Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
23668 | 2jxf RC | 15559 | cing | 1-original | 2 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 H1 GLN 1 HT1 GLN 1 -23.655 0.226 1.159
2 H2 GLN 1 HT2 GLN 1 -23.936 1.618 0.227
3 H3 GLN 1 HT3 GLN 1 -23.482 1.761 1.860
4 HA GLN 1 HA GLN 1 -21.583 2.258 0.460
5 HB2 GLN 1 HB2 GLN 1 -21.796 0.097 2.410
6 HB3 GLN 1 HB1 GLN 1 -20.434 -0.140 1.322
7 HG2 GLN 1 HG2 GLN 1 -19.406 1.217 2.865
8 HG3 GLN 1 HG1 GLN 1 -20.071 2.470 1.822
9 HE21 GLN 1 1HE2 GLN 1 -19.697 1.946 5.016
10 HE22 GLN 1 2HE2 GLN 1 -21.146 2.601 5.604
11 H THR 2 HN THR 2 -20.020 1.521 -1.033
12 HA THR 2 HA THR 2 -20.493 -0.853 -2.686
13 HB THR 2 HB THR 2 -22.101 0.620 -3.651
14 HG1 THR 2 HG1 THR 2 -21.390 0.161 -5.530
15 HG21 THR 2 3HG2 THR 2 -21.354 2.917 -4.542
16 HG22 THR 2 1HG2 THR 2 -20.002 2.768 -3.419
17 HG23 THR 2 2HG2 THR 2 -21.658 2.772 -2.813
18 H ASN 3 HN ASN 3 -18.877 1.355 -4.520
19 HA ASN 3 HA ASN 3 -16.316 0.162 -4.304
20 HB2 ASN 3 HB2 ASN 3 -15.543 2.238 -5.543
21 HB3 ASN 3 HB1 ASN 3 -16.862 1.343 -6.286
22 HD21 ASN 3 1HD2 ASN 3 -18.697 2.591 -6.836
23 HD22 ASN 3 2HD2 ASN 3 -19.017 4.136 -6.209
24 H TRP 4 HN TRP 4 -17.680 2.563 -2.264
25 HA TRP 4 HA TRP 4 -15.387 3.918 -1.253
26 HB2 TRP 4 HB2 TRP 4 -18.008 3.092 0.025
27 HB3 TRP 4 HB1 TRP 4 -16.871 4.197 0.781
28 HD1 TRP 4 HD1 TRP 4 -19.929 4.388 -0.923
29 HE1 TRP 4 HE1 TRP 4 -20.223 6.552 -2.298
30 HE3 TRP 4 HE3 TRP 4 -15.076 5.970 -1.131
31 HZ2 TRP 4 HZ2 TRP 4 -18.610 8.671 -3.348
32 HZ3 TRP 4 HZ3 TRP 4 -14.485 8.054 -2.320
33 HH2 TRP 4 HH2 TRP 4 -16.240 9.407 -3.428
34 H GLN 5 HN GLN 5 -17.020 0.971 -0.054
35 HA GLN 5 HA GLN 5 -15.216 0.386 2.089
36 HB2 GLN 5 HB2 GLN 5 -16.857 -1.459 0.308
37 HB3 GLN 5 HB1 GLN 5 -16.088 -1.958 1.811
38 HG2 GLN 5 HG2 GLN 5 -17.915 0.418 1.852
39 HG3 GLN 5 HG1 GLN 5 -18.620 -1.189 1.773
40 HE21 GLN 5 1HE2 GLN 5 -19.513 -0.753 3.984
41 HE22 GLN 5 2HE2 GLN 5 -18.498 -0.915 5.333
42 H LYS 6 HN LYS 6 -15.155 -0.493 -1.383
43 HA LYS 6 HA LYS 6 -12.780 -2.114 -1.264
44 HB2 LYS 6 HB2 LYS 6 -14.625 -1.861 -3.101
45 HB3 LYS 6 HB1 LYS 6 -13.627 -0.523 -3.680
46 HG2 LYS 6 HG2 LYS 6 -11.705 -1.981 -3.922
47 HG3 LYS 6 HG1 LYS 6 -12.578 -3.325 -3.191
48 HD2 LYS 6 HD2 LYS 6 -13.592 -1.969 -5.691
49 HD3 LYS 6 HD1 LYS 6 -12.406 -3.266 -5.771
50 HE2 LYS 6 HE2 LYS 6 -14.919 -3.676 -4.163
51 HE3 LYS 6 HE1 LYS 6 -14.964 -3.866 -5.924
52 HZ1 LYS 6 HZ1 LYS 6 -13.035 -5.231 -4.109
53 HZ2 LYS 6 HZ2 LYS 6 -13.127 -5.414 -5.798
54 HZ3 LYS 6 HZ3 LYS 6 -14.397 -5.951 -4.810
55 H LEU 7 HN LEU 7 -13.292 1.409 -1.620
56 HA LEU 7 HA LEU 7 -10.681 2.142 -2.492
57 HB2 LEU 7 HB2 LEU 7 -12.676 3.619 -2.461
58 HB3 LEU 7 HB1 LEU 7 -12.630 3.631 -0.702
59 HG LEU 7 HG LEU 7 -10.047 4.349 -1.880
60 HD11 LEU 7 1HD1 LEU 7 -11.545 5.293 -3.630
61 HD12 LEU 7 2HD1 LEU 7 -10.695 6.541 -2.720
62 HD13 LEU 7 3HD1 LEU 7 -12.392 6.204 -2.379
63 HD21 LEU 7 3HD2 LEU 7 -11.958 5.745 0.024
64 HD22 LEU 7 1HD2 LEU 7 -10.285 6.219 -0.270
65 HD23 LEU 7 2HD2 LEU 7 -10.641 4.668 0.488
66 H GLU 8 HN GLU 8 -11.935 1.513 0.816
67 HA GLU 8 HA GLU 8 -9.468 2.360 2.108
68 HB2 GLU 8 HB2 GLU 8 -12.001 0.945 2.895
69 HB3 GLU 8 HB1 GLU 8 -10.612 0.841 3.984
70 HG2 GLU 8 HG2 GLU 8 -10.425 3.408 3.669
71 HG3 GLU 8 HG1 GLU 8 -12.079 3.306 3.064
72 H VAL 9 HN VAL 9 -10.781 -0.764 0.987
73 HA VAL 9 HA VAL 9 -8.619 -2.423 1.945
74 HB VAL 9 HB VAL 9 -10.421 -2.737 -0.503
75 HG11 VAL 9 1HG1 VAL 9 -9.942 -5.141 -0.294
76 HG12 VAL 9 2HG1 VAL 9 -8.870 -4.820 1.067
77 HG13 VAL 9 3HG1 VAL 9 -8.451 -4.233 -0.543
78 HG21 VAL 9 3HG2 VAL 9 -11.704 -2.530 1.623
79 HG22 VAL 9 1HG2 VAL 9 -10.755 -3.851 2.305
80 HG23 VAL 9 2HG2 VAL 9 -11.828 -4.148 0.939
81 H PHE 10 HN PHE 10 -9.274 -0.673 -1.067
82 HA PHE 10 HA PHE 10 -6.962 -1.297 -2.609
83 HB2 PHE 10 HB2 PHE 10 -8.793 -0.243 -3.695
84 HB3 PHE 10 HB1 PHE 10 -8.985 0.919 -2.407
85 HD1 PHE 10 HD2 PHE 10 -6.528 -0.058 -5.083
86 HD2 PHE 10 HD1 PHE 10 -8.198 3.086 -2.675
87 HE1 PHE 10 HE2 PHE 10 -5.218 1.618 -6.357
88 HE2 PHE 10 HE1 PHE 10 -6.888 4.759 -3.952
89 HZ PHE 10 HZ PHE 10 -5.398 4.025 -5.793
90 H TRP 11 HN TRP 11 -7.657 1.369 -0.363
91 HA TRP 11 HA TRP 11 -5.323 2.893 -0.483
92 HB2 TRP 11 HB2 TRP 11 -7.649 2.830 1.031
93 HB3 TRP 11 HB1 TRP 11 -6.385 2.587 2.227
94 HD1 TRP 11 HD1 TRP 11 -6.803 4.851 -0.861
95 HE1 TRP 11 HE1 TRP 11 -6.037 7.235 -0.232
96 HE3 TRP 11 HE3 TRP 11 -5.465 4.068 3.991
97 HZ2 TRP 11 HZ2 TRP 11 -4.988 8.622 2.051
98 HZ3 TRP 11 HZ3 TRP 11 -4.586 5.927 5.373
99 HH2 TRP 11 HH2 TRP 11 -4.346 8.197 4.413
100 H ALA 12 HN ALA 12 -5.962 0.265 1.903
101 HA ALA 12 HA ALA 12 -3.351 0.368 3.055
102 HB1 ALA 12 HB1 ALA 12 -5.754 -1.211 3.327
103 HB2 ALA 12 HB2 ALA 12 -4.461 -0.954 4.499
104 HB3 ALA 12 HB3 ALA 12 -4.345 -2.272 3.337
105 H LYS 13 HN LYS 13 -4.648 -1.608 0.378
106 HA LYS 13 HA LYS 13 -2.433 -3.357 -0.016
107 HB2 LYS 13 HB2 LYS 13 -4.753 -3.421 -1.047
108 HB3 LYS 13 HB1 LYS 13 -4.242 -2.122 -2.121
109 HG2 LYS 13 HG2 LYS 13 -2.247 -4.184 -2.181
110 HG3 LYS 13 HG1 LYS 13 -3.828 -4.922 -2.437
111 HD2 LYS 13 HD2 LYS 13 -4.225 -2.980 -4.120
112 HD3 LYS 13 HD1 LYS 13 -2.477 -2.770 -4.056
113 HE2 LYS 13 HE2 LYS 13 -2.705 -4.271 -5.843
114 HE3 LYS 13 HE1 LYS 13 -2.433 -5.379 -4.489
115 HZ1 LYS 13 HZ1 LYS 13 -4.347 -6.195 -5.514
116 HZ2 LYS 13 HZ2 LYS 13 -5.003 -4.650 -5.766
117 HZ3 LYS 13 HZ3 LYS 13 -4.953 -5.313 -4.201
118 H HIS 14 HN HIS 14 -3.164 -0.180 -1.464
119 HA HIS 14 HA HIS 14 -0.727 0.115 -2.975
120 HB2 HIS 14 HB2 HIS 14 -3.078 1.336 -3.015
121 HB3 HIS 14 HB1 HIS 14 -2.313 2.416 -1.855
122 HD1 HIS 14 HD1 HIS 14 -2.989 2.429 -5.237
123 HD2 HIS 14 HD2 HIS 14 0.577 2.953 -3.140
124 HE1 HIS 14 HE1 HIS 14 -1.418 3.661 -6.795
125 H MET 15 HN MET 15 -1.768 1.318 0.225
126 HA MET 15 HA MET 15 0.566 2.771 0.966
127 HB2 MET 15 HB2 MET 15 -1.819 1.591 2.259
128 HB3 MET 15 HB1 MET 15 -0.443 1.786 3.328
129 HG2 MET 15 HG2 MET 15 -0.641 4.174 1.782
130 HG3 MET 15 HG1 MET 15 -2.254 3.795 2.383
131 HE1 MET 15 HE1 MET 15 0.634 5.690 2.880
132 HE2 MET 15 HE2 MET 15 0.448 6.271 4.531
133 HE3 MET 15 HE3 MET 15 -0.879 6.462 3.391
134 H TRP 16 HN TRP 16 -0.248 -0.691 1.438
135 HA TRP 16 HA TRP 16 2.164 -1.307 2.906
136 HB2 TRP 16 HB2 TRP 16 -0.205 -2.623 2.336
137 HB3 TRP 16 HB1 TRP 16 0.950 -3.487 1.322
138 HD1 TRP 16 HD1 TRP 16 1.515 -5.592 2.625
139 HE1 TRP 16 HE1 TRP 16 2.342 -6.122 5.014
140 HE3 TRP 16 HE3 TRP 16 1.216 -0.956 4.668
141 HZ2 TRP 16 HZ2 TRP 16 2.813 -4.727 7.485
142 HZ3 TRP 16 HZ3 TRP 16 1.853 -0.563 7.039
143 HH2 TRP 16 HH2 TRP 16 2.651 -2.441 8.444
144 H ASN 17 HN ASN 17 1.306 -1.238 -0.545
145 HA ASN 17 HA ASN 17 3.667 -2.540 -1.491
146 HB2 ASN 17 HB2 ASN 17 1.403 -1.824 -2.673
147 HB3 ASN 17 HB1 ASN 17 2.295 -0.345 -3.034
148 HD21 ASN 17 1HD2 ASN 17 4.311 -0.572 -4.349
149 HD22 ASN 17 2HD2 ASN 17 4.514 -1.936 -5.337
150 H PHE 18 HN PHE 18 2.935 0.787 -0.555
151 HA PHE 18 HA PHE 18 5.314 2.095 -1.513
152 HB2 PHE 18 HB2 PHE 18 3.244 3.259 -0.789
153 HB3 PHE 18 HB1 PHE 18 3.427 2.600 0.823
154 HD1 PHE 18 HD2 PHE 18 5.077 4.848 -1.665
155 HD2 PHE 18 HD1 PHE 18 4.724 3.682 2.455
156 HE1 PHE 18 HE2 PHE 18 6.466 6.790 -0.995
157 HE2 PHE 18 HE1 PHE 18 6.112 5.624 3.124
158 HZ PHE 18 HZ PHE 18 6.984 7.179 1.398
159 H ILE 19 HN ILE 19 4.389 0.574 1.568
160 HA ILE 19 HA ILE 19 6.911 0.931 2.913
161 HB ILE 19 HB ILE 19 4.322 -0.512 3.323
162 HG12 ILE 19 2HG1 ILE 19 5.796 1.193 5.301
163 HG13 ILE 19 1HG1 ILE 19 5.053 1.947 3.894
164 HG21 ILE 19 1HG2 ILE 19 5.724 -2.242 4.169
165 HG22 ILE 19 2HG2 ILE 19 5.223 -1.305 5.575
166 HG23 ILE 19 3HG2 ILE 19 6.838 -1.086 4.900
167 HD11 ILE 19 3HD1 ILE 19 3.454 1.993 5.705
168 HD12 ILE 19 1HD1 ILE 19 3.666 0.266 5.993
169 HD13 ILE 19 2HD1 ILE 19 2.894 0.824 4.508
170 H SER 20 HN SER 20 5.559 -1.812 0.992
171 HA SER 20 HA SER 20 7.722 -3.603 1.594
172 HB2 SER 20 HB2 SER 20 6.849 -4.911 -0.295
173 HB3 SER 20 HB1 SER 20 5.544 -4.332 0.721
174 HG SER 20 HG SER 20 5.019 -3.953 -1.420
175 H GLY 21 HN GLY 21 7.331 -1.146 -0.963
176 HA2 GLY 21 HA2 GLY 21 9.652 -1.833 -2.494
177 HA3 GLY 21 HA1 GLY 21 8.883 -0.242 -2.468
178 H ILE 22 HN ILE 22 9.151 0.496 0.173
179 HA ILE 22 HA ILE 22 11.841 1.464 0.357
180 HB ILE 22 HB ILE 22 9.503 1.272 2.287
181 HG12 ILE 22 2HG1 ILE 22 10.749 3.714 1.005
182 HG13 ILE 22 1HG1 ILE 22 9.463 2.795 0.230
183 HG21 ILE 22 1HG2 ILE 22 10.633 2.652 3.863
184 HG22 ILE 22 2HG2 ILE 22 11.975 2.954 2.761
185 HG23 ILE 22 3HG2 ILE 22 11.770 1.359 3.485
186 HD11 ILE 22 3HD1 ILE 22 8.991 4.884 1.884
187 HD12 ILE 22 1HD1 ILE 22 8.976 3.567 3.058
188 HD13 ILE 22 2HD1 ILE 22 7.868 3.539 1.688
189 H GLN 23 HN GLN 23 10.156 -1.262 1.962
190 HA GLN 23 HA GLN 23 12.326 -2.109 3.629
191 HB2 GLN 23 HB2 GLN 23 9.855 -2.739 3.730
192 HB3 GLN 23 HB1 GLN 23 10.171 -3.832 2.386
193 HG2 GLN 23 HG2 GLN 23 10.445 -5.254 4.210
194 HG3 GLN 23 HG1 GLN 23 12.104 -4.734 3.923
195 HE21 GLN 23 1HE2 GLN 23 9.248 -4.077 6.011
196 HE22 GLN 23 2HE2 GLN 23 10.154 -3.392 7.272
197 H TYR 24 HN TYR 24 11.332 -3.014 0.390
198 HA TYR 24 HA TYR 24 13.284 -5.050 -0.162
199 HB2 TYR 24 HB2 TYR 24 11.299 -4.869 -1.491
200 HB3 TYR 24 HB1 TYR 24 11.594 -3.172 -1.834
201 HD1 TYR 24 HD2 TYR 24 12.986 -6.595 -2.396
202 HD2 TYR 24 HD1 TYR 24 12.788 -2.527 -3.764
203 HE1 TYR 24 HE2 TYR 24 14.204 -7.229 -4.459
204 HE2 TYR 24 HE1 TYR 24 14.006 -3.162 -5.827
205 HH TYR 24 HH TYR 24 14.216 -5.891 -7.070
206 H LEU 25 HN LEU 25 13.196 -1.570 -1.004
207 HA LEU 25 HA LEU 25 15.819 -1.454 -2.174
208 HB2 LEU 25 HB2 LEU 25 13.640 0.357 -1.460
209 HB3 LEU 25 HB1 LEU 25 15.222 1.088 -1.220
210 HG LEU 25 HG LEU 25 15.338 -0.342 -3.680
211 HD11 LEU 25 1HD1 LEU 25 13.041 -0.344 -4.065
212 HD12 LEU 25 2HD1 LEU 25 13.546 1.151 -4.848
213 HD13 LEU 25 3HD1 LEU 25 12.795 1.201 -3.253
214 HD21 LEU 25 3HD2 LEU 25 15.113 2.640 -3.152
215 HD22 LEU 25 1HD2 LEU 25 15.809 1.879 -4.584
216 HD23 LEU 25 2HD2 LEU 25 16.603 1.701 -3.019
217 H ALA 26 HN ALA 26 14.694 -1.005 1.172
218 HA ALA 26 HA ALA 26 16.981 0.188 2.337
219 HB1 ALA 26 HB1 ALA 26 16.168 -1.041 4.415
220 HB2 ALA 26 HB2 ALA 26 14.978 -1.835 3.383
221 HB3 ALA 26 HB3 ALA 26 14.939 -0.084 3.587
222 H GLY 27 HN GLY 27 16.281 -3.281 1.761
223 HA2 GLY 27 HA2 GLY 27 18.919 -4.116 2.733
224 HA3 GLY 27 HA1 GLY 27 17.670 -5.167 2.066
225 H LEU 28 HN LEU 28 17.487 -3.233 -0.349
226 HA LEU 28 HA LEU 28 19.933 -4.179 -1.791
227 HB2 LEU 28 HB2 LEU 28 17.253 -4.869 -2.106
228 HB3 LEU 28 HB1 LEU 28 17.512 -3.671 -3.366
229 HG LEU 28 HG LEU 28 19.459 -5.939 -2.966
230 HD11 LEU 28 1HD1 LEU 28 18.178 -7.181 -4.699
231 HD12 LEU 28 2HD1 LEU 28 16.915 -5.953 -4.618
232 HD13 LEU 28 3HD1 LEU 28 17.251 -6.966 -3.215
233 HD21 LEU 28 3HD2 LEU 28 18.648 -4.191 -5.319
234 HD22 LEU 28 1HD2 LEU 28 19.791 -5.531 -5.426
235 HD23 LEU 28 2HD2 LEU 28 20.175 -4.121 -4.439
236 H SER 29 HN SER 29 20.312 -1.797 -0.640
237 HA SER 29 HA SER 29 19.495 0.351 -2.544
238 HB2 SER 29 HB2 SER 29 19.397 0.281 0.151
239 HB3 SER 29 HB1 SER 29 21.017 0.930 -0.053
240 HG SER 29 HG SER 29 18.527 2.016 -0.699
241 H THR 30 HN THR 30 21.446 2.155 -2.477
242 HA THR 30 HA THR 30 23.964 0.753 -3.301
243 HB THR 30 HB THR 30 22.746 3.231 -4.554
244 HG1 THR 30 HG1 THR 30 22.011 1.875 -6.157
245 HG21 THR 30 3HG2 THR 30 24.351 2.826 -6.336
246 HG22 THR 30 1HG2 THR 30 24.916 1.361 -5.531
247 HG23 THR 30 2HG2 THR 30 25.200 2.938 -4.794
Start of MODEL 2
1 H1 GLN 1 HT1 GLN 1 -22.098 -4.334 -3.088
2 H2 GLN 1 HT2 GLN 1 -22.898 -3.101 -3.943
3 H3 GLN 1 HT3 GLN 1 -22.563 -2.917 -2.289
4 HA GLN 1 HA GLN 1 -20.155 -2.960 -2.780
5 HB2 GLN 1 HB2 GLN 1 -20.562 -4.323 -4.861
6 HB3 GLN 1 HB1 GLN 1 -21.166 -2.866 -5.640
7 HG2 GLN 1 HG2 GLN 1 -18.464 -2.749 -4.354
8 HG3 GLN 1 HG1 GLN 1 -18.621 -3.612 -5.881
9 HE21 GLN 1 1HE2 GLN 1 -19.612 -2.312 -7.754
10 HE22 GLN 1 2HE2 GLN 1 -19.376 -0.633 -7.761
11 H THR 2 HN THR 2 -19.727 -0.923 -2.077
12 HA THR 2 HA THR 2 -20.708 1.413 -3.616
13 HB THR 2 HB THR 2 -21.097 1.048 -0.622
14 HG1 THR 2 HG1 THR 2 -22.983 0.283 -1.109
15 HG21 THR 2 3HG2 THR 2 -22.008 3.160 -0.538
16 HG22 THR 2 1HG2 THR 2 -22.476 3.145 -2.237
17 HG23 THR 2 2HG2 THR 2 -20.793 3.420 -1.788
18 H ASN 3 HN ASN 3 -19.385 2.068 -0.497
19 HA ASN 3 HA ASN 3 -16.980 3.201 -1.720
20 HB2 ASN 3 HB2 ASN 3 -16.652 4.239 0.395
21 HB3 ASN 3 HB1 ASN 3 -18.394 4.239 0.129
22 HD21 ASN 3 1HD2 ASN 3 -15.860 3.065 2.234
23 HD22 ASN 3 2HD2 ASN 3 -16.867 2.173 3.266
24 H TRP 4 HN TRP 4 -17.713 0.168 -0.379
25 HA TRP 4 HA TRP 4 -15.267 -0.524 0.929
26 HB2 TRP 4 HB2 TRP 4 -17.288 -2.208 -0.594
27 HB3 TRP 4 HB1 TRP 4 -16.055 -2.862 0.471
28 HD1 TRP 4 HD1 TRP 4 -19.439 -2.648 0.685
29 HE1 TRP 4 HE1 TRP 4 -20.370 -1.973 2.988
30 HE3 TRP 4 HE3 TRP 4 -15.255 -0.584 2.765
31 HZ2 TRP 4 HZ2 TRP 4 -19.463 -0.722 5.399
32 HZ3 TRP 4 HZ3 TRP 4 -15.316 0.338 5.057
33 HH2 TRP 4 HH2 TRP 4 -17.410 0.274 6.378
34 H GLN 5 HN GLN 5 -16.333 -1.234 -2.408
35 HA GLN 5 HA GLN 5 -13.878 -2.286 -3.393
36 HB2 GLN 5 HB2 GLN 5 -16.312 -0.980 -4.543
37 HB3 GLN 5 HB1 GLN 5 -14.892 -1.052 -5.580
38 HG2 GLN 5 HG2 GLN 5 -16.010 -3.476 -4.150
39 HG3 GLN 5 HG1 GLN 5 -16.470 -3.023 -5.788
40 HE21 GLN 5 1HE2 GLN 5 -14.384 -2.641 -7.299
41 HE22 GLN 5 2HE2 GLN 5 -13.154 -3.793 -7.099
42 H LYS 6 HN LYS 6 -15.037 1.095 -3.150
43 HA LYS 6 HA LYS 6 -12.778 2.328 -4.435
44 HB2 LYS 6 HB2 LYS 6 -15.166 3.218 -3.756
45 HB3 LYS 6 HB1 LYS 6 -14.372 3.633 -2.235
46 HG2 LYS 6 HG2 LYS 6 -12.860 5.109 -3.284
47 HG3 LYS 6 HG1 LYS 6 -13.177 4.443 -4.885
48 HD2 LYS 6 HD2 LYS 6 -15.406 5.381 -4.913
49 HD3 LYS 6 HD1 LYS 6 -15.260 5.910 -3.240
50 HE2 LYS 6 HE2 LYS 6 -13.345 6.884 -5.372
51 HE3 LYS 6 HE1 LYS 6 -14.882 7.702 -5.055
52 HZ1 LYS 6 HZ1 LYS 6 -13.525 8.770 -3.578
53 HZ2 LYS 6 HZ2 LYS 6 -12.543 7.417 -3.301
54 HZ3 LYS 6 HZ3 LYS 6 -14.078 7.520 -2.579
55 H LEU 7 HN LEU 7 -13.476 1.442 -1.034
56 HA LEU 7 HA LEU 7 -11.116 2.626 0.122
57 HB2 LEU 7 HB2 LEU 7 -13.291 1.795 1.248
58 HB3 LEU 7 HB1 LEU 7 -12.605 0.180 1.123
59 HG LEU 7 HG LEU 7 -11.023 2.409 2.397
60 HD11 LEU 7 1HD1 LEU 7 -13.265 0.789 3.603
61 HD12 LEU 7 2HD1 LEU 7 -12.987 2.528 3.701
62 HD13 LEU 7 3HD1 LEU 7 -11.950 1.418 4.594
63 HD21 LEU 7 3HD2 LEU 7 -10.960 -0.579 2.274
64 HD22 LEU 7 1HD2 LEU 7 -10.443 0.175 3.781
65 HD23 LEU 7 2HD2 LEU 7 -9.624 0.571 2.274
66 H GLU 8 HN GLU 8 -11.810 -0.644 -1.229
67 HA GLU 8 HA GLU 8 -9.368 -1.918 -0.511
68 HB2 GLU 8 HB2 GLU 8 -11.563 -2.291 -2.448
69 HB3 GLU 8 HB1 GLU 8 -10.024 -2.923 -3.023
70 HG2 GLU 8 HG2 GLU 8 -9.879 -3.978 -0.615
71 HG3 GLU 8 HG1 GLU 8 -11.626 -3.749 -0.623
72 H VAL 9 HN VAL 9 -10.195 0.035 -3.383
73 HA VAL 9 HA VAL 9 -7.668 -0.102 -4.732
74 HB VAL 9 HB VAL 9 -9.789 2.083 -4.658
75 HG11 VAL 9 1HG1 VAL 9 -8.881 2.990 -6.614
76 HG12 VAL 9 2HG1 VAL 9 -7.968 1.530 -6.990
77 HG13 VAL 9 3HG1 VAL 9 -7.438 2.588 -5.684
78 HG21 VAL 9 3HG2 VAL 9 -10.064 -0.540 -5.522
79 HG22 VAL 9 1HG2 VAL 9 -9.664 0.325 -7.006
80 HG23 VAL 9 2HG2 VAL 9 -11.056 0.817 -6.043
81 H PHE 10 HN PHE 10 -8.972 2.099 -2.272
82 HA PHE 10 HA PHE 10 -6.736 3.914 -2.077
83 HB2 PHE 10 HB2 PHE 10 -8.873 4.613 -1.255
84 HB3 PHE 10 HB1 PHE 10 -9.111 3.112 -0.390
85 HD1 PHE 10 HD2 PHE 10 -6.749 6.029 -0.462
86 HD2 PHE 10 HD1 PHE 10 -8.751 3.055 1.904
87 HE1 PHE 10 HE2 PHE 10 -5.818 7.045 1.601
88 HE2 PHE 10 HE1 PHE 10 -7.819 4.072 3.968
89 HZ PHE 10 HZ PHE 10 -6.353 6.065 3.816
90 H TRP 11 HN TRP 11 -7.793 1.127 -0.137
91 HA TRP 11 HA TRP 11 -5.686 1.006 1.739
92 HB2 TRP 11 HB2 TRP 11 -8.010 -0.355 1.267
93 HB3 TRP 11 HB1 TRP 11 -6.813 -1.573 0.832
94 HD1 TRP 11 HD1 TRP 11 -7.121 1.033 3.640
95 HE1 TRP 11 HE1 TRP 11 -6.541 -0.103 5.890
96 HE3 TRP 11 HE3 TRP 11 -6.128 -3.678 1.983
97 HZ2 TRP 11 HZ2 TRP 11 -5.758 -2.689 6.843
98 HZ3 TRP 11 HZ3 TRP 11 -5.467 -5.462 3.574
99 HH2 TRP 11 HH2 TRP 11 -5.280 -4.976 5.995
100 H ALA 12 HN ALA 12 -5.955 -0.578 -1.479
101 HA ALA 12 HA ALA 12 -3.558 -2.104 -1.273
102 HB1 ALA 12 HB1 ALA 12 -3.726 -2.284 -3.711
103 HB2 ALA 12 HB2 ALA 12 -4.778 -0.871 -3.771
104 HB3 ALA 12 HB3 ALA 12 -5.349 -2.363 -3.024
105 H LYS 13 HN LYS 13 -4.142 1.177 -2.589
106 HA LYS 13 HA LYS 13 -1.425 1.759 -3.339
107 HB2 LYS 13 HB2 LYS 13 -3.956 3.283 -2.795
108 HB3 LYS 13 HB1 LYS 13 -2.454 4.191 -2.932
109 HG2 LYS 13 HG2 LYS 13 -2.110 2.739 -5.104
110 HG3 LYS 13 HG1 LYS 13 -3.859 2.541 -5.008
111 HD2 LYS 13 HD2 LYS 13 -3.259 5.309 -4.578
112 HD3 LYS 13 HD1 LYS 13 -2.382 4.776 -6.006
113 HE2 LYS 13 HE2 LYS 13 -4.444 5.388 -6.927
114 HE3 LYS 13 HE1 LYS 13 -4.700 3.656 -6.650
115 HZ1 LYS 13 HZ1 LYS 13 -5.548 4.275 -4.388
116 HZ2 LYS 13 HZ2 LYS 13 -6.526 4.783 -5.680
117 HZ3 LYS 13 HZ3 LYS 13 -5.526 5.899 -4.884
118 H HIS 14 HN HIS 14 -3.295 2.239 -0.353
119 HA HIS 14 HA HIS 14 -1.344 3.695 1.168
120 HB2 HIS 14 HB2 HIS 14 -3.694 3.629 1.758
121 HB3 HIS 14 HB1 HIS 14 -3.679 1.875 1.839
122 HD1 HIS 14 HD1 HIS 14 -1.488 4.541 3.492
123 HD2 HIS 14 HD2 HIS 14 -3.774 1.205 4.508
124 HE1 HIS 14 HE1 HIS 14 -1.220 4.223 5.988
125 H MET 15 HN MET 15 -2.164 0.213 1.026
126 HA MET 15 HA MET 15 -0.081 -0.710 2.784
127 HB2 MET 15 HB2 MET 15 -2.292 -1.793 1.574
128 HB3 MET 15 HB1 MET 15 -1.011 -2.496 0.594
129 HG2 MET 15 HG2 MET 15 -0.969 -4.064 2.245
130 HG3 MET 15 HG1 MET 15 0.022 -2.877 3.087
131 HE1 MET 15 HE1 MET 15 -2.034 -1.409 5.785
132 HE2 MET 15 HE2 MET 15 -1.773 -0.601 4.243
133 HE3 MET 15 HE3 MET 15 -0.492 -1.593 4.930
134 H TRP 16 HN TRP 16 -0.270 -0.468 -0.797
135 HA TRP 16 HA TRP 16 2.329 -1.483 -1.363
136 HB2 TRP 16 HB2 TRP 16 0.284 -0.852 -2.901
137 HB3 TRP 16 HB1 TRP 16 1.085 0.717 -2.994
138 HD1 TRP 16 HD1 TRP 16 2.331 0.773 -5.192
139 HE1 TRP 16 HE1 TRP 16 3.933 -0.800 -6.457
140 HE3 TRP 16 HE3 TRP 16 2.151 -3.287 -2.130
141 HZ2 TRP 16 HZ2 TRP 16 5.000 -3.452 -6.197
142 HZ3 TRP 16 HZ3 TRP 16 3.462 -5.328 -2.651
143 HH2 TRP 16 HH2 TRP 16 4.884 -5.413 -4.677
144 H ASN 17 HN ASN 17 1.266 1.738 -0.335
145 HA ASN 17 HA ASN 17 3.674 3.185 -0.895
146 HB2 ASN 17 HB2 ASN 17 1.379 4.086 -0.273
147 HB3 ASN 17 HB1 ASN 17 1.695 3.572 1.383
148 HD21 ASN 17 1HD2 ASN 17 3.156 4.885 2.671
149 HD22 ASN 17 2HD2 ASN 17 3.811 6.334 2.080
150 H PHE 18 HN PHE 18 2.540 1.330 1.919
151 HA PHE 18 HA PHE 18 4.714 1.739 3.726
152 HB2 PHE 18 HB2 PHE 18 2.414 0.677 4.114
153 HB3 PHE 18 HB1 PHE 18 3.029 -0.763 3.321
154 HD1 PHE 18 HD2 PHE 18 3.252 1.375 6.310
155 HD2 PHE 18 HD1 PHE 18 4.705 -2.187 4.397
156 HE1 PHE 18 HE2 PHE 18 4.244 0.629 8.457
157 HE2 PHE 18 HE1 PHE 18 5.696 -2.933 6.546
158 HZ PHE 18 HZ PHE 18 5.466 -1.527 8.574
159 H ILE 19 HN ILE 19 4.146 -0.537 1.067
160 HA ILE 19 HA ILE 19 6.598 -2.060 1.388
161 HB ILE 19 HB ILE 19 4.344 -1.815 -0.590
162 HG12 ILE 19 2HG1 ILE 19 5.208 -4.454 0.337
163 HG13 ILE 19 1HG1 ILE 19 4.861 -3.355 1.666
164 HG21 ILE 19 1HG2 ILE 19 7.021 -3.056 -1.134
165 HG22 ILE 19 2HG2 ILE 19 5.957 -2.170 -2.221
166 HG23 ILE 19 3HG2 ILE 19 5.568 -3.827 -1.771
167 HD11 ILE 19 3HD1 ILE 19 2.742 -4.181 1.285
168 HD12 ILE 19 1HD1 ILE 19 3.025 -4.411 -0.439
169 HD13 ILE 19 2HD1 ILE 19 2.717 -2.795 0.197
170 H SER 20 HN SER 20 5.561 0.693 -0.663
171 HA SER 20 HA SER 20 7.750 0.898 -2.404
172 HB2 SER 20 HB2 SER 20 5.830 2.848 -1.180
173 HB3 SER 20 HB1 SER 20 7.159 3.447 -2.163
174 HG SER 20 HG SER 20 4.865 2.375 -2.957
175 H GLY 21 HN GLY 21 7.462 2.346 0.874
176 HA2 GLY 21 HA2 GLY 21 10.027 3.627 0.863
177 HA3 GLY 21 HA1 GLY 21 9.098 3.219 2.309
178 H ILE 22 HN ILE 22 8.939 0.456 2.103
179 HA ILE 22 HA ILE 22 11.533 -0.386 3.059
180 HB ILE 22 HB ILE 22 8.985 -1.866 2.339
181 HG12 ILE 22 2HG1 ILE 22 10.162 -1.461 5.088
182 HG13 ILE 22 1HG1 ILE 22 9.182 -0.201 4.344
183 HG21 ILE 22 1HG2 ILE 22 10.624 -3.557 2.166
