -1.216
174 HG21 THR 18 HG21 THR 18 0.255 0.437 -2.018
175 HG22 THR 18 HG22 THR 18 -1.044 -0.023 -0.919
176 HG23 THR 18 HG23 THR 18 0.583 0.238 -0.298
177 H SER 19 H SER 19 0.668 4.098 1.297
178 HA SER 19 HA SER 19 2.796 2.560 2.424
179 HB2 SER 19 HB3 SER 19 3.382 4.561 1.281
180 HB3 SER 19 HB2 SER 19 2.233 5.516 2.201
181 HG SER 19 HG SER 19 3.663 4.731 4.071
182 H HIS 20 H HIS 20 -0.025 2.573 3.555
183 HA HIS 20 HA HIS 20 0.400 3.519 6.252
184 HB2 HIS 20 HB3 HIS 20 -1.838 2.313 4.758
185 HB3 HIS 20 HB2 HIS 20 -1.770 1.897 6.468
186 HD1 HIS 20 HD1 HIS 20 -3.034 3.464 7.897
187 HD2 HIS 20 HD2 HIS 20 -1.611 5.322 4.466
188 HE1 HIS 20 HE1 HIS 20 -3.914 5.819 7.988
189 HE2 HIS 20 HE2 HIS 20 -2.878 6.970 5.998
190 H ILE 21 H ILE 21 0.478 0.419 4.538
191 HA ILE 21 HA ILE 21 1.740 -0.719 6.945
192 HB ILE 21 HB ILE 21 -0.141 -2.221 5.117
193 HG12 ILE 21 HG13 ILE 21 -0.549 -1.275 7.966
194 HG13 ILE 21 HG12 ILE 21 -1.323 -0.585 6.544
195 HG21 ILE 21 HG21 ILE 21 0.064 -4.028 6.746
196 HG22 ILE 21 HG22 ILE 21 1.203 -3.064 7.685
197 HG23 ILE 21 HG23 ILE 21 1.637 -3.611 6.065
198 HD11 ILE 21 HD11 ILE 21 -2.442 -2.722 6.135
199 HD12 ILE 21 HD12 ILE 21 -2.835 -2.055 7.718
200 HD13 ILE 21 HD13 ILE 21 -1.684 -3.383 7.582
201 H ASP 22 H ASP 22 1.109 -1.767 3.592
202 HA ASP 22 HA ASP 22 2.429 -2.653 1.971
203 HB2 ASP 22 HB3 ASP 22 3.911 -0.717 2.177
204 HB3 ASP 22 HB2 ASP 22 4.747 -1.470 3.522
205 H LYS 23 H LYS 23 3.852 -4.427 1.529
206 HA LYS 23 HA LYS 23 3.589 -6.489 3.457
207 HB2 LYS 23 HB3 LYS 23 5.045 -7.789 1.814
208 HB3 LYS 23 HB2 LYS 23 3.500 -7.199 1.226
209 HG2 LYS 23 HG3 LYS 23 4.949 -6.744 -0.518
210 HG3 LYS 23 HG2 LYS 23 4.845 -5.199 0.324
211 HD2 LYS 23 HD3 LYS 23 6.938 -5.776 1.523
212 HD3 LYS 23 HD2 LYS 23 7.060 -7.233 0.534
213 HE2 LYS 23 HE3 LYS 23 7.025 -5.750 -1.482
214 HE3 LYS 23 HE2 LYS 23 7.129 -4.369 -0.390
215 HZ1 LYS 23 HZ1 LYS 23 9.299 -4.993 -1.227
216 HZ2 LYS 23 HZ2 LYS 23 9.127 -6.555 -0.613
217 HZ3 LYS 23 HZ3 LYS 23 9.230 -5.239 0.441
218 H VAL 24 H VAL 24 6.048 -4.109 2.905