184 HG22 ILE 22 2HG2 ILE 22 10.064 -3.687 3.832
185 HG23 ILE 22 3HG2 ILE 22 11.592 -2.881 3.477
186 HD11 ILE 22 3HD1 ILE 22 8.358 -2.783 5.483
187 HD12 ILE 22 1HD1 ILE 22 7.647 -2.442 3.904
188 HD13 ILE 22 2HD1 ILE 22 7.424 -1.307 5.232
189 H GLN 23 HN GLN 23 9.793 -0.930 -0.038
190 HA GLN 23 HA GLN 23 11.640 -2.742 -1.180
191 HB2 GLN 23 HB2 GLN 23 10.395 -2.467 -3.119
192 HB3 GLN 23 HB1 GLN 23 9.267 -1.901 -1.909
193 HG2 GLN 23 HG2 GLN 23 9.103 0.025 -3.019
194 HG3 GLN 23 HG1 GLN 23 10.788 0.370 -2.680
195 HE21 GLN 23 1HE2 GLN 23 11.918 -1.772 -4.392
196 HE22 GLN 23 2HE2 GLN 23 11.567 -1.329 -5.991
197 H TYR 24 HN TYR 24 11.926 0.661 -0.718
198 HA TYR 24 HA TYR 24 14.184 1.025 -2.561
199 HB2 TYR 24 HB2 TYR 24 12.919 2.948 -2.449
200 HB3 TYR 24 HB1 TYR 24 12.377 2.626 -0.821
201 HD1 TYR 24 HD2 TYR 24 15.926 2.955 -2.042
202 HD2 TYR 24 HD1 TYR 24 12.720 4.673 0.241
203 HE1 TYR 24 HE2 TYR 24 17.465 4.698 -1.194
204 HE2 TYR 24 HE1 TYR 24 14.260 6.417 1.086
205 HH TYR 24 HH TYR 24 17.392 6.243 1.132
206 H LEU 25 HN LEU 25 13.665 0.997 1.000
207 HA LEU 25 HA LEU 25 16.491 1.160 1.617
208 HB2 LEU 25 HB2 LEU 25 13.919 0.763 3.067
209 HB3 LEU 25 HB1 LEU 25 15.372 0.211 3.885
210 HG LEU 25 HG LEU 25 14.824 2.528 4.491
211 HD11 LEU 25 1HD1 LEU 25 17.265 1.623 4.072
212 HD12 LEU 25 2HD1 LEU 25 16.991 3.329 4.422
213 HD13 LEU 25 3HD1 LEU 25 17.248 2.801 2.760
214 HD21 LEU 25 3HD2 LEU 25 15.280 3.150 1.564
215 HD22 LEU 25 1HD2 LEU 25 14.944 4.321 2.838
216 HD23 LEU 25 2HD2 LEU 25 13.711 3.153 2.370
217 H ALA 26 HN ALA 26 14.188 -1.600 1.664
218 HA ALA 26 HA ALA 26 16.079 -3.602 2.443
219 HB1 ALA 26 HB1 ALA 26 13.625 -3.832 0.662
220 HB2 ALA 26 HB2 ALA 26 13.604 -3.873 2.424
221 HB3 ALA 26 HB3 ALA 26 14.401 -5.162 1.523
222 H GLY 27 HN GLY 27 15.177 -2.283 -0.745
223 HA2 GLY 27 HA2 GLY 27 16.806 -4.098 -2.289
224 HA3 GLY 27 HA1 GLY 27 16.089 -2.596 -2.869
225 H LEU 28 HN LEU 28 17.411 -0.958 -0.721
226 HA LEU 28 HA LEU 28 20.116 -0.818 -1.957
227 HB2 LEU 28 HB2 LEU 28 18.384 1.082 -1.934
228 HB3 LEU 28 HB1 LEU 28 18.704 1.209 -0.210
229 HG LEU 28 HG LEU 28 21.238 1.129 -1.495
230 HD11 LEU 28 1HD1 LEU 28 19.168 2.742 -2.947
231 HD12 LEU 28 2HD1 LEU 28 20.529 1.827 -3.594
232 HD13 LEU 28 3HD1 LEU 28 20.807 3.378 -2.806
233 HD21 LEU 28 3HD2 LEU 28 21.514 3.275 -0.443
234 HD22 LEU 28 1HD2 LEU 28 20.472 2.327 0.617
235 HD23 LEU 28 2HD2 LEU 28 19.774 3.563 -0.430
236 H SER 29 HN SER 29 19.959 -2.904 -0.209
237 HA SER 29 HA SER 29 20.758 -2.084 2.513
238 HB2 SER 29 HB2 SER 29 20.329 -4.702 1.060
239 HB3 SER 29 HB1 SER 29 20.949 -4.645 2.700
240 HG SER 29 HG SER 29 18.414 -4.023 1.682
241 H THR 30 HN THR 30 22.574 -0.896 1.161
242 HA THR 30 HA THR 30 24.823 -0.543 0.881
243 HB THR 30 HB THR 30 25.139 -3.283 2.154
244 HG1 THR 30 HG1 THR 30 24.259 -2.193 3.743
245 HG21 THR 30 3HG2 THR 30 27.196 -2.553 1.104
246 HG22 THR 30 1HG2 THR 30 27.348 -2.361 2.850
247 HG23 THR 30 2HG2 THR 30 27.043 -0.954 1.832
Start of MODEL 3
1 H1 GLN 1 HT1 GLN 1 23.294 0.320 -0.930
2 H2 GLN 1 HT2 GLN 1 22.596 -0.929 -1.838
3 H3 GLN 1 HT3 GLN 1 22.606 -1.014 -0.143
4 HA GLN 1 HA GLN 1 20.400 -0.396 -1.051
5 HB2 GLN 1 HB2 GLN 1 20.077 1.426 0.537
6 HB3 GLN 1 HB1 GLN 1 21.156 0.222 1.223
7 HG2 GLN 1 HG2 GLN 1 22.887 1.684 1.344
8 HG3 GLN 1 HG1 GLN 1 22.570 2.341 -0.258
9 HE21 GLN 1 1HE2 GLN 1 22.875 3.491 2.737
10 HE22 GLN 1 2HE2 GLN 1 21.649 4.662 2.763
11 H THR 2 HN THR 2 19.101 1.140 -2.005
12 HA THR 2 HA THR 2 19.977 3.533 -3.316
13 HB THR 2 HB THR 2 21.207 1.950 -4.710
14 HG1 THR 2 HG1 THR 2 20.641 2.920 -6.468
15 HG21 THR 2 3HG2 THR 2 19.083 0.558 -6.044
16 HG22 THR 2 1HG2 THR 2 18.980 0.240 -4.312
17 HG23 THR 2 2HG2 THR 2 20.469 -0.109 -5.187
18 H ASN 3 HN ASN 3 17.958 2.501 -5.547
19 HA ASN 3 HA ASN 3 15.585 3.668 -4.346
20 HB2 ASN 3 HB2 ASN 3 14.609 3.378 -6.523
21 HB3 ASN 3 HB1 ASN 3 16.280 3.873 -6.757
22 HD21 ASN 3 1HD2 ASN 3 14.135 1.914 -8.195
23 HD22 ASN 3 2HD2 ASN 3 15.129 0.616 -8.647
24 H TRP 4 HN TRP 4 16.764 0.432 -4.575
25 HA TRP 4 HA TRP 4 14.300 -1.025 -4.428
26 HB2 TRP 4 HB2 TRP 4 17.152 -1.561 -3.571
27 HB3 TRP 4 HB1 TRP 4 15.880 -2.729 -3.241
28 HD1 TRP 4 HD1 TRP 4 18.429 -2.233 -5.622
29 HE1 TRP 4 HE1 TRP 4 17.862 -3.208 -7.940
30 HE3 TRP 4 HE3 TRP 4 13.381 -2.833 -5.119
31 HZ2 TRP 4 HZ2 TRP 4 15.570 -4.119 -9.393
32 HZ3 TRP 4 HZ3 TRP 4 12.036 -3.752 -6.983
33 HH2 TRP 4 HH2 TRP 4 13.118 -4.394 -9.114
34 H GLN 5 HN GLN 5 16.532 0.024 -1.809
35 HA GLN 5 HA GLN 5 14.942 -0.810 0.387
36 HB2 GLN 5 HB2 GLN 5 16.919 1.453 -0.001
37 HB3 GLN 5 HB1 GLN 5 16.181 1.119 1.565
38 HG2 GLN 5 HG2 GLN 5 17.056 -1.383 0.576
39 HG3 GLN 5 HG1 GLN 5 18.371 -0.254 0.271
40 HE21 GLN 5 1HE2 GLN 5 16.615 -1.957 2.813
41 HE22 GLN 5 2HE2 GLN 5 17.569 -1.380 4.091
42 H LYS 6 HN LYS 6 14.775 2.185 -1.560
43 HA LYS 6 HA LYS 6 12.702 3.431 0.052
44 HB2 LYS 6 HB2 LYS 6 13.580 3.862 -2.828
45 HB3 LYS 6 HB1 LYS 6 12.509 4.932 -1.938
46 HG2 LYS 6 HG2 LYS 6 15.445 4.409 -1.471
47 HG3 LYS 6 HG1 LYS 6 14.648 5.940 -1.802
48 HD2 LYS 6 HD2 LYS 6 13.379 5.280 0.487
49 HD3 LYS 6 HD1 LYS 6 14.901 4.440 0.758
50 HE2 LYS 6 HE2 LYS 6 14.634 7.389 0.072
51 HE3 LYS 6 HE1 LYS 6 14.951 6.738 1.685
52 HZ1 LYS 6 HZ1 LYS 6 17.068 7.104 0.960
53 HZ2 LYS 6 HZ2 LYS 6 16.705 6.796 -0.668
54 HZ3 LYS 6 HZ3 LYS 6 16.885 5.507 0.428
55 H LEU 7 HN LEU 7 12.762 1.363 -2.843
56 HA LEU 7 HA LEU 7 9.962 1.444 -3.477
57 HB2 LEU 7 HB2 LEU 7 11.766 0.712 -5.008
58 HB3 LEU 7 HB1 LEU 7 12.098 -0.657 -3.958
59 HG LEU 7 HG LEU 7 9.276 -0.460 -4.792
60 HD11 LEU 7 1HD1 LEU 7 11.449 -1.023 -6.834
61 HD12 LEU 7 2HD1 LEU 7 10.306 0.321 -6.872
62 HD13 LEU 7 3HD1 LEU 7 9.729 -1.332 -7.072
63 HD21 LEU 7 3HD2 LEU 7 9.437 -2.792 -4.806
64 HD22 LEU 7 1HD2 LEU 7 10.660 -2.366 -3.610
65 HD23 LEU 7 2HD2 LEU 7 11.143 -2.775 -5.255
66 H GLU 8 HN GLU 8 11.911 -0.680 -1.340
67 HA GLU 8 HA GLU 8 9.871 -2.597 -0.733
68 HB2 GLU 8 HB2 GLU 8 12.335 -1.568 0.699
69 HB3 GLU 8 HB1 GLU 8 11.345 -2.859 1.374
70 HG2 GLU 8 HG2 GLU 8 11.900 -4.363 -0.313
71 HG3 GLU 8 HG1 GLU 8 12.269 -3.092 -1.472
72 H VAL 9 HN VAL 9 10.841 0.421 0.926
73 HA VAL 9 HA VAL 9 8.828 0.357 2.992
74 HB VAL 9 HB VAL 9 10.382 2.627 1.676
75 HG11 VAL 9 1HG1 VAL 9 9.873 3.930 3.716
76 HG12 VAL 9 2HG1 VAL 9 8.835 2.625 4.286
77 HG13 VAL 9 3HG1 VAL 9 8.402 3.524 2.832
78 HG21 VAL 9 3HG2 VAL 9 10.840 1.205 4.315
79 HG22 VAL 9 1HG2 VAL 9 11.860 2.453 3.600
80 HG23 VAL 9 2HG2 VAL 9 11.737 0.871 2.834
81 H PHE 10 HN PHE 10 9.035 1.883 -0.215
82 HA PHE 10 HA PHE 10 6.527 3.207 -0.338
83 HB2 PHE 10 HB2 PHE 10 8.185 3.679 -1.986
84 HB3 PHE 10 HB1 PHE 10 8.422 1.978 -2.336
85 HD1 PHE 10 HD2 PHE 10 5.709 4.567 -2.432
86 HD2 PHE 10 HD1 PHE 10 7.430 1.068 -4.231
87 HE1 PHE 10 HE2 PHE 10 4.048 4.700 -4.272
88 HE2 PHE 10 HE1 PHE 10 5.769 1.201 -6.074
89 HZ PHE 10 HZ PHE 10 4.080 3.014 -6.092
90 H TRP 11 HN TRP 11 7.451 -0.094 -1.354
91 HA TRP 11 HA TRP 11 4.973 -0.959 -2.387
92 HB2 TRP 11 HB2 TRP 11 7.465 -2.054 -2.068
93 HB3 TRP 11 HB1 TRP 11 6.524 -2.992 -0.911
94 HD1 TRP 11 HD1 TRP 11 5.927 -1.687 -4.482
95 HE1 TRP 11 HE1 TRP 11 4.898 -3.586 -5.892
96 HE3 TRP 11 HE3 TRP 11 5.710 -5.355 -0.950
97 HZ2 TRP 11 HZ2 TRP 11 4.088 -6.316 -5.551
98 HZ3 TRP 11 HZ3 TRP 11 4.808 -7.593 -1.513
99 HH2 TRP 11 HH2 TRP 11 3.997 -8.079 -3.802
100 H ALA 12 HN ALA 12 6.163 -1.117 1.005
101 HA ALA 12 HA ALA 12 3.912 -2.584 1.985
102 HB1 ALA 12 HB1 ALA 12 6.202 -2.063 3.105
103 HB2 ALA 12 HB2 ALA 12 4.775 -2.075 4.143
104 HB3 ALA 12 HB3 ALA 12 5.455 -0.542 3.601
105 H LYS 13 HN LYS 13 4.559 0.916 1.692
106 HA LYS 13 HA LYS 13 2.079 1.817 2.879
107 HB2 LYS 13 HB2 LYS 13 4.459 2.952 2.033
108 HB3 LYS 13 HB1 LYS 13 3.332 3.506 0.796
109 HG2 LYS 13 HG2 LYS 13 2.314 3.706 3.565
110 HG3 LYS 13 HG1 LYS 13 3.698 4.736 3.214
111 HD2 LYS 13 HD2 LYS 13 2.165 5.142 0.981
112 HD3 LYS 13 HD1 LYS 13 0.926 4.892 2.207
113 HE2 LYS 13 HE2 LYS 13 1.315 7.216 2.313
114 HE3 LYS 13 HE1 LYS 13 2.320 6.592 3.631
115 HZ1 LYS 13 HZ1 LYS 13 3.577 8.100 2.208
116 HZ2 LYS 13 HZ2 LYS 13 3.263 7.121 0.855
117 HZ3 LYS 13 HZ3 LYS 13 4.217 6.535 2.134
118 H HIS 14 HN HIS 14 3.129 1.012 -0.418
119 HA HIS 14 HA HIS 14 0.763 1.824 -1.851
120 HB2 HIS 14 HB2 HIS 14 3.084 1.354 -2.748
121 HB3 HIS 14 HB1 HIS 14 2.800 -0.358 -2.453
122 HD1 HIS 14 HD1 HIS 14 2.007 2.410 -4.785
123 HD2 HIS 14 HD2 HIS 14 0.777 -1.525 -4.179
124 HE1 HIS 14 HE1 HIS 14 0.725 1.734 -6.863
125 H MET 15 HN MET 15 1.866 -1.330 -0.535
126 HA MET 15 HA MET 15 -0.492 -2.825 -1.236
127 HB2 MET 15 HB2 MET 15 1.966 -3.495 -0.345
128 HB3 MET 15 HB1 MET 15 1.119 -3.511 1.198
129 HG2 MET 15 HG2 MET 15 0.510 -5.617 0.658
130 HG3 MET 15 HG1 MET 15 -0.642 -4.867 -0.442
131 HE1 MET 15 HE1 MET 15 0.754 -5.122 -3.869
132 HE2 MET 15 HE2 MET 15 1.098 -3.692 -2.903
133 HE3 MET 15 HE3 MET 15 -0.457 -4.499 -2.733
134 H TRP 16 HN TRP 16 0.466 -0.952 1.649
135 HA TRP 16 HA TRP 16 -1.770 -1.614 3.330
136 HB2 TRP 16 HB2 TRP 16 0.165 -0.544 4.299
137 HB3 TRP 16 HB1 TRP 16 0.116 0.756 3.112
138 HD1 TRP 16 HD1 TRP 16 -1.625 -0.506 6.228
139 HE1 TRP 16 HE1 TRP 16 -3.052 1.388 7.252
140 HE3 TRP 16 HE3 TRP 16 -1.158 2.950 2.564
141 HZ2 TRP 16 HZ2 TRP 16 -3.883 4.060 6.565
142 HZ3 TRP 16 HZ3 TRP 16 -2.263 5.167 2.740
143 HH2 TRP 16 HH2 TRP 16 -3.626 5.721 4.736
144 H ASN 17 HN ASN 17 -1.131 1.074 1.035
145 HA ASN 17 HA ASN 17 -3.641 2.353 1.380
146 HB2 ASN 17 HB2 ASN 17 -1.344 2.934 0.048
147 HB3 ASN 17 HB1 ASN 17 -2.341 2.449 -1.319
148 HD21 ASN 17 1HD2 ASN 17 -4.774 3.535 -1.057
149 HD22 ASN 17 2HD2 ASN 17 -4.712 5.188 -0.683
150 H PHE 18 HN PHE 18 -2.541 -0.189 -0.858
151 HA PHE 18 HA PHE 18 -4.886 -0.531 -2.450
152 HB2 PHE 18 HB2 PHE 18 -2.805 -1.596 -3.045
153 HB3 PHE 18 HB1 PHE 18 -2.644 -2.322 -1.460
154 HD1 PHE 18 HD1 PHE 18 -4.877 -2.344 -4.472
155 HD2 PHE 18 HD2 PHE 18 -3.334 -4.529 -1.111
156 HE1 PHE 18 HE1 PHE 18 -5.991 -4.399 -5.297
157 HE2 PHE 18 HE2 PHE 18 -4.448 -6.584 -1.937
158 HZ PHE 18 HZ PHE 18 -5.776 -6.520 -4.029
159 H ILE 19 HN ILE 19 -3.854 -1.958 0.629
160 HA ILE 19 HA ILE 19 -6.147 -3.583 1.164
161 HB ILE 19 HB ILE 19 -3.607 -2.980 2.231
162 HG12 ILE 19 2HG1 ILE 19 -4.051 -5.006 3.608
163 HG13 ILE 19 1HG1 ILE 19 -5.730 -4.953 3.074
164 HG21 ILE 19 1HG2 ILE 19 -4.783 -1.417 3.830
165 HG22 ILE 19 2HG2 ILE 19 -3.814 -2.689 4.555
166 HG23 ILE 19 3HG2 ILE 19 -5.570 -2.843 4.504
167 HD11 ILE 19 3HD1 ILE 19 -3.701 -4.802 0.918
168 HD12 ILE 19 1HD1 ILE 19 -5.217 -5.702 0.980
169 HD13 ILE 19 2HD1 ILE 19 -3.779 -6.336 1.782
170 H SER 20 HN SER 20 -5.339 -0.234 2.085
171 HA SER 20 HA SER 20 -7.614 0.265 3.754
172 HB2 SER 20 HB2 SER 20 -5.404 1.622 3.350
173 HB3 SER 20 HB1 SER 20 -6.324 2.387 2.060
174 HG SER 20 HG SER 20 -7.936 2.862 3.688
175 H GLY 21 HN GLY 21 -7.199 0.604 0.203
176 HA2 GLY 21 HA2 GLY 21 -9.692 1.946 -0.271
177 HA3 GLY 21 HA1 GLY 21 -8.784 1.024 -1.475
178 H ILE 22 HN ILE 22 -8.748 -1.494 -0.335
179 HA ILE 22 HA ILE 22 -11.309 -2.593 -1.031
180 HB ILE 22 HB ILE 22 -8.961 -3.713 0.549
181 HG12 ILE 22 2HG1 ILE 22 -9.652 -4.412 -2.296
182 HG13 ILE 22 1HG1 ILE 22 -8.751 -2.936 -1.959
183 HG21 ILE 22 1HG2 ILE 22 -11.497 -4.975 -0.437
184 HG22 ILE 22 2HG2 ILE 22 -10.611 -5.263 1.059
185 HG23 ILE 22 3HG2 ILE 22 -10.010 -5.923 -0.460
186 HD11 ILE 22 3HD1 ILE 22 -7.301 -4.576 -0.449
187 HD12 ILE 22 1HD1 ILE 22 -6.997 -4.412 -2.177
188 HD13 ILE 22 2HD1 ILE 22 -7.928 -5.782 -1.573
189 H GLN 23 HN GLN 23 -9.699 -2.137 2.131
190 HA GLN 23 HA GLN 23 -11.834 -3.015 3.798
191 HB2 GLN 23 HB2 GLN 23 -9.368 -2.602 4.331
192 HB3 GLN 23 HB1 GLN 23 -9.778 -0.894 4.447
193 HG2 GLN 23 HG2 GLN 23 -10.746 -1.144 6.466
194 HG3 GLN 23 HG1 GLN 23 -11.595 -2.614 5.992
195 HE21 GLN 23 1HE2 GLN 23 -9.998 -4.649 5.824
196 HE22 GLN 23 2HE2 GLN 23 -8.818 -4.741 7.041
197 H TYR 24 HN TYR 24 -11.083 0.166 2.486
198 HA TYR 24 HA TYR 24 -13.002 1.752 3.860
199 HB2 TYR 24 HB2 TYR 24 -11.217 2.710 2.478
200 HB3 TYR 24 HB1 TYR 24 -11.920 1.993 1.028
201 HD1 TYR 24 HD1 TYR 24 -12.435 4.500 3.705
202 HD2 TYR 24 HD2 TYR 24 -13.828 2.988 -0.068
203 HE1 TYR 24 HE1 TYR 24 -13.909 6.479 3.454
204 HE2 TYR 24 HE2 TYR 24 -15.296 4.962 -0.319
205 HH TYR 24 HH TYR 24 -16.342 6.768 1.868
206 H LEU 25 HN LEU 25 -13.315 -0.092 0.797
207 HA LEU 25 HA LEU 25 -16.081 0.648 0.357
208 HB2 LEU 25 HB2 LEU 25 -14.045 -1.169 -0.798
209 HB3 LEU 25 HB1 LEU 25 -15.716 -1.681 -1.028
210 HG LEU 25 HG LEU 25 -16.079 0.856 -1.686
211 HD11 LEU 25 1HD1 LEU 25 -14.187 1.906 -2.701
212 HD12 LEU 25 2HD1 LEU 25 -13.194 0.462 -2.500
213 HD13 LEU 25 3HD1 LEU 25 -13.680 1.403 -1.090
214 HD21 LEU 25 3HD2 LEU 25 -16.450 -1.053 -3.197
215 HD22 LEU 25 1HD2 LEU 25 -14.716 -1.165 -3.499
216 HD23 LEU 25 2HD2 LEU 25 -15.619 0.246 -4.048
217 H ALA 26 HN ALA 26 -14.517 -2.187 1.859
218 HA ALA 26 HA ALA 26 -16.715 -3.862 2.336
219 HB1 ALA 26 HB1 ALA 26 -14.436 -3.297 4.247
220 HB2 ALA 26 HB2 ALA 26 -14.275 -4.277 2.790
221 HB3 ALA 26 HB3 ALA 26 -15.344 -4.801 4.091
222 H GLY 27 HN GLY 27 -15.662 -1.053 4.292
223 HA2 GLY 27 HA2 GLY 27 -18.189 -1.280 5.872
224 HA3 GLY 27 HA1 GLY 27 -16.704 -0.564 6.486
225 H LEU 28 HN LEU 28 -17.285 0.349 3.221
226 HA LEU 28 HA LEU 28 -19.086 2.568 3.645
227 HB2 LEU 28 HB2 LEU 28 -16.537 2.913 4.667
228 HB3 LEU 28 HB1 LEU 28 -16.408 3.652 3.077
229 HG LEU 28 HG LEU 28 -18.662 4.296 4.991
230 HD11 LEU 28 1HD1 LEU 28 -16.489 4.844 6.036
231 HD12 LEU 28 2HD1 LEU 28 -17.384 6.301 5.608
232 HD13 LEU 28 3HD1 LEU 28 -16.039 5.766 4.601
233 HD21 LEU 28 3HD2 LEU 28 -17.747 5.215 2.315
234 HD22 LEU 28 1HD2 LEU 28 -18.231 6.492 3.431
235 HD23 LEU 28 2HD2 LEU 28 -19.367 5.212 3.009
236 H SER 29 HN SER 29 -19.491 0.910 1.677
237 HA SER 29 HA SER 29 -18.075 1.890 -0.769
238 HB2 SER 29 HB2 SER 29 -19.143 -0.174 -1.796
239 HB3 SER 29 HB1 SER 29 -17.959 -0.496 -0.547
240 HG SER 29 HG SER 29 -20.801 -0.538 -0.387
241 H THR 30 HN THR 30 -19.181 3.704 -1.380
242 HA THR 30 HA THR 30 -20.828 5.044 -2.273
243 HB THR 30 HB THR 30 -22.443 2.503 -2.617
244 HG1 THR 30 HG1 THR 30 -20.269 3.486 -4.160
245 HG21 THR 30 3HG2 THR 30 -23.189 3.663 -4.685
246 HG22 THR 30 1HG2 THR 30 -22.274 5.084 -4.181
247 HG23 THR 30 2HG2 THR 30 -23.632 4.520 -3.209
Start of MODEL 4
1 H1 GLN 1 HT1 GLN 1 -22.120 5.430 0.023
2 H2 GLN 1 HT2 GLN 1 -22.869 5.032 1.491
3 H3 GLN 1 HT3 GLN 1 -23.626 4.654 0.014
4 HA GLN 1 HA GLN 1 -21.145 3.452 1.139
5 HB2 GLN 1 HB2 GLN 1 -23.981 2.835 1.186
6 HB3 GLN 1 HB1 GLN 1 -23.080 1.532 0.417
7 HG2 GLN 1 HG2 GLN 1 -21.587 1.366 2.334
8 HG3 GLN 1 HG1 GLN 1 -22.365 2.750 3.100
9 HE21 GLN 1 1HE2 GLN 1 -24.808 2.422 3.612
10 HE22 GLN 1 2HE2 GLN 1 -25.300 0.852 4.028
11 H THR 2 HN THR 2 -19.971 2.086 -0.257
12 HA THR 2 HA THR 2 -20.802 1.728 -3.066
13 HB THR 2 HB THR 2 -18.111 2.964 -2.562
14 HG1 THR 2 HG1 THR 2 -20.541 4.344 -3.053
15 HG21 THR 2 3HG2 THR 2 -19.899 3.011 -4.992
16 HG22 THR 2 1HG2 THR 2 -18.655 1.795 -4.707
17 HG23 THR 2 2HG2 THR 2 -18.205 3.487 -4.896
18 H ASN 3 HN ASN 3 -18.032 1.476 -0.915
19 HA ASN 3 HA ASN 3 -16.738 -0.301 -0.221
20 HB2 ASN 3 HB2 ASN 3 -18.956 -1.660 -0.989
21 HB3 ASN 3 HB1 ASN 3 -17.829 -2.237 -2.215
22 HD21 ASN 3 1HD2 ASN 3 -18.960 -2.977 0.868
23 HD22 ASN 3 2HD2 ASN 3 -17.624 -3.865 1.419
24 H TRP 4 HN TRP 4 -17.303 -0.074 -3.698
25 HA TRP 4 HA TRP 4 -14.667 -0.885 -4.547
26 HB2 TRP 4 HB2 TRP 4 -16.809 0.903 -5.762
27 HB3 TRP 4 HB1 TRP 4 -15.337 0.471 -6.615
28 HD1 TRP 4 HD1 TRP 4 -18.774 -0.552 -6.318
29 HE1 TRP 4 HE1 TRP 4 -19.134 -2.987 -7.080
30 HE3 TRP 4 HE3 TRP 4 -13.934 -2.177 -6.378
31 HZ2 TRP 4 HZ2 TRP 4 -17.572 -5.320 -7.639
32 HZ3 TRP 4 HZ3 TRP 4 -13.399 -4.502 -7.026
33 HH2 TRP 4 HH2 TRP 4 -15.205 -6.077 -7.657
34 H GLN 5 HN GLN 5 -16.174 2.315 -4.047
35 HA GLN 5 HA GLN 5 -13.884 3.942 -4.501
36 HB2 GLN 5 HB2 GLN 5 -16.443 4.207 -2.926
37 HB3 GLN 5 HB1 GLN 5 -15.225 5.475 -2.828
38 HG2 GLN 5 HG2 GLN 5 -15.214 5.494 -5.379
39 HG3 GLN 5 HG1 GLN 5 -16.661 4.493 -5.301
40 HE21 GLN 5 1HE2 GLN 5 -18.515 5.505 -3.869
41 HE22 GLN 5 2HE2 GLN 5 -18.685 7.190 -3.962
42 H LYS 6 HN LYS 6 -15.013 2.277 -1.528
43 HA LYS 6 HA LYS 6 -12.905 3.366 0.150
44 HB2 LYS 6 HB2 LYS 6 -15.113 1.365 0.342
45 HB3 LYS 6 HB1 LYS 6 -13.771 1.160 1.471
46 HG2 LYS 6 HG2 LYS 6 -14.135 3.199 2.512
47 HG3 LYS 6 HG1 LYS 6 -14.908 3.904 1.095
48 HD2 LYS 6 HD2 LYS 6 -16.963 2.864 1.536
49 HD3 LYS 6 HD1 LYS 6 -16.227 1.621 2.543
50 HE2 LYS 6 HE2 LYS 6 -17.289 3.065 4.097
51 HE3 LYS 6 HE1 LYS 6 -15.591 3.558 4.150
52 HZ1 LYS 6 HZ1 LYS 6 -16.686 5.556 3.863
53 HZ2 LYS 6 HZ2 LYS 6 -17.865 4.902 2.835
54 HZ3 LYS 6 HZ3 LYS 6 -16.290 5.173 2.263
55 H LEU 7 HN LEU 7 -13.290 0.447 -1.862
56 HA LEU 7 HA LEU 7 -10.924 -0.934 -0.958
57 HB2 LEU 7 HB2 LEU 7 -12.804 -1.976 -2.229
58 HB3 LEU 7 HB1 LEU 7 -12.408 -0.964 -3.602
59 HG LEU 7 HG LEU 7 -11.598 -3.401 -3.635
60 HD11 LEU 7 1HD1 LEU 7 -10.079 -2.809 -5.180
61 HD12 LEU 7 2HD1 LEU 7 -9.219 -1.731 -4.081
62 HD13 LEU 7 3HD1 LEU 7 -10.691 -1.183 -4.879
63 HD21 LEU 7 3HD2 LEU 7 -10.645 -3.320 -1.283
64 HD22 LEU 7 1HD2 LEU 7 -9.374 -2.271 -1.912
65 HD23 LEU 7 2HD2 LEU 7 -9.531 -3.921 -2.509
66 H GLU 8 HN GLU 8 -11.556 1.446 -3.572
67 HA GLU 8 HA GLU 8 -8.950 1.401 -4.756
68 HB2 GLU 8 HB2 GLU 8 -11.059 3.577 -4.546
69 HB3 GLU 8 HB1 GLU 8 -9.656 3.666 -5.609
70 HG2 GLU 8 HG2 GLU 8 -11.532 1.307 -5.731
71 HG3 GLU 8 HG1 GLU 8 -11.898 2.792 -6.597
72 H VAL 9 HN VAL 9 -10.306 3.361 -2.085
73 HA VAL 9 HA VAL 9 -7.954 4.959 -1.593
74 HB VAL 9 HB VAL 9 -10.249 4.043 0.199
75 HG11 VAL 9 1HG1 VAL 9 -8.290 6.316 0.659
76 HG12 VAL 9 2HG1 VAL 9 -8.296 4.790 1.544
77 HG13 VAL 9 3HG1 VAL 9 -9.662 5.897 1.685
78 HG21 VAL 9 3HG2 VAL 9 -11.434 5.496 -1.047
79 HG22 VAL 9 1HG2 VAL 9 -9.990 6.057 -1.888
80 HG23 VAL 9 2HG2 VAL 9 -10.457 6.784 -0.350
81 H PHE 10 HN PHE 10 -9.213 1.935 -0.213
82 HA PHE 10 HA PHE 10 -7.170 1.256 1.636
83 HB2 PHE 10 HB2 PHE 10 -9.272 0.079 1.592
84 HB3 PHE 10 HB1 PHE 10 -9.098 -0.294 -0.109
85 HD1 PHE 10 HD2 PHE 10 -7.598 -2.105 -0.876
86 HD2 PHE 10 HD1 PHE 10 -8.094 -1.196 3.292
87 HE1 PHE 10 HE2 PHE 10 -6.542 -4.267 -0.275
88 HE2 PHE 10 HE1 PHE 10 -7.038 -3.362 3.893
89 HZ PHE 10 HZ PHE 10 -6.262 -4.896 2.105
90 H TRP 11 HN TRP 11 -7.593 0.363 -1.776
91 HA TRP 11 HA TRP 11 -5.333 -1.212 -2.265
92 HB2 TRP 11 HB2 TRP 11 -7.407 -0.061 -3.738
93 HB3 TRP 11 HB1 TRP 11 -5.964 0.625 -4.450
94 HD1 TRP 11 HD1 TRP 11 -8.033 -1.581 -5.608
95 HE1 TRP 11 HE1 TRP 11 -7.048 -3.757 -6.603
96 HE3 TRP 11 HE3 TRP 11 -3.432 -1.554 -3.399
97 HZ2 TRP 11 HZ2 TRP 11 -4.618 -5.269 -6.468
98 HZ3 TRP 11 HZ3 TRP 11 -1.810 -3.354 -3.841
99 HH2 TRP 11 HH2 TRP 11 -2.390 -5.214 -5.371
100 H ALA 12 HN ALA 12 -5.666 2.349 -2.732
101 HA ALA 12 HA ALA 12 -3.051 2.827 -3.648
102 HB1 ALA 12 HB1 ALA 12 -3.509 5.126 -3.194
103 HB2 ALA 12 HB2 ALA 12 -4.571 4.726 -1.846
104 HB3 ALA 12 HB3 ALA 12 -5.089 4.405 -3.502
105 H LYS 13 HN LYS 13 -4.286 2.814 -0.297
106 HA LYS 13 HA LYS 13 -1.798 3.442 1.025
107 HB2 LYS 13 HB2 LYS 13 -4.220 3.539 1.892
108 HB3 LYS 13 HB1 LYS 13 -4.096 1.792 2.111
109 HG2 LYS 13 HG2 LYS 13 -1.962 2.272 3.454
110 HG3 LYS 13 HG1 LYS 13 -2.484 3.956 3.475
111 HD2 LYS 13 HD2 LYS 13 -4.481 1.877 4.264
112 HD3 LYS 13 HD1 LYS 13 -3.187 2.246 5.402
113 HE2 LYS 13 HE2 LYS 13 -3.785 4.627 5.366
114 HE3 LYS 13 HE1 LYS 13 -5.059 4.305 4.176
115 HZ1 LYS 13 HZ1 LYS 13 -5.986 4.317 6.395
116 HZ2 LYS 13 HZ2 LYS 13 -4.892 3.123 6.903
117 HZ3 LYS 13 HZ3 LYS 13 -6.085 2.758 5.746
118 H HIS 14 HN HIS 14 -3.418 0.401 0.118
119 HA HIS 14 HA HIS 14 -1.576 -1.439 1.328
120 HB2 HIS 14 HB2 HIS 14 -3.943 -1.829 0.434
121 HB3 HIS 14 HB1 HIS 14 -3.242 -1.828 -1.182
122 HD1 HIS 14 HD1 HIS 14 -3.823 -3.974 1.725
123 HD2 HIS 14 HD2 HIS 14 -1.232 -3.972 -1.541
124 HE1 HIS 14 HE1 HIS 14 -2.853 -6.309 1.581
125 H MET 15 HN MET 15 -1.778 -0.024 -1.961
126 HA MET 15 HA MET 15 0.535 -1.361 -3.045
127 HB2 MET 15 HB2 MET 15 -1.448 0.061 -4.147
128 HB3 MET 15 HB1 MET 15 -0.321 1.393 -3.918
129 HG2 MET 15 HG2 MET 15 0.909 0.747 -5.681
130 HG3 MET 15 HG1 MET 15 1.082 -0.879 -5.029
131 HE1 MET 15 HE1 MET 15 0.885 -2.428 -6.859
132 HE2 MET 15 HE2 MET 15 -0.710 -2.983 -7.351
133 HE3 MET 15 HE3 MET 15 -0.316 -2.894 -5.640
134 H TRP 16 HN TRP 16 0.054 1.866 -1.548
135 HA TRP 16 HA TRP 16 2.782 2.736 -1.662
136 HB2 TRP 16 HB2 TRP 16 0.373 3.817 -0.888
137 HB3 TRP 16 HB1 TRP 16 1.147 3.568 0.672
138 HD1 TRP 16 HD1 TRP 16 1.895 5.917 1.293
139 HE1 TRP 16 HE1 TRP 16 3.413 7.711 0.216
140 HE3 TRP 16 HE3 TRP 16 2.635 3.792 -3.266
141 HZ2 TRP 16 HZ2 TRP 16 4.764 8.171 -2.272
142 HZ3 TRP 16 HZ3 TRP 16 4.037 4.916 -4.979
143 HH2 TRP 16 HH2 TRP 16 5.100 7.098 -4.487
144 H ASN 17 HN ASN 17 0.976 0.790 0.702
145 HA ASN 17 HA ASN 17 2.975 0.645 2.731
146 HB2 ASN 17 HB2 ASN 17 0.639 -0.020 3.099
147 HB3 ASN 17 HB1 ASN 17 0.775 -1.276 1.871
148 HD21 ASN 17 1HD2 ASN 17 0.934 -3.313 2.889
149 HD22 ASN 17 2HD2 ASN 17 1.829 -3.602 4.301
150 H PHE 18 HN PHE 18 2.281 -1.393 -0.118
151 HA PHE 18 HA PHE 18 4.259 -3.412 0.200
152 HB2 PHE 18 HB2 PHE 18 2.436 -3.431 -1.480
153 HB3 PHE 18 HB1 PHE 18 3.132 -2.027 -2.265
154 HD1 PHE 18 HD1 PHE 18 3.964 -5.562 -1.322
155 HD2 PHE 18 HD2 PHE 18 4.678 -2.272 -3.990
156 HE1 PHE 18 HE1 PHE 18 5.391 -7.015 -2.735
157 HE2 PHE 18 HE2 PHE 18 6.105 -3.725 -5.402
158 HZ PHE 18 HZ PHE 18 6.462 -6.099 -4.774
159 H ILE 19 HN ILE 19 4.373 -0.200 -1.294
160 HA ILE 19 HA ILE 19 7.088 -0.179 -2.185
161 HB ILE 19 HB ILE 19 4.847 1.721 -1.689
162 HG12 ILE 19 2HG1 ILE 19 6.519 2.062 -4.055
163 HG13 ILE 19 1HG1 ILE 19 5.982 0.398 -3.847
164 HG21 ILE 19 1HG2 ILE 19 6.554 3.077 -0.675
165 HG22 ILE 19 2HG2 ILE 19 6.273 3.686 -2.304
166 HG23 ILE 19 3HG2 ILE 19 7.695 2.697 -1.966
167 HD11 ILE 19 3HD1 ILE 19 4.065 1.080 -4.826
168 HD12 ILE 19 1HD1 ILE 19 4.430 2.782 -4.552
169 HD13 ILE 19 2HD1 ILE 19 3.690 1.821 -3.272
170 H SER 20 HN SER 20 5.592 0.786 0.924
171 HA SER 20 HA SER 20 7.903 1.858 2.202
172 HB2 SER 20 HB2 SER 20 5.237 0.833 2.962
173 HB3 SER 20 HB1 SER 20 6.451 0.685 4.223
174 HG SER 20 HG SER 20 5.166 2.779 3.862
175 H GLY 21 HN GLY 21 6.767 -1.520 1.892
176 HA2 GLY 21 HA2 GLY 21 8.636 -2.720 3.693
177 HA3 GLY 21 HA1 GLY 21 7.828 -3.554 2.360
178 H ILE 22 HN ILE 22 8.710 -2.259 0.145
179 HA ILE 22 HA ILE 22 11.404 -3.264 -0.184
180 HB ILE 22 HB ILE 22 9.410 -1.722 -1.852
181 HG12 ILE 22 2HG1 ILE 22 10.262 -3.952 -3.231
182 HG13 ILE 22 1HG1 ILE 22 10.379 -4.490 -1.560
183 HG21 ILE 22 1HG2 ILE 22 11.056 -2.051 -3.781
184 HG22 ILE 22 2HG2 ILE 22 12.299 -2.294 -2.553
185 HG23 ILE 22 3HG2 ILE 22 11.441 -0.754 -2.649
186 HD11 ILE 22 3HD1 ILE 22 8.137 -4.874 -2.716
187 HD12 ILE 22 1HD1 ILE 22 7.908 -3.127 -2.644
188 HD13 ILE 22 2HD1 ILE 22 8.073 -4.059 -1.156
189 H GLN 23 HN GLN 23 10.037 0.002 0.296
190 HA GLN 23 HA GLN 23 12.386 1.551 -0.087
191 HB2 GLN 23 HB2 GLN 23 9.777 2.051 0.518
192 HB3 GLN 23 HB1 GLN 23 10.514 2.330 2.089
193 HG2 GLN 23 HG2 GLN 23 11.432 4.273 1.423
194 HG3 GLN 23 HG1 GLN 23 12.014 3.588 -0.094
195 HE21 GLN 23 1HE2 GLN 23 10.451 3.576 -1.957
196 HE22 GLN 23 2HE2 GLN 23 9.130 4.642 -1.945
197 H TYR 24 HN TYR 24 11.141 -0.079 2.765
198 HA TYR 24 HA TYR 24 13.087 0.746 4.689
199 HB2 TYR 24 HB2 TYR 24 11.069 -0.260 5.454
200 HB3 TYR 24 HB1 TYR 24 11.246 -1.633 4.370
201 HD1 TYR 24 HD2 TYR 24 12.880 0.021 7.314
202 HD2 TYR 24 HD1 TYR 24 12.231 -3.615 5.122
203 HE1 TYR 24 HE2 TYR 24 14.036 -1.261 9.093
204 HE2 TYR 24 HE1 TYR 24 13.387 -4.897 6.900
205 HH TYR 24 HH TYR 24 13.767 -4.184 9.723
206 H LEU 25 HN LEU 25 12.964 -2.113 2.550
207 HA LEU 25 HA LEU 25 15.480 -3.273 3.325
208 HB2 LEU 25 HB2 LEU 25 13.417 -3.602 1.229
209 HB3 LEU 25 HB1 LEU 25 15.033 -4.110 0.755
210 HG LEU 25 HG LEU 25 14.920 -5.227 3.222
211 HD11 LEU 25 1HD1 LEU 25 12.745 -6.096 3.693
212 HD12 LEU 25 2HD1 LEU 25 12.103 -5.512 2.156
213 HD13 LEU 25 3HD1 LEU 25 12.534 -4.367 3.423
214 HD21 LEU 25 3HD2 LEU 25 14.174 -7.329 2.003
215 HD22 LEU 25 1HD2 LEU 25 15.524 -6.480 1.251
216 HD23 LEU 25 2HD2 LEU 25 13.900 -6.321 0.582
217 H ALA 26 HN ALA 26 14.575 -0.966 0.758
218 HA ALA 26 HA ALA 26 16.930 -0.824 -0.762
219 HB1 ALA 26 HB1 ALA 26 15.283 1.573 0.068
220 HB2 ALA 26 HB2 ALA 26 14.673 0.354 -1.050
221 HB3 ALA 26 HB3 ALA 26 16.104 1.296 -1.467
222 H GLY 27 HN GLY 27 16.203 0.880 2.301
223 HA2 GLY 27 HA2 GLY 27 18.951 1.984 2.397
224 HA3 GLY 27 HA1 GLY 27 17.619 2.428 3.460
225 H LEU 28 HN LEU 28 17.059 -0.603 3.836
226 HA LEU 28 HA LEU 28 19.386 -1.378 5.517
227 HB2 LEU 28 HB2 LEU 28 17.462 -0.010 6.655
228 HB3 LEU 28 HB1 LEU 28 16.547 -1.509 6.521
229 HG LEU 28 HG LEU 28 19.254 -1.919 7.573
230 HD11 LEU 28 1HD1 LEU 28 18.678 0.358 8.506
231 HD12 LEU 28 2HD1 LEU 28 18.942 -0.891 9.722
232 HD13 LEU 28 3HD1 LEU 28 17.300 -0.394 9.311
233 HD21 LEU 28 3HD2 LEU 28 17.404 -2.804 9.435
234 HD22 LEU 28 1HD2 LEU 28 18.025 -3.756 8.089
235 HD23 LEU 28 2HD2 LEU 28 16.498 -2.893 7.926
236 H SER 29 HN SER 29 19.494 -2.776 3.538
237 HA SER 29 HA SER 29 17.480 -4.921 3.295
238 HB2 SER 29 HB2 SER 29 19.345 -5.585 1.479
239 HB3 SER 29 HB1 SER 29 18.110 -4.382 1.176
240 HG SER 29 HG SER 29 19.623 -2.894 1.163
241 H THR 30 HN THR 30 21.037 -4.765 3.849
242 HA THR 30 HA THR 30 20.824 -7.168 5.586
243 HB THR 30 HB THR 30 22.808 -6.956 3.306
244 HG1 THR 30 HG1 THR 30 20.299 -8.278 3.442
245 HG21 THR 30 3HG2 THR 30 21.990 -9.251 5.098
246 HG22 THR 30 1HG2 THR 30 23.524 -8.380 5.147
247 HG23 THR 30 2HG2 THR 30 23.114 -9.366 3.744
Start of MODEL 5
1 H1 GLN 1 HT1 GLN 1 -23.869 -6.082 -0.274
2 H2 GLN 1 HT2 GLN 1 -23.765 -5.888 1.410
3 H3 GLN 1 HT3 GLN 1 -23.736 -7.443 0.730
4 HA GLN 1 HA GLN 1 -21.504 -6.761 1.415
5 HB2 GLN 1 HB2 GLN 1 -22.378 -7.436 -1.314
6 HB3 GLN 1 HB1 GLN 1 -20.767 -6.727 -1.252
7 HG2 GLN 1 HG2 GLN 1 -19.916 -8.423 0.110
8 HG3 GLN 1 HG1 GLN 1 -21.510 -8.904 0.687
9 HE21 GLN 1 1HE2 GLN 1 -23.010 -9.710 -1.319
10 HE22 GLN 1 2HE2 GLN 1 -22.216 -10.757 -2.392
11 H THR 2 HN THR 2 -20.221 -5.134 1.827
12 HA THR 2 HA THR 2 -20.409 -2.573 0.276
13 HB THR 2 HB THR 2 -19.893 -2.804 3.251
14 HG1 THR 2 HG1 THR 2 -21.965 -3.029 3.633
15 HG21 THR 2 3HG2 THR 2 -19.426 -0.678 1.973
16 HG22 THR 2 1HG2 THR 2 -20.571 -0.511 3.303
17 HG23 THR 2 2HG2 THR 2 -21.155 -0.584 1.642
18 H ASN 3 HN ASN 3 -18.120 -2.291 2.658
19 HA ASN 3 HA ASN 3 -15.821 -2.266 2.688
20 HB2 ASN 3 HB2 ASN 3 -16.494 -4.868 1.372
21 HB3 ASN 3 HB1 ASN 3 -14.807 -4.375 1.497
22 HD21 ASN 3 1HD2 ASN 3 -13.796 -4.486 3.582
23 HD22 ASN 3 2HD2 ASN 3 -14.623 -5.003 4.971
24 H TRP 4 HN TRP 4 -17.365 -1.398 -0.045
25 HA TRP 4 HA TRP 4 -15.195 -1.393 -1.995
26 HB2 TRP 4 HB2 TRP 4 -17.793 0.198 -1.751
27 HB3 TRP 4 HB1 TRP 4 -16.793 0.138 -3.191
28 HD1 TRP 4 HD1 TRP 4 -19.868 -1.163 -2.157
29 HE1 TRP 4 HE1 TRP 4 -20.408 -3.483 -3.141
30 HE3 TRP 4 HE3 TRP 4 -15.204 -2.574 -3.676
31 HZ2 TRP 4 HZ2 TRP 4 -19.029 -5.662 -4.403
32 HZ3 TRP 4 HZ3 TRP 4 -14.843 -4.768 -4.759
33 HH2 TRP 4 HH2 TRP 4 -16.745 -6.311 -5.124
34 H GLN 5 HN GLN 5 -16.861 1.034 -0.035
35 HA GLN 5 HA GLN 5 -15.230 3.285 -0.364
36 HB2 GLN 5 HB2 GLN 5 -16.022 3.780 2.030
37 HB3 GLN 5 HB1 GLN 5 -17.272 3.476 0.828
38 HG2 GLN 5 HG2 GLN 5 -16.680 0.957 1.969
39 HG3 GLN 5 HG1 GLN 5 -16.720 2.091 3.313
40 HE21 GLN 5 1HE2 GLN 5 -18.770 2.216 4.200
41 HE22 GLN 5 2HE2 GLN 5 -20.215 2.097 3.322
42 H LYS 6 HN LYS 6 -14.866 0.639 1.992
43 HA LYS 6 HA LYS 6 -12.408 1.549 3.191
44 HB2 LYS 6 HB2 LYS 6 -14.255 -0.717 3.345
45 HB3 LYS 6 HB1 LYS 6 -12.578 -1.228 3.492
46 HG2 LYS 6 HG2 LYS 6 -13.137 -0.739 5.701
47 HG3 LYS 6 HG1 LYS 6 -12.363 0.754 5.175
48 HD2 LYS 6 HD2 LYS 6 -14.488 1.832 4.836
49 HD3 LYS 6 HD1 LYS 6 -15.356 0.315 5.050
50 HE2 LYS 6 HE2 LYS 6 -15.615 1.303 7.161
51 HE3 LYS 6 HE1 LYS 6 -14.180 0.299 7.419
52 HZ1 LYS 6 HZ1 LYS 6 -13.690 2.486 8.186
53 HZ2 LYS 6 HZ2 LYS 6 -14.233 3.194 6.744
54 HZ3 LYS 6 HZ3 LYS 6 -12.815 2.254 6.756
55 H LEU 7 HN LEU 7 -13.131 -0.681 0.463
56 HA LEU 7 HA LEU 7 -10.481 -1.669 0.060
57 HB2 LEU 7 HB2 LEU 7 -12.543 -2.644 -0.895
58 HB3 LEU 7 HB1 LEU 7 -12.749 -1.222 -1.908
59 HG LEU 7 HG LEU 7 -10.096 -2.493 -2.149
60 HD11 LEU 7 1HD1 LEU 7 -10.917 -4.374 -3.514
61 HD12 LEU 7 2HD1 LEU 7 -12.579 -3.947 -3.114
62 HD13 LEU 7 3HD1 LEU 7 -11.485 -4.510 -1.851
63 HD21 LEU 7 3HD2 LEU 7 -12.066 -2.039 -4.376
64 HD22 LEU 7 1HD2 LEU 7 -10.315 -1.831 -4.373
65 HD23 LEU 7 2HD2 LEU 7 -11.343 -0.644 -3.574
66 H GLU 8 HN GLU 8 -12.081 1.303 -1.129
67 HA GLU 8 HA GLU 8 -10.018 2.075 -2.997
68 HB2 GLU 8 HB2 GLU 8 -12.407 3.268 -1.684
69 HB3 GLU 8 HB1 GLU 8 -11.181 4.421 -2.212
70 HG2 GLU 8 HG2 GLU 8 -11.756 2.323 -4.196
71 HG3 GLU 8 HG1 GLU 8 -13.134 3.355 -3.831
72 H VAL 9 HN VAL 9 -10.665 2.944 0.404
73 HA VAL 9 HA VAL 9 -8.356 4.636 0.784
74 HB VAL 9 HB VAL 9 -10.037 2.975 2.713
75 HG11 VAL 9 1HG1 VAL 9 -9.200 4.457 4.480
76 HG12 VAL 9 2HG1 VAL 9 -8.182 5.301 3.314
77 HG13 VAL 9 3HG1 VAL 9 -7.856 3.615 3.711
78 HG21 VAL 9 3HG2 VAL 9 -10.882 5.419 3.196
79 HG22 VAL 9 1HG2 VAL 9 -11.515 4.538 1.808
80 HG23 VAL 9 2HG2 VAL 9 -10.256 5.753 1.581
81 H PHE 10 HN PHE 10 -9.010 1.182 1.229
82 HA PHE 10 HA PHE 10 -6.512 0.329 2.340
83 HB2 PHE 10 HB2 PHE 10 -8.346 -1.168 2.469
84 HB3 PHE 10 HB1 PHE 10 -8.815 -0.862 0.814
85 HD1 PHE 10 HD1 PHE 10 -5.953 -2.331 2.763
86 HD2 PHE 10 HD2 PHE 10 -8.344 -2.439 -0.804
87 HE1 PHE 10 HE1 PHE 10 -4.751 -4.372 2.018
88 HE2 PHE 10 HE2 PHE 10 -7.142 -4.481 -1.549
89 HZ PHE 10 HZ PHE 10 -5.347 -5.444 -0.137
90 H TRP 11 HN TRP 11 -7.721 0.554 -1.015
91 HA TRP 11 HA TRP 11 -5.533 -0.499 -2.435
92 HB2 TRP 11 HB2 TRP 11 -7.951 0.738 -3.025
93 HB3 TRP 11 HB1 TRP 11 -6.767 1.847 -3.686
94 HD1 TRP 11 HD1 TRP 11 -8.762 0.059 -5.356
95 HE1 TRP 11 HE1 TRP 11 -7.830 -1.550 -7.148
96 HE3 TRP 11 HE3 TRP 11 -3.962 -0.421 -3.693
97 HZ2 TRP 11 HZ2 TRP 11 -5.359 -2.860 -7.783
98 HZ3 TRP 11 HZ3 TRP 11 -2.348 -1.840 -4.895
99 HH2 TRP 11 HH2 TRP 11 -3.031 -3.063 -6.939
100 H ALA 12 HN ALA 12 -6.148 2.927 -1.509
101 HA ALA 12 HA ALA 12 -3.787 3.962 -2.693
102 HB1 ALA 12 HB1 ALA 12 -5.120 5.727 -2.122
103 HB2 ALA 12 HB2 ALA 12 -4.275 5.661 -0.577
104 HB3 ALA 12 HB3 ALA 12 -5.835 4.863 -0.760
105 H LYS 13 HN LYS 13 -4.374 2.662 0.575
106 HA LYS 13 HA LYS 13 -1.743 3.243 1.635
107 HB2 LYS 13 HB2 LYS 13 -4.038 2.597 2.774
108 HB3 LYS 13 HB1 LYS 13 -3.486 0.941 2.521
109 HG2 LYS 13 HG2 LYS 13 -1.522 1.296 3.846
110 HG3 LYS 13 HG1 LYS 13 -1.787 3.037 3.890
111 HD2 LYS 13 HD2 LYS 13 -2.762 2.616 5.899
112 HD3 LYS 13 HD1 LYS 13 -4.149 2.149 4.925
113 HE2 LYS 13 HE2 LYS 13 -3.970 0.201 6.128
114 HE3 LYS 13 HE1 LYS 13 -2.758 -0.195 4.899
115 HZ1 LYS 13 HZ1 LYS 13 -1.686 -0.484 6.962
116 HZ2 LYS 13 HZ2 LYS 13 -2.299 0.969 7.590
117 HZ3 LYS 13 HZ3 LYS 13 -1.112 0.995 6.372
118 H HIS 14 HN HIS 14 -3.260 0.360 0.172
119 HA HIS 14 HA HIS 14 -1.065 -1.451 0.246
120 HB2 HIS 14 HB2 HIS 14 -3.437 -1.992 -0.283
121 HB3 HIS 14 HB1 HIS 14 -3.300 -1.100 -1.789
122 HD1 HIS 14 HD1 HIS 14 -3.321 -4.439 -0.691
123 HD2 HIS 14 HD2 HIS 14 -0.831 -2.355 -3.304
124 HE1 HIS 14 HE1 HIS 14 -2.186 -6.174 -2.134
125 H MET 15 HN MET 15 -2.059 0.905 -2.268
126 HA MET 15 HA MET 15 0.080 0.395 -4.121
127 HB2 MET 15 HB2 MET 15 -2.189 1.705 -4.357
128 HB3 MET 15 HB1 MET 15 -1.271 3.070 -3.738
129 HG2 MET 15 HG2 MET 15 -0.630 3.449 -5.862
130 HG3 MET 15 HG1 MET 15 0.397 2.026 -5.710
131 HE1 MET 15 HE1 MET 15 -0.951 -0.418 -5.715
132 HE2 MET 15 HE2 MET 15 0.158 -0.064 -7.035
133 HE3 MET 15 HE3 MET 15 -1.404 -0.794 -7.388
134 H TRP 16 HN TRP 16 -0.300 2.914 -1.565
135 HA TRP 16 HA TRP 16 2.296 4.069 -1.956
136 HB2 TRP 16 HB2 TRP 16 0.133 4.852 -0.628
137 HB3 TRP 16 HB1 TRP 16 0.935 4.055 0.722
138 HD1 TRP 16 HD1 TRP 16 1.797 6.012 2.080
139 HE1 TRP 16 HE1 TRP 16 3.377 7.999 1.644
140 HE3 TRP 16 HE3 TRP 16 2.363 5.594 -2.976
141 HZ2 TRP 16 HZ2 TRP 16 4.709 9.250 -0.565
142 HZ3 TRP 16 HZ3 TRP 16 3.787 7.191 -4.218
143 HH2 TRP 16 HH2 TRP 16 4.959 9.015 -3.024
144 H ASN 17 HN ASN 17 1.160 1.326 -0.037
145 HA ASN 17 HA ASN 17 3.492 0.865 1.556
146 HB2 ASN 17 HB2 ASN 17 1.255 -0.186 1.900
147 HB3 ASN 17 HB1 ASN 17 1.443 -1.060 0.385
148 HD21 ASN 17 1HD2 ASN 17 2.896 -0.744 3.665
149 HD22 ASN 17 2HD2 ASN 17 3.562 -2.305 3.665
150 H PHE 18 HN PHE 18 2.555 -0.110 -1.742
151 HA PHE 18 HA PHE 18 4.714 -1.867 -2.386
152 HB2 PHE 18 HB2 PHE 18 2.651 -1.554 -3.756
153 HB3 PHE 18 HB1 PHE 18 3.130 0.103 -4.081
154 HD1 PHE 18 HD1 PHE 18 4.352 -3.416 -4.483
155 HD2 PHE 18 HD2 PHE 18 4.464 0.632 -5.918
156 HE1 PHE 18 HE1 PHE 18 5.710 -4.141 -6.428
157 HE2 PHE 18 HE2 PHE 18 5.821 -0.093 -7.860
158 HZ PHE 18 HZ PHE 18 6.444 -2.480 -8.116
159 H ILE 19 HN ILE 19 4.304 1.653 -2.618
160 HA ILE 19 HA ILE 19 6.890 2.271 -3.742
161 HB ILE 19 HB ILE 19 4.538 3.670 -2.539
162 HG12 ILE 19 2HG1 ILE 19 5.398 5.103 -4.703
163 HG13 ILE 19 1HG1 ILE 19 5.999 3.496 -5.096
164 HG21 ILE 19 1HG2 ILE 19 5.882 5.882 -2.848
165 HG22 ILE 19 2HG2 ILE 19 7.293 4.867 -2.556
166 HG23 ILE 19 3HG2 ILE 19 6.031 4.995 -1.331
167 HD11 ILE 19 3HD1 ILE 19 3.159 3.959 -4.179
168 HD12 ILE 19 1HD1 ILE 19 3.826 2.543 -4.993
169 HD13 ILE 19 2HD1 ILE 19 3.624 4.055 -5.877
170 H SER 20 HN SER 20 5.585 2.190 -0.410
171 HA SER 20 HA SER 20 7.919 3.071 0.987
172 HB2 SER 20 HB2 SER 20 5.539 1.339 1.675
173 HB3 SER 20 HB1 SER 20 6.807 1.646 2.852
174 HG SER 20 HG SER 20 6.022 3.602 3.087
175 H GLY 21 HN GLY 21 6.892 -0.190 -0.084
176 HA2 GLY 21 HA2 GLY 21 8.957 -1.690 1.195
177 HA3 GLY 21 HA1 GLY 21 8.055 -2.210 -0.234
178 H ILE 22 HN ILE 22 8.710 -0.298 -2.090
179 HA ILE 22 HA ILE 22 11.290 -1.096 -3.057
180 HB ILE 22 HB ILE 22 9.406 1.197 -3.692
181 HG12 ILE 22 2HG1 ILE 22 8.600 -1.123 -4.143
182 HG13 ILE 22 1HG1 ILE 22 8.730 -0.139 -5.591
183 HG21 ILE 22 1HG2 ILE 22 11.507 1.971 -4.491
184 HG22 ILE 22 2HG2 ILE 22 10.647 1.336 -5.893
185 HG23 ILE 22 3HG2 ILE 22 11.928 0.385 -5.139
186 HD11 ILE 22 3HD1 ILE 22 10.322 -1.481 -6.494
187 HD12 ILE 22 1HD1 ILE 22 9.765 -2.666 -5.314
188 HD13 ILE 22 2HD1 ILE 22 11.175 -1.667 -4.963
189 H GLN 23 HN GLN 23 10.152 1.933 -1.559
190 HA GLN 23 HA GLN 23 12.594 3.365 -1.430
191 HB2 GLN 23 HB2 GLN 23 9.940 3.729 -0.700
192 HB3 GLN 23 HB1 GLN 23 10.772 3.724 0.845
193 HG2 GLN 23 HG2 GLN 23 11.280 5.868 0.477
194 HG3 GLN 23 HG1 GLN 23 12.367 5.339 -0.805
195 HE21 GLN 23 1HE2 GLN 23 8.785 5.896 -0.404
196 HE22 GLN 23 2HE2 GLN 23 8.608 6.643 -1.916
197 H TYR 24 HN TYR 24 11.153 1.092 0.838
198 HA TYR 24 HA TYR 24 13.066 1.284 2.959
199 HB2 TYR 24 HB2 TYR 24 10.996 0.273 3.467
200 HB3 TYR 24 HB1 TYR 24 11.051 -0.770 2.052
201 HD1 TYR 24 HD2 TYR 24 12.930 -0.092 5.233
202 HD2 TYR 24 HD1 TYR 24 11.741 -2.986 2.290
203 HE1 TYR 24 HE2 TYR 24 13.966 -1.894 6.585
204 HE2 TYR 24 HE1 TYR 24 12.778 -4.789 3.643
205 HH TYR 24 HH TYR 24 13.342 -4.835 6.517
206 H LEU 25 HN LEU 25 12.914 -0.894 0.111
207 HA LEU 25 HA LEU 25 15.222 -2.459 0.784
208 HB2 LEU 25 HB2 LEU 25 13.407 -2.061 -1.486
209 HB3 LEU 25 HB1 LEU 25 15.055 -2.413 -1.996
210 HG LEU 25 HG LEU 25 14.846 -4.268 -0.072
211 HD11 LEU 25 1HD1 LEU 25 12.486 -3.465 0.418
212 HD12 LEU 25 2HD1 LEU 25 12.652 -5.192 0.110
213 HD13 LEU 25 3HD1 LEU 25 12.024 -4.128 -1.149
214 HD21 LEU 25 3HD2 LEU 25 14.290 -5.879 -1.829
215 HD22 LEU 25 1HD2 LEU 25 15.360 -4.643 -2.488
216 HD23 LEU 25 2HD2 LEU 25 13.632 -4.592 -2.839
217 H ALA 26 HN ALA 26 14.890 0.605 -0.982
218 HA ALA 26 HA ALA 26 17.580 0.795 -1.960
219 HB1 ALA 26 HB1 ALA 26 16.163 2.360 -2.918
220 HB2 ALA 26 HB2 ALA 26 16.882 3.370 -1.666
221 HB3 ALA 26 HB3 ALA 26 15.292 2.652 -1.413
222 H GLY 27 HN GLY 27 16.052 1.930 1.075
223 HA2 GLY 27 HA2 GLY 27 18.509 3.004 2.185
224 HA3 GLY 27 HA1 GLY 27 16.990 2.776 3.048
225 H LEU 28 HN LEU 28 16.764 -0.103 2.477
226 HA LEU 28 HA LEU 28 19.021 -1.145 4.150
227 HB2 LEU 28 HB2 LEU 28 16.057 -1.327 4.308
228 HB3 LEU 28 HB1 LEU 28 16.927 -2.826 4.616
229 HG LEU 28 HG LEU 28 18.407 -0.993 6.055
230 HD11 LEU 28 1HD1 LEU 28 16.883 0.393 7.297
231 HD12 LEU 28 2HD1 LEU 28 15.485 -0.337 6.506
232 HD13 LEU 28 3HD1 LEU 28 16.585 0.688 5.585
233 HD21 LEU 28 3HD2 LEU 28 16.076 -2.741 6.911
234 HD22 LEU 28 1HD2 LEU 28 17.230 -2.013 8.029
235 HD23 LEU 28 2HD2 LEU 28 17.777 -3.203 6.848
236 H SER 29 HN SER 29 19.707 -1.246 1.681
237 HA SER 29 HA SER 29 18.627 -3.481 0.152
238 HB2 SER 29 HB2 SER 29 21.033 -2.772 -1.038
239 HB3 SER 29 HB1 SER 29 19.454 -2.130 -1.430
240 HG SER 29 HG SER 29 19.971 -0.304 -0.420
241 H THR 30 HN THR 30 18.890 -5.174 1.675
242 HA THR 30 HA THR 30 21.675 -6.114 2.201
243 HB THR 30 HB THR 30 18.988 -6.870 3.405
244 HG1 THR 30 HG1 THR 30 19.504 -4.899 4.170
245 HG21 THR 30 3HG2 THR 30 20.530 -8.737 3.560
246 HG22 THR 30 1HG2 THR 30 20.372 -7.983 5.147
247 HG23 THR 30 2HG2 THR 30 21.803 -7.676 4.163
Start of MODEL 6
1 H1 GLN 1 HT1 GLN 1 24.082 -0.374 2.659
2 H2 GLN 1 HT2 GLN 1 24.835 0.926 3.445
3 H3 GLN 1 HT3 GLN 1 24.545 0.990 1.770
4 HA GLN 1 HA GLN 1 22.450 0.934 3.893
5 HB2 GLN 1 HB2 GLN 1 23.924 2.993 3.644
6 HB3 GLN 1 HB1 GLN 1 23.298 3.154 2.005
7 HG2 GLN 1 HG2 GLN 1 21.081 3.545 2.781
8 HG3 GLN 1 HG1 GLN 1 21.472 3.000 4.412
9 HE21 GLN 1 1HE2 GLN 1 21.651 5.761 2.213
10 HE22 GLN 1 2HE2 GLN 1 22.281 6.846 3.355
11 H THR 2 HN THR 2 21.400 -0.843 2.716
12 HA THR 2 HA THR 2 20.525 -0.246 -0.049
13 HB THR 2 HB THR 2 19.615 -2.621 0.140
14 HG1 THR 2 HG1 THR 2 20.243 -3.813 1.884
15 HG21 THR 2 3HG2 THR 2 22.559 -2.067 0.527
16 HG22 THR 2 1HG2 THR 2 21.686 -2.220 -0.997
17 HG23 THR 2 2HG2 THR 2 21.907 -3.631 0.036
18 H ASN 3 HN ASN 3 18.264 -2.086 1.740
19 HA ASN 3 HA ASN 3 16.115 -1.704 2.446
20 HB2 ASN 3 HB2 ASN 3 17.563 0.201 3.682
21 HB3 ASN 3 HB1 ASN 3 16.481 1.227 2.743
22 HD21 ASN 3 1HD2 ASN 3 16.665 -0.034 5.772
23 HD22 ASN 3 2HD2 ASN 3 15.016 -0.289 6.081
24 H TRP 4 HN TRP 4 17.263 -0.387 -0.406
25 HA TRP 4 HA TRP 4 14.953 1.103 -1.329
26 HB2 TRP 4 HB2 TRP 4 17.137 -0.388 -2.855
27 HB3 TRP 4 HB1 TRP 4 16.126 0.887 -3.505
28 HD1 TRP 4 HD1 TRP 4 19.441 0.696 -3.021
29 HE1 TRP 4 HE1 TRP 4 20.570 2.741 -1.923
30 HE3 TRP 4 HE3 TRP 4 15.370 2.906 -0.886
31 HZ2 TRP 4 HZ2 TRP 4 19.835 5.013 -0.345
32 HZ3 TRP 4 HZ3 TRP 4 15.605 5.003 0.406
33 HH2 TRP 4 HH2 TRP 4 17.828 6.060 0.680
34 H GLN 5 HN GLN 5 16.295 -2.096 -1.875
35 HA GLN 5 HA GLN 5 14.306 -3.390 -3.371
36 HB2 GLN 5 HB2 GLN 5 15.158 -5.447 -2.080
37 HB3 GLN 5 HB1 GLN 5 16.356 -4.530 -2.981
38 HG2 GLN 5 HG2 GLN 5 16.401 -3.369 -0.435
39 HG3 GLN 5 HG1 GLN 5 16.131 -5.071 -0.108
40 HE21 GLN 5 1HE2 GLN 5 18.272 -3.229 -2.441
41 HE22 GLN 5 2HE2 GLN 5 19.645 -4.149 -2.057
42 H LYS 6 HN LYS 6 14.562 -3.058 0.168
43 HA LYS 6 HA LYS 6 12.062 -4.375 0.807
44 HB2 LYS 6 HB2 LYS 6 13.934 -4.264 2.360
45 HB3 LYS 6 HB1 LYS 6 13.906 -2.504 2.326
46 HG2 LYS 6 HG2 LYS 6 12.168 -2.373 3.782
47 HG3 LYS 6 HG1 LYS 6 11.333 -3.753 3.072
48 HD2 LYS 6 HD2 LYS 6 13.161 -5.203 4.157
49 HD3 LYS 6 HD1 LYS 6 13.568 -3.770 5.104
50 HE2 LYS 6 HE2 LYS 6 11.316 -3.663 6.023
51 HE3 LYS 6 HE1 LYS 6 10.789 -4.997 4.982
52 HZ1 LYS 6 HZ1 LYS 6 12.448 -6.427 6.024
53 HZ2 LYS 6 HZ2 LYS 6 11.372 -5.806 7.181
54 HZ3 LYS 6 HZ3 LYS 6 12.935 -5.159 7.040
55 H LEU 7 HN LEU 7 13.050 -0.936 0.443
56 HA LEU 7 HA LEU 7 10.628 0.291 1.275
57 HB2 LEU 7 HB2 LEU 7 12.835 1.390 0.965
58 HB3 LEU 7 HB1 LEU 7 12.653 1.225 -0.777
59 HG LEU 7 HG LEU 7 10.335 2.486 0.528
60 HD11 LEU 7 1HD1 LEU 7 11.406 4.612 0.990