219 HA VAL 24 HA VAL 24 7.488 -5.216 5.194
220 HB VAL 24 HB VAL 24 8.939 -4.618 2.602
221 HG11 VAL 24 HG11 VAL 24 10.053 -5.234 5.340
222 HG12 VAL 24 HG12 VAL 24 10.187 -3.701 4.479
223 HG13 VAL 24 HG13 VAL 24 10.996 -5.138 3.854
224 HG21 VAL 24 HG21 VAL 24 9.720 -6.912 2.749
225 HG22 VAL 24 HG22 VAL 24 7.958 -6.874 2.744
226 HG23 VAL 24 HG23 VAL 24 8.830 -7.142 4.252
227 H LEU 25 H LEU 25 8.447 -2.710 2.852
228 HA LEU 25 HA LEU 25 7.598 -0.496 4.347
229 HB2 LEU 25 HB3 LEU 25 9.309 -1.437 5.929
230 HB3 LEU 25 HB2 LEU 25 10.529 -1.121 4.713
231 HG LEU 25 HG LEU 25 10.022 1.295 4.851
232 HD11 LEU 25 HD11 LEU 25 7.701 1.170 5.545
233 HD12 LEU 25 HD12 LEU 25 8.637 2.120 6.699
234 HD13 LEU 25 HD13 LEU 25 8.180 0.461 7.086
235 HD21 LEU 25 HD21 LEU 25 10.676 -0.010 7.489
236 HD22 LEU 25 HD22 LEU 25 11.026 1.662 7.050
237 HD23 LEU 25 HD23 LEU 25 11.818 0.340 6.193
238 H ARG 26 H ARG 26 7.594 -1.160 1.627
239 HA ARG 26 HA ARG 26 9.125 1.141 0.635
240 HB2 ARG 26 HB3 ARG 26 9.659 -0.170 -1.472
241 HB3 ARG 26 HB2 ARG 26 10.568 -0.600 -0.034
242 HG2 ARG 26 HG3 ARG 26 10.073 -2.685 -0.737
243 HG3 ARG 26 HG2 ARG 26 8.599 -2.385 0.183
244 HD2 ARG 26 HD3 ARG 26 8.099 -3.343 -2.007
245 HD3 ARG 26 HD2 ARG 26 7.446 -1.708 -1.866
246 HE ARG 26 HE ARG 26 10.009 -1.593 -3.025
247 HH11 ARG 26 HH11 ARG 26 6.801 -2.752 -3.783
248 HH12 ARG 26 HH12 ARG 26 6.940 -2.402 -5.481
249 HH21 ARG 26 HH22 ARG 26 10.216 -1.164 -5.253
250 HH22 ARG 26 HH21 ARG 26 8.890 -1.501 -6.320
251 HA PRO 27 HA PRO 27 4.711 0.571 -0.761
252 HB2 PRO 27 HB2 PRO 27 3.699 2.667 0.830
253 HB3 PRO 27 HB3 PRO 27 3.506 0.927 1.090
254 HG2 PRO 27 HG3 PRO 27 4.950 2.666 2.729
255 HG3 PRO 27 HG2 PRO 27 5.090 0.900 2.720
256 HD2 PRO 27 HD3 PRO 27 6.830 2.951 1.432
257 HD3 PRO 27 HD2 PRO 27 7.268 1.394 2.170
258 H GLN 28 H GLN 28 6.693 2.098 -2.113
259 HA GLN 28 HA GLN 28 5.088 4.419 -2.960
260 HB2 GLN 28 HB3 GLN 28 8.062 3.962 -3.241
261 HB3 GLN 28 HB2 GLN 28 7.194 5.321 -3.936
262 HG2 GLN 28 HG3 GLN 28 8.070 6.224 -2.008
263 HG3 GLN 28 HG2 GLN 28 6.435 5.777 -1.511