61 HD12 LEU 7 2HD1 LEU 7 12.969 3.986 0.471
62 HD13 LEU 7 3HD1 LEU 7 12.211 3.363 1.937
63 HD21 LEU 7 3HD2 LEU 7 10.320 3.771 -1.421
64 HD22 LEU 7 1HD2 LEU 7 11.087 2.290 -1.992
65 HD23 LEU 7 2HD2 LEU 7 12.072 3.701 -1.606
66 H GLU 8 HN GLU 8 11.579 -0.895 -1.982
67 HA GLU 8 HA GLU 8 9.310 0.194 -3.386
68 HB2 GLU 8 HB2 GLU 8 11.278 -2.055 -3.843
69 HB3 GLU 8 HB1 GLU 8 9.948 -1.791 -4.970
70 HG2 GLU 8 HG2 GLU 8 11.045 0.763 -4.519
71 HG3 GLU 8 HG1 GLU 8 12.428 -0.311 -4.695
72 H VAL 9 HN VAL 9 9.910 -2.991 -1.899
73 HA VAL 9 HA VAL 9 7.333 -4.165 -2.452
74 HB VAL 9 HB VAL 9 9.434 -4.637 -0.293
75 HG11 VAL 9 1HG1 VAL 9 7.181 -5.537 0.359
76 HG12 VAL 9 2HG1 VAL 9 8.409 -6.782 0.147
77 HG13 VAL 9 3HG1 VAL 9 7.199 -6.516 -1.108
78 HG21 VAL 9 3HG2 VAL 9 8.830 -6.243 -2.790
79 HG22 VAL 9 1HG2 VAL 9 10.183 -6.461 -1.682
80 HG23 VAL 9 2HG2 VAL 9 10.099 -5.022 -2.694
81 H PHE 10 HN PHE 10 8.700 -2.381 0.294
82 HA PHE 10 HA PHE 10 6.497 -2.351 2.090
83 HB2 PHE 10 HB2 PHE 10 8.608 -1.673 2.906
84 HB3 PHE 10 HB1 PHE 10 8.917 -0.673 1.507
85 HD1 PHE 10 HD2 PHE 10 6.545 -0.889 4.418
86 HD2 PHE 10 HD1 PHE 10 8.711 1.621 1.686
87 HE1 PHE 10 HE2 PHE 10 5.770 1.117 5.649
88 HE2 PHE 10 HE1 PHE 10 7.934 3.632 2.920
89 HZ PHE 10 HZ PHE 10 6.463 3.378 4.901
90 H TRP 11 HN TRP 11 7.415 -0.106 -0.528
91 HA TRP 11 HA TRP 11 5.417 1.862 -0.195
92 HB2 TRP 11 HB2 TRP 11 7.508 1.396 -1.938
93 HB3 TRP 11 HB1 TRP 11 6.103 1.247 -2.988
94 HD1 TRP 11 HD1 TRP 11 7.189 3.614 -0.159
95 HE1 TRP 11 HE1 TRP 11 6.647 6.038 -0.856
96 HE3 TRP 11 HE3 TRP 11 5.091 2.751 -4.725
97 HZ2 TRP 11 HZ2 TRP 11 5.471 7.423 -3.070
98 HZ3 TRP 11 HZ3 TRP 11 4.267 4.633 -6.106
99 HH2 TRP 11 HH2 TRP 11 4.451 6.964 -5.290
100 H ALA 12 HN ALA 12 5.327 -1.062 -2.294
101 HA ALA 12 HA ALA 12 2.681 -0.561 -3.263
102 HB1 ALA 12 HB1 ALA 12 4.317 -2.066 -4.355
103 HB2 ALA 12 HB2 ALA 12 2.782 -2.882 -4.054
104 HB3 ALA 12 HB3 ALA 12 4.163 -3.193 -3.005
105 H LYS 13 HN LYS 13 3.834 -2.171 -0.312
106 HA LYS 13 HA LYS 13 1.411 -3.553 0.360
107 HB2 LYS 13 HB2 LYS 13 3.733 -3.825 1.369
108 HB3 LYS 13 HB1 LYS 13 3.449 -2.327 2.254
109 HG2 LYS 13 HG2 LYS 13 1.513 -3.294 3.368
110 HG3 LYS 13 HG1 LYS 13 1.660 -4.772 2.420
111 HD2 LYS 13 HD2 LYS 13 3.341 -5.585 3.706
112 HD3 LYS 13 HD1 LYS 13 4.131 -4.013 3.838
113 HE2 LYS 13 HE2 LYS 13 2.309 -3.337 5.472
114 HE3 LYS 13 HE1 LYS 13 1.786 -5.032 5.473
115 HZ1 LYS 13 HZ1 LYS 13 3.381 -4.644 7.239
116 HZ2 LYS 13 HZ2 LYS 13 4.524 -4.064 6.126
117 HZ3 LYS 13 HZ3 LYS 13 4.039 -5.694 6.086
118 H HIS 14 HN HIS 14 2.635 -0.319 1.344
119 HA HIS 14 HA HIS 14 0.198 0.438 2.725
120 HB2 HIS 14 HB2 HIS 14 2.683 1.365 2.840
121 HB3 HIS 14 HB1 HIS 14 2.124 2.428 1.548
122 HD1 HIS 14 HD1 HIS 14 2.039 2.022 5.184
123 HD2 HIS 14 HD2 HIS 14 -0.279 3.982 2.326
124 HE1 HIS 14 HE1 HIS 14 0.611 3.691 6.444
125 H MET 15 HN MET 15 1.459 0.917 -0.574
126 HA MET 15 HA MET 15 -0.553 2.714 -1.547
127 HB2 MET 15 HB2 MET 15 1.414 0.758 -2.706
128 HB3 MET 15 HB1 MET 15 0.172 1.403 -3.769
129 HG2 MET 15 HG2 MET 15 1.596 3.391 -2.078
130 HG3 MET 15 HG1 MET 15 2.544 2.634 -3.353
131 HE1 MET 15 HE1 MET 15 -0.612 5.821 -3.659
132 HE2 MET 15 HE2 MET 15 0.500 5.400 -2.362
133 HE3 MET 15 HE3 MET 15 -0.937 4.419 -2.624
134 H TRP 16 HN TRP 16 -0.341 -0.885 -1.630
135 HA TRP 16 HA TRP 16 -2.896 -1.256 -2.871
136 HB2 TRP 16 HB2 TRP 16 -0.824 -2.909 -2.328
137 HB3 TRP 16 HB1 TRP 16 -1.881 -3.332 -0.980
138 HD1 TRP 16 HD1 TRP 16 -2.949 -5.542 -1.723
139 HE1 TRP 16 HE1 TRP 16 -4.317 -6.314 -3.766
140 HE3 TRP 16 HE3 TRP 16 -2.473 -1.430 -4.679
141 HZ2 TRP 16 HZ2 TRP 16 -5.111 -5.302 -6.337
142 HZ3 TRP 16 HZ3 TRP 16 -3.540 -1.347 -6.919
143 HH2 TRP 16 HH2 TRP 16 -4.854 -3.276 -7.749
144 H ASN 17 HN ASN 17 -1.942 -0.757 0.513
145 HA ASN 17 HA ASN 17 -4.437 -1.525 1.708
146 HB2 ASN 17 HB2 ASN 17 -2.386 -1.168 3.013
147 HB3 ASN 17 HB1 ASN 17 -2.337 0.526 2.523
148 HD21 ASN 17 1HD2 ASN 17 -3.326 1.971 3.992
149 HD22 ASN 17 2HD2 ASN 17 -4.489 1.509 5.139
150 H PHE 18 HN PHE 18 -3.252 1.502 0.260
151 HA PHE 18 HA PHE 18 -5.439 3.235 0.881
152 HB2 PHE 18 HB2 PHE 18 -3.207 3.909 -0.072
153 HB3 PHE 18 HB1 PHE 18 -3.630 3.096 -1.568
154 HD1 PHE 18 HD1 PHE 18 -4.761 5.847 0.713
155 HD2 PHE 18 HD2 PHE 18 -4.857 4.170 -3.241
156 HE1 PHE 18 HE1 PHE 18 -5.922 7.871 -0.119
157 HE2 PHE 18 HE2 PHE 18 -6.018 6.195 -4.073
158 HZ PHE 18 HZ PHE 18 -6.552 8.048 -2.511
159 H ILE 19 HN ILE 19 -4.780 1.077 -1.880
160 HA ILE 19 HA ILE 19 -7.269 1.508 -3.269
161 HB ILE 19 HB ILE 19 -4.967 -0.424 -3.356
162 HG12 ILE 19 2HG1 ILE 19 -5.582 0.530 -5.898
163 HG13 ILE 19 1HG1 ILE 19 -5.982 1.879 -4.841
164 HG21 ILE 19 1HG2 ILE 19 -7.597 -0.819 -4.795
165 HG22 ILE 19 2HG2 ILE 19 -6.711 -1.990 -3.818
166 HG23 ILE 19 3HG2 ILE 19 -6.079 -1.493 -5.386
167 HD11 ILE 19 3HD1 ILE 19 -3.550 1.686 -5.720
168 HD12 ILE 19 1HD1 ILE 19 -3.376 0.403 -4.523
169 HD13 ILE 19 2HD1 ILE 19 -3.791 2.038 -4.010
170 H SER 20 HN SER 20 -6.235 -0.885 -0.816
171 HA SER 20 HA SER 20 -8.493 -2.609 -0.872
172 HB2 SER 20 HB2 SER 20 -6.213 -2.766 0.372
173 HB3 SER 20 HB1 SER 20 -7.014 -1.847 1.640
174 HG SER 20 HG SER 20 -7.670 -3.798 2.205
175 H GLY 21 HN GLY 21 -8.002 0.442 0.971
176 HA2 GLY 21 HA2 GLY 21 -10.453 0.314 2.455
177 HA3 GLY 21 HA1 GLY 21 -9.531 1.787 2.132
178 H ILE 22 HN ILE 22 -9.583 1.925 -0.610
179 HA ILE 22 HA ILE 22 -12.179 3.023 -1.187
180 HB ILE 22 HB ILE 22 -9.756 2.286 -2.869
181 HG12 ILE 22 2HG1 ILE 22 -10.859 5.001 -2.089
182 HG13 ILE 22 1HG1 ILE 22 -9.636 4.153 -1.149
183 HG21 ILE 22 1HG2 ILE 22 -11.697 2.243 -4.354
184 HG22 ILE 22 2HG2 ILE 22 -10.751 3.698 -4.659
185 HG23 ILE 22 3HG2 ILE 22 -12.245 3.798 -3.726
186 HD11 ILE 22 3HD1 ILE 22 -8.072 4.217 -2.972
187 HD12 ILE 22 1HD1 ILE 22 -8.723 5.846 -2.796
188 HD13 ILE 22 2HD1 ILE 22 -9.306 4.801 -4.091
189 H GLN 23 HN GLN 23 -10.576 -0.014 -2.166
190 HA GLN 23 HA GLN 23 -12.669 -1.111 -3.759
191 HB2 GLN 23 HB2 GLN 23 -10.133 -1.755 -3.287
192 HB3 GLN 23 HB1 GLN 23 -10.863 -2.834 -2.105
193 HG2 GLN 23 HG2 GLN 23 -11.256 -4.295 -3.757
194 HG3 GLN 23 HG1 GLN 23 -12.368 -3.139 -4.487
195 HE21 GLN 23 1HE2 GLN 23 -8.742 -3.462 -4.255
196 HE22 GLN 23 2HE2 GLN 23 -8.490 -3.123 -5.899
197 H TYR 24 HN TYR 24 -12.004 -1.326 -0.306
198 HA TYR 24 HA TYR 24 -13.987 -3.234 0.456
199 HB2 TYR 24 HB2 TYR 24 -12.261 -2.616 2.010
200 HB3 TYR 24 HB1 TYR 24 -12.668 -0.909 1.887
201 HD1 TYR 24 HD2 TYR 24 -14.059 -4.207 2.971
202 HD2 TYR 24 HD1 TYR 24 -14.218 0.066 3.378
203 HE1 TYR 24 HE2 TYR 24 -15.641 -4.445 4.862
204 HE2 TYR 24 HE1 TYR 24 -15.801 -0.173 5.267
205 HH TYR 24 HH TYR 24 -17.562 -2.137 5.960
206 H LEU 25 HN LEU 25 -14.119 0.331 0.226
207 HA LEU 25 HA LEU 25 -16.845 0.630 1.077
208 HB2 LEU 25 HB2 LEU 25 -14.689 2.249 -0.090
209 HB3 LEU 25 HB1 LEU 25 -16.298 2.768 -0.586
210 HG LEU 25 HG LEU 25 -16.860 2.474 1.980
211 HD11 LEU 25 1HD1 LEU 25 -13.959 3.240 2.221
212 HD12 LEU 25 2HD1 LEU 25 -14.462 1.553 2.305
213 HD13 LEU 25 3HD1 LEU 25 -15.078 2.714 3.479
214 HD21 LEU 25 3HD2 LEU 25 -16.183 4.851 2.346
215 HD22 LEU 25 1HD2 LEU 25 -16.990 4.617 0.796
216 HD23 LEU 25 2HD2 LEU 25 -15.235 4.786 0.860
217 H ALA 26 HN ALA 26 -15.408 0.046 -2.109
218 HA ALA 26 HA ALA 26 -17.581 0.574 -3.829
219 HB1 ALA 26 HB1 ALA 26 -16.384 -0.746 -5.388
220 HB2 ALA 26 HB2 ALA 26 -15.733 -1.796 -4.130
221 HB3 ALA 26 HB3 ALA 26 -15.139 -0.143 -4.295
222 H GLY 27 HN GLY 27 -16.892 -2.374 -1.933
223 HA2 GLY 27 HA2 GLY 27 -19.486 -3.561 -2.767
224 HA3 GLY 27 HA1 GLY 27 -18.162 -4.428 -1.994
225 H LEU 28 HN LEU 28 -17.859 -2.164 0.031
226 HA LEU 28 HA LEU 28 -20.298 -2.600 1.694
227 HB2 LEU 28 HB2 LEU 28 -17.553 -3.517 2.015
228 HB3 LEU 28 HB1 LEU 28 -18.018 -2.486 3.361
229 HG LEU 28 HG LEU 28 -20.021 -4.516 2.517
230 HD11 LEU 28 1HD1 LEU 28 -17.790 -5.694 2.405
231 HD12 LEU 28 2HD1 LEU 28 -18.900 -6.347 3.609
232 HD13 LEU 28 3HD1 LEU 28 -17.569 -5.305 4.111
233 HD21 LEU 28 3HD2 LEU 28 -20.135 -2.848 4.489
234 HD22 LEU 28 1HD2 LEU 28 -18.939 -3.882 5.272
235 HD23 LEU 28 2HD2 LEU 28 -20.521 -4.530 4.843
236 H SER 29 HN SER 29 -20.580 -0.412 0.584
237 HA SER 29 HA SER 29 -19.005 1.899 1.075
238 HB2 SER 29 HB2 SER 29 -21.658 1.234 0.081
239 HB3 SER 29 HB1 SER 29 -21.676 2.728 0.996
240 HG SER 29 HG SER 29 -20.501 3.642 -0.523
241 H THR 30 HN THR 30 -18.942 3.387 2.753
242 HA THR 30 HA THR 30 -20.602 2.841 5.185
243 HB THR 30 HB THR 30 -18.572 3.735 6.427
244 HG1 THR 30 HG1 THR 30 -17.626 4.632 4.446
245 HG21 THR 30 3HG2 THR 30 -17.214 1.539 5.811
246 HG22 THR 30 1HG2 THR 30 -18.707 1.145 4.961
247 HG23 THR 30 2HG2 THR 30 -18.738 1.467 6.694
Start of MODEL 7
1 H1 GLN 1 HT1 GLN 1 14.904 -0.490 6.155
2 H2 GLN 1 HT2 GLN 1 15.481 -1.067 4.664
3 H3 GLN 1 HT3 GLN 1 14.654 0.417 4.747
4 HA GLN 1 HA GLN 1 16.472 1.295 6.179
5 HB2 GLN 1 HB2 GLN 1 17.019 -1.435 6.328
6 HB3 GLN 1 HB1 GLN 1 18.315 -0.807 5.318
7 HG2 GLN 1 HG2 GLN 1 19.302 0.242 7.053
8 HG3 GLN 1 HG1 GLN 1 17.778 0.909 7.634
9 HE21 GLN 1 1HE2 GLN 1 17.045 0.031 9.608
10 HE22 GLN 1 2HE2 GLN 1 17.539 -1.470 10.225
11 H THR 2 HN THR 2 18.712 1.873 5.103
12 HA THR 2 HA THR 2 19.733 3.035 3.381
13 HB THR 2 HB THR 2 18.741 0.683 1.756
14 HG1 THR 2 HG1 THR 2 20.967 0.810 3.508
15 HG21 THR 2 3HG2 THR 2 20.436 1.117 0.288
16 HG22 THR 2 1HG2 THR 2 21.505 1.757 1.534
17 HG23 THR 2 2HG2 THR 2 20.215 2.762 0.877
18 H ASN 3 HN ASN 3 17.867 2.033 0.740
19 HA ASN 3 HA ASN 3 15.816 4.080 0.914
20 HB2 ASN 3 HB2 ASN 3 18.238 4.988 0.078
21 HB3 ASN 3 HB1 ASN 3 17.526 4.506 -1.469
22 HD21 ASN 3 1HD2 ASN 3 15.445 5.531 -2.100
23 HD22 ASN 3 2HD2 ASN 3 14.969 6.993 -1.381
24 H TRP 4 HN TRP 4 17.510 1.855 -1.262
25 HA TRP 4 HA TRP 4 15.307 1.475 -3.097
26 HB2 TRP 4 HB2 TRP 4 17.705 -0.220 -2.279
27 HB3 TRP 4 HB1 TRP 4 16.581 -0.735 -3.531
28 HD1 TRP 4 HD1 TRP 4 19.780 0.727 -3.367
29 HE1 TRP 4 HE1 TRP 4 20.289 2.304 -5.339
30 HE3 TRP 4 HE3 TRP 4 15.050 1.475 -5.142
31 HZ2 TRP 4 HZ2 TRP 4 18.879 3.699 -7.396
32 HZ3 TRP 4 HZ3 TRP 4 14.661 2.928 -7.103
33 HH2 TRP 4 HH2 TRP 4 16.563 4.043 -8.236
34 H GLN 5 HN GLN 5 16.476 -0.331 -0.270
35 HA GLN 5 HA GLN 5 14.396 -2.267 -0.001
36 HB2 GLN 5 HB2 GLN 5 16.468 -0.946 1.692
37 HB3 GLN 5 HB1 GLN 5 15.141 -1.699 2.566
38 HG2 GLN 5 HG2 GLN 5 15.970 -3.516 0.522
39 HG3 GLN 5 HG1 GLN 5 17.412 -2.943 1.360
40 HE21 GLN 5 1HE2 GLN 5 17.687 -5.081 2.410
41 HE22 GLN 5 2HE2 GLN 5 16.663 -5.546 3.680
42 H LYS 6 HN LYS 6 14.758 1.060 1.210
43 HA LYS 6 HA LYS 6 12.358 1.358 2.720
44 HB2 LYS 6 HB2 LYS 6 14.587 2.866 1.942
45 HB3 LYS 6 HB1 LYS 6 13.235 3.716 1.206
46 HG2 LYS 6 HG2 LYS 6 12.305 4.281 3.245
47 HG3 LYS 6 HG1 LYS 6 12.977 2.872 4.064
48 HD2 LYS 6 HD2 LYS 6 14.198 4.767 4.872
49 HD3 LYS 6 HD1 LYS 6 15.269 3.908 3.765
50 HE2 LYS 6 HE2 LYS 6 14.436 5.519 1.940
51 HE3 LYS 6 HE1 LYS 6 13.744 6.479 3.258
52 HZ1 LYS 6 HZ1 LYS 6 15.861 6.737 4.258
53 HZ2 LYS 6 HZ2 LYS 6 16.070 7.079 2.604
54 HZ3 LYS 6 HZ3 LYS 6 16.583 5.586 3.232
55 H LEU 7 HN LEU 7 13.098 1.921 -0.729
56 HA LEU 7 HA LEU 7 10.486 2.830 -1.546
57 HB2 LEU 7 HB2 LEU 7 12.685 3.201 -2.737
58 HB3 LEU 7 HB1 LEU 7 12.677 1.495 -3.168
59 HG LEU 7 HG LEU 7 10.196 3.004 -3.808
60 HD11 LEU 7 1HD1 LEU 7 12.809 3.427 -5.284
61 HD12 LEU 7 2HD1 LEU 7 11.808 4.659 -4.513
62 HD13 LEU 7 3HD1 LEU 7 11.224 3.820 -5.949
63 HD21 LEU 7 3HD2 LEU 7 10.122 0.810 -4.578
64 HD22 LEU 7 1HD2 LEU 7 11.848 0.762 -4.933
65 HD23 LEU 7 2HD2 LEU 7 10.750 1.628 -6.007
66 H GLU 8 HN GLU 8 12.091 -0.376 -1.473
67 HA GLU 8 HA GLU 8 10.121 -1.875 -2.888
68 HB2 GLU 8 HB2 GLU 8 12.181 -2.478 -0.756
69 HB3 GLU 8 HB1 GLU 8 11.117 -3.749 -1.354
70 HG2 GLU 8 HG2 GLU 8 12.107 -3.814 -3.412
71 HG3 GLU 8 HG1 GLU 8 12.413 -2.085 -3.437
72 H VAL 9 HN VAL 9 10.466 -1.207 0.608
73 HA VAL 9 HA VAL 9 8.022 -2.506 1.444
74 HB VAL 9 HB VAL 9 9.739 -0.303 2.664
75 HG11 VAL 9 1HG1 VAL 9 7.555 -0.246 3.728
76 HG12 VAL 9 2HG1 VAL 9 8.702 -1.002 4.832
77 HG13 VAL 9 3HG1 VAL 9 7.564 -1.998 3.926
78 HG21 VAL 9 3HG2 VAL 9 11.175 -2.061 2.834
79 HG22 VAL 9 1HG2 VAL 9 9.904 -3.249 2.549
80 HG23 VAL 9 2HG2 VAL 9 10.128 -2.566 4.159
81 H PHE 10 HN PHE 10 8.910 0.865 0.717
82 HA PHE 10 HA PHE 10 6.460 2.207 1.148
83 HB2 PHE 10 HB2 PHE 10 8.425 3.479 0.781
84 HB3 PHE 10 HB1 PHE 10 8.836 2.570 -0.661
85 HD1 PHE 10 HD1 PHE 10 6.180 4.857 0.671
86 HD2 PHE 10 HD2 PHE 10 8.350 3.459 -2.767
87 HE1 PHE 10 HE1 PHE 10 5.059 6.567 -0.733
88 HE2 PHE 10 HE2 PHE 10 7.228 5.171 -4.167
89 HZ PHE 10 HZ PHE 10 5.584 6.723 -3.152
90 H TRP 11 HN TRP 11 7.647 0.544 -1.781
91 HA TRP 11 HA TRP 11 5.576 1.194 -3.579
92 HB2 TRP 11 HB2 TRP 11 7.835 -0.398 -3.600
93 HB3 TRP 11 HB1 TRP 11 6.544 -1.589 -3.741
94 HD1 TRP 11 HD1 TRP 11 7.303 1.860 -5.259
95 HE1 TRP 11 HE1 TRP 11 6.756 1.789 -7.780
96 HE3 TRP 11 HE3 TRP 11 5.637 -2.940 -5.642
97 HZ2 TRP 11 HZ2 TRP 11 5.737 -0.075 -9.704
98 HZ3 TRP 11 HZ3 TRP 11 4.883 -3.842 -7.822
99 HH2 TRP 11 HH2 TRP 11 4.929 -2.421 -9.851
100 H ALA 12 HN ALA 12 5.783 -1.564 -1.301
101 HA ALA 12 HA ALA 12 3.201 -2.615 -1.999
102 HB1 ALA 12 HB1 ALA 12 5.134 -3.013 0.281
103 HB2 ALA 12 HB2 ALA 12 4.689 -4.143 -0.999
104 HB3 ALA 12 HB3 ALA 12 3.554 -3.796 0.305
105 H LYS 13 HN LYS 13 4.283 -0.191 0.367
106 HA LYS 13 HA LYS 13 1.959 -0.056 2.019
107 HB2 LYS 13 HB2 LYS 13 4.291 1.659 1.341
108 HB3 LYS 13 HB1 LYS 13 2.885 2.514 1.961
109 HG2 LYS 13 HG2 LYS 13 3.455 1.909 4.041
110 HG3 LYS 13 HG1 LYS 13 3.215 0.221 3.603
111 HD2 LYS 13 HD2 LYS 13 5.414 -0.130 3.827
112 HD3 LYS 13 HD1 LYS 13 5.711 0.980 2.496
113 HE2 LYS 13 HE2 LYS 13 5.181 2.197 5.177
114 HE3 LYS 13 HE1 LYS 13 6.745 1.403 4.935
115 HZ1 LYS 13 HZ1 LYS 13 6.588 3.825 4.261
116 HZ2 LYS 13 HZ2 LYS 13 5.650 3.314 2.946
117 HZ3 LYS 13 HZ3 LYS 13 7.255 2.768 3.124
118 H HIS 14 HN HIS 14 2.749 1.667 -1.031
119 HA HIS 14 HA HIS 14 0.238 3.138 -1.096
120 HB2 HIS 14 HB2 HIS 14 2.449 3.760 -2.233
121 HB3 HIS 14 HB1 HIS 14 2.086 2.504 -3.420
122 HD1 HIS 14 HD1 HIS 14 1.049 5.931 -2.337
123 HD2 HIS 14 HD2 HIS 14 -0.194 3.046 -5.079
124 HE1 HIS 14 HE1 HIS 14 -0.596 7.074 -3.881
125 H MET 15 HN MET 15 1.464 0.149 -2.662
126 HA MET 15 HA MET 15 -0.879 -0.390 -4.234
127 HB2 MET 15 HB2 MET 15 1.493 -1.419 -4.339
128 HB3 MET 15 HB1 MET 15 0.983 -2.442 -3.005
129 HG2 MET 15 HG2 MET 15 0.721 -3.472 -5.303
130 HG3 MET 15 HG1 MET 15 -0.728 -3.468 -4.311
131 HE1 MET 15 HE1 MET 15 0.240 -0.542 -7.718
132 HE2 MET 15 HE2 MET 15 1.351 -1.254 -6.552
133 HE3 MET 15 HE3 MET 15 0.322 0.088 -6.062
134 H TRP 16 HN TRP 16 0.099 -1.429 -0.944
135 HA TRP 16 HA TRP 16 -2.272 -2.958 -0.381
136 HB2 TRP 16 HB2 TRP 16 -0.084 -3.067 0.897
137 HB3 TRP 16 HB1 TRP 16 -0.470 -1.484 1.580
138 HD1 TRP 16 HD1 TRP 16 -1.626 -1.645 3.848
139 HE1 TRP 16 HE1 TRP 16 -3.207 -3.324 5.003
140 HE3 TRP 16 HE3 TRP 16 -2.087 -5.075 0.135
141 HZ2 TRP 16 HZ2 TRP 16 -4.506 -5.821 4.411
142 HZ3 TRP 16 HZ3 TRP 16 -3.496 -7.102 0.435
143 HH2 TRP 16 HH2 TRP 16 -4.702 -7.473 2.566
144 H ASN 17 HN ASN 17 -1.373 0.475 0.063
145 HA ASN 17 HA ASN 17 -3.638 1.316 1.559
146 HB2 ASN 17 HB2 ASN 17 -1.704 2.748 1.245
147 HB3 ASN 17 HB1 ASN 17 -1.895 2.709 -0.506
148 HD21 ASN 17 1HD2 ASN 17 -2.817 4.637 -1.277
149 HD22 ASN 17 2HD2 ASN 17 -3.960 5.559 -0.429
150 H PHE 18 HN PHE 18 -3.115 1.019 -1.951
151 HA PHE 18 HA PHE 18 -5.581 2.015 -2.954
152 HB2 PHE 18 HB2 PHE 18 -3.507 1.427 -4.237
153 HB3 PHE 18 HB1 PHE 18 -3.817 -0.267 -3.913
154 HD1 PHE 18 HD2 PHE 18 -5.616 2.725 -5.322
155 HD2 PHE 18 HD1 PHE 18 -4.912 -1.506 -5.522
156 HE1 PHE 18 HE2 PHE 18 -7.069 2.578 -7.325
157 HE2 PHE 18 HE1 PHE 18 -6.363 -1.654 -7.524
158 HZ PHE 18 HZ PHE 18 -7.443 0.389 -8.428
159 H ILE 19 HN ILE 19 -4.621 -1.186 -1.781
160 HA ILE 19 HA ILE 19 -7.194 -2.466 -2.238
161 HB ILE 19 HB ILE 19 -4.462 -3.115 -1.334
162 HG12 ILE 19 2HG1 ILE 19 -5.185 -5.291 -2.533
163 HG13 ILE 19 1HG1 ILE 19 -6.627 -4.388 -2.990
164 HG21 ILE 19 1HG2 ILE 19 -6.792 -4.688 -0.217
165 HG22 ILE 19 2HG2 ILE 19 -5.503 -3.897 0.694
166 HG23 ILE 19 3HG2 ILE 19 -5.139 -5.294 -0.315
167 HD11 ILE 19 3HD1 ILE 19 -4.860 -4.251 -4.722
168 HD12 ILE 19 1HD1 ILE 19 -3.776 -3.514 -3.542
169 HD13 ILE 19 2HD1 ILE 19 -5.239 -2.668 -4.046
170 H SER 20 HN SER 20 -5.580 -0.962 0.583
171 HA SER 20 HA SER 20 -7.391 -1.831 2.586
172 HB2 SER 20 HB2 SER 20 -6.312 -0.264 3.961
173 HB3 SER 20 HB1 SER 20 -5.106 -0.695 2.771
174 HG SER 20 HG SER 20 -5.742 1.271 1.650
175 H GLY 21 HN GLY 21 -7.668 1.007 0.412
176 HA2 GLY 21 HA2 GLY 21 -9.987 2.121 1.708
177 HA3 GLY 21 HA1 GLY 21 -9.483 2.456 0.047
178 H ILE 22 HN ILE 22 -9.540 -0.063 -1.075
179 HA ILE 22 HA ILE 22 -12.333 -0.454 -1.666
180 HB ILE 22 HB ILE 22 -9.882 -2.175 -2.180
181 HG12 ILE 22 2HG1 ILE 22 -9.658 0.037 -3.196
182 HG13 ILE 22 1HG1 ILE 22 -9.949 -1.161 -4.446
183 HG21 ILE 22 1HG2 ILE 22 -11.883 -3.523 -2.468
184 HG22 ILE 22 2HG2 ILE 22 -11.205 -3.141 -4.049
185 HG23 ILE 22 3HG2 ILE 22 -12.623 -2.270 -3.466
186 HD11 ILE 22 3HD1 ILE 22 -12.399 -0.519 -4.354
187 HD12 ILE 22 1HD1 ILE 22 -11.323 0.741 -4.953
188 HD13 ILE 22 2HD1 ILE 22 -11.937 0.820 -3.303
189 H GLN 23 HN GLN 23 -9.999 -2.277 0.344
190 HA GLN 23 HA GLN 23 -11.703 -4.405 1.151
191 HB2 GLN 23 HB2 GLN 23 -9.121 -3.895 1.442
192 HB3 GLN 23 HB1 GLN 23 -9.643 -3.239 2.989
193 HG2 GLN 23 HG2 GLN 23 -9.622 -5.326 3.810
194 HG3 GLN 23 HG1 GLN 23 -10.963 -5.722 2.737
195 HE21 GLN 23 1HE2 GLN 23 -7.359 -5.285 2.374
196 HE22 GLN 23 2HE2 GLN 23 -7.173 -6.666 1.406
197 H TYR 24 HN TYR 24 -11.182 -1.219 2.557
198 HA TYR 24 HA TYR 24 -12.746 -1.472 4.931
199 HB2 TYR 24 HB2 TYR 24 -11.287 0.387 4.727
200 HB3 TYR 24 HB1 TYR 24 -11.902 0.810 3.136
201 HD1 TYR 24 HD2 TYR 24 -12.991 0.540 6.719
202 HD2 TYR 24 HD1 TYR 24 -13.521 2.477 2.923
203 HE1 TYR 24 HE2 TYR 24 -14.600 2.119 7.748
204 HE2 TYR 24 HE1 TYR 24 -15.131 4.056 3.951
205 HH TYR 24 HH TYR 24 -15.370 4.799 6.864
206 H LEU 25 HN LEU 25 -13.644 -0.359 1.655
207 HA LEU 25 HA LEU 25 -16.419 0.153 2.174
208 HB2 LEU 25 HB2 LEU 25 -14.602 -0.129 -0.138
209 HB3 LEU 25 HB1 LEU 25 -16.271 -0.566 -0.480
210 HG LEU 25 HG LEU 25 -16.760 1.701 0.846
211 HD11 LEU 25 1HD1 LEU 25 -14.232 1.955 1.211
212 HD12 LEU 25 2HD1 LEU 25 -15.085 3.360 0.577
213 HD13 LEU 25 3HD1 LEU 25 -14.134 2.342 -0.506
214 HD21 LEU 25 3HD2 LEU 25 -17.516 1.324 -1.421
215 HD22 LEU 25 1HD2 LEU 25 -15.869 1.433 -2.044
216 HD23 LEU 25 2HD2 LEU 25 -16.666 2.868 -1.400
217 H ALA 26 HN ALA 26 -14.699 -2.784 1.111
218 HA ALA 26 HA ALA 26 -16.877 -4.468 0.480
219 HB1 ALA 26 HB1 ALA 26 -14.388 -5.372 1.932
220 HB2 ALA 26 HB2 ALA 26 -14.328 -4.802 0.264
221 HB3 ALA 26 HB3 ALA 26 -15.292 -6.219 0.678
222 H GLY 27 HN GLY 27 -15.361 -3.879 3.676
223 HA2 GLY 27 HA2 GLY 27 -17.302 -5.608 5.040
224 HA3 GLY 27 HA1 GLY 27 -15.995 -4.707 5.800
225 H LEU 28 HN LEU 28 -17.156 -2.238 4.169
226 HA LEU 28 HA LEU 28 -19.131 -1.496 6.266
227 HB2 LEU 28 HB2 LEU 28 -16.899 -0.269 5.669
228 HB3 LEU 28 HB1 LEU 28 -17.808 0.352 4.294
229 HG LEU 28 HG LEU 28 -19.517 0.674 6.507
230 HD11 LEU 28 1HD1 LEU 28 -17.175 0.327 7.709
231 HD12 LEU 28 2HD1 LEU 28 -18.315 1.551 8.266
232 HD13 LEU 28 3HD1 LEU 28 -16.951 2.015 7.250
233 HD21 LEU 28 3HD2 LEU 28 -19.260 3.032 6.012
234 HD22 LEU 28 1HD2 LEU 28 -19.179 2.147 4.489
235 HD23 LEU 28 2HD2 LEU 28 -17.701 2.751 5.240
236 H SER 29 HN SER 29 -20.217 -3.184 4.392
237 HA SER 29 HA SER 29 -21.461 -1.674 2.192
238 HB2 SER 29 HB2 SER 29 -20.737 -4.274 2.534
239 HB3 SER 29 HB1 SER 29 -22.434 -4.375 2.972
240 HG SER 29 HG SER 29 -22.965 -3.579 0.959
241 H THR 30 HN THR 30 -22.552 -3.250 5.205
242 HA THR 30 HA THR 30 -24.548 -3.218 6.359
243 HB THR 30 HB THR 30 -25.047 -0.869 7.111