264 HE21 GLN 28 HE22 GLN 28 7.078 5.693 0.655
265 HE22 GLN 28 HE21 GLN 28 8.025 4.388 1.274
266 H GLY 29 H GLY 29 5.802 1.328 -3.756
267 HA2 GLY 29 HA3 GLY 29 4.746 0.336 -5.651
268 HA3 GLY 29 HA2 GLY 29 5.027 1.823 -6.544
Start of MODEL 20
1 H1 ARG 1 H1 ARG 1 -8.952 3.757 3.228
2 H2 ARG 1 H2 ARG 1 -9.357 2.979 4.668
3 H3 ARG 1 H3 ARG 1 -10.417 4.105 4.001
4 HA ARG 1 HA ARG 1 -11.257 1.932 3.571
5 HB2 ARG 1 HB3 ARG 1 -10.019 3.255 1.153
6 HB3 ARG 1 HB2 ARG 1 -11.100 1.878 1.029
7 HG2 ARG 1 HG3 ARG 1 -12.457 3.720 0.628
8 HG3 ARG 1 HG2 ARG 1 -12.784 3.308 2.310
9 HD2 ARG 1 HD3 ARG 1 -11.252 5.069 3.032
10 HD3 ARG 1 HD2 ARG 1 -10.912 5.470 1.353
11 HE ARG 1 HE ARG 1 -13.632 5.683 1.603
12 HH11 ARG 1 HH12 ARG 1 -10.889 7.080 3.262
13 HH12 ARG 1 HH11 ARG 1 -11.672 8.599 3.551
14 HH21 ARG 1 HH21 ARG 1 -14.677 7.682 1.985
15 HH22 ARG 1 HH22 ARG 1 -13.834 8.941 2.828
16 H LYS 2 H LYS 2 -10.683 -0.143 3.818
17 HA LYS 2 HA LYS 2 -7.968 -0.925 3.067
18 HB2 LYS 2 HB3 LYS 2 -10.022 -2.618 4.502
19 HB3 LYS 2 HB2 LYS 2 -8.307 -2.960 4.303
20 HG2 LYS 2 HG3 LYS 2 -8.364 -2.210 6.467
21 HG3 LYS 2 HG2 LYS 2 -8.003 -0.713 5.605
22 HD2 LYS 2 HD3 LYS 2 -10.368 -0.098 5.679
23 HD3 LYS 2 HD2 LYS 2 -10.741 -1.605 6.517
24 HE2 LYS 2 HE3 LYS 2 -9.301 -0.915 8.379
25 HE3 LYS 2 HE2 LYS 2 -8.957 0.601 7.545
26 HZ1 LYS 2 HZ1 LYS 2 -10.662 0.965 9.163
27 HZ2 LYS 2 HZ2 LYS 2 -11.596 -0.308 8.559
28 HZ3 LYS 2 HZ3 LYS 2 -11.362 1.083 7.631
29 H CYS 3 H CYS 3 -8.542 -0.668 0.827
30 HA CYS 3 HA CYS 3 -10.513 -2.117 -0.506
31 HB2 CYS 3 HB3 CYS 3 -8.567 -1.796 -2.395
32 HB3 CYS 3 HB2 CYS 3 -9.730 -0.554 -1.927
33 H ASN 4 H ASN 4 -7.024 -2.824 -0.815
34 HA ASN 4 HA ASN 4 -7.145 -5.533 -0.154
35 HB2 ASN 4 HB3 ASN 4 -7.149 -6.633 -2.321
36 HB3 ASN 4 HB2 ASN 4 -8.621 -5.685 -2.160
37 HD21 ASN 4 HD22 ASN 4 -7.227 -6.659 -4.537
38 HD22 ASN 4 HD21 ASN 4 -6.883 -5.263 -5.502
39 H PHE 5 H PHE 5 -5.301 -6.661 -1.800
40 HA PHE 5 HA PHE 5 -2.866 -5.506 -1.092
41 HB2 PHE 5 HB3 PHE 5 -1.994 -6.982 -3.036
42 HB3 PHE 5 HB2 PHE 5 -2.688 -7.748 -1.609
43 HD1 PHE 5 HD2 PHE 5 -3.362 -6.814 -5.122
44 HD2 PHE 5 HD1 PHE 5 -4.634 -9.085 -1.757
45 HE1 PHE 5 HE2 PHE 5 -4.972 -8.012 -6.541
46 HE2 PHE 5 HE1 PHE 5 -6.246 -10.287 -3.174
47 HZ PHE 5 HZ PHE 5 -6.417 -9.749 -5.569
48 H LEU 6 H LEU 6 -1.220 -4.660 -2.467
49 HA LEU 6 HA LEU 6 -0.473 -2.894 -3.622
50 HB2 LEU 6 HB3 LEU 6 -2.397 -4.034 -5.636
51 HB3 LEU 6 HB2 LEU 6 -1.310 -2.712 -6.003
52 HG LEU 6 HG LEU 6 -0.263 -4.627 -6.867
53 HD11 LEU 6 HD11 LEU 6 0.989 -4.219 -4.157
54 HD12 LEU 6 HD12 LEU 6 1.238 -3.188 -5.567
55 HD13 LEU 6 HD13 LEU 6 1.771 -4.868 -5.601
56 HD21 LEU 6 HD21 LEU 6 -1.600 -6.334 -5.812
57 HD22 LEU 6 HD22 LEU 6 -0.835 -6.013 -4.257
58 HD23 LEU 6 HD23 LEU 6 0.111 -6.685 -5.584
59 H CYS 7 H CYS 7 -2.494 -2.242 -1.751
60 HA CYS 7 HA CYS 7 -3.550 0.197 -2.830
61 HB2 CYS 7 HB3 CYS 7 -5.158 -1.566 -3.649
62 HB3 CYS 7 HB2 CYS 7 -5.568 -1.877 -1.966
63 H LYS 8 H LYS 8 -4.137 -2.148 -0.143
64 HA LYS 8 HA LYS 8 -2.829 -0.347 1.694
65 HB2 LYS 8 HB3 LYS 8 -5.225 0.485 1.623
66 HB3 LYS 8 HB2 LYS 8 -5.716 -1.073 2.276
67 HG2 LYS 8 HG3 LYS 8 -4.223 -0.649 4.227
68 HG3 LYS 8 HG2 LYS 8 -3.940 0.969 3.592
69 HD2 LYS 8 HD3 LYS 8 -6.270 1.519 3.810
70 HD3 LYS 8 HD2 LYS 8 -6.652 -0.139 4.278
71 HE2 LYS 8 HE3 LYS 8 -4.900 1.770 5.818
72 HE3 LYS 8 HE2 LYS 8 -6.564 1.348 6.217
73 HZ1 LYS 8 HZ1 LYS 8 -4.299 -0.567 6.123
74 HZ2 LYS 8 HZ2 LYS 8 -5.889 -0.929 6.559
75 HZ3 LYS 8 HZ3 LYS 8 -4.955 0.093 7.531
76 H LEU 9 H LEU 9 -2.235 -2.837 0.724
77 HA LEU 9 HA LEU 9 -2.248 -4.458 3.157
78 HB2 LEU 9 HB3 LEU 9 -3.509 -5.253 0.611
79 HB3 LEU 9 HB2 LEU 9 -2.470 -6.458 1.342
80 HG LEU 9 HG LEU 9 -3.890 -6.050 3.474
81 HD11 LEU 9 HD11 LEU 9 -5.786 -5.019 1.374
82 HD12 LEU 9 HD12 LEU 9 -5.037 -4.053 2.645
83 HD13 LEU 9 HD13 LEU 9 -6.169 -5.339 3.065
84 HD21 LEU 9 HD21 LEU 9 -5.522 -7.712 2.734
85 HD22 LEU 9 HD22 LEU 9 -3.891 -8.120 2.198
86 HD23 LEU 9 HD23 LEU 9 -5.048 -7.431 1.058
87 H LYS 10 H LYS 10 -1.144 -4.624 -0.258
88 HA LYS 10 HA LYS 10 1.511 -5.416 0.766
89 HB2 LYS 10 HB3 LYS 10 0.172 -6.118 -1.839