244 HG1 THR 30 HG1 THR 30 -24.356 0.084 5.044
245 HG21 THR 30 3HG2 THR 30 -23.406 -2.200 8.272
246 HG22 THR 30 1HG2 THR 30 -22.819 -0.542 8.148
247 HG23 THR 30 2HG2 THR 30 -22.172 -1.787 7.081
Start of MODEL 8
1 H1 GLN 1 HT1 GLN 1 -22.911 2.434 0.803
2 H2 GLN 1 HT2 GLN 1 -22.567 0.931 1.501
3 H3 GLN 1 HT3 GLN 1 -22.602 1.101 -0.191
4 HA GLN 1 HA GLN 1 -20.644 2.424 1.634
5 HB2 GLN 1 HB2 GLN 1 -20.475 0.014 -0.196
6 HB3 GLN 1 HB1 GLN 1 -19.060 0.817 0.478
7 HG2 GLN 1 HG2 GLN 1 -20.369 0.467 2.766
8 HG3 GLN 1 HG1 GLN 1 -21.149 -0.825 1.859
9 HE21 GLN 1 1HE2 GLN 1 -18.489 -0.223 3.846
10 HE22 GLN 1 2HE2 GLN 1 -17.508 -1.508 3.335
11 H THR 2 HN THR 2 -18.852 3.403 0.378
12 HA THR 2 HA THR 2 -19.483 4.146 -2.437
13 HB THR 2 HB THR 2 -18.923 6.041 -0.131
14 HG1 THR 2 HG1 THR 2 -20.998 6.627 -0.367
15 HG21 THR 2 3HG2 THR 2 -19.555 6.856 -2.962
16 HG22 THR 2 1HG2 THR 2 -17.891 6.631 -2.418
17 HG23 THR 2 2HG2 THR 2 -18.913 7.840 -1.646
18 H ASN 3 HN ASN 3 -17.142 4.987 0.059
19 HA ASN 3 HA ASN 3 -14.882 4.368 -1.787
20 HB2 ASN 3 HB2 ASN 3 -13.624 5.973 -0.475
21 HB3 ASN 3 HB1 ASN 3 -15.145 6.699 -0.976
22 HD21 ASN 3 1HD2 ASN 3 -13.190 6.772 1.629
23 HD22 ASN 3 2HD2 ASN 3 -14.335 6.837 2.878
24 H TRP 4 HN TRP 4 -16.404 3.171 1.007
25 HA TRP 4 HA TRP 4 -14.184 2.150 2.504
26 HB2 TRP 4 HB2 TRP 4 -16.995 1.029 2.171
27 HB3 TRP 4 HB1 TRP 4 -15.907 0.683 3.502
28 HD1 TRP 4 HD1 TRP 4 -18.880 2.269 3.360
29 HE1 TRP 4 HE1 TRP 4 -19.057 4.480 4.678
30 HE3 TRP 4 HE3 TRP 4 -13.928 3.386 3.898
31 HZ2 TRP 4 HZ2 TRP 4 -17.330 6.454 5.813
32 HZ3 TRP 4 HZ3 TRP 4 -13.221 5.429 5.100
33 HH2 TRP 4 HH2 TRP 4 -14.913 6.966 6.058
34 H GLN 5 HN GLN 5 -16.348 0.438 0.227
35 HA GLN 5 HA GLN 5 -14.918 -1.955 -0.116
36 HB2 GLN 5 HB2 GLN 5 -16.843 -0.312 -1.665
37 HB3 GLN 5 HB1 GLN 5 -15.891 -1.428 -2.636
38 HG2 GLN 5 HG2 GLN 5 -16.987 -2.571 -0.132
39 HG3 GLN 5 HG1 GLN 5 -18.184 -2.126 -1.348
40 HE21 GLN 5 1HE2 GLN 5 -15.325 -4.206 -0.789
41 HE22 GLN 5 2HE2 GLN 5 -15.625 -5.227 -2.109
42 H LYS 6 HN LYS 6 -14.423 1.197 -1.727
43 HA LYS 6 HA LYS 6 -12.303 0.414 -3.511
44 HB2 LYS 6 HB2 LYS 6 -13.134 3.053 -2.262
45 HB3 LYS 6 HB1 LYS 6 -11.843 2.924 -3.447
46 HG2 LYS 6 HG2 LYS 6 -13.430 1.959 -5.076
47 HG3 LYS 6 HG1 LYS 6 -14.730 2.098 -3.892
48 HD2 LYS 6 HD2 LYS 6 -14.278 4.567 -3.779
49 HD3 LYS 6 HD1 LYS 6 -13.138 4.374 -5.107
50 HE2 LYS 6 HE2 LYS 6 -15.828 3.199 -5.570
51 HE3 LYS 6 HE1 LYS 6 -15.769 4.965 -5.480
52 HZ1 LYS 6 HZ1 LYS 6 -13.972 3.300 -7.170
53 HZ2 LYS 6 HZ2 LYS 6 -14.006 4.999 -7.109
54 HZ3 LYS 6 HZ3 LYS 6 -15.326 4.139 -7.739
55 H LEU 7 HN LEU 7 -12.348 1.738 -0.191
56 HA LEU 7 HA LEU 7 -9.550 2.097 0.219
57 HB2 LEU 7 HB2 LEU 7 -11.749 2.720 1.588
58 HB3 LEU 7 HB1 LEU 7 -11.391 1.210 2.416
59 HG LEU 7 HG LEU 7 -9.272 3.329 2.054
60 HD11 LEU 7 1HD1 LEU 7 -11.507 3.184 4.071
61 HD12 LEU 7 2HD1 LEU 7 -10.892 4.588 3.197
62 HD13 LEU 7 3HD1 LEU 7 -9.950 3.887 4.511
63 HD21 LEU 7 3HD2 LEU 7 -8.566 2.237 4.288
64 HD22 LEU 7 1HD2 LEU 7 -8.358 1.270 2.830
65 HD23 LEU 7 2HD2 LEU 7 -9.729 0.970 3.899
66 H GLU 8 HN GLU 8 -11.654 -0.764 0.719
67 HA GLU 8 HA GLU 8 -9.713 -2.447 1.990
68 HB2 GLU 8 HB2 GLU 8 -12.298 -2.776 0.506
69 HB3 GLU 8 HB1 GLU 8 -11.327 -4.218 0.799
70 HG2 GLU 8 HG2 GLU 8 -12.598 -4.188 2.732
71 HG3 GLU 8 HG1 GLU 8 -11.201 -3.257 3.261
72 H VAL 9 HN VAL 9 -10.572 -1.957 -1.435
73 HA VAL 9 HA VAL 9 -8.690 -3.882 -2.524
74 HB VAL 9 HB VAL 9 -10.058 -1.419 -3.701
75 HG11 VAL 9 1HG1 VAL 9 -7.971 -2.400 -4.917
76 HG12 VAL 9 2HG1 VAL 9 -9.440 -2.126 -5.851
77 HG13 VAL 9 3HG1 VAL 9 -9.033 -3.752 -5.308
78 HG21 VAL 9 3HG2 VAL 9 -10.783 -4.348 -4.005
79 HG22 VAL 9 1HG2 VAL 9 -11.703 -2.960 -4.582
80 HG23 VAL 9 2HG2 VAL 9 -11.562 -3.264 -2.852
81 H PHE 10 HN PHE 10 -8.716 -0.358 -2.071
82 HA PHE 10 HA PHE 10 -6.141 0.369 -3.000
83 HB2 PHE 10 HB2 PHE 10 -7.752 2.064 -2.493
84 HB3 PHE 10 HB1 PHE 10 -8.058 1.387 -0.908
85 HD1 PHE 10 HD1 PHE 10 -5.401 3.089 -2.922
86 HD2 PHE 10 HD2 PHE 10 -6.902 2.139 0.991
87 HE1 PHE 10 HE1 PHE 10 -3.717 4.601 -1.906
88 HE2 PHE 10 HE2 PHE 10 -5.220 3.651 2.003
89 HZ PHE 10 HZ PHE 10 -3.626 4.882 0.556
90 H TRP 11 HN TRP 11 -7.226 -0.784 0.190
91 HA TRP 11 HA TRP 11 -5.021 -0.405 1.799
92 HB2 TRP 11 HB2 TRP 11 -7.410 -1.787 1.966
93 HB3 TRP 11 HB1 TRP 11 -6.209 -3.063 2.146
94 HD1 TRP 11 HD1 TRP 11 -6.570 0.541 3.445
95 HE1 TRP 11 HE1 TRP 11 -5.951 0.576 5.955
96 HE3 TRP 11 HE3 TRP 11 -5.438 -4.379 4.121
97 HZ2 TRP 11 HZ2 TRP 11 -5.089 -1.255 7.974
98 HZ3 TRP 11 HZ3 TRP 11 -4.720 -5.213 6.341
99 HH2 TRP 11 HH2 TRP 11 -4.542 -3.664 8.265
100 H ALA 12 HN ALA 12 -5.502 -3.323 -0.289
101 HA ALA 12 HA ALA 12 -3.008 -4.503 0.461
102 HB1 ALA 12 HB1 ALA 12 -4.892 -5.685 -0.698
103 HB2 ALA 12 HB2 ALA 12 -3.332 -5.946 -1.480
104 HB3 ALA 12 HB3 ALA 12 -4.483 -4.809 -2.175
105 H LYS 13 HN LYS 13 -3.815 -2.139 -2.084
106 HA LYS 13 HA LYS 13 -1.330 -2.202 -3.514
107 HB2 LYS 13 HB2 LYS 13 -3.334 0.039 -3.040
108 HB3 LYS 13 HB1 LYS 13 -2.035 0.107 -4.222
109 HG2 LYS 13 HG2 LYS 13 -2.971 -1.780 -5.441
110 HG3 LYS 13 HG1 LYS 13 -4.210 -2.008 -4.209
111 HD2 LYS 13 HD2 LYS 13 -5.523 -0.413 -5.089
112 HD3 LYS 13 HD1 LYS 13 -4.195 0.737 -5.188
113 HE2 LYS 13 HE2 LYS 13 -4.539 -1.515 -7.191
114 HE3 LYS 13 HE1 LYS 13 -5.265 0.083 -7.418
115 HZ1 LYS 13 HZ1 LYS 13 -2.896 0.938 -6.894
116 HZ2 LYS 13 HZ2 LYS 13 -3.216 0.309 -8.438
117 HZ3 LYS 13 HZ3 LYS 13 -2.403 -0.635 -7.287
118 H HIS 14 HN HIS 14 -2.453 -0.089 -0.837
119 HA HIS 14 HA HIS 14 0.099 1.235 -0.482
120 HB2 HIS 14 HB2 HIS 14 -2.362 1.886 0.236
121 HB3 HIS 14 HB1 HIS 14 -1.972 0.963 1.689
122 HD1 HIS 14 HD1 HIS 14 -1.321 4.202 0.017
123 HD2 HIS 14 HD2 HIS 14 0.319 2.006 3.161
124 HE1 HIS 14 HE1 HIS 14 0.172 5.793 1.298
125 H MET 15 HN MET 15 -1.508 -1.542 1.083
126 HA MET 15 HA MET 15 0.351 -2.077 3.170
127 HB2 MET 15 HB2 MET 15 -1.613 -3.667 1.541
128 HB3 MET 15 HB1 MET 15 -0.543 -4.528 2.632
129 HG2 MET 15 HG2 MET 15 -2.289 -2.204 3.484
130 HG3 MET 15 HG1 MET 15 -2.759 -3.891 3.647
131 HE1 MET 15 HE1 MET 15 -0.555 -0.965 5.040
132 HE2 MET 15 HE2 MET 15 -0.890 -1.463 6.694
133 HE3 MET 15 HE3 MET 15 -2.220 -1.290 5.556
134 H TRP 16 HN TRP 16 0.250 -3.314 -0.207
135 HA TRP 16 HA TRP 16 2.727 -4.785 0.016
136 HB2 TRP 16 HB2 TRP 16 0.678 -4.572 -1.863
137 HB3 TRP 16 HB1 TRP 16 2.041 -3.805 -2.674
138 HD1 TRP 16 HD1 TRP 16 2.857 -5.616 -4.258
139 HE1 TRP 16 HE1 TRP 16 3.681 -8.058 -4.005
140 HE3 TRP 16 HE3 TRP 16 1.736 -6.376 0.630
141 HZ2 TRP 16 HZ2 TRP 16 3.836 -10.068 -1.955
142 HZ3 TRP 16 HZ3 TRP 16 2.224 -8.551 1.729
143 HH2 TRP 16 HH2 TRP 16 3.272 -10.392 0.443
144 H ASN 17 HN ASN 17 1.909 -1.446 -0.944
145 HA ASN 17 HA ASN 17 4.526 -0.762 -1.889
146 HB2 ASN 17 HB2 ASN 17 2.246 0.483 -2.099
147 HB3 ASN 17 HB1 ASN 17 2.607 1.139 -0.503
148 HD21 ASN 17 1HD2 ASN 17 3.626 3.175 -0.642
149 HD22 ASN 17 2HD2 ASN 17 4.658 3.639 -1.905
150 H PHE 18 HN PHE 18 3.058 -0.922 1.327
151 HA PHE 18 HA PHE 18 5.163 0.400 2.809
152 HB2 PHE 18 HB2 PHE 18 2.673 -0.182 3.382
153 HB3 PHE 18 HB1 PHE 18 3.324 -1.745 3.866
154 HD1 PHE 18 HD1 PHE 18 3.416 1.892 4.507
155 HD2 PHE 18 HD2 PHE 18 4.649 -1.991 5.867
156 HE1 PHE 18 HE1 PHE 18 4.122 2.878 6.675
157 HE2 PHE 18 HE2 PHE 18 5.356 -1.008 8.032
158 HZ PHE 18 HZ PHE 18 5.092 1.426 8.436
159 H ILE 19 HN ILE 19 4.998 -2.654 1.224
160 HA ILE 19 HA ILE 19 7.129 -3.886 2.899
161 HB ILE 19 HB ILE 19 4.752 -4.752 1.308
162 HG12 ILE 19 2HG1 ILE 19 5.750 -6.225 3.681
163 HG13 ILE 19 1HG1 ILE 19 5.284 -4.549 3.947
164 HG21 ILE 19 1HG2 ILE 19 6.258 -6.122 0.135
165 HG22 ILE 19 2HG2 ILE 19 5.649 -7.151 1.429
166 HG23 ILE 19 3HG2 ILE 19 7.249 -6.418 1.564
167 HD11 ILE 19 3HD1 ILE 19 3.141 -5.195 3.998
168 HD12 ILE 19 1HD1 ILE 19 3.588 -6.844 3.566
169 HD13 ILE 19 2HD1 ILE 19 3.271 -5.656 2.301
170 H SER 20 HN SER 20 6.099 -3.343 -0.511
171 HA SER 20 HA SER 20 8.705 -4.110 -1.608
172 HB2 SER 20 HB2 SER 20 6.203 -2.817 -2.749
173 HB3 SER 20 HB1 SER 20 7.594 -3.271 -3.723
174 HG SER 20 HG SER 20 6.875 -5.261 -3.647
175 H GLY 21 HN GLY 21 6.893 -1.048 -1.154
176 HA2 GLY 21 HA2 GLY 21 8.833 0.712 -2.260
177 HA3 GLY 21 HA1 GLY 21 7.618 1.169 -1.060
178 H ILE 22 HN ILE 22 8.410 -0.612 1.032
179 HA ILE 22 HA ILE 22 10.637 0.891 2.147
180 HB ILE 22 HB ILE 22 8.681 -1.181 3.049
181 HG12 ILE 22 2HG1 ILE 22 8.855 0.535 5.057
182 HG13 ILE 22 1HG1 ILE 22 9.628 1.547 3.844
183 HG21 ILE 22 1HG2 ILE 22 10.728 -2.200 3.900
184 HG22 ILE 22 2HG2 ILE 22 9.871 -1.425 5.230
185 HG23 ILE 22 3HG2 ILE 22 11.281 -0.644 4.518
186 HD11 ILE 22 3HD1 ILE 22 6.804 0.641 4.048
187 HD12 ILE 22 1HD1 ILE 22 7.477 0.752 2.421
188 HD13 ILE 22 2HD1 ILE 22 7.456 2.171 3.465
189 H GLN 23 HN GLN 23 10.262 -2.473 0.913
190 HA GLN 23 HA GLN 23 12.871 -3.324 1.633
191 HB2 GLN 23 HB2 GLN 23 12.406 -5.251 0.438
192 HB3 GLN 23 HB1 GLN 23 10.795 -4.647 0.756
193 HG2 GLN 23 HG2 GLN 23 10.641 -3.752 -1.497
194 HG3 GLN 23 HG1 GLN 23 12.323 -4.167 -1.821
195 HE21 GLN 23 1HE2 GLN 23 9.354 -5.894 -0.614
196 HE22 GLN 23 2HE2 GLN 23 9.637 -7.280 -1.552
197 H TYR 24 HN TYR 24 11.844 -1.391 -1.077
198 HA TYR 24 HA TYR 24 14.141 -1.631 -2.758
199 HB2 TYR 24 HB2 TYR 24 12.037 -0.535 -3.441
200 HB3 TYR 24 HB1 TYR 24 12.296 0.736 -2.245
201 HD1 TYR 24 HD2 TYR 24 13.673 -0.788 -5.351
202 HD2 TYR 24 HD1 TYR 24 13.759 2.574 -2.677
203 HE1 TYR 24 HE2 TYR 24 15.060 0.471 -6.975
204 HE2 TYR 24 HE1 TYR 24 15.146 3.830 -4.301
205 HH TYR 24 HH TYR 24 16.883 2.701 -6.504
206 H LEU 25 HN LEU 25 13.416 0.637 -0.085
207 HA LEU 25 HA LEU 25 16.082 1.845 -0.162
208 HB2 LEU 25 HB2 LEU 25 13.514 2.234 1.213
209 HB3 LEU 25 HB1 LEU 25 14.897 2.498 2.269
210 HG LEU 25 HG LEU 25 15.714 3.783 -0.011
211 HD11 LEU 25 1HD1 LEU 25 13.995 4.813 -1.133
212 HD12 LEU 25 2HD1 LEU 25 12.906 4.755 0.254
213 HD13 LEU 25 3HD1 LEU 25 13.186 3.305 -0.709
214 HD21 LEU 25 3HD2 LEU 25 15.746 4.590 2.375
215 HD22 LEU 25 1HD2 LEU 25 14.050 5.042 2.195
216 HD23 LEU 25 2HD2 LEU 25 15.283 5.834 1.215
217 H ALA 26 HN ALA 26 14.405 -0.571 1.849
218 HA ALA 26 HA ALA 26 16.365 -0.947 3.873
219 HB1 ALA 26 HB1 ALA 26 14.609 -3.089 2.666
220 HB2 ALA 26 HB2 ALA 26 13.976 -1.816 3.709
221 HB3 ALA 26 HB3 ALA 26 15.166 -2.956 4.333
222 H GLY 27 HN GLY 27 16.312 -2.136 0.529
223 HA2 GLY 27 HA2 GLY 27 18.760 -3.749 1.059
224 HA3 GLY 27 HA1 GLY 27 17.634 -4.046 -0.255
225 H LEU 28 HN LEU 28 18.018 -0.686 -0.198
226 HA LEU 28 HA LEU 28 20.462 -0.804 -1.912
227 HB2 LEU 28 HB2 LEU 28 17.911 -0.741 -2.881
228 HB3 LEU 28 HB1 LEU 28 18.306 0.974 -2.831
229 HG LEU 28 HG LEU 28 20.578 0.118 -3.937
230 HD11 LEU 28 1HD1 LEU 28 20.160 -2.231 -3.944
231 HD12 LEU 28 2HD1 LEU 28 19.926 -1.700 -5.609
232 HD13 LEU 28 3HD1 LEU 28 18.529 -2.012 -4.580
233 HD21 LEU 28 3HD2 LEU 28 17.903 0.753 -5.149
234 HD22 LEU 28 1HD2 LEU 28 19.233 0.294 -6.213
235 HD23 LEU 28 2HD2 LEU 28 19.391 1.701 -5.165
236 H SER 29 HN SER 29 19.605 0.492 0.880
237 HA SER 29 HA SER 29 21.302 2.827 0.594
238 HB2 SER 29 HB2 SER 29 19.296 4.346 1.405
239 HB3 SER 29 HB1 SER 29 19.572 4.041 -0.295
240 HG SER 29 HG SER 29 17.867 2.412 1.302
241 H THR 30 HN THR 30 22.118 3.459 2.577
242 HA THR 30 HA THR 30 20.936 2.211 5.034
243 HB THR 30 HB THR 30 23.825 2.969 4.518
244 HG1 THR 30 HG1 THR 30 24.156 0.898 3.917
245 HG21 THR 30 3HG2 THR 30 24.283 1.543 6.437
246 HG22 THR 30 1HG2 THR 30 22.571 1.145 6.582
247 HG23 THR 30 2HG2 THR 30 23.122 2.792 6.887
Start of MODEL 9
1 H1 GLN 1 HT1 GLN 1 22.493 6.450 0.426
2 H2 GLN 1 HT2 GLN 1 23.080 4.860 0.294
3 H3 GLN 1 HT3 GLN 1 21.519 5.148 0.892
4 HA GLN 1 HA GLN 1 20.782 5.956 -1.256
5 HB2 GLN 1 HB2 GLN 1 23.194 6.827 -1.656
6 HB3 GLN 1 HB1 GLN 1 23.533 5.210 -2.267
7 HG2 GLN 1 HG2 GLN 1 21.128 5.948 -3.510
8 HG3 GLN 1 HG1 GLN 1 22.124 7.402 -3.557
9 HE21 GLN 1 1HE2 GLN 1 24.024 7.380 -4.934
10 HE22 GLN 1 2HE2 GLN 1 24.389 6.062 -5.939
11 H THR 2 HN THR 2 19.634 4.048 -0.491
12 HA THR 2 HA THR 2 20.357 1.637 -2.076
13 HB THR 2 HB THR 2 19.251 0.461 0.040
14 HG1 THR 2 HG1 THR 2 20.039 1.507 1.944
15 HG21 THR 2 3HG2 THR 2 21.486 0.073 -1.026
16 HG22 THR 2 1HG2 THR 2 21.466 -0.160 0.722
17 HG23 THR 2 2HG2 THR 2 22.146 1.316 0.036
18 H ASN 3 HN ASN 3 18.752 0.940 -3.237
19 HA ASN 3 HA ASN 3 16.096 2.175 -3.069
20 HB2 ASN 3 HB2 ASN 3 17.648 1.435 -5.148
21 HB3 ASN 3 HB1 ASN 3 16.624 0.003 -5.021
22 HD21 ASN 3 1HD2 ASN 3 14.212 0.370 -5.149
23 HD22 ASN 3 2HD2 ASN 3 13.634 1.744 -5.959
24 H TRP 4 HN TRP 4 17.489 -0.791 -1.991
25 HA TRP 4 HA TRP 4 15.105 -2.418 -1.969
26 HB2 TRP 4 HB2 TRP 4 16.522 -3.971 -0.950
27 HB3 TRP 4 HB1 TRP 4 17.707 -2.869 -1.629
28 HD1 TRP 4 HD1 TRP 4 19.301 -1.672 -0.022
29 HE1 TRP 4 HE1 TRP 4 19.601 -1.637 2.532
30 HE3 TRP 4 HE3 TRP 4 15.066 -4.148 1.393
31 HZ2 TRP 4 HZ2 TRP 4 18.223 -2.545 4.881
32 HZ3 TRP 4 HZ3 TRP 4 14.584 -4.551 3.786
33 HH2 TRP 4 HH2 TRP 4 16.152 -3.755 5.531
34 H GLN 5 HN GLN 5 16.554 -0.174 0.338
35 HA GLN 5 HA GLN 5 14.745 -0.529 2.534
36 HB2 GLN 5 HB2 GLN 5 16.849 1.292 1.699
37 HB3 GLN 5 HB1 GLN 5 15.506 2.211 2.366
38 HG2 GLN 5 HG2 GLN 5 16.336 -0.214 3.880
39 HG3 GLN 5 HG1 GLN 5 17.449 1.147 3.890
40 HE21 GLN 5 1HE2 GLN 5 16.854 1.227 6.301
41 HE22 GLN 5 2HE2 GLN 5 15.441 2.057 6.741
42 H LYS 6 HN LYS 6 14.621 1.509 -0.386
43 HA LYS 6 HA LYS 6 12.181 2.919 0.186
44 HB2 LYS 6 HB2 LYS 6 13.627 2.156 -2.370
45 HB3 LYS 6 HB1 LYS 6 12.175 3.146 -2.364
46 HG2 LYS 6 HG2 LYS 6 14.105 4.147 -0.436
47 HG3 LYS 6 HG1 LYS 6 14.819 4.035 -2.043
48 HD2 LYS 6 HD2 LYS 6 13.051 5.365 -3.009
49 HD3 LYS 6 HD1 LYS 6 12.142 5.348 -1.500
50 HE2 LYS 6 HE2 LYS 6 14.946 6.460 -1.543
51 HE3 LYS 6 HE1 LYS 6 13.583 7.460 -2.070
52 HZ1 LYS 6 HZ1 LYS 6 14.105 7.569 0.368
53 HZ2 LYS 6 HZ2 LYS 6 13.567 5.965 0.500
54 HZ3 LYS 6 HZ3 LYS 6 12.499 7.188 -0.003
55 H LEU 7 HN LEU 7 12.883 -0.148 -1.530
56 HA LEU 7 HA LEU 7 10.259 -0.771 -2.430
57 HB2 LEU 7 HB2 LEU 7 12.231 -1.926 -3.243
58 HB3 LEU 7 HB1 LEU 7 12.638 -2.455 -1.621
59 HG LEU 7 HG LEU 7 10.561 -3.828 -1.569
60 HD11 LEU 7 1HD1 LEU 7 8.978 -3.119 -3.042
61 HD12 LEU 7 2HD1 LEU 7 9.799 -4.226 -4.140
62 HD13 LEU 7 3HD1 LEU 7 10.164 -2.502 -4.192
63 HD21 LEU 7 3HD2 LEU 7 11.366 -5.538 -3.191
64 HD22 LEU 7 1HD2 LEU 7 12.670 -4.869 -2.211
65 HD23 LEU 7 2HD2 LEU 7 12.457 -4.337 -3.881
66 H GLU 8 HN GLU 8 11.871 -1.496 0.692
67 HA GLU 8 HA GLU 8 9.807 -3.119 1.830
68 HB2 GLU 8 HB2 GLU 8 12.235 -1.714 2.672
69 HB3 GLU 8 HB1 GLU 8 10.995 -1.680 3.923
70 HG2 GLU 8 HG2 GLU 8 11.681 -4.248 2.496
71 HG3 GLU 8 HG1 GLU 8 12.615 -3.696 3.883
72 H VAL 9 HN VAL 9 10.357 0.407 1.911
73 HA VAL 9 HA VAL 9 8.037 1.072 3.510
74 HB VAL 9 HB VAL 9 9.719 2.661 1.523
75 HG11 VAL 9 1HG1 VAL 9 7.299 3.498 2.384
76 HG12 VAL 9 2HG1 VAL 9 8.648 4.598 2.109
77 HG13 VAL 9 3HG1 VAL 9 8.290 4.035 3.740
78 HG21 VAL 9 3HG2 VAL 9 10.909 1.710 3.534
79 HG22 VAL 9 1HG2 VAL 9 9.818 2.650 4.552
80 HG23 VAL 9 2HG2 VAL 9 10.927 3.470 3.453
81 H PHE 10 HN PHE 10 8.749 1.105 0.027
82 HA PHE 10 HA PHE 10 6.286 1.934 -1.077
83 HB2 PHE 10 HB2 PHE 10 8.238 1.776 -2.446
84 HB3 PHE 10 HB1 PHE 10 8.540 0.128 -1.940
85 HD1 PHE 10 HD2 PHE 10 5.593 1.949 -3.413
86 HD2 PHE 10 HD1 PHE 10 8.243 -1.420 -3.619
87 HE1 PHE 10 HE2 PHE 10 4.340 1.090 -5.375
88 HE2 PHE 10 HE1 PHE 10 6.993 -2.284 -5.582
89 HZ PHE 10 HZ PHE 10 5.042 -1.029 -6.459
90 H TRP 11 HN TRP 11 7.437 -1.338 -0.291
91 HA TRP 11 HA TRP 11 5.468 -3.018 -1.221
92 HB2 TRP 11 HB2 TRP 11 7.616 -3.166 0.545
93 HB3 TRP 11 HB1 TRP 11 6.243 -3.679 1.514
94 HD1 TRP 11 HD1 TRP 11 7.409 -4.325 -2.095
95 HE1 TRP 11 HE1 TRP 11 7.167 -6.854 -2.590
96 HE3 TRP 11 HE3 TRP 11 5.550 -5.883 2.377
97 HZ2 TRP 11 HZ2 TRP 11 6.287 -9.228 -1.231
98 HZ3 TRP 11 HZ3 TRP 11 5.016 -8.272 2.761
99 HH2 TRP 11 HH2 TRP 11 5.380 -9.943 0.969
100 H ALA 12 HN ALA 12 5.355 -1.284 1.921
101 HA ALA 12 HA ALA 12 2.850 -2.383 2.732
102 HB1 ALA 12 HB1 ALA 12 3.942 0.336 3.509
103 HB2 ALA 12 HB2 ALA 12 4.583 -1.174 4.164
104 HB3 ALA 12 HB3 ALA 12 2.907 -0.718 4.470
105 H LYS 13 HN LYS 13 3.662 0.601 0.922
106 HA LYS 13 HA LYS 13 1.019 1.702 0.798
107 HB2 LYS 13 HB2 LYS 13 3.074 2.952 0.239
108 HB3 LYS 13 HB1 LYS 13 3.360 1.888 -1.135
109 HG2 LYS 13 HG2 LYS 13 1.992 3.098 -2.441
110 HG3 LYS 13 HG1 LYS 13 0.679 2.958 -1.281
111 HD2 LYS 13 HD2 LYS 13 0.922 5.210 -1.118
112 HD3 LYS 13 HD1 LYS 13 2.237 4.798 -0.019
113 HE2 LYS 13 HE2 LYS 13 3.593 4.663 -2.348
114 HE3 LYS 13 HE1 LYS 13 2.362 5.852 -2.808
115 HZ1 LYS 13 HZ1 LYS 13 4.174 7.015 -1.812
116 HZ2 LYS 13 HZ2 LYS 13 4.178 5.991 -0.459
117 HZ3 LYS 13 HZ3 LYS 13 2.881 7.061 -0.721
118 H HIS 14 HN HIS 14 2.722 -0.691 -1.227
119 HA HIS 14 HA HIS 14 0.715 -0.932 -3.282
120 HB2 HIS 14 HB2 HIS 14 2.981 -1.655 -3.660
121 HB3 HIS 14 HB1 HIS 14 2.955 -2.690 -2.239
122 HD1 HIS 14 HD1 HIS 14 0.754 -2.412 -5.358
123 HD2 HIS 14 HD2 HIS 14 2.699 -5.300 -3.066
124 HE1 HIS 14 HE1 HIS 14 0.241 -4.646 -6.437
125 H MET 15 HN MET 15 1.392 -2.858 -0.331
126 HA MET 15 HA MET 15 -0.836 -4.663 -0.602
127 HB2 MET 15 HB2 MET 15 1.377 -4.521 0.973
128 HB3 MET 15 HB1 MET 15 0.170 -3.927 2.111
129 HG2 MET 15 HG2 MET 15 -0.232 -6.121 2.526
130 HG3 MET 15 HG1 MET 15 -1.127 -6.089 1.010
131 HE1 MET 15 HE1 MET 15 0.930 -5.935 -1.337
132 HE2 MET 15 HE2 MET 15 -0.497 -6.940 -1.104
133 HE3 MET 15 HE3 MET 15 1.021 -7.689 -1.580
134 H TRP 16 HN TRP 16 -0.434 -1.630 1.297
135 HA TRP 16 HA TRP 16 -3.105 -1.600 2.331
136 HB2 TRP 16 HB2 TRP 16 -1.090 -0.212 3.093
137 HB3 TRP 16 HB1 TRP 16 -1.415 0.842 1.711
138 HD1 TRP 16 HD1 TRP 16 -2.845 2.829 2.374
139 HE1 TRP 16 HE1 TRP 16 -4.793 3.245 4.009
140 HE3 TRP 16 HE3 TRP 16 -3.257 -1.807 4.414
141 HZ2 TRP 16 HZ2 TRP 16 -6.333 1.779 5.954
142 HZ3 TRP 16 HZ3 TRP 16 -4.956 -2.288 6.153
143 HH2 TRP 16 HH2 TRP 16 -6.493 -0.503 6.923
144 H ASN 17 HN ASN 17 -1.706 -0.478 -0.733
145 HA ASN 17 HA ASN 17 -3.915 1.047 -1.695
146 HB2 ASN 17 HB2 ASN 17 -1.654 1.024 -2.708
147 HB3 ASN 17 HB1 ASN 17 -1.866 -0.663 -3.158
148 HD21 ASN 17 1HD2 ASN 17 -3.196 2.624 -3.797
149 HD22 ASN 17 2HD2 ASN 17 -3.784 2.228 -5.338
150 H PHE 18 HN PHE 18 -3.195 -2.436 -1.727
151 HA PHE 18 HA PHE 18 -5.348 -3.368 -3.374
152 HB2 PHE 18 HB2 PHE 18 -3.329 -4.675 -2.623
153 HB3 PHE 18 HB1 PHE 18 -3.960 -4.652 -0.985
154 HD1 PHE 18 HD1 PHE 18 -4.688 -5.831 -4.443
155 HD2 PHE 18 HD2 PHE 18 -5.623 -6.177 -0.265
156 HE1 PHE 18 HE1 PHE 18 -6.063 -7.840 -4.917
157 HE2 PHE 18 HE2 PHE 18 -6.999 -8.185 -0.739
158 HZ PHE 18 HZ PHE 18 -7.219 -9.017 -3.065
159 H ILE 19 HN ILE 19 -5.033 -2.689 0.104
160 HA ILE 19 HA ILE 19 -7.723 -3.492 0.835
161 HB ILE 19 HB ILE 19 -5.369 -2.096 2.090
162 HG12 ILE 19 2HG1 ILE 19 -6.365 -4.041 3.794
163 HG13 ILE 19 1HG1 ILE 19 -6.735 -4.690 2.200
164 HG21 ILE 19 1HG2 ILE 19 -7.023 -0.727 3.064
165 HG22 ILE 19 2HG2 ILE 19 -6.780 -2.014 4.242
166 HG23 ILE 19 3HG2 ILE 19 -8.182 -2.052 3.176
167 HD11 ILE 19 3HD1 ILE 19 -4.423 -5.231 3.245
168 HD12 ILE 19 1HD1 ILE 19 -4.004 -3.575 2.806
169 HD13 ILE 19 2HD1 ILE 19 -4.477 -4.728 1.556
170 H SER 20 HN SER 20 -6.155 -0.404 -0.035
171 HA SER 20 HA SER 20 -8.250 1.416 0.528
172 HB2 SER 20 HB2 SER 20 -5.984 1.316 -1.450
173 HB3 SER 20 HB1 SER 20 -7.140 2.637 -1.505
174 HG SER 20 HG SER 20 -5.109 2.659 -0.048
175 H GLY 21 HN GLY 21 -7.650 -0.464 -2.487
176 HA2 GLY 21 HA2 GLY 21 -9.851 0.595 -3.976
177 HA3 GLY 21 HA1 GLY 21 -9.054 -0.948 -4.296
178 H ILE 22 HN ILE 22 -9.537 -2.320 -1.940
179 HA ILE 22 HA ILE 22 -12.211 -3.311 -2.276
180 HB ILE 22 HB ILE 22 -10.172 -3.573 -0.038
181 HG12 ILE 22 2HG1 ILE 22 -9.447 -4.440 -2.252
182 HG13 ILE 22 1HG1 ILE 22 -9.617 -5.716 -1.058
183 HG21 ILE 22 1HG2 ILE 22 -11.433 -5.691 0.525
184 HG22 ILE 22 2HG2 ILE 22 -12.741 -5.097 -0.499