90 HB3 LYS 10 HB2 LYS 10 1.881 -6.393 -1.537
91 HG2 LYS 10 HG3 LYS 10 1.101 -7.707 0.526
92 HG3 LYS 10 HG2 LYS 10 -0.485 -7.695 -0.247
93 HD2 LYS 10 HD3 LYS 10 2.056 -8.748 -1.490
94 HD3 LYS 10 HD2 LYS 10 0.795 -9.738 -0.757
95 HE2 LYS 10 HE3 LYS 10 -0.804 -8.947 -2.417
96 HE3 LYS 10 HE2 LYS 10 0.432 -7.917 -3.132
97 HZ1 LYS 10 HZ1 LYS 10 0.590 -10.874 -2.968
98 HZ2 LYS 10 HZ2 LYS 10 1.690 -9.852 -3.746
99 HZ3 LYS 10 HZ3 LYS 10 0.116 -10.011 -4.341
100 H GLU 11 H GLU 11 0.046 -3.648 -1.963
101 HA GLU 11 HA GLU 11 0.477 -1.597 -2.801
102 HB2 GLU 11 HB3 GLU 11 2.150 -1.429 -0.336
103 HB3 GLU 11 HB2 GLU 11 2.095 -0.117 -1.508
104 HG2 GLU 11 HG3 GLU 11 0.518 0.317 0.222
105 HG3 GLU 11 HG2 GLU 11 -0.347 -0.050 -1.266
106 H LYS 12 H LYS 12 2.261 -0.091 -3.495
107 HA LYS 12 HA LYS 12 4.598 -1.497 -4.473
108 HB2 LYS 12 HB3 LYS 12 4.138 -0.988 -6.807
109 HB3 LYS 12 HB2 LYS 12 2.825 -1.942 -6.137
110 HG2 LYS 12 HG3 LYS 12 2.613 1.032 -6.236
111 HG3 LYS 12 HG2 LYS 12 2.333 0.076 -7.688
112 HD2 LYS 12 HD3 LYS 12 0.661 -1.258 -6.330
113 HD3 LYS 12 HD2 LYS 12 0.818 -0.007 -5.087
114 HE2 LYS 12 HE3 LYS 12 -0.019 1.661 -6.517
115 HE3 LYS 12 HE2 LYS 12 0.193 0.647 -7.944
116 HZ1 LYS 12 HZ1 LYS 12 -2.137 0.835 -7.264
117 HZ2 LYS 12 HZ2 LYS 12 -1.775 0.139 -5.766
118 HZ3 LYS 12 HZ3 LYS 12 -1.598 -0.762 -7.186
119 H LEU 13 H LEU 13 2.710 1.489 -4.347
120 HA LEU 13 HA LEU 13 4.784 3.027 -3.280
121 HB2 LEU 13 HB3 LEU 13 5.572 2.734 -5.701
122 HB3 LEU 13 HB2 LEU 13 4.212 3.740 -6.157
123 HG LEU 13 HG LEU 13 5.127 5.599 -4.842
124 HD11 LEU 13 HD11 LEU 13 7.413 5.428 -3.933
125 HD12 LEU 13 HD12 LEU 13 7.389 3.695 -4.265
126 HD13 LEU 13 HD13 LEU 13 6.263 4.386 -3.096
127 HD21 LEU 13 HD21 LEU 13 5.745 5.395 -7.189
128 HD22 LEU 13 HD22 LEU 13 7.116 4.378 -6.750
129 HD23 LEU 13 HD23 LEU 13 7.074 6.067 -6.246
130 H ARG 14 H ARG 14 3.495 5.235 -5.253
131 HA ARG 14 HA ARG 14 1.714 6.612 -5.345
132 HB2 ARG 14 HB3 ARG 14 0.325 4.561 -5.427
133 HB3 ARG 14 HB2 ARG 14 0.213 4.598 -3.674
134 HG2 ARG 14 HG3 ARG 14 -1.781 5.506 -4.803