185 HG23 ILE 22 3HG2 ILE 22 -12.260 -4.189 0.934
186 HD11 ILE 22 3HD1 ILE 22 -10.877 -5.493 -3.613
187 HD12 ILE 22 1HD1 ILE 22 -12.137 -5.423 -2.381
188 HD13 ILE 22 2HD1 ILE 22 -11.030 -6.793 -2.432
189 H GLN 23 HN GLN 23 -10.735 -1.263 0.248
190 HA GLN 23 HA GLN 23 -13.016 -0.751 1.858
191 HB2 GLN 23 HB2 GLN 23 -10.431 -0.271 2.085
192 HB3 GLN 23 HB1 GLN 23 -10.859 1.280 1.375
193 HG2 GLN 23 HG2 GLN 23 -11.343 1.943 3.473
194 HG3 GLN 23 HG1 GLN 23 -12.779 0.933 3.344
195 HE21 GLN 23 1HE2 GLN 23 -9.251 0.502 4.157
196 HE22 GLN 23 2HE2 GLN 23 -9.557 -0.612 5.398
197 H TYR 24 HN TYR 24 -11.752 0.933 -0.939
198 HA TYR 24 HA TYR 24 -13.561 3.159 -1.038
199 HB2 TYR 24 HB2 TYR 24 -11.510 3.282 -2.206
200 HB3 TYR 24 HB1 TYR 24 -11.753 1.724 -2.972
201 HD1 TYR 24 HD2 TYR 24 -12.703 5.297 -3.003
202 HD2 TYR 24 HD1 TYR 24 -13.092 1.504 -4.981
203 HE1 TYR 24 HE2 TYR 24 -13.664 6.427 -4.988
204 HE2 TYR 24 HE1 TYR 24 -14.051 2.634 -6.965
205 HH TYR 24 HH TYR 24 -15.269 5.666 -6.963
206 H LEU 25 HN LEU 25 -13.931 -0.212 -2.083
207 HA LEU 25 HA LEU 25 -16.225 0.417 -3.794
208 HB2 LEU 25 HB2 LEU 25 -14.416 -1.790 -3.284
209 HB3 LEU 25 HB1 LEU 25 -16.088 -2.339 -3.307
210 HG LEU 25 HG LEU 25 -16.124 -0.692 -5.460
211 HD11 LEU 25 1HD1 LEU 25 -14.092 -0.804 -6.702
212 HD12 LEU 25 2HD1 LEU 25 -13.375 -1.945 -5.564
213 HD13 LEU 25 3HD1 LEU 25 -13.644 -0.273 -5.083
214 HD21 LEU 25 3HD2 LEU 25 -16.848 -3.050 -5.431
215 HD22 LEU 25 1HD2 LEU 25 -15.165 -3.577 -5.430
216 HD23 LEU 25 2HD2 LEU 25 -15.827 -2.740 -6.834
217 H ALA 26 HN ALA 26 -15.812 -0.534 -0.448
218 HA ALA 26 HA ALA 26 -18.640 -1.341 -0.166
219 HB1 ALA 26 HB1 ALA 26 -17.892 -2.328 1.748
220 HB2 ALA 26 HB2 ALA 26 -17.005 -0.892 2.254
221 HB3 ALA 26 HB3 ALA 26 -16.283 -2.012 1.100
222 H GLY 27 HN GLY 27 -18.462 1.256 -1.153
223 HA2 GLY 27 HA2 GLY 27 -19.880 3.129 -0.655
224 HA3 GLY 27 HA1 GLY 27 -19.595 2.862 1.063
225 H LEU 28 HN LEU 28 -17.068 3.021 -1.487
226 HA LEU 28 HA LEU 28 -15.210 4.412 -1.694
227 HB2 LEU 28 HB2 LEU 28 -17.397 5.871 -1.963
228 HB3 LEU 28 HB1 LEU 28 -16.788 6.646 -0.504
229 HG LEU 28 HG LEU 28 -14.601 6.299 -2.334
230 HD11 LEU 28 1HD1 LEU 28 -17.080 7.598 -3.489
231 HD12 LEU 28 2HD1 LEU 28 -16.181 6.233 -4.153
232 HD13 LEU 28 3HD1 LEU 28 -15.456 7.840 -4.132
233 HD21 LEU 28 3HD2 LEU 28 -16.107 8.753 -1.363
234 HD22 LEU 28 1HD2 LEU 28 -14.521 8.775 -2.134
235 HD23 LEU 28 2HD2 LEU 28 -14.726 8.000 -0.564
236 H SER 29 HN SER 29 -15.863 3.199 1.121
237 HA SER 29 HA SER 29 -13.512 3.877 2.511
238 HB2 SER 29 HB2 SER 29 -14.901 6.101 2.660
239 HB3 SER 29 HB1 SER 29 -15.903 5.205 3.792
240 HG SER 29 HG SER 29 -13.326 6.162 4.031
241 H THR 30 HN THR 30 -13.418 2.684 4.485
242 HA THR 30 HA THR 30 -13.811 0.780 5.765
243 HB THR 30 HB THR 30 -16.606 1.896 6.012
244 HG1 THR 30 HG1 THR 30 -15.421 3.730 6.157
245 HG21 THR 30 3HG2 THR 30 -16.148 -0.025 7.379
246 HG22 THR 30 1HG2 THR 30 -16.167 1.399 8.418
247 HG23 THR 30 2HG2 THR 30 -14.631 0.677 7.942
Start of MODEL 10
1 H1 GLN 1 HT1 GLN 1 18.554 -7.730 5.751
2 H2 GLN 1 HT2 GLN 1 17.485 -6.555 5.144
3 H3 GLN 1 HT3 GLN 1 18.366 -6.257 6.561
4 HA GLN 1 HA GLN 1 20.342 -5.889 5.467
5 HB2 GLN 1 HB2 GLN 1 19.181 -7.931 3.725
6 HB3 GLN 1 HB1 GLN 1 20.012 -6.677 2.813
7 HG2 GLN 1 HG2 GLN 1 22.046 -7.352 3.513
8 HG3 GLN 1 HG1 GLN 1 21.519 -7.519 5.184
9 HE21 GLN 1 1HE2 GLN 1 20.565 -9.635 5.833
10 HE22 GLN 1 2HE2 GLN 1 20.830 -11.011 4.877
11 H THR 2 HN THR 2 20.832 -3.997 4.405
12 HA THR 2 HA THR 2 20.597 -1.959 3.366
13 HB THR 2 HB THR 2 18.206 -3.087 1.928
14 HG1 THR 2 HG1 THR 2 20.950 -3.450 1.290
15 HG21 THR 2 3HG2 THR 2 18.729 -0.704 1.562
16 HG22 THR 2 1HG2 THR 2 19.017 -1.659 0.109
17 HG23 THR 2 2HG2 THR 2 20.375 -1.139 1.103
18 H ASN 3 HN ASN 3 17.256 -2.983 3.826
19 HA ASN 3 HA ASN 3 15.533 -2.162 5.121
20 HB2 ASN 3 HB2 ASN 3 17.520 -1.472 6.706
21 HB3 ASN 3 HB1 ASN 3 17.194 0.148 6.092
22 HD21 ASN 3 1HD2 ASN 3 15.946 -2.401 8.187
23 HD22 ASN 3 2HD2 ASN 3 14.600 -1.527 8.736
24 H TRP 4 HN TRP 4 17.429 0.421 3.601
25 HA TRP 4 HA TRP 4 15.212 2.144 3.024
26 HB2 TRP 4 HB2 TRP 4 17.312 3.154 2.813
27 HB3 TRP 4 HB1 TRP 4 18.023 1.751 2.028
28 HD1 TRP 4 HD1 TRP 4 18.232 1.839 -0.505
29 HE1 TRP 4 HE1 TRP 4 17.356 3.387 -2.367
30 HE3 TRP 4 HE3 TRP 4 15.062 4.779 2.212
31 HZ2 TRP 4 HZ2 TRP 4 15.546 5.591 -2.669
32 HZ3 TRP 4 HZ3 TRP 4 13.777 6.588 1.117
33 HH2 TRP 4 HH2 TRP 4 14.013 6.999 -1.314
34 H GLN 5 HN GLN 5 16.723 -0.484 1.150
35 HA GLN 5 HA GLN 5 15.067 -0.326 -1.185
36 HB2 GLN 5 HB2 GLN 5 16.812 -2.377 0.156
37 HB3 GLN 5 HB1 GLN 5 15.764 -2.902 -1.157
38 HG2 GLN 5 HG2 GLN 5 17.518 -0.475 -1.484
39 HG3 GLN 5 HG1 GLN 5 18.159 -2.096 -1.756
40 HE21 GLN 5 1HE2 GLN 5 15.916 0.345 -3.053
41 HE22 GLN 5 2HE2 GLN 5 15.600 -0.494 -4.494
42 H LYS 6 HN LYS 6 14.722 -2.002 1.933
43 HA LYS 6 HA LYS 6 12.267 -3.399 1.281
44 HB2 LYS 6 HB2 LYS 6 13.805 -2.726 3.795
45 HB3 LYS 6 HB1 LYS 6 12.243 -3.534 3.879
46 HG2 LYS 6 HG2 LYS 6 14.275 -4.656 1.995
47 HG3 LYS 6 HG1 LYS 6 14.528 -4.914 3.720
48 HD2 LYS 6 HD2 LYS 6 12.463 -6.057 3.970
49 HD3 LYS 6 HD1 LYS 6 11.876 -5.505 2.400
50 HE2 LYS 6 HE2 LYS 6 13.685 -6.840 1.295
51 HE3 LYS 6 HE1 LYS 6 14.137 -7.480 2.885
52 HZ1 LYS 6 HZ1 LYS 6 11.484 -7.737 1.567
53 HZ2 LYS 6 HZ2 LYS 6 11.817 -8.237 3.159
54 HZ3 LYS 6 HZ3 LYS 6 12.593 -8.981 1.846
55 H LEU 7 HN LEU 7 13.079 -0.251 2.727
56 HA LEU 7 HA LEU 7 10.479 0.497 3.675
57 HB2 LEU 7 HB2 LEU 7 12.664 1.514 4.312
58 HB3 LEU 7 HB1 LEU 7 12.794 2.197 2.695
59 HG LEU 7 HG LEU 7 10.233 2.805 4.000
60 HD11 LEU 7 1HD1 LEU 7 11.633 2.836 6.011
61 HD12 LEU 7 2HD1 LEU 7 11.194 4.481 5.552
62 HD13 LEU 7 3HD1 LEU 7 12.809 3.870 5.197
63 HD21 LEU 7 3HD2 LEU 7 12.201 4.887 3.152
64 HD22 LEU 7 1HD2 LEU 7 10.469 4.781 2.837
65 HD23 LEU 7 2HD2 LEU 7 11.596 3.801 1.901
66 H GLU 8 HN GLU 8 12.084 0.900 0.504
67 HA GLU 8 HA GLU 8 10.096 2.618 -0.683
68 HB2 GLU 8 HB2 GLU 8 12.151 0.666 -1.770
69 HB3 GLU 8 HB1 GLU 8 11.161 1.680 -2.819
70 HG2 GLU 8 HG2 GLU 8 12.081 3.692 -1.907
71 HG3 GLU 8 HG1 GLU 8 12.854 2.822 -0.584
72 H VAL 9 HN VAL 9 10.582 -0.920 -0.701
73 HA VAL 9 HA VAL 9 8.228 -1.589 -2.237
74 HB VAL 9 HB VAL 9 9.871 -3.145 -0.193
75 HG11 VAL 9 1HG1 VAL 9 7.575 -3.926 -1.938
76 HG12 VAL 9 2HG1 VAL 9 8.034 -4.530 -0.347
77 HG13 VAL 9 3HG1 VAL 9 8.904 -5.075 -1.780
78 HG21 VAL 9 3HG2 VAL 9 11.105 -2.334 -2.222
79 HG22 VAL 9 1HG2 VAL 9 9.951 -3.214 -3.225
80 HG23 VAL 9 2HG2 VAL 9 11.012 -4.090 -2.122
81 H PHE 10 HN PHE 10 8.947 -1.330 1.233
82 HA PHE 10 HA PHE 10 6.464 -2.112 2.368
83 HB2 PHE 10 HB2 PHE 10 8.364 -1.894 3.777
84 HB3 PHE 10 HB1 PHE 10 8.754 -0.314 3.133
85 HD1 PHE 10 HD2 PHE 10 6.075 -2.078 5.071
86 HD2 PHE 10 HD1 PHE 10 8.145 1.608 4.307
87 HE1 PHE 10 HE2 PHE 10 4.839 -1.000 6.932
88 HE2 PHE 10 HE1 PHE 10 6.907 2.686 6.169
89 HZ PHE 10 HZ PHE 10 5.256 1.383 7.480
90 H TRP 11 HN TRP 11 7.632 1.108 1.318
91 HA TRP 11 HA TRP 11 5.423 2.672 2.122
92 HB2 TRP 11 HB2 TRP 11 7.805 3.062 0.715
93 HB3 TRP 11 HB1 TRP 11 6.552 3.510 -0.441
94 HD1 TRP 11 HD1 TRP 11 7.273 4.078 3.276
95 HE1 TRP 11 HE1 TRP 11 6.668 6.518 3.885
96 HE3 TRP 11 HE3 TRP 11 5.532 5.677 -1.234
97 HZ2 TRP 11 HZ2 TRP 11 5.582 8.839 2.604
98 HZ3 TRP 11 HZ3 TRP 11 4.717 7.999 -1.520
99 HH2 TRP 11 HH2 TRP 11 4.738 9.580 0.387
100 H ALA 12 HN ALA 12 5.988 1.072 -1.038
101 HA ALA 12 HA ALA 12 3.492 1.905 -2.163
102 HB1 ALA 12 HB1 ALA 12 5.339 1.208 -3.574
103 HB2 ALA 12 HB2 ALA 12 3.991 0.103 -3.849
104 HB3 ALA 12 HB3 ALA 12 5.346 -0.397 -2.838
105 H LYS 13 HN LYS 13 4.361 -0.819 -0.080
106 HA LYS 13 HA LYS 13 2.110 -2.523 -0.570
107 HB2 LYS 13 HB2 LYS 13 4.319 -2.934 0.723
108 HB3 LYS 13 HB1 LYS 13 3.521 -2.150 2.085
109 HG2 LYS 13 HG2 LYS 13 1.580 -3.863 1.516
110 HG3 LYS 13 HG1 LYS 13 2.896 -4.774 0.778
111 HD2 LYS 13 HD2 LYS 13 3.118 -3.690 3.586
112 HD3 LYS 13 HD1 LYS 13 2.364 -5.247 3.258
113 HE2 LYS 13 HE2 LYS 13 4.355 -6.239 2.599
114 HE3 LYS 13 HE1 LYS 13 5.065 -4.709 2.056
115 HZ1 LYS 13 HZ1 LYS 13 4.527 -5.448 4.889
116 HZ2 LYS 13 HZ2 LYS 13 5.193 -3.975 4.353
117 HZ3 LYS 13 HZ3 LYS 13 6.047 -5.424 4.146
118 H HIS 14 HN HIS 14 2.663 0.049 1.867
119 HA HIS 14 HA HIS 14 -0.007 -0.052 3.001
120 HB2 HIS 14 HB2 HIS 14 2.202 0.924 3.971
121 HB3 HIS 14 HB1 HIS 14 1.868 2.332 2.971
122 HD1 HIS 14 HD1 HIS 14 1.826 2.234 6.188
123 HD2 HIS 14 HD2 HIS 14 -1.512 2.197 3.690
124 HE1 HIS 14 HE1 HIS 14 -0.112 3.073 7.571
125 H MET 15 HN MET 15 1.613 1.993 0.565
126 HA MET 15 HA MET 15 -0.525 3.766 -0.060
127 HB2 MET 15 HB2 MET 15 1.971 2.772 -1.368
128 HB3 MET 15 HB1 MET 15 0.812 3.615 -2.388
129 HG2 MET 15 HG2 MET 15 1.631 4.791 0.259
130 HG3 MET 15 HG1 MET 15 2.645 5.012 -1.166
131 HE1 MET 15 HE1 MET 15 0.687 6.725 0.916
132 HE2 MET 15 HE2 MET 15 -0.032 8.021 -0.029
133 HE3 MET 15 HE3 MET 15 1.708 7.769 -0.091
134 H TRP 16 HN TRP 16 0.316 0.580 -1.530
135 HA TRP 16 HA TRP 16 -1.845 0.626 -3.420
136 HB2 TRP 16 HB2 TRP 16 0.322 -0.941 -3.157
137 HB3 TRP 16 HB1 TRP 16 -0.843 -1.982 -2.336
138 HD1 TRP 16 HD1 TRP 16 -1.466 -3.751 -4.079
139 HE1 TRP 16 HE1 TRP 16 -2.342 -3.709 -6.501
140 HE3 TRP 16 HE3 TRP 16 -1.097 1.234 -5.043
141 HZ2 TRP 16 HZ2 TRP 16 -2.827 -1.792 -8.585
142 HZ3 TRP 16 HZ3 TRP 16 -1.771 2.151 -7.248
143 HH2 TRP 16 HH2 TRP 16 -2.633 0.645 -9.015
144 H ASN 17 HN ASN 17 -1.639 -0.341 -0.018
145 HA ASN 17 HA ASN 17 -4.149 -1.722 0.130
146 HB2 ASN 17 HB2 ASN 17 -2.148 -1.464 1.842
147 HB3 ASN 17 HB1 ASN 17 -3.026 -0.032 2.371
148 HD21 ASN 17 1HD2 ASN 17 -2.933 -1.767 4.388
149 HD22 ASN 17 2HD2 ASN 17 -4.342 -2.700 4.524
150 H PHE 18 HN PHE 18 -3.220 1.701 0.317
151 HA PHE 18 HA PHE 18 -5.740 2.840 1.080
152 HB2 PHE 18 HB2 PHE 18 -3.511 4.005 1.069
153 HB3 PHE 18 HB1 PHE 18 -3.490 3.900 -0.682
154 HD1 PHE 18 HD2 PHE 18 -5.379 5.355 2.190
155 HD2 PHE 18 HD1 PHE 18 -4.604 5.474 -2.034
156 HE1 PHE 18 HE2 PHE 18 -6.659 7.472 2.012
157 HE2 PHE 18 HE1 PHE 18 -5.884 7.589 -2.211
158 HZ PHE 18 HZ PHE 18 -6.912 8.589 -0.187
159 H ILE 19 HN ILE 19 -4.220 2.173 -2.084
160 HA ILE 19 HA ILE 19 -6.433 3.006 -3.720
161 HB ILE 19 HB ILE 19 -3.883 1.453 -4.036
162 HG12 ILE 19 2HG1 ILE 19 -4.063 3.315 -6.040
163 HG13 ILE 19 1HG1 ILE 19 -5.031 4.068 -4.777
164 HG21 ILE 19 1HG2 ILE 19 -6.110 1.510 -6.082
165 HG22 ILE 19 2HG2 ILE 19 -5.230 0.106 -5.476
166 HG23 ILE 19 3HG2 ILE 19 -4.420 1.269 -6.523
167 HD11 ILE 19 3HD1 ILE 19 -2.546 4.616 -4.748
168 HD12 ILE 19 1HD1 ILE 19 -2.274 2.943 -4.261
169 HD13 ILE 19 2HD1 ILE 19 -3.216 4.021 -3.230
170 H SER 20 HN SER 20 -5.581 -0.149 -2.243
171 HA SER 20 HA SER 20 -7.545 -1.737 -3.588
172 HB2 SER 20 HB2 SER 20 -5.547 -2.431 -2.072
173 HB3 SER 20 HB1 SER 20 -6.667 -2.187 -0.739
174 HG SER 20 HG SER 20 -8.078 -3.702 -1.820
175 H GLY 21 HN GLY 21 -7.776 0.247 -0.603
176 HA2 GLY 21 HA2 GLY 21 -10.400 -0.622 0.165
177 HA3 GLY 21 HA1 GLY 21 -9.654 0.911 0.640
178 H ILE 22 HN ILE 22 -9.222 2.100 -1.801
179 HA ILE 22 HA ILE 22 -11.762 3.259 -2.479
180 HB ILE 22 HB ILE 22 -9.085 3.200 -3.918
181 HG12 ILE 22 2HG1 ILE 22 -8.904 4.188 -1.688
182 HG13 ILE 22 1HG1 ILE 22 -8.749 5.437 -2.912
183 HG21 ILE 22 1HG2 ILE 22 -9.808 5.220 -5.092
184 HG22 ILE 22 2HG2 ILE 22 -11.389 5.126 -4.317
185 HG23 ILE 22 3HG2 ILE 22 -10.885 3.872 -5.451
186 HD11 ILE 22 3HD1 ILE 22 -11.412 5.581 -2.496
187 HD12 ILE 22 1HD1 ILE 22 -10.248 6.501 -1.544
188 HD13 ILE 22 2HD1 ILE 22 -10.908 4.993 -0.913
189 H GLN 23 HN GLN 23 -9.648 0.955 -4.210
190 HA GLN 23 HA GLN 23 -11.305 0.422 -6.455
191 HB2 GLN 23 HB2 GLN 23 -8.804 -0.224 -5.683
192 HB3 GLN 23 HB1 GLN 23 -9.608 -1.743 -5.318
193 HG2 GLN 23 HG2 GLN 23 -9.414 -2.285 -7.481
194 HG3 GLN 23 HG1 GLN 23 -10.550 -0.996 -7.868
195 HE21 GLN 23 1HE2 GLN 23 -7.030 -1.068 -6.903
196 HE22 GLN 23 2HE2 GLN 23 -6.546 -0.035 -8.160
197 H TYR 24 HN TYR 24 -11.147 -1.143 -3.304
198 HA TYR 24 HA TYR 24 -12.941 -3.317 -3.711
199 HB2 TYR 24 HB2 TYR 24 -11.521 -3.161 -1.756
200 HB3 TYR 24 HB1 TYR 24 -12.246 -1.629 -1.286
201 HD1 TYR 24 HD1 TYR 24 -13.009 -5.249 -1.794
202 HD2 TYR 24 HD2 TYR 24 -14.166 -1.564 0.085
203 HE1 TYR 24 HE1 TYR 24 -14.724 -6.459 -0.471
204 HE2 TYR 24 HE2 TYR 24 -15.877 -2.772 1.407
205 HH TYR 24 HH TYR 24 -15.960 -5.647 2.111
206 H LEU 25 HN LEU 25 -13.567 0.005 -2.551
207 HA LEU 25 HA LEU 25 -16.419 -0.252 -2.279
208 HB2 LEU 25 HB2 LEU 25 -14.343 1.833 -2.188
209 HB3 LEU 25 HB1 LEU 25 -15.889 2.419 -2.789
210 HG LEU 25 HG LEU 25 -16.773 0.953 -0.701
211 HD11 LEU 25 1HD1 LEU 25 -14.498 0.294 -0.023
212 HD12 LEU 25 2HD1 LEU 25 -15.270 1.283 1.215
213 HD13 LEU 25 3HD1 LEU 25 -14.056 1.992 0.152
214 HD21 LEU 25 3HD2 LEU 25 -15.646 3.753 -0.374
215 HD22 LEU 25 1HD2 LEU 25 -17.005 3.041 0.496
216 HD23 LEU 25 2HD2 LEU 25 -17.152 3.401 -1.223
217 H ALA 26 HN ALA 26 -14.345 0.745 -5.000
218 HA ALA 26 HA ALA 26 -16.311 1.733 -6.789
219 HB1 ALA 26 HB1 ALA 26 -13.748 1.728 -6.931
220 HB2 ALA 26 HB2 ALA 26 -14.618 1.450 -8.439
221 HB3 ALA 26 HB3 ALA 26 -13.897 0.093 -7.575
222 H GLY 27 HN GLY 27 -15.348 -1.623 -6.076
223 HA2 GLY 27 HA2 GLY 27 -17.175 -2.687 -8.138
224 HA3 GLY 27 HA1 GLY 27 -16.043 -3.623 -7.172
225 H LEU 28 HN LEU 28 -17.047 -2.377 -4.585
226 HA LEU 28 HA LEU 28 -19.552 -3.999 -4.397
227 HB2 LEU 28 HB2 LEU 28 -17.250 -3.372 -2.607
228 HB3 LEU 28 HB1 LEU 28 -18.806 -3.734 -1.871
229 HG LEU 28 HG LEU 28 -18.749 -5.751 -3.629
230 HD11 LEU 28 1HD1 LEU 28 -15.840 -5.096 -3.082
231 HD12 LEU 28 2HD1 LEU 28 -16.629 -5.191 -4.656
232 HD13 LEU 28 3HD1 LEU 28 -16.403 -6.650 -3.694
233 HD21 LEU 28 3HD2 LEU 28 -19.029 -6.192 -1.316
234 HD22 LEU 28 1HD2 LEU 28 -17.448 -5.525 -0.912
235 HD23 LEU 28 2HD2 LEU 28 -17.564 -7.073 -1.750
236 H SER 29 HN SER 29 -19.223 -0.927 -5.065
237 HA SER 29 HA SER 29 -20.402 1.026 -4.659
238 HB2 SER 29 HB2 SER 29 -22.153 -1.042 -4.658
239 HB3 SER 29 HB1 SER 29 -22.444 -0.404 -3.048
240 HG SER 29 HG SER 29 -22.779 0.787 -5.575
241 H THR 30 HN THR 30 -21.959 1.847 -2.408
242 HA THR 30 HA THR 30 -19.801 2.407 -0.482
243 HB THR 30 HB THR 30 -21.651 3.861 0.528
244 HG1 THR 30 HG1 THR 30 -23.359 2.640 -0.551
245 HG21 THR 30 3HG2 THR 30 -20.972 4.386 -2.366
246 HG22 THR 30 1HG2 THR 30 -19.875 4.675 -1.016
247 HG23 THR 30 2HG2 THR 30 -21.384 5.580 -1.135
Start of MODEL 11
1 H1 GLN 1 HT1 GLN 1 24.406 2.634 1.156
2 H2 GLN 1 HT2 GLN 1 23.507 3.705 2.122
3 H3 GLN 1 HT3 GLN 1 24.999 4.187 1.487
4 HA GLN 1 HA GLN 1 22.949 5.087 0.313
5 HB2 GLN 1 HB2 GLN 1 25.397 3.802 -0.744
6 HB3 GLN 1 HB1 GLN 1 24.164 4.169 -1.942
7 HG2 GLN 1 HG2 GLN 1 24.909 6.269 0.069
8 HG3 GLN 1 HG1 GLN 1 25.972 5.975 -1.300
9 HE21 GLN 1 1HE2 GLN 1 24.295 8.414 -0.777
10 HE22 GLN 1 2HE2 GLN 1 23.273 8.551 -2.124
11 H THR 2 HN THR 2 22.179 2.197 1.276
12 HA THR 2 HA THR 2 20.986 1.136 -1.211
13 HB THR 2 HB THR 2 20.015 -0.481 0.653
14 HG1 THR 2 HG1 THR 2 20.783 0.119 2.525
15 HG21 THR 2 3HG2 THR 2 21.823 -1.970 0.201
16 HG22 THR 2 1HG2 THR 2 22.919 -0.633 -0.150
17 HG23 THR 2 2HG2 THR 2 21.578 -0.987 -1.240
18 H ASN 3 HN ASN 3 18.980 1.548 -1.775
19 HA ASN 3 HA ASN 3 17.098 2.787 0.189
20 HB2 ASN 3 HB2 ASN 3 18.054 3.740 -2.265
21 HB3 ASN 3 HB1 ASN 3 16.401 3.216 -2.599
22 HD21 ASN 3 1HD2 ASN 3 18.263 5.746 -1.143
23 HD22 ASN 3 2HD2 ASN 3 16.964 6.551 -0.407
24 H TRP 4 HN TRP 4 17.506 0.088 -1.908
25 HA TRP 4 HA TRP 4 14.789 -0.625 -2.400
26 HB2 TRP 4 HB2 TRP 4 15.831 -2.397 -3.424
27 HB3 TRP 4 HB1 TRP 4 17.306 -1.542 -3.024
28 HD1 TRP 4 HD1 TRP 4 18.933 -2.662 -1.357
29 HE1 TRP 4 HE1 TRP 4 18.919 -4.888 -0.060
30 HE3 TRP 4 HE3 TRP 4 14.123 -4.130 -2.196
31 HZ2 TRP 4 HZ2 TRP 4 17.093 -7.022 0.545
32 HZ3 TRP 4 HZ3 TRP 4 13.271 -6.258 -1.254
33 HH2 TRP 4 HH2 TRP 4 14.743 -7.701 0.112
34 H GLN 5 HN GLN 5 16.949 -1.233 0.320
35 HA GLN 5 HA GLN 5 15.394 -2.951 1.926
36 HB2 GLN 5 HB2 GLN 5 16.532 -1.577 3.856
37 HB3 GLN 5 HB1 GLN 5 17.517 -2.568 2.799
38 HG2 GLN 5 HG2 GLN 5 18.575 -0.754 1.901
39 HG3 GLN 5 HG1 GLN 5 17.142 0.256 1.928
40 HE21 GLN 5 1HE2 GLN 5 16.443 0.650 4.502
41 HE22 GLN 5 2HE2 GLN 5 17.751 1.159 5.454
42 H LYS 6 HN LYS 6 15.355 0.620 1.839
43 HA LYS 6 HA LYS 6 13.125 0.888 3.680
44 HB2 LYS 6 HB2 LYS 6 14.923 2.588 2.072
45 HB3 LYS 6 HB1 LYS 6 13.294 3.240 2.226
46 HG2 LYS 6 HG2 LYS 6 13.409 3.383 4.547
47 HG3 LYS 6 HG1 LYS 6 14.670 2.159 4.665
48 HD2 LYS 6 HD2 LYS 6 16.271 3.748 3.611
49 HD3 LYS 6 HD1 LYS 6 15.008 4.982 3.610
50 HE2 LYS 6 HE2 LYS 6 14.819 4.478 6.165
51 HE3 LYS 6 HE1 LYS 6 16.421 3.746 5.974
52 HZ1 LYS 6 HZ1 LYS 6 16.457 6.160 6.522
53 HZ2 LYS 6 HZ2 LYS 6 15.750 6.480 5.013
54 HZ3 LYS 6 HZ3 LYS 6 17.289 5.762 5.105
55 H LEU 7 HN LEU 7 13.495 0.855 0.138
56 HA LEU 7 HA LEU 7 10.859 1.552 -0.635
57 HB2 LEU 7 HB2 LEU 7 12.930 1.361 -2.060
58 HB3 LEU 7 HB1 LEU 7 12.752 -0.390 -1.983
59 HG LEU 7 HG LEU 7 10.390 -0.052 -2.901
60 HD11 LEU 7 1HD1 LEU 7 10.114 2.065 -4.227
61 HD12 LEU 7 2HD1 LEU 7 11.565 2.694 -3.449
62 HD13 LEU 7 3HD1 LEU 7 10.133 2.333 -2.485
63 HD21 LEU 7 3HD2 LEU 7 12.836 0.664 -4.546
64 HD22 LEU 7 1HD2 LEU 7 11.268 0.254 -5.242
65 HD23 LEU 7 2HD2 LEU 7 12.152 -0.944 -4.300
66 H GLU 8 HN GLU 8 12.156 -1.614 0.438
67 HA GLU 8 HA GLU 8 9.816 -3.156 -0.330
68 HB2 GLU 8 HB2 GLU 8 12.390 -3.648 0.697
69 HB3 GLU 8 HB1 GLU 8 11.307 -4.157 1.988
70 HG2 GLU 8 HG2 GLU 8 10.719 -5.010 -0.832
71 HG3 GLU 8 HG1 GLU 8 11.959 -5.854 0.089
72 H VAL 9 HN VAL 9 10.937 -1.655 2.703
73 HA VAL 9 HA VAL 9 8.672 -2.327 4.347
74 HB VAL 9 HB VAL 9 10.601 0.034 4.451
75 HG11 VAL 9 1HG1 VAL 9 8.703 -1.113 6.516
76 HG12 VAL 9 2HG1 VAL 9 8.729 0.531 5.877
77 HG13 VAL 9 3HG1 VAL 9 10.035 -0.030 6.921
78 HG21 VAL 9 3HG2 VAL 9 11.790 -1.361 6.139
79 HG22 VAL 9 1HG2 VAL 9 11.774 -2.118 4.548
80 HG23 VAL 9 2HG2 VAL 9 10.673 -2.685 5.802
81 H PHE 10 HN PHE 10 9.392 0.306 2.109
82 HA PHE 10 HA PHE 10 7.065 1.958 2.610
83 HB2 PHE 10 HB2 PHE 10 8.953 2.990 1.558
84 HB3 PHE 10 HB1 PHE 10 9.166 1.643 0.458
85 HD1 PHE 10 HD2 PHE 10 6.901 4.490 1.265
86 HD2 PHE 10 HD1 PHE 10 8.127 1.599 -1.667
87 HE1 PHE 10 HE2 PHE 10 5.533 5.649 -0.451
88 HE2 PHE 10 HE1 PHE 10 6.759 2.756 -3.381
89 HZ PHE 10 HZ PHE 10 5.463 4.780 -2.773
90 H TRP 11 HN TRP 11 7.963 -0.503 0.192
91 HA TRP 11 HA TRP 11 5.764 -0.556 -1.496
92 HB2 TRP 11 HB2 TRP 11 8.024 -2.105 -1.080
93 HB3 TRP 11 HB1 TRP 11 6.720 -3.231 -0.770
94 HD1 TRP 11 HD1 TRP 11 8.671 -3.378 -3.227
95 HE1 TRP 11 HE1 TRP 11 7.713 -3.360 -5.627
96 HE3 TRP 11 HE3 TRP 11 4.110 -1.246 -2.357
97 HZ2 TRP 11 HZ2 TRP 11 5.339 -2.550 -6.984
98 HZ3 TRP 11 HZ3 TRP 11 2.529 -0.865 -4.205
99 HH2 TRP 11 HH2 TRP 11 3.128 -1.512 -6.523
100 H ALA 12 HN ALA 12 6.136 -2.699 1.399
101 HA ALA 12 HA ALA 12 3.561 -3.842 1.240
102 HB1 ALA 12 HB1 ALA 12 5.531 -4.491 2.740
103 HB2 ALA 12 HB2 ALA 12 3.938 -4.569 3.495
104 HB3 ALA 12 HB3 ALA 12 5.004 -3.205 3.829
105 H LYS 13 HN LYS 13 4.564 -0.822 2.878
106 HA LYS 13 HA LYS 13 1.980 -0.218 4.034
107 HB2 LYS 13 HB2 LYS 13 4.470 0.704 4.374
108 HB3 LYS 13 HB1 LYS 13 3.919 1.920 3.224
109 HG2 LYS 13 HG2 LYS 13 2.198 2.670 4.653
110 HG3 LYS 13 HG1 LYS 13 2.267 1.220 5.651
111 HD2 LYS 13 HD2 LYS 13 4.596 3.141 5.446
112 HD3 LYS 13 HD1 LYS 13 3.313 3.344 6.633
113 HE2 LYS 13 HE2 LYS 13 4.498 1.953 7.972
114 HE3 LYS 13 HE1 LYS 13 4.019 0.643 6.881
115 HZ1 LYS 13 HZ1 LYS 13 5.954 1.267 5.458
116 HZ2 LYS 13 HZ2 LYS 13 6.385 0.669 6.984
117 HZ3 LYS 13 HZ3 LYS 13 6.456 2.335 6.673
118 H HIS 14 HN HIS 14 3.601 0.670 0.990
119 HA HIS 14 HA HIS 14 1.566 2.421 -0.056
120 HB2 HIS 14 HB2 HIS 14 4.004 2.214 -0.732
121 HB3 HIS 14 HB1 HIS 14 3.592 0.700 -1.529
122 HD1 HIS 14 HD1 HIS 14 3.266 4.389 -1.834
123 HD2 HIS 14 HD2 HIS 14 1.949 1.012 -3.881
124 HE1 HIS 14 HE1 HIS 14 2.379 5.208 -4.062
125 H MET 15 HN MET 15 2.357 -1.003 -0.732
126 HA MET 15 HA MET 15 0.144 -1.553 -2.464
127 HB2 MET 15 HB2 MET 15 2.427 -2.864 -1.472
128 HB3 MET 15 HB1 MET 15 1.081 -3.864 -0.942
129 HG2 MET 15 HG2 MET 15 0.823 -2.913 -3.714
130 HG3 MET 15 HG1 MET 15 2.233 -3.929 -3.447
131 HE1 MET 15 HE1 MET 15 0.138 -6.567 -5.001
132 HE2 MET 15 HE2 MET 15 1.507 -5.463 -5.063
133 HE3 MET 15 HE3 MET 15 -0.103 -4.866 -5.444
134 H TRP 16 HN TRP 16 0.511 -1.915 1.093
135 HA TRP 16 HA TRP 16 -2.043 -3.172 1.501
136 HB2 TRP 16 HB2 TRP 16 -0.048 -2.989 3.125
137 HB3 TRP 16 HB1 TRP 16 -0.626 -1.355 3.473
138 HD1 TRP 16 HD1 TRP 16 -1.914 -1.425 5.653
139 HE1 TRP 16 HE1 TRP 16 -3.702 -2.959 6.702
140 HE3 TRP 16 HE3 TRP 16 -2.139 -5.050 2.085
141 HZ2 TRP 16 HZ2 TRP 16 -5.056 -5.419 6.091
142 HZ3 TRP 16 HZ3 TRP 16 -3.676 -6.976 2.331
143 HH2 TRP 16 HH2 TRP 16 -5.132 -7.165 4.326
144 H ASN 17 HN ASN 17 -0.986 0.214 1.311
145 HA ASN 17 HA ASN 17 -3.449 1.465 2.097
146 HB2 ASN 17 HB2 ASN 17 -1.061 2.454 1.754
147 HB3 ASN 17 HB1 ASN 17 -1.484 2.522 0.047
148 HD21 ASN 17 1HD2 ASN 17 -1.503 4.903 0.039
149 HD22 ASN 17 2HD2 ASN 17 -2.746 5.760 0.811
150 H PHE 18 HN PHE 18 -2.143 0.404 -1.041
151 HA PHE 18 HA PHE 18 -4.186 1.284 -2.808
152 HB2 PHE 18 HB2 PHE 18 -2.068 0.432 -3.587
153 HB3 PHE 18 HB1 PHE 18 -2.281 -1.073 -2.720
154 HD1 PHE 18 HD2 PHE 18 -3.632 0.954 -5.545
155 HD2 PHE 18 HD1 PHE 18 -3.336 -2.935 -3.741
156 HE1 PHE 18 HE2 PHE 18 -4.650 -0.064 -7.564
157 HE2 PHE 18 HE1 PHE 18 -4.351 -3.949 -5.760
158 HZ PHE 18 HZ PHE 18 -5.009 -2.513 -7.672
159 H ILE 19 HN ILE 19 -3.910 -1.579 -0.751
160 HA ILE 19 HA ILE 19 -6.321 -2.928 -1.593
161 HB ILE 19 HB ILE 19 -4.154 -3.159 0.411
162 HG12 ILE 19 2HG1 ILE 19 -5.200 -5.666 -0.398
163 HG13 ILE 19 1HG1 ILE 19 -5.263 -4.609 -1.805
164 HG21 ILE 19 1HG2 ILE 19 -6.886 -4.279 1.037
165 HG22 ILE 19 2HG2 ILE 19 -5.851 -3.291 2.068
166 HG23 ILE 19 3HG2 ILE 19 -5.394 -4.949 1.695
167 HD11 ILE 19 3HD1 ILE 19 -2.954 -4.239 -1.796
168 HD12 ILE 19 1HD1 ILE 19 -3.068 -5.935 -1.326
169 HD13 ILE 19 2HD1 ILE 19 -2.786 -4.698 -0.100
170 H SER 20 HN SER 20 -5.534 -0.717 1.124
171 HA SER 20 HA SER 20 -8.041 -0.746 2.461
172 HB2 SER 20 HB2 SER 20 -5.954 1.428 2.116
173 HB3 SER 20 HB1 SER 20 -7.299 1.536 3.238
174 HG SER 20 HG SER 20 -6.480 -0.388 4.228
175 H GLY 21 HN GLY 21 -6.948 1.200 -0.331
176 HA2 GLY 21 HA2 GLY 21 -9.257 2.891 -0.508
177 HA3 GLY 21 HA1 GLY 21 -8.122 2.566 -1.822
178 H ILE 22 HN ILE 22 -8.362 -0.136 -2.208
179 HA ILE 22 HA ILE 22 -10.782 -0.398 -3.728
180 HB ILE 22 HB ILE 22 -8.704 -2.386 -2.753
181 HG12 ILE 22 2HG1 ILE 22 -9.217 -1.368 -5.558
182 HG13 ILE 22 1HG1 ILE 22 -8.144 -0.528 -4.442
183 HG21 ILE 22 1HG2 ILE 22 -11.227 -2.820 -4.295
184 HG22 ILE 22 2HG2 ILE 22 -10.368 -3.911 -3.209
185 HG23 ILE 22 3HG2 ILE 22 -9.784 -3.669 -4.853
186 HD11 ILE 22 3HD1 ILE 22 -7.526 -3.357 -4.476
187 HD12 ILE 22 1HD1 ILE 22 -6.487 -1.982 -4.846
188 HD13 ILE 22 2HD1 ILE 22 -7.486 -2.698 -6.110
189 H GLN 23 HN GLN 23 -9.856 -1.660 -0.511
190 HA GLN 23 HA GLN 23 -12.159 -3.207 0.058
191 HB2 GLN 23 HB2 GLN 23 -9.816 -2.510 1.333
192 HB3 GLN 23 HB1 GLN 23 -11.020 -1.685 2.312
193 HG2 GLN 23 HG2 GLN 23 -11.007 -3.731 3.361
194 HG3 GLN 23 HG1 GLN 23 -12.251 -4.049 2.154
195 HE21 GLN 23 1HE2 GLN 23 -11.780 -5.650 0.527
196 HE22 GLN 23 2HE2 GLN 23 -10.307 -6.487 0.469
197 H TYR 24 HN TYR 24 -11.638 0.242 0.317
198 HA TYR 24 HA TYR 24 -14.124 0.855 1.704
199 HB2 TYR 24 HB2 TYR 24 -12.057 2.169 1.911
200 HB3 TYR 24 HB1 TYR 24 -12.154 2.599 0.204
201 HD1 TYR 24 HD2 TYR 24 -13.989 2.847 3.450
202 HD2 TYR 24 HD1 TYR 24 -13.503 4.385 -0.533
203 HE1 TYR 24 HE2 TYR 24 -15.513 4.729 3.988
204 HE2 TYR 24 HE1 TYR 24 -15.029 6.264 0.006
205 HH TYR 24 HH TYR 24 -15.688 7.371 2.691
206 H LEU 25 HN LEU 25 -13.448 0.207 -1.656
207 HA LEU 25 HA LEU 25 -16.030 1.541 -2.397
208 HB2 LEU 25 HB2 LEU 25 -13.363 1.331 -3.744
209 HB3 LEU 25 HB1 LEU 25 -14.813 1.466 -4.738
210 HG LEU 25 HG LEU 25 -15.171 3.383 -2.724
211 HD11 LEU 25 1HD1 LEU 25 -12.323 3.416 -3.760
212 HD12 LEU 25 2HD1 LEU 25 -12.828 3.202 -2.086
213 HD13 LEU 25 3HD1 LEU 25 -13.099 4.744 -2.896
214 HD21 LEU 25 3HD2 LEU 25 -14.236 3.563 -5.603
215 HD22 LEU 25 1HD2 LEU 25 -14.678 4.979 -4.648
216 HD23 LEU 25 2HD2 LEU 25 -15.880 3.738 -4.990
217 H ALA 26 HN ALA 26 -13.905 -1.208 -3.350
218 HA ALA 26 HA ALA 26 -15.810 -2.593 -4.938
219 HB1 ALA 26 HB1 ALA 26 -14.366 -4.546 -4.515
220 HB2 ALA 26 HB2 ALA 26 -13.591 -3.689 -3.185
221 HB3 ALA 26 HB3 ALA 26 -13.402 -3.106 -4.839
222 H GLY 27 HN GLY 27 -15.472 -2.470 -1.401
223 HA2 GLY 27 HA2 GLY 27 -17.714 -4.418 -1.136
224 HA3 GLY 27 HA1 GLY 27 -16.513 -4.103 0.110
225 H LEU 28 HN LEU 28 -17.509 -1.150 -1.354
226 HA LEU 28 HA LEU 28 -19.528 -0.705 0.817
227 HB2 LEU 28 HB2 LEU 28 -16.980 0.351 0.536
228 HB3 LEU 28 HB1 LEU 28 -17.999 1.617 -0.136
229 HG LEU 28 HG LEU 28 -18.887 0.397 2.435
230 HD11 LEU 28 1HD1 LEU 28 -16.642 0.610 3.086
231 HD12 LEU 28 2HD1 LEU 28 -17.334 2.159 3.565
232 HD13 LEU 28 3HD1 LEU 28 -16.387 2.037 2.082
233 HD21 LEU 28 3HD2 LEU 28 -19.765 2.564 2.823
234 HD22 LEU 28 1HD2 LEU 28 -19.964 2.348 1.085
235 HD23 LEU 28 2HD2 LEU 28 -18.631 3.320 1.705
236 H SER 29 HN SER 29 -20.077 -1.559 -1.921
237 HA SER 29 HA SER 29 -21.984 0.509 -2.727
238 HB2 SER 29 HB2 SER 29 -20.045 1.441 -3.778
239 HB3 SER 29 HB1 SER 29 -19.474 -0.137 -4.286
240 HG SER 29 HG SER 29 -21.701 1.360 -5.247
241 H THR 30 HN THR 30 -20.241 -2.281 -4.186
242 HA THR 30 HA THR 30 -22.859 -3.680 -4.507
243 HB THR 30 HB THR 30 -22.020 -2.438 -6.526
244 HG1 THR 30 HG1 THR 30 -22.295 -5.250 -6.630
245 HG21 THR 30 3HG2 THR 30 -20.190 -4.326 -7.549
246 HG22 THR 30 1HG2 THR 30 -19.602 -3.900 -5.942
247 HG23 THR 30 2HG2 THR 30 -19.877 -2.640 -7.142
Start of MODEL 12
1 H1 GLN 1 HT1 GLN 1 21.898 2.290 2.725
2 H2 GLN 1 HT2 GLN 1 23.035 1.404 1.823
3 H3 GLN 1 HT3 GLN 1 21.547 0.704 2.252
4 HA GLN 1 HA GLN 1 20.345 2.229 0.835
5 HB2 GLN 1 HB2 GLN 1 23.096 3.419 0.740
6 HB3 GLN 1 HB1 GLN 1 22.079 3.585 -0.686
7 HG2 GLN 1 HG2 GLN 1 21.019 4.293 2.049
8 HG3 GLN 1 HG1 GLN 1 21.965 5.449 1.115
9 HE21 GLN 1 1HE2 GLN 1 20.985 6.372 -0.822
10 HE22 GLN 1 2HE2 GLN 1 19.352 6.109 -1.198
11 H THR 2 HN THR 2 19.729 0.505 -0.294
12 HA THR 2 HA THR 2 21.268 -0.349 -2.638
13 HB THR 2 HB THR 2 22.281 -1.734 -0.962
14 HG1 THR 2 HG1 THR 2 21.861 -3.664 -1.812
15 HG21 THR 2 3HG2 THR 2 21.216 -2.057 0.992
16 HG22 THR 2 1HG2 THR 2 20.305 -3.332 0.184
17 HG23 THR 2 2HG2 THR 2 19.644 -1.702 0.278
18 H ASN 3 HN ASN 3 19.172 -2.772 -1.880
19 HA ASN 3 HA ASN 3 17.140 -1.894 -3.771
20 HB2 ASN 3 HB2 ASN 3 16.225 -4.096 -3.436
21 HB3 ASN 3 HB1 ASN 3 17.979 -4.255 -3.444
22 HD21 ASN 3 1HD2 ASN 3 15.121 -4.773 -1.543
23 HD22 ASN 3 2HD2 ASN 3 15.902 -5.287 -0.127
24 H TRP 4 HN TRP 4 17.519 -1.439 -0.404
25 HA TRP 4 HA TRP 4 14.871 -1.454 0.595
26 HB2 TRP 4 HB2 TRP 4 17.462 -0.132 1.266
27 HB3 TRP 4 HB1 TRP 4 16.018 0.605 1.949
28 HD1 TRP 4 HD1 TRP 4 18.300 -2.339 2.305
29 HE1 TRP 4 HE1 TRP 4 17.496 -3.840 4.239
30 HE3 TRP 4 HE3 TRP 4 13.720 -0.253 3.202
31 HZ2 TRP 4 HZ2 TRP 4 15.210 -4.121 5.944
32 HZ3 TRP 4 HZ3 TRP 4 12.257 -1.155 4.980
33 HH2 TRP 4 HH2 TRP 4 12.992 -3.083 6.351
34 H GLN 5 HN GLN 5 16.682 1.145 -1.071
35 HA GLN 5 HA GLN 5 14.783 3.245 -0.982
36 HB2 GLN 5 HB2 GLN 5 17.053 2.385 -2.701
37 HB3 GLN 5 HB1 GLN 5 15.917 3.482 -3.473
38 HG2 GLN 5 HG2 GLN 5 16.710 4.246 -0.726
39 HG3 GLN 5 HG1 GLN 5 18.005 4.287 -1.916
40 HE21 GLN 5 1HE2 GLN 5 15.599 6.228 -0.598
41 HE22 GLN 5 2HE2 GLN 5 15.411 7.310 -1.892
42 H LYS 6 HN LYS 6 15.139 0.599 -3.360
43 HA LYS 6 HA LYS 6 12.825 1.255 -4.963
44 HB2 LYS 6 HB2 LYS 6 14.684 -1.085 -4.602
45 HB3 LYS 6 HB1 LYS 6 13.224 -1.294 -5.559
46 HG2 LYS 6 HG2 LYS 6 13.977 0.850 -6.808
47 HG3 LYS 6 HG1 LYS 6 15.550 0.554 -6.068
48 HD2 LYS 6 HD2 LYS 6 14.944 -1.937 -7.026
49 HD3 LYS 6 HD1 LYS 6 14.182 -0.915 -8.239
50 HE2 LYS 6 HE2 LYS 6 16.906 -0.046 -7.473
51 HE3 LYS 6 HE1 LYS 6 16.832 -1.623 -8.273
52 HZ1 LYS 6 HZ1 LYS 6 15.475 0.824 -9.285
53 HZ2 LYS 6 HZ2 LYS 6 15.565 -0.688 -10.059
54 HZ3 LYS 6 HZ3 LYS 6 16.963 0.251 -9.852
55 H LEU 7 HN LEU 7 13.400 -0.938 -2.216
56 HA LEU 7 HA LEU 7 10.859 -2.248 -2.145
57 HB2 LEU 7 HB2 LEU 7 13.041 -2.892 -1.028
58 HB3 LEU 7 HB1 LEU 7 12.725 -1.625 0.154
59 HG LEU 7 HG LEU 7 10.411 -2.819 0.438
60 HD11 LEU 7 1HD1 LEU 7 12.114 -5.072 -0.669
61 HD12 LEU 7 2HD1 LEU 7 10.721 -4.355 -1.480
62 HD13 LEU 7 3HD1 LEU 7 10.504 -5.234 0.032
63 HD21 LEU 7 3HD2 LEU 7 11.638 -4.520 2.003
64 HD22 LEU 7 1HD2 LEU 7 11.833 -2.796 2.306
65 HD23 LEU 7 2HD2 LEU 7 13.104 -3.694 1.476
66 H GLU 8 HN GLU 8 11.979 0.819 -0.652
67 HA GLU 8 HA GLU 8 9.654 1.210 1.010
68 HB2 GLU 8 HB2 GLU 8 11.696 3.123 -0.175
69 HB3 GLU 8 HB1 GLU 8 10.499 3.594 1.030
70 HG2 GLU 8 HG2 GLU 8 12.353 1.268 1.529
71 HG3 GLU 8 HG1 GLU 8 12.871 2.916 1.854
72 H VAL 9 HN VAL 9 10.497 2.278 -2.298
73 HA VAL 9 HA VAL 9 8.066 3.763 -2.802
74 HB VAL 9 HB VAL 9 10.039 2.326 -4.639
75 HG11 VAL 9 1HG1 VAL 9 7.883 2.730 -5.790
76 HG12 VAL 9 2HG1 VAL 9 9.163 3.751 -6.442
77 HG13 VAL 9 3HG1 VAL 9 7.968 4.433 -5.339
78 HG21 VAL 9 3HG2 VAL 9 9.782 5.236 -3.818
79 HG22 VAL 9 1HG2 VAL 9 10.926 4.617 -5.009
80 HG23 VAL 9 2HG2 VAL 9 11.061 4.127 -3.322
81 H PHE 10 HN PHE 10 9.131 0.422 -3.398
82 HA PHE 10 HA PHE 10 6.807 -0.661 -4.639
83 HB2 PHE 10 HB2 PHE 10 8.834 -1.930 -4.639
84 HB3 PHE 10 HB1 PHE 10 9.055 -1.713 -2.914
85 HD1 PHE 10 HD2 PHE 10 6.659 -3.241 -5.352
86 HD2 PHE 10 HD1 PHE 10 8.429 -3.414 -1.444
87 HE1 PHE 10 HE2 PHE 10 5.496 -5.393 -4.923
88 HE2 PHE 10 HE1 PHE 10 7.267 -5.565 -1.014
89 HZ PHE 10 HZ PHE 10 5.803 -6.553 -2.750
90 H TRP 11 HN TRP 11 7.780 -0.431 -1.227
91 HA TRP 11 HA TRP 11 5.644 -1.719 0.074
92 HB2 TRP 11 HB2 TRP 11 7.901 -0.238 0.783
93 HB3 TRP 11 HB1 TRP 11 6.577 0.717 1.413
94 HD1 TRP 11 HD1 TRP 11 8.767 -1.007 3.020
95 HE1 TRP 11 HE1 TRP 11 7.931 -2.701 4.790
96 HE3 TRP 11 HE3 TRP 11 3.962 -1.647 1.426
97 HZ2 TRP 11 HZ2 TRP 11 5.535 -4.126 5.429
98 HZ3 TRP 11 HZ3 TRP 11 2.430 -3.164 2.621
99 HH2 TRP 11 HH2 TRP 11 3.200 -4.406 4.619
100 H ALA 12 HN ALA 12 6.036 1.780 -0.643
101 HA ALA 12 HA ALA 12 3.598 2.692 0.384
102 HB1 ALA 12 HB1 ALA 12 4.018 4.678 -0.864
103 HB2 ALA 12 HB2 ALA 12 4.861 3.791 -2.132
104 HB3 ALA 12 HB3 ALA 12 5.613 3.992 -0.548
105 H LYS 13 HN LYS 13 4.271 1.327 -2.837
106 HA LYS 13 HA LYS 13 1.703 1.796 -4.035
107 HB2 LYS 13 HB2 LYS 13 3.642 1.247 -5.363
108 HB3 LYS 13 HB1 LYS 13 3.938 -0.220 -4.444
109 HG2 LYS 13 HG2 LYS 13 1.668 -1.045 -5.324
110 HG3 LYS 13 HG1 LYS 13 1.731 0.317 -6.440
111 HD2 LYS 13 HD2 LYS 13 2.710 -1.365 -7.712
112 HD3 LYS 13 HD1 LYS 13 4.123 -0.587 -7.008
113 HE2 LYS 13 HE2 LYS 13 4.649 -2.412 -5.733
114 HE3 LYS 13 HE1 LYS 13 2.955 -2.767 -5.360
115 HZ1 LYS 13 HZ1 LYS 13 4.243 -3.254 -8.006
116 HZ2 LYS 13 HZ2 LYS 13 2.643 -3.630 -7.570
117 HZ3 LYS 13 HZ3 LYS 13 3.938 -4.443 -6.837
118 H HIS 14 HN HIS 14 3.044 -0.941 -2.175
119 HA HIS 14 HA HIS 14 0.670 -2.593 -2.245
120 HB2 HIS 14 HB2 HIS 14 3.066 -3.303 -1.795
121 HB3 HIS 14 HB1 HIS 14 2.929 -2.539 -0.213
122 HD1 HIS 14 HD1 HIS 14 2.014 -5.594 -2.084
123 HD2 HIS 14 HD2 HIS 14 0.962 -3.805 1.532
124 HE1 HIS 14 HE1 HIS 14 0.808 -7.362 -0.735
125 H MET 15 HN MET 15 2.003 -0.280 0.150
126 HA MET 15 HA MET 15 -0.039 -0.618 2.139
127 HB2 MET 15 HB2 MET 15 2.294 0.542 2.242
128 HB3 MET 15 HB1 MET 15 1.460 1.954 1.596
129 HG2 MET 15 HG2 MET 15 0.962 2.452 3.739
130 HG3 MET 15 HG1 MET 15 -0.220 1.151 3.646
131 HE1 MET 15 HE1 MET 15 0.000 -1.131 4.528
132 HE2 MET 15 HE2 MET 15 1.447 -1.880 5.194
133 HE3 MET 15 HE3 MET 15 1.388 -1.482 3.481
134 H TRP 16 HN TRP 16 0.272 1.715 -0.587
135 HA TRP 16 HA TRP 16 -2.228 3.046 -0.048
136 HB2 TRP 16 HB2 TRP 16 -0.099 3.601 -1.624
137 HB3 TRP 16 HB1 TRP 16 -1.176 2.919 -2.842
138 HD1 TRP 16 HD1 TRP 16 -2.134 4.969 -4.043
139 HE1 TRP 16 HE1 TRP 16 -3.367 7.110 -3.310
140 HE3 TRP 16 HE3 TRP 16 -1.696 4.531 1.008
141 HZ2 TRP 16 HZ2 TRP 16 -4.077 8.464 -0.877
142 HZ3 TRP 16 HZ3 TRP 16 -2.654 6.250 2.519
143 HH2 TRP 16 HH2 TRP 16 -3.842 8.213 1.583
144 H ASN 17 HN ASN 17 -1.332 0.154 -1.864
145 HA ASN 17 HA ASN 17 -3.800 -0.226 -3.277
146 HB2 ASN 17 HB2 ASN 17 -1.827 -1.474 -3.940
147 HB3 ASN 17 HB1 ASN 17 -1.556 -2.029 -2.299
148 HD21 ASN 17 1HD2 ASN 17 -4.288 -2.232 -4.706
149 HD22 ASN 17 2HD2 ASN 17 -4.589 -3.868 -4.381
150 H PHE 18 HN PHE 18 -2.570 -1.282 -0.097
151 HA PHE 18 HA PHE 18 -4.819 -2.792 0.810
152 HB2 PHE 18 HB2 PHE 18 -2.533 -2.663 1.859
153 HB3 PHE 18 HB1 PHE 18 -2.874 -1.005 2.324
154 HD1 PHE 18 HD2 PHE 18 -3.943 -4.540 2.859
155 HD2 PHE 18 HD1 PHE 18 -4.191 -0.472 4.222
156 HE1 PHE 18 HE2 PHE 18 -5.056 -5.300 4.936
157 HE2 PHE 18 HE1 PHE 18 -5.304 -1.235 6.299
158 HZ PHE 18 HZ PHE 18 -5.738 -3.651 6.657
159 H ILE 19 HN ILE 19 -3.977 0.656 1.070
160 HA ILE 19 HA ILE 19 -6.268 1.590 2.500
161 HB ILE 19 HB ILE 19 -4.133 2.756 0.736
162 HG12 ILE 19 2HG1 ILE 19 -3.583 2.157 3.043
163 HG13 ILE 19 1HG1 ILE 19 -3.503 3.899 2.819
164 HG21 ILE 19 1HG2 ILE 19 -5.795 4.276 0.118
165 HG22 ILE 19 2HG2 ILE 19 -5.032 5.055 1.502
166 HG23 ILE 19 3HG2 ILE 19 -6.573 4.222 1.699
167 HD11 ILE 19 3HD1 ILE 19 -6.024 3.791 3.652
168 HD12 ILE 19 1HD1 ILE 19 -4.692 3.782 4.807
169 HD13 ILE 19 2HD1 ILE 19 -5.486 2.272 4.366
170 H SER 20 HN SER 20 -5.620 1.373 -1.028
171 HA SER 20 HA SER 20 -8.118 2.540 -1.849
172 HB2 SER 20 HB2 SER 20 -5.913 0.952 -3.100
173 HB3 SER 20 HB1 SER 20 -7.434 1.078 -3.975
174 HG SER 20 HG SER 20 -5.519 2.873 -3.829
175 H GLY 21 HN GLY 21 -7.228 -0.785 -0.964
176 HA2 GLY 21 HA2 GLY 21 -9.616 -2.039 -1.993
177 HA3 GLY 21 HA1 GLY 21 -8.500 -2.740 -0.818
178 H ILE 22 HN ILE 22 -8.610 -0.902 1.254
179 HA ILE 22 HA ILE 22 -11.011 -1.623 2.639
180 HB ILE 22 HB ILE 22 -8.945 0.539 3.136
181 HG12 ILE 22 2HG1 ILE 22 -8.069 -1.783 3.140
182 HG13 ILE 22 1HG1 ILE 22 -7.986 -1.047 4.732
183 HG21 ILE 22 1HG2 ILE 22 -10.607 1.288 4.540
184 HG22 ILE 22 2HG2 ILE 22 -9.849 0.097 5.597
185 HG23 ILE 22 3HG2 ILE 22 -11.326 -0.311 4.726
186 HD11 ILE 22 3HD1 ILE 22 -9.976 -2.273 5.444
187 HD12 ILE 22 1HD1 ILE 22 -8.793 -3.405 4.790
188 HD13 ILE 22 2HD1 ILE 22 -10.187 -2.930 3.821
189 H GLN 23 HN GLN 23 -10.138 1.318 0.812
190 HA GLN 23 HA GLN 23 -12.314 2.973 1.532
191 HB2 GLN 23 HB2 GLN 23 -10.207 3.477 0.171
192 HB3 GLN 23 HB1 GLN 23 -11.078 2.824 -1.214
193 HG2 GLN 23 HG2 GLN 23 -11.609 5.067 -1.408
194 HG3 GLN 23 HG1 GLN 23 -12.964 4.512 -0.428
195 HE21 GLN 23 1HE2 GLN 23 -10.011 6.468 -0.371
196 HE22 GLN 23 2HE2 GLN 23 -10.255 7.087 1.190
197 H TYR 24 HN TYR 24 -12.261 0.216 -0.604
198 HA TYR 24 HA TYR 24 -14.694 0.739 -2.056
199 HB2 TYR 24 HB2 TYR 24 -12.880 -0.869 -2.698
200 HB3 TYR 24 HB1 TYR 24 -13.388 -1.913 -1.373
201 HD1 TYR 24 HD1 TYR 24 -15.161 0.042 -4.062
202 HD2 TYR 24 HD2 TYR 24 -14.636 -3.737 -2.083
203 HE1 TYR 24 HE1 TYR 24 -16.908 -0.957 -5.506
204 HE2 TYR 24 HE2 TYR 24 -16.383 -4.734 -3.527
205 HH TYR 24 HH TYR 24 -17.297 -3.907 -6.147
206 H LEU 25 HN LEU 25 -14.051 -0.829 1.080
207 HA LEU 25 HA LEU 25 -16.961 -1.394 1.409
208 HB2 LEU 25 HB2 LEU 25 -14.398 -2.508 2.455
209 HB3 LEU 25 HB1 LEU 25 -15.785 -2.553 3.538
210 HG LEU 25 HG LEU 25 -17.034 -3.482 1.397
211 HD11 LEU 25 1HD1 LEU 25 -14.162 -4.319 0.896
212 HD12 LEU 25 2HD1 LEU 25 -15.058 -3.155 -0.080
213 HD13 LEU 25 3HD1 LEU 25 -15.577 -4.839 -0.018
214 HD21 LEU 25 3HD2 LEU 25 -16.549 -5.753 2.164
215 HD22 LEU 25 1HD2 LEU 25 -16.658 -4.683 3.561
216 HD23 LEU 25 2HD2 LEU 25 -15.080 -5.198 2.966
217 H ALA 26 HN ALA 26 -14.210 0.119 3.174
218 HA ALA 26 HA ALA 26 -15.741 1.191 5.341
219 HB1 ALA 26 HB1 ALA 26 -13.792 2.637 5.668
220 HB2 ALA 26 HB2 ALA 26 -13.243 2.311 4.023
221 HB3 ALA 26 HB3 ALA 26 -13.248 1.019 5.224
222 H GLY 27 HN GLY 27 -14.997 2.465 2.095
223 HA2 GLY 27 HA2 GLY 27 -16.473 4.958 2.603
224 HA3 GLY 27 HA1 GLY 27 -15.585 4.550 1.139
225 H LEU 28 HN LEU 28 -17.077 1.808 1.090
226 HA LEU 28 HA LEU 28 -19.708 2.887 0.150
227 HB2 LEU 28 HB2 LEU 28 -17.535 1.723 -1.282
228 HB3 LEU 28 HB1 LEU 28 -18.906 0.626 -1.389
229 HG LEU 28 HG LEU 28 -19.611 3.470 -1.749
230 HD11 LEU 28 1HD1 LEU 28 -17.942 2.050 -3.845
231 HD12 LEU 28 2HD1 LEU 28 -17.384 3.396 -2.852
232 HD13 LEU 28 3HD1 LEU 28 -18.694 3.638 -4.006
233 HD21 LEU 28 3HD2 LEU 28 -20.137 0.867 -3.218
234 HD22 LEU 28 1HD2 LEU 28 -20.803 2.419 -3.728
235 HD23 LEU 28 2HD2 LEU 28 -21.247 1.741 -2.162
236 H SER 29 HN SER 29 -19.577 1.856 2.702
237 HA SER 29 HA SER 29 -20.666 0.413 4.144
238 HB2 SER 29 HB2 SER 29 -22.349 0.883 2.167
239 HB3 SER 29 HB1 SER 29 -22.113 -0.830 1.854
240 HG SER 29 HG SER 29 -23.142 -1.279 3.669
241 H THR 30 HN THR 30 -21.118 -1.870 4.671
242 HA THR 30 HA THR 30 -20.667 -4.127 4.859
243 HB THR 30 HB THR 30 -18.829 -3.915 2.463
244 HG1 THR 30 HG1 THR 30 -20.590 -3.438 1.426
245 HG21 THR 30 3HG2 THR 30 -18.713 -5.990 3.791
246 HG22 THR 30 1HG2 THR 30 -19.396 -6.280 2.190
247 HG23 THR 30 2HG2 THR 30 -20.454 -6.200 3.600
Start of MODEL 13
1 H1 GLN 1 HT1 GLN 1 -23.208 -1.586 1.143
2 H2 GLN 1 HT2 GLN 1 -23.875 -2.069 -0.344
3 H3 GLN 1 HT3 GLN 1 -22.993 -0.622 -0.229
4 HA GLN 1 HA GLN 1 -20.958 -1.842 0.252
5 HB2 GLN 1 HB2 GLN 1 -22.609 -3.701 1.238
6 HB3 GLN 1 HB1 GLN 1 -22.397 -4.394 -0.367
7 HG2 GLN 1 HG2 GLN 1 -19.895 -3.494 0.936
8 HG3 GLN 1 HG1 GLN 1 -20.705 -4.843 1.728
9 HE21 GLN 1 1HE2 GLN 1 -21.186 -6.801 0.302
10 HE22 GLN 1 2HE2 GLN 1 -20.170 -7.093 -1.024
11 H THR 2 HN THR 2 -19.704 -1.774 -1.515
12 HA THR 2 HA THR 2 -20.460 -2.907 -4.088
13 HB THR 2 HB THR 2 -21.754 -0.921 -4.268
14 HG1 THR 2 HG1 THR 2 -20.794 -0.970 -6.155
15 HG21 THR 2 3HG2 THR 2 -20.467 1.370 -3.994
16 HG22 THR 2 1HG2 THR 2 -19.478 0.425 -2.881
17 HG23 THR 2 2HG2 THR 2 -21.213 0.578 -2.610
18 H ASN 3 HN ASN 3 -18.377 -0.346 -4.613
19 HA ASN 3 HA ASN 3 -16.054 -2.106 -4.824
20 HB2 ASN 3 HB2 ASN 3 -16.896 0.091 -6.149
21 HB3 ASN 3 HB1 ASN 3 -15.740 0.835 -5.048
22 HD21 ASN 3 1HD2 ASN 3 -13.484 -0.445 -4.998
23 HD22 ASN 3 2HD2 ASN 3 -12.937 -0.981 -6.516
24 H TRP 4 HN TRP 4 -17.295 -0.527 -2.131
25 HA TRP 4 HA TRP 4 -15.007 0.576 -0.855
26 HB2 TRP 4 HB2 TRP 4 -17.680 -0.474 -0.051
27 HB3 TRP 4 HB1 TRP 4 -16.471 -0.388 1.227
28 HD1 TRP 4 HD1 TRP 4 -18.827 1.732 -0.720
29 HE1 TRP 4 HE1 TRP 4 -18.486 4.219 -0.125
30 HE3 TRP 4 HE3 TRP 4 -14.453 1.417 1.890
31 HZ2 TRP 4 HZ2 TRP 4 -16.597 5.858 1.278
32 HZ3 TRP 4 HZ3 TRP 4 -13.406 3.444 2.842
33 HH2 TRP 4 HH2 TRP 4 -14.469 5.663 2.542
34 H GLN 5 HN GLN 5 -16.268 -2.767 -0.798
35 HA GLN 5 HA GLN 5 -14.397 -3.962 0.942
36 HB2 GLN 5 HB2 GLN 5 -14.714 -5.993 -0.667
37 HB3 GLN 5 HB1 GLN 5 -16.096 -5.410 0.249
38 HG2 GLN 5 HG2 GLN 5 -17.141 -4.577 -1.644
39 HG3 GLN 5 HG1 GLN 5 -15.636 -4.284 -2.493
40 HE21 GLN 5 1HE2 GLN 5 -18.297 -6.351 -2.448
41 HE22 GLN 5 2HE2 GLN 5 -17.593 -7.672 -3.246
42 H LYS 6 HN LYS 6 -14.093 -3.321 -2.543
43 HA LYS 6 HA LYS 6 -11.485 -4.475 -2.927
44 HB2 LYS 6 HB2 LYS 6 -13.423 -2.788 -4.397
45 HB3 LYS 6 HB1 LYS 6 -11.745 -2.503 -4.838
46 HG2 LYS 6 HG2 LYS 6 -12.112 -4.257 -6.250
47 HG3 LYS 6 HG1 LYS 6 -11.738 -5.208 -4.813
48 HD2 LYS 6 HD2 LYS 6 -14.210 -5.184 -4.266
49 HD3 LYS 6 HD1 LYS 6 -14.482 -4.457 -5.846
50 HE2 LYS 6 HE2 LYS 6 -14.785 -6.741 -6.297
51 HE3 LYS 6 HE1 LYS 6 -13.087 -6.508 -6.739
52 HZ1 LYS 6 HZ1 LYS 6 -12.394 -7.287 -4.597
53 HZ2 LYS 6 HZ2 LYS 6 -13.474 -8.427 -5.244
54 HZ3 LYS 6 HZ3 LYS 6 -13.996 -7.356 -4.032
55 H LEU 7 HN LEU 7 -12.614 -1.198 -2.068
56 HA LEU 7 HA LEU 7 -10.052 0.119 -2.144
57 HB2 LEU 7 HB2 LEU 7 -12.292 1.225 -2.216
58 HB3 LEU 7 HB1 LEU 7 -12.563 0.734 -0.548