135 HG3 ARG 14 HG2 ARG 14 -0.994 6.674 -3.740
136 HD2 ARG 14 HD3 ARG 14 -1.679 7.692 -5.862
137 HD3 ARG 14 HD2 ARG 14 0.068 7.731 -5.653
138 HE ARG 14 HE ARG 14 -1.079 5.548 -7.222
139 HH11 ARG 14 HH11 ARG 14 0.704 8.559 -7.130
140 HH12 ARG 14 HH12 ARG 14 1.294 8.410 -8.753
141 HH21 ARG 14 HH22 ARG 14 -0.296 5.347 -9.369
142 HH22 ARG 14 HH21 ARG 14 0.720 6.590 -10.025
143 H THR 15 H THR 15 2.855 5.470 -2.289
144 HA THR 15 HA THR 15 3.222 6.498 -0.306
145 HB THR 15 HB THR 15 4.904 7.588 -1.641
146 HG1 THR 15 HG1 THR 15 3.628 9.457 0.092
147 HG21 THR 15 HG21 THR 15 4.603 9.790 -2.649
148 HG22 THR 15 HG22 THR 15 2.895 9.769 -2.208
149 HG23 THR 15 HG23 THR 15 3.518 8.611 -3.383
150 H VAL 16 H VAL 16 1.128 6.289 0.538
151 HA VAL 16 HA VAL 16 -0.178 8.515 1.529
152 HB VAL 16 HB VAL 16 -0.613 8.799 -0.991
153 HG11 VAL 16 HG11 VAL 16 -1.227 6.304 -1.187
154 HG12 VAL 16 HG12 VAL 16 -2.124 7.500 -2.134
155 HG13 VAL 16 HG13 VAL 16 -2.829 6.834 -0.662
156 HG21 VAL 16 HG21 VAL 16 -2.925 8.811 0.940
157 HG22 VAL 16 HG22 VAL 16 -2.939 9.577 -0.645
158 HG23 VAL 16 HG23 VAL 16 -1.811 10.126 0.592
159 H ILE 17 H ILE 17 -2.918 7.356 1.400
160 HA ILE 17 HA ILE 17 -2.911 5.380 3.318
161 HB ILE 17 HB ILE 17 -4.952 6.527 2.736
162 HG12 ILE 17 HG13 ILE 17 -4.974 4.041 3.551
163 HG13 ILE 17 HG12 ILE 17 -6.471 4.800 3.033
164 HG21 ILE 17 HG21 ILE 17 -4.654 6.883 0.395
165 HG22 ILE 17 HG22 ILE 17 -6.176 6.027 0.641
166 HG23 ILE 17 HG23 ILE 17 -4.756 5.153 0.067
167 HD11 ILE 17 HD11 ILE 17 -6.526 2.670 2.084
168 HD12 ILE 17 HD12 ILE 17 -4.824 2.725 1.602
169 HD13 ILE 17 HD13 ILE 17 -6.023 3.716 0.758
170 H THR 18 H THR 18 -2.418 5.117 -0.129
171 HA THR 18 HA THR 18 -2.672 2.378 -0.489
172 HB THR 18 HB THR 18 -0.583 4.118 -1.833
173 HG1 THR 18 HG1 THR 18 -3.364 3.776 -2.429
174 HG21 THR 18 HG21 THR 18 -0.957 2.596 -3.732
175 HG22 THR 18 HG22 THR 18 -2.096 1.665 -2.761
176 HG23 THR 18 HG23 THR 18 -0.394 1.727 -2.306
177 H SER 19 H SER 19 0.497 3.922 -0.480
178 HA SER 19 HA SER 19 1.822 1.590 0.446
179 HB2 SER 19 HB3 SER 19 2.823 3.315 -1.057
180 HB3 SER 19 HB2 SER 19 2.873 4.422 0.313
181 HG SER 19 HG SER 19 4.129 1.877 0.301
182 H HIS 20 H HIS 20 0.255 1.529 2.365
183 HA HIS 20 HA HIS 20 1.298 3.146 4.598
184 HB2 HIS 20 HB3 HIS 20 -1.082 3.581 4.004
185 HB3 HIS 20 HB2 HIS 20 -1.442 1.896 4.355
186 HD1 HIS 20 HD1 HIS 20 0.513 4.505 6.331
187 HD2 HIS 20 HD2 HIS 20 -2.653 1.839 6.754
188 HE1 HIS 20 HE1 HIS 20 -0.212 4.680 8.737
189 HE2 HIS 20 HE2 HIS 20 -2.201 3.147 8.937
190 H ILE 21 H ILE 21 -0.368 0.021 4.045
191 HA ILE 21 HA ILE 21 0.995 -1.123 6.318
192 HB ILE 21 HB ILE 21 -0.718 -2.444 4.200
193 HG12 ILE 21 HG13 ILE 21 -1.252 -1.574 7.046
194 HG13 ILE 21 HG12 ILE 21 -2.027 -0.972 5.586
195 HG21 ILE 21 HG21 ILE 21 -0.732 -4.395 5.699
196 HG22 ILE 21 HG22 ILE 21 0.427 -3.583 6.752
197 HG23 ILE 21 HG23 ILE 21 0.890 -4.029 5.109
198 HD11 ILE 21 HD11 ILE 21 -3.073 -3.146 5.246
199 HD12 ILE 21 HD12 ILE 21 -3.492 -2.460 6.816
200 HD13 ILE 21 HD13 ILE 21 -2.294 -3.749 6.709
201 H ASP 22 H ASP 22 0.877 -2.009 2.856
202 HA ASP 22 HA ASP 22 2.534 -2.415 1.352
203 HB2 ASP 22 HB3 ASP 22 3.455 -0.313 2.430
204 HB3 ASP 22 HB2 ASP 22 4.445 -1.356 3.432
205 H LYS 23 H LYS 23 3.881 -4.131 0.788
206 HA LYS 23 HA LYS 23 4.202 -6.221 2.706
207 HB2 LYS 23 HB3 LYS 23 5.677 -7.231 0.792
208 HB3 LYS 23 HB2 LYS 23 3.933 -7.165 0.646
209 HG2 LYS 23 HG3 LYS 23 4.914 -6.566 -1.447
210 HG3 LYS 23 HG2 LYS 23 4.161 -5.136 -0.752
211 HD2 LYS 23 HD3 LYS 23 7.026 -5.530 -0.139
212 HD3 LYS 23 HD2 LYS 23 6.630 -5.154 -1.818
213 HE2 LYS 23 HE3 LYS 23 5.722 -3.567 0.571
214 HE3 LYS 23 HE2 LYS 23 7.090 -3.135 -0.440
215 HZ1 LYS 23 HZ1 LYS 23 5.635 -2.833 -2.294
216 HZ2 LYS 23 HZ2 LYS 23 5.031 -1.940 -0.986
217 HZ3 LYS 23 HZ3 LYS 23 4.306 -3.409 -1.425
218 H VAL 24 H VAL 24 5.539 -3.614 3.162
219 HA VAL 24 HA VAL 24 7.358 -2.854 4.247
220 HB VAL 24 HB VAL 24 8.105 -5.757 4.638
221 HG11 VAL 24 HG11 VAL 24 8.820 -3.285 6.213
222 HG12 VAL 24 HG12 VAL 24 9.908 -4.209 5.177
223 HG13 VAL 24 HG13 VAL 24 9.254 -4.939 6.644
224 HG21 VAL 24 HG21 VAL 24 6.894 -5.602 6.766
225 HG22 VAL 24 HG22 VAL 24 5.821 -5.365 5.387
226 HG23 VAL 24 HG23 VAL 24 6.359 -3.978 6.336
227 H LEU 25 H LEU 25 7.937 -2.141 2.034
228 HA LEU 25 HA LEU 25 10.724 -2.865 1.665
229 HB2 LEU 25 HB3 LEU 25 9.350 -4.306 0.097
230 HB3 LEU 25 HB2 LEU 25 8.902 -2.830 -0.732
231 HG LEU 25 HG LEU 25 11.197 -2.419 -1.372
232 HD11 LEU 25 HD11 LEU 25 12.356 -3.248 0.574
233 HD12 LEU 25 HD12 LEU 25 12.953 -4.084 -0.858
234 HD13 LEU 25 HD13 LEU 25 11.828 -4.894 0.229
235 HD21 LEU 25 HD21 LEU 25 9.881 -3.861 -2.821
236 HD22 LEU 25 HD22 LEU 25 10.372 -5.274 -1.888
237 HD23 LEU 25 HD23 LEU 25 11.570 -4.369 -2.814
238 H ARG 26 H ARG 26 7.995 -0.776 0.774
239 HA ARG 26 HA ARG 26 9.691 1.495 1.273
240 HB2 ARG 26 HB3 ARG 26 9.294 2.629 -0.864
241 HB3 ARG 26 HB2 ARG 26 10.204 1.146 -1.080
242 HG2 ARG 26 HG3 ARG 26 7.239 1.142 -1.460
243 HG3 ARG 26 HG2 ARG 26 8.297 1.753 -2.731
244 HD2 ARG 26 HD3 ARG 26 8.531 -0.972 -1.470
245 HD3 ARG 26 HD2 ARG 26 7.691 -0.643 -2.983
246 HE ARG 26 HE ARG 26 10.477 0.191 -2.820
247 HH11 ARG 26 HH11 ARG 26 8.165 -2.189 -3.950
248 HH12 ARG 26 HH12 ARG 26 9.259 -2.887 -5.097
249 HH21 ARG 26 HH22 ARG 26 11.903 -0.725 -4.334
250 HH22 ARG 26 HH21 ARG 26 11.383 -2.058 -5.315
251 HA PRO 27 HA PRO 27 5.106 2.094 2.188
252 HB2 PRO 27 HB2 PRO 27 5.984 2.220 4.998
253 HB3 PRO 27 HB3 PRO 27 4.644 1.306 4.279
254 HG2 PRO 27 HG3 PRO 27 6.839 0.068 5.169
255 HG3 PRO 27 HG2 PRO 27 5.990 -0.466 3.704
256 HD2 PRO 27 HD3 PRO 27 8.476 1.215 3.932
257 HD3 PRO 27 HD2 PRO 27 8.165 -0.183 2.877
258 H GLN 28 H GLN 28 4.795 4.229 1.721
259 HA GLN 28 HA GLN 28 6.508 6.174 3.137
260 HB2 GLN 28 HB3 GLN 28 5.245 6.838 0.511
261 HB3 GLN 28 HB2 GLN 28 6.702 7.491 1.244
262 HG2 GLN 28 HG3 GLN 28 7.684 5.142 0.871
263 HG3 GLN 28 HG2 GLN 28 6.321 4.921 -0.232
264 HE21 GLN 28 HE22 GLN 28 6.395 7.825 -0.898
265 HE22 GLN 28 HE21 GLN 28 7.706 7.986 -2.011
266 H GLY 29 H GLY 29 3.569 5.035 3.417
267 HA2 GLY 29 HA3 GLY 29 2.375 7.703 3.828
268 HA3 GLY 29 HA2 GLY 29 1.457 6.382 3.123