59 HG LEU 7 HG LEU 7 -10.011 2.145 -0.942
60 HD11 LEU 7 1HD1 LEU 7 -10.949 4.350 -1.264
61 HD12 LEU 7 2HD1 LEU 7 -12.590 3.707 -1.265
62 HD13 LEU 7 3HD1 LEU 7 -11.493 3.330 -2.595
63 HD21 LEU 7 3HD2 LEU 7 -11.455 1.498 1.197
64 HD22 LEU 7 1HD2 LEU 7 -12.237 3.041 0.853
65 HD23 LEU 7 2HD2 LEU 7 -10.503 2.983 1.167
66 H GLU 8 HN GLU 8 -11.812 -1.675 0.386
67 HA GLU 8 HA GLU 8 -10.144 -0.985 2.621
68 HB2 GLU 8 HB2 GLU 8 -11.976 -3.293 1.916
69 HB3 GLU 8 HB1 GLU 8 -11.138 -3.227 3.463
70 HG2 GLU 8 HG2 GLU 8 -12.408 -1.483 4.241
71 HG3 GLU 8 HG1 GLU 8 -12.587 -0.762 2.650
72 H VAL 9 HN VAL 9 -10.109 -3.733 0.341
73 HA VAL 9 HA VAL 9 -7.750 -5.043 1.361
74 HB VAL 9 HB VAL 9 -9.162 -5.023 -1.341
75 HG11 VAL 9 1HG1 VAL 9 -7.899 -6.898 -2.030
76 HG12 VAL 9 2HG1 VAL 9 -7.231 -7.154 -0.418
77 HG13 VAL 9 3HG1 VAL 9 -6.698 -5.779 -1.386
78 HG21 VAL 9 3HG2 VAL 9 -9.837 -7.349 -0.488
79 HG22 VAL 9 1HG2 VAL 9 -10.593 -5.965 0.299
80 HG23 VAL 9 2HG2 VAL 9 -9.266 -6.811 1.092
81 H PHE 10 HN PHE 10 -8.360 -2.648 -1.190
82 HA PHE 10 HA PHE 10 -5.715 -2.312 -2.215
83 HB2 PHE 10 HB2 PHE 10 -7.534 -1.437 -3.462
84 HB3 PHE 10 HB1 PHE 10 -8.242 -0.683 -2.049
85 HD1 PHE 10 HD1 PHE 10 -5.420 -0.454 -4.463
86 HD2 PHE 10 HD2 PHE 10 -7.680 1.530 -1.394
87 HE1 PHE 10 HE1 PHE 10 -4.294 1.687 -5.018
88 HE2 PHE 10 HE2 PHE 10 -6.552 3.670 -1.949
89 HZ PHE 10 HZ PHE 10 -4.861 3.748 -3.759
90 H TRP 11 HN TRP 11 -7.485 -0.650 0.393
91 HA TRP 11 HA TRP 11 -5.836 1.409 1.140
92 HB2 TRP 11 HB2 TRP 11 -8.048 0.166 2.169
93 HB3 TRP 11 HB1 TRP 11 -6.849 -0.171 3.411
94 HD1 TRP 11 HD1 TRP 11 -7.737 2.915 1.266
95 HE1 TRP 11 HE1 TRP 11 -7.782 4.983 2.809
96 HE3 TRP 11 HE3 TRP 11 -6.559 0.707 5.709
97 HZ2 TRP 11 HZ2 TRP 11 -7.367 5.611 5.573
98 HZ3 TRP 11 HZ3 TRP 11 -6.389 2.056 7.779
99 HH2 TRP 11 HH2 TRP 11 -6.790 4.499 7.719
100 H ALA 12 HN ALA 12 -5.504 -1.890 2.584
101 HA ALA 12 HA ALA 12 -3.048 -1.198 3.937
102 HB1 ALA 12 HB1 ALA 12 -3.904 -3.994 3.162
103 HB2 ALA 12 HB2 ALA 12 -4.706 -3.101 4.457
104 HB3 ALA 12 HB3 ALA 12 -2.989 -3.488 4.581
105 H LYS 13 HN LYS 13 -3.729 -2.788 0.809
106 HA LYS 13 HA LYS 13 -1.042 -3.550 0.154
107 HB2 LYS 13 HB2 LYS 13 -3.539 -2.901 -1.438
108 HB3 LYS 13 HB1 LYS 13 -2.042 -3.381 -2.232
109 HG2 LYS 13 HG2 LYS 13 -2.024 -5.477 -0.902
110 HG3 LYS 13 HG1 LYS 13 -3.554 -5.003 -0.162
111 HD2 LYS 13 HD2 LYS 13 -4.504 -4.840 -2.518
112 HD3 LYS 13 HD1 LYS 13 -3.035 -5.637 -3.076
113 HE2 LYS 13 HE2 LYS 13 -4.417 -6.963 -0.799
114 HE3 LYS 13 HE1 LYS 13 -5.273 -6.998 -2.348
115 HZ1 LYS 13 HZ1 LYS 13 -2.431 -7.795 -1.955
116 HZ2 LYS 13 HZ2 LYS 13 -3.293 -7.845 -3.421
117 HZ3 LYS 13 HZ3 LYS 13 -3.732 -8.862 -2.136
118 H HIS 14 HN HIS 14 -2.940 -0.634 -0.625
119 HA HIS 14 HA HIS 14 -0.896 0.807 -2.040
120 HB2 HIS 14 HB2 HIS 14 -3.361 1.225 -2.095
121 HB3 HIS 14 HB1 HIS 14 -3.286 1.777 -0.427
122 HD1 HIS 14 HD1 HIS 14 -2.028 2.725 -3.896
123 HD2 HIS 14 HD2 HIS 14 -2.486 4.430 -0.115
124 HE1 HIS 14 HE1 HIS 14 -1.523 5.186 -4.154
125 H MET 15 HN MET 15 -1.922 0.791 1.397
126 HA MET 15 HA MET 15 -0.089 2.788 2.350
127 HB2 MET 15 HB2 MET 15 -2.004 0.892 3.420
128 HB3 MET 15 HB1 MET 15 -0.546 0.848 4.392
129 HG2 MET 15 HG2 MET 15 -1.835 3.464 3.615
130 HG3 MET 15 HG1 MET 15 -2.349 2.568 5.041
131 HE1 MET 15 HE1 MET 15 -0.533 5.779 4.959
132 HE2 MET 15 HE2 MET 15 -0.584 5.360 6.667
133 HE3 MET 15 HE3 MET 15 -1.954 4.962 5.638
134 H TRP 16 HN TRP 16 0.175 -0.799 2.199
135 HA TRP 16 HA TRP 16 2.842 -0.894 3.269
136 HB2 TRP 16 HB2 TRP 16 0.960 -2.758 2.792
137 HB3 TRP 16 HB1 TRP 16 1.901 -2.959 1.315
138 HD1 TRP 16 HD1 TRP 16 3.216 -5.095 1.774
139 HE1 TRP 16 HE1 TRP 16 4.892 -5.864 3.575
140 HE3 TRP 16 HE3 TRP 16 2.775 -1.239 5.080
141 HZ2 TRP 16 HZ2 TRP 16 5.913 -4.953 6.097
142 HZ3 TRP 16 HZ3 TRP 16 4.103 -1.208 7.169
143 HH2 TRP 16 HH2 TRP 16 5.670 -3.057 7.682
144 H ASN 17 HN ASN 17 1.544 -0.350 0.023
145 HA ASN 17 HA ASN 17 3.978 -0.689 -1.452
146 HB2 ASN 17 HB2 ASN 17 1.384 -0.252 -2.103
147 HB3 ASN 17 HB1 ASN 17 1.991 1.397 -2.264
148 HD21 ASN 17 1HD2 ASN 17 3.884 1.709 -3.787
149 HD22 ASN 17 2HD2 ASN 17 4.069 0.620 -5.075
150 H PHE 18 HN PHE 18 2.592 2.014 0.397
151 HA PHE 18 HA PHE 18 4.406 4.102 -0.367
152 HB2 PHE 18 HB2 PHE 18 2.260 4.435 0.857
153 HB3 PHE 18 HB1 PHE 18 2.895 3.523 2.213
154 HD1 PHE 18 HD1 PHE 18 3.521 6.614 0.188
155 HD2 PHE 18 HD2 PHE 18 4.118 4.553 3.910
156 HE1 PHE 18 HE1 PHE 18 4.509 8.665 1.168
157 HE2 PHE 18 HE2 PHE 18 5.105 6.603 4.889
158 HZ PHE 18 HZ PHE 18 5.301 8.662 3.517
159 H ILE 19 HN ILE 19 4.416 1.652 2.211
160 HA ILE 19 HA ILE 19 6.953 2.349 3.400
161 HB ILE 19 HB ILE 19 4.956 0.102 3.495
162 HG12 ILE 19 2HG1 ILE 19 5.634 0.774 6.057
163 HG13 ILE 19 1HG1 ILE 19 5.942 2.289 5.216
164 HG21 ILE 19 1HG2 ILE 19 6.876 -1.278 3.577
165 HG22 ILE 19 2HG2 ILE 19 6.458 -0.994 5.265
166 HG23 ILE 19 3HG2 ILE 19 7.786 -0.102 4.524
167 HD11 ILE 19 3HD1 ILE 19 3.573 1.935 6.127
168 HD12 ILE 19 1HD1 ILE 19 3.372 0.749 4.837
169 HD13 ILE 19 2HD1 ILE 19 3.704 2.436 4.442
170 H SER 20 HN SER 20 5.949 -0.080 0.955
171 HA SER 20 HA SER 20 8.431 -1.363 0.499
172 HB2 SER 20 HB2 SER 20 6.007 -0.781 -1.198
173 HB3 SER 20 HB1 SER 20 7.395 -1.622 -1.871
174 HG SER 20 HG SER 20 5.602 -2.883 -0.795
175 H GLY 21 HN GLY 21 7.131 1.643 -0.975
176 HA2 GLY 21 HA2 GLY 21 9.256 2.064 -2.842
177 HA3 GLY 21 HA1 GLY 21 8.185 3.324 -2.221
178 H ILE 22 HN ILE 22 8.711 3.428 0.424
179 HA ILE 22 HA ILE 22 11.192 4.851 0.617
180 HB ILE 22 HB ILE 22 9.251 3.738 2.667
181 HG12 ILE 22 2HG1 ILE 22 9.754 6.620 1.905
182 HG13 ILE 22 1HG1 ILE 22 8.626 5.617 1.000
183 HG21 ILE 22 1HG2 ILE 22 10.441 5.619 4.099
184 HG22 ILE 22 2HG2 ILE 22 11.800 5.288 3.028
185 HG23 ILE 22 3HG2 ILE 22 11.126 3.997 4.023
186 HD11 ILE 22 3HD1 ILE 22 7.045 5.983 2.545
187 HD12 ILE 22 1HD1 ILE 22 8.164 7.002 3.447
188 HD13 ILE 22 2HD1 ILE 22 8.074 5.275 3.790
189 H GLN 23 HN GLN 23 10.282 1.521 1.588
190 HA GLN 23 HA GLN 23 12.668 0.770 2.906
191 HB2 GLN 23 HB2 GLN 23 10.315 -0.452 2.325
192 HB3 GLN 23 HB1 GLN 23 11.363 -1.246 1.155
193 HG2 GLN 23 HG2 GLN 23 11.452 -2.604 3.094
194 HG3 GLN 23 HG1 GLN 23 12.958 -1.692 3.112
195 HE21 GLN 23 1HE2 GLN 23 13.244 -0.080 4.798
196 HE22 GLN 23 2HE2 GLN 23 12.155 0.065 6.092
197 H TYR 24 HN TYR 24 11.896 0.798 -0.516
198 HA TYR 24 HA TYR 24 14.444 -0.366 -1.380
199 HB2 TYR 24 HB2 TYR 24 12.680 -0.775 -2.857
200 HB3 TYR 24 HB1 TYR 24 11.979 0.823 -2.635
201 HD1 TYR 24 HD1 TYR 24 14.933 -0.941 -4.087
202 HD2 TYR 24 HD2 TYR 24 12.419 2.542 -4.200
203 HE1 TYR 24 HE1 TYR 24 16.093 -0.171 -6.138
204 HE2 TYR 24 HE2 TYR 24 13.578 3.311 -6.254
205 HH TYR 24 HH TYR 24 16.181 2.731 -7.206
206 H LEU 25 HN LEU 25 13.032 2.898 -1.230
207 HA LEU 25 HA LEU 25 15.257 4.312 -2.368
208 HB2 LEU 25 HB2 LEU 25 12.692 4.845 -1.178
209 HB3 LEU 25 HB1 LEU 25 13.895 5.930 -0.495
210 HG LEU 25 HG LEU 25 14.540 5.967 -3.181
211 HD11 LEU 25 1HD1 LEU 25 12.499 4.683 -3.711
212 HD12 LEU 25 2HD1 LEU 25 12.423 6.309 -4.385
213 HD13 LEU 25 3HD1 LEU 25 11.518 5.916 -2.921
214 HD21 LEU 25 3HD2 LEU 25 13.480 8.212 -3.160
215 HD22 LEU 25 1HD2 LEU 25 14.393 7.918 -1.680
216 HD23 LEU 25 2HD2 LEU 25 12.633 7.792 -1.671
217 H ALA 26 HN ALA 26 14.935 2.885 0.763
218 HA ALA 26 HA ALA 26 16.738 4.676 2.183
219 HB1 ALA 26 HB1 ALA 26 15.517 1.971 2.767
220 HB2 ALA 26 HB2 ALA 26 14.981 3.541 3.364
221 HB3 ALA 26 HB3 ALA 26 16.508 2.859 3.924
222 H GLY 27 HN GLY 27 18.014 3.832 -0.171
223 HA2 GLY 27 HA2 GLY 27 20.354 3.414 -0.498
224 HA3 GLY 27 HA1 GLY 27 20.339 2.342 0.898
225 H LEU 28 HN LEU 28 17.970 2.228 -1.791
226 HA LEU 28 HA LEU 28 17.390 0.466 -3.206
227 HB2 LEU 28 HB2 LEU 28 19.811 1.357 -3.840
228 HB3 LEU 28 HB1 LEU 28 20.292 -0.265 -3.347
229 HG LEU 28 HG LEU 28 18.111 -0.826 -4.896
230 HD11 LEU 28 1HD1 LEU 28 19.545 1.452 -6.285
231 HD12 LEU 28 2HD1 LEU 28 17.971 1.615 -5.508
232 HD13 LEU 28 3HD1 LEU 28 18.165 0.534 -6.887
233 HD21 LEU 28 3HD2 LEU 28 19.681 -1.663 -6.487
234 HD22 LEU 28 1HD2 LEU 28 20.510 -1.735 -4.933
235 HD23 LEU 28 2HD2 LEU 28 20.876 -0.435 -6.067
236 H SER 29 HN SER 29 17.110 -0.211 -0.517
237 HA SER 29 HA SER 29 18.371 -2.807 0.037
238 HB2 SER 29 HB2 SER 29 16.121 -1.350 1.453
239 HB3 SER 29 HB1 SER 29 17.087 -2.664 2.100
240 HG SER 29 HG SER 29 17.600 -0.049 2.142
241 H THR 30 HN THR 30 17.282 -4.813 0.050
242 HA THR 30 HA THR 30 15.827 -6.462 -0.671
243 HB THR 30 HB THR 30 13.674 -4.339 -0.480
244 HG1 THR 30 HG1 THR 30 14.841 -5.801 1.661
245 HG21 THR 30 3HG2 THR 30 12.881 -6.467 -1.259
246 HG22 THR 30 1HG2 THR 30 12.368 -6.276 0.417
247 HG23 THR 30 2HG2 THR 30 13.737 -7.316 0.027
Start of MODEL 14
1 H1 GLN 1 HT1 GLN 1 -22.738 -3.190 1.159
2 H2 GLN 1 HT2 GLN 1 -23.224 -3.108 -0.468
3 H3 GLN 1 HT3 GLN 1 -22.972 -1.686 0.422
4 HA GLN 1 HA GLN 1 -20.605 -2.151 0.596
5 HB2 GLN 1 HB2 GLN 1 -21.558 -4.753 0.058
6 HB3 GLN 1 HB1 GLN 1 -20.560 -4.324 -1.328
7 HG2 GLN 1 HG2 GLN 1 -18.635 -4.061 -0.037
8 HG3 GLN 1 HG1 GLN 1 -19.541 -3.776 1.446
9 HE21 GLN 1 1HE2 GLN 1 -19.002 -6.447 -0.963
10 HE22 GLN 1 2HE2 GLN 1 -19.063 -7.676 0.206
11 H THR 2 HN THR 2 -19.566 -0.791 -0.773
12 HA THR 2 HA THR 2 -20.198 -0.754 -3.666
13 HB THR 2 HB THR 2 -20.330 1.735 -1.926
14 HG1 THR 2 HG1 THR 2 -22.440 0.104 -2.905
15 HG21 THR 2 3HG2 THR 2 -19.805 2.103 -4.313
16 HG22 THR 2 1HG2 THR 2 -21.387 2.747 -3.877
17 HG23 THR 2 2HG2 THR 2 -21.267 1.225 -4.758
18 H ASN 3 HN ASN 3 -18.513 2.021 -2.540
19 HA ASN 3 HA ASN 3 -16.019 0.914 -3.631
20 HB2 ASN 3 HB2 ASN 3 -17.018 3.262 -4.063
21 HB3 ASN 3 HB1 ASN 3 -16.372 3.678 -2.476
22 HD21 ASN 3 1HD2 ASN 3 -13.988 3.739 -2.236
23 HD22 ASN 3 2HD2 ASN 3 -12.979 3.724 -3.600
24 H TRP 4 HN TRP 4 -17.342 0.625 -0.621
25 HA TRP 4 HA TRP 4 -15.102 1.377 1.064
26 HB2 TRP 4 HB2 TRP 4 -17.399 -0.592 1.440
27 HB3 TRP 4 HB1 TRP 4 -16.305 -0.103 2.724
28 HD1 TRP 4 HD1 TRP 4 -19.591 0.469 2.121
29 HE1 TRP 4 HE1 TRP 4 -20.409 2.875 2.561
30 HE3 TRP 4 HE3 TRP 4 -15.123 2.953 2.063
31 HZ2 TRP 4 HZ2 TRP 4 -19.315 5.501 2.848
32 HZ3 TRP 4 HZ3 TRP 4 -15.044 5.395 2.419
33 HH2 TRP 4 HH2 TRP 4 -17.128 6.675 2.812
34 H GLN 5 HN GLN 5 -16.324 -1.772 -0.104
35 HA GLN 5 HA GLN 5 -14.221 -3.476 0.659
36 HB2 GLN 5 HB2 GLN 5 -16.289 -3.360 -1.477
37 HB3 GLN 5 HB1 GLN 5 -14.940 -4.432 -1.811
38 HG2 GLN 5 HG2 GLN 5 -16.172 -4.593 0.904
39 HG3 GLN 5 HG1 GLN 5 -17.092 -5.240 -0.448
40 HE21 GLN 5 1HE2 GLN 5 -15.780 -6.771 1.792
41 HE22 GLN 5 2HE2 GLN 5 -14.700 -7.830 1.027
42 H LYS 6 HN LYS 6 -14.490 -1.395 -2.228
43 HA LYS 6 HA LYS 6 -11.952 -2.094 -3.418
44 HB2 LYS 6 HB2 LYS 6 -14.067 -0.996 -4.435
45 HB3 LYS 6 HB1 LYS 6 -13.445 0.513 -3.761
46 HG2 LYS 6 HG2 LYS 6 -11.316 0.160 -4.984
47 HG3 LYS 6 HG1 LYS 6 -11.985 -1.305 -5.700
48 HD2 LYS 6 HD2 LYS 6 -13.057 -0.121 -7.276
49 HD3 LYS 6 HD1 LYS 6 -13.844 0.875 -6.055
50 HE2 LYS 6 HE2 LYS 6 -11.504 2.082 -5.919
51 HE3 LYS 6 HE1 LYS 6 -11.271 1.384 -7.532
52 HZ1 LYS 6 HZ1 LYS 6 -13.647 2.977 -6.700
53 HZ2 LYS 6 HZ2 LYS 6 -13.349 2.340 -8.251
54 HZ3 LYS 6 HZ3 LYS 6 -12.356 3.566 -7.625
55 H LEU 7 HN LEU 7 -13.021 0.670 -1.377
56 HA LEU 7 HA LEU 7 -10.530 2.060 -1.247
57 HB2 LEU 7 HB2 LEU 7 -12.832 2.900 -0.596
58 HB3 LEU 7 HB1 LEU 7 -12.709 1.916 0.854
59 HG LEU 7 HG LEU 7 -10.309 3.503 0.560
60 HD11 LEU 7 1HD1 LEU 7 -11.952 4.996 -0.688
61 HD12 LEU 7 2HD1 LEU 7 -11.186 5.721 0.725
62 HD13 LEU 7 3HD1 LEU 7 -12.844 5.132 0.828
63 HD21 LEU 7 3HD2 LEU 7 -11.137 2.488 2.655
64 HD22 LEU 7 1HD2 LEU 7 -12.557 3.533 2.604
65 HD23 LEU 7 2HD2 LEU 7 -10.954 4.233 2.827
66 H GLU 8 HN GLU 8 -11.867 -0.568 0.792
67 HA GLU 8 HA GLU 8 -9.815 -0.507 2.806
68 HB2 GLU 8 HB2 GLU 8 -11.969 -2.359 1.878
69 HB3 GLU 8 HB1 GLU 8 -10.682 -3.073 2.845
70 HG2 GLU 8 HG2 GLU 8 -11.664 -2.280 4.696
71 HG3 GLU 8 HG1 GLU 8 -11.361 -0.645 4.133
72 H VAL 9 HN VAL 9 -10.149 -2.438 -0.201
73 HA VAL 9 HA VAL 9 -7.652 -3.863 0.039
74 HB VAL 9 HB VAL 9 -9.435 -3.080 -2.305
75 HG11 VAL 9 1HG1 VAL 9 -7.046 -3.557 -3.017
76 HG12 VAL 9 2HG1 VAL 9 -8.257 -4.637 -3.703
77 HG13 VAL 9 3HG1 VAL 9 -7.253 -5.182 -2.360
78 HG21 VAL 9 3HG2 VAL 9 -10.078 -4.762 -0.362
79 HG22 VAL 9 1HG2 VAL 9 -9.056 -5.868 -1.280
80 HG23 VAL 9 2HG2 VAL 9 -10.469 -5.134 -2.039
81 H PHE 10 HN PHE 10 -8.636 -0.862 -1.572
82 HA PHE 10 HA PHE 10 -6.187 -0.020 -2.745
83 HB2 PHE 10 HB2 PHE 10 -8.239 1.063 -3.342
84 HB3 PHE 10 HB1 PHE 10 -8.666 1.318 -1.664
85 HD1 PHE 10 HD2 PHE 10 -5.946 2.237 -4.082
86 HD2 PHE 10 HD1 PHE 10 -8.367 3.416 -0.736
87 HE1 PHE 10 HE2 PHE 10 -4.921 4.496 -4.141
88 HE2 PHE 10 HE1 PHE 10 -7.341 5.678 -0.794
89 HZ PHE 10 HZ PHE 10 -5.620 6.216 -2.495
90 H TRP 11 HN TRP 11 -7.582 0.582 0.487
91 HA TRP 11 HA TRP 11 -5.668 2.349 1.546
92 HB2 TRP 11 HB2 TRP 11 -7.944 1.058 2.451
93 HB3 TRP 11 HB1 TRP 11 -6.681 0.343 3.448
94 HD1 TRP 11 HD1 TRP 11 -7.523 3.888 2.205
95 HE1 TRP 11 HE1 TRP 11 -7.224 5.536 4.171
96 HE3 TRP 11 HE3 TRP 11 -6.012 0.639 5.827
97 HZ2 TRP 11 HZ2 TRP 11 -6.442 5.471 6.925
98 HZ3 TRP 11 HZ3 TRP 11 -5.495 1.451 8.111
99 HH2 TRP 11 HH2 TRP 11 -5.705 3.856 8.665
100 H ALA 12 HN ALA 12 -5.703 -1.246 1.749
101 HA ALA 12 HA ALA 12 -3.163 -1.365 3.119
102 HB1 ALA 12 HB1 ALA 12 -4.924 -3.154 3.165
103 HB2 ALA 12 HB2 ALA 12 -3.339 -3.777 2.701
104 HB3 ALA 12 HB3 ALA 12 -4.570 -3.498 1.470
105 H LYS 13 HN LYS 13 -4.149 -1.530 -0.305
106 HA LYS 13 HA LYS 13 -1.628 -2.291 -1.441
107 HB2 LYS 13 HB2 LYS 13 -3.831 -2.295 -2.612
108 HB3 LYS 13 HB1 LYS 13 -3.866 -0.536 -2.533
109 HG2 LYS 13 HG2 LYS 13 -1.710 -0.514 -3.848
110 HG3 LYS 13 HG1 LYS 13 -1.892 -2.256 -4.064
111 HD2 LYS 13 HD2 LYS 13 -3.717 -2.041 -5.466
112 HD3 LYS 13 HD1 LYS 13 -4.227 -0.518 -4.747
113 HE2 LYS 13 HE2 LYS 13 -3.358 0.362 -6.678
114 HE3 LYS 13 HE1 LYS 13 -1.826 0.242 -5.798
115 HZ1 LYS 13 HZ1 LYS 13 -1.600 -0.847 -7.909
116 HZ2 LYS 13 HZ2 LYS 13 -2.971 -1.808 -7.630
117 HZ3 LYS 13 HZ3 LYS 13 -1.565 -2.023 -6.695
118 H HIS 14 HN HIS 14 -3.104 0.913 -0.829
119 HA HIS 14 HA HIS 14 -0.887 2.517 -1.693
120 HB2 HIS 14 HB2 HIS 14 -3.295 3.213 -1.327
121 HB3 HIS 14 HB1 HIS 14 -2.990 3.136 0.406
122 HD1 HIS 14 HD1 HIS 14 -1.213 4.755 -2.581
123 HD2 HIS 14 HD2 HIS 14 -2.316 5.628 1.346
124 HE1 HIS 14 HE1 HIS 14 -0.435 7.120 -2.127
125 H MET 15 HN MET 15 -1.828 1.259 1.526
126 HA MET 15 HA MET 15 0.314 2.446 3.030
127 HB2 MET 15 HB2 MET 15 -1.841 0.505 3.393
128 HB3 MET 15 HB1 MET 15 -0.399 0.003 4.254
129 HG2 MET 15 HG2 MET 15 -1.518 2.805 4.457
130 HG3 MET 15 HG1 MET 15 -1.995 1.508 5.548
131 HE1 MET 15 HE1 MET 15 -0.822 3.677 7.404
132 HE2 MET 15 HE2 MET 15 -0.708 4.354 5.784
133 HE3 MET 15 HE3 MET 15 0.715 4.340 6.819
134 H TRP 16 HN TRP 16 -0.013 -0.879 1.676
135 HA TRP 16 HA TRP 16 2.627 -1.750 2.327
136 HB2 TRP 16 HB2 TRP 16 0.446 -2.972 1.348
137 HB3 TRP 16 HB1 TRP 16 1.299 -2.718 -0.175
138 HD1 TRP 16 HD1 TRP 16 2.411 -4.948 -0.728
139 HE1 TRP 16 HE1 TRP 16 3.906 -6.621 0.533
140 HE3 TRP 16 HE3 TRP 16 2.311 -2.862 3.907
141 HZ2 TRP 16 HZ2 TRP 16 4.933 -7.021 3.186
142 HZ3 TRP 16 HZ3 TRP 16 3.554 -3.901 5.795
143 HH2 TRP 16 HH2 TRP 16 4.861 -5.973 5.436
144 H ASN 17 HN ASN 17 1.354 0.072 -0.441
145 HA ASN 17 HA ASN 17 3.663 -0.059 -2.118
146 HB2 ASN 17 HB2 ASN 17 1.339 0.726 -2.715
147 HB3 ASN 17 HB1 ASN 17 1.649 2.197 -1.796
148 HD21 ASN 17 1HD2 ASN 17 2.973 3.833 -2.787
149 HD22 ASN 17 2HD2 ASN 17 3.582 3.673 -4.364
150 H PHE 18 HN PHE 18 2.733 2.116 0.537
151 HA PHE 18 HA PHE 18 4.887 4.004 0.405
152 HB2 PHE 18 HB2 PHE 18 2.696 4.082 1.736
153 HB3 PHE 18 HB1 PHE 18 3.427 2.944 2.856
154 HD1 PHE 18 HD2 PHE 18 5.294 3.612 4.311
155 HD2 PHE 18 HD1 PHE 18 3.469 6.392 1.592
156 HE1 PHE 18 HE2 PHE 18 6.397 5.496 5.492
157 HE2 PHE 18 HE1 PHE 18 4.571 8.274 2.773
158 HZ PHE 18 HZ PHE 18 6.036 7.825 4.723
159 H ILE 19 HN ILE 19 4.466 0.853 1.965
160 HA ILE 19 HA ILE 19 7.031 0.759 3.312
161 HB ILE 19 HB ILE 19 4.718 -1.069 2.710
162 HG12 ILE 19 2HG1 ILE 19 5.802 -0.893 5.424
163 HG13 ILE 19 1HG1 ILE 19 5.391 0.679 4.749
164 HG21 ILE 19 1HG2 ILE 19 7.419 -1.973 3.702
165 HG22 ILE 19 2HG2 ILE 19 6.399 -2.704 2.463
166 HG23 ILE 19 3HG2 ILE 19 5.937 -2.813 4.159
167 HD11 ILE 19 3HD1 ILE 19 3.314 0.133 5.529
168 HD12 ILE 19 1HD1 ILE 19 3.618 -1.600 5.434
169 HD13 ILE 19 2HD1 ILE 19 3.205 -0.695 3.978
170 H SER 20 HN SER 20 5.776 -0.465 0.188
171 HA SER 20 HA SER 20 8.020 -1.990 -0.647
172 HB2 SER 20 HB2 SER 20 5.850 -0.461 -2.079
173 HB3 SER 20 HB1 SER 20 7.089 -1.335 -2.967
174 HG SER 20 HG SER 20 6.426 -3.223 -1.900
175 H GLY 21 HN GLY 21 7.371 1.523 -1.097
176 HA2 GLY 21 HA2 GLY 21 9.666 2.065 -2.723
177 HA3 GLY 21 HA1 GLY 21 8.798 3.265 -1.759
178 H ILE 22 HN ILE 22 9.124 2.261 0.794
179 HA ILE 22 HA ILE 22 11.789 3.119 1.493
180 HB ILE 22 HB ILE 22 9.436 1.875 2.933
181 HG12 ILE 22 2HG1 ILE 22 10.797 4.531 3.404
182 HG13 ILE 22 1HG1 ILE 22 9.573 4.325 2.155
183 HG21 ILE 22 1HG2 ILE 22 11.321 1.004 4.166
184 HG22 ILE 22 2HG2 ILE 22 10.663 2.359 5.079
185 HG23 ILE 22 3HG2 ILE 22 12.135 2.569 4.130
186 HD11 ILE 22 3HD1 ILE 22 9.189 3.764 5.112
187 HD12 ILE 22 1HD1 ILE 22 7.966 3.538 3.861
188 HD13 ILE 22 2HD1 ILE 22 8.558 5.157 4.235
189 H GLN 23 HN GLN 23 10.222 -0.098 1.361
190 HA GLN 23 HA GLN 23 12.410 -1.679 2.257
191 HB2 GLN 23 HB2 GLN 23 9.841 -2.153 1.629
192 HB3 GLN 23 HB1 GLN 23 10.594 -2.734 0.147
193 HG2 GLN 23 HG2 GLN 23 10.788 -4.672 1.323
194 HG3 GLN 23 HG1 GLN 23 12.217 -3.890 2.001
195 HE21 GLN 23 1HE2 GLN 23 8.705 -4.376 2.629
196 HE22 GLN 23 2HE2 GLN 23 8.831 -4.179 4.311
197 H TYR 24 HN TYR 24 11.510 -0.578 -0.958
198 HA TYR 24 HA TYR 24 13.495 -2.006 -2.456
199 HB2 TYR 24 HB2 TYR 24 11.596 -1.024 -3.579
200 HB3 TYR 24 HB1 TYR 24 11.999 0.583 -2.968
201 HD1 TYR 24 HD2 TYR 24 13.543 -2.216 -4.937
202 HD2 TYR 24 HD1 TYR 24 13.258 2.020 -4.287
203 HE1 TYR 24 HE2 TYR 24 15.043 -1.819 -6.872
204 HE2 TYR 24 HE1 TYR 24 14.761 2.418 -6.221
205 HH TYR 24 HH TYR 24 15.321 0.438 -8.542
206 H LEU 25 HN LEU 25 13.573 1.168 -0.818
207 HA LEU 25 HA LEU 25 16.227 1.825 -1.825
208 HB2 LEU 25 HB2 LEU 25 14.135 2.992 -0.111
209 HB3 LEU 25 HB1 LEU 25 15.771 3.393 0.398
210 HG LEU 25 HG LEU 25 16.117 3.862 -2.191
211 HD11 LEU 25 1HD1 LEU 25 14.174 4.589 -3.349
212 HD12 LEU 25 2HD1 LEU 25 13.187 4.537 -1.887
213 HD13 LEU 25 3HD1 LEU 25 13.737 3.039 -2.634
214 HD21 LEU 25 3HD2 LEU 25 15.463 6.229 -1.777
215 HD22 LEU 25 1HD2 LEU 25 16.363 5.552 -0.421
216 HD23 LEU 25 2HD2 LEU 25 14.611 5.724 -0.319
217 H ALA 26 HN ALA 26 15.011 0.252 1.104
218 HA ALA 26 HA ALA 26 17.144 0.359 2.863
219 HB1 ALA 26 HB1 ALA 26 16.410 -2.042 3.445
220 HB2 ALA 26 HB2 ALA 26 15.259 -1.877 2.123
221 HB3 ALA 26 HB3 ALA 26 15.174 -0.787 3.507
222 H GLY 27 HN GLY 27 16.810 -1.985 0.212
223 HA2 GLY 27 HA2 GLY 27 19.652 -2.022 -0.367
224 HA3 GLY 27 HA1 GLY 27 19.116 -3.507 0.435
225 H LEU 28 HN LEU 28 17.593 -1.367 -2.026
226 HA LEU 28 HA LEU 28 16.546 -1.860 -4.042
227 HB2 LEU 28 HB2 LEU 28 19.044 -2.607 -4.326
228 HB3 LEU 28 HB1 LEU 28 18.390 -4.242 -4.251
229 HG LEU 28 HG LEU 28 16.679 -3.272 -6.042
230 HD11 LEU 28 1HD1 LEU 28 17.669 -0.973 -5.894
231 HD12 LEU 28 2HD1 LEU 28 17.702 -1.644 -7.523
232 HD13 LEU 28 3HD1 LEU 28 19.172 -1.623 -6.550
233 HD21 LEU 28 3HD2 LEU 28 18.211 -4.114 -7.808
234 HD22 LEU 28 1HD2 LEU 28 18.192 -5.173 -6.399
235 HD23 LEU 28 2HD2 LEU 28 19.544 -4.070 -6.655
236 H SER 29 HN SER 29 15.403 -2.922 -1.624
237 HA SER 29 HA SER 29 13.742 -4.340 -0.892
238 HB2 SER 29 HB2 SER 29 13.508 -4.245 -3.831
239 HB3 SER 29 HB1 SER 29 12.737 -5.639 -3.089
240 HG SER 29 HG SER 29 11.624 -3.408 -3.241
241 H THR 30 HN THR 30 16.439 -5.341 -0.817
242 HA THR 30 HA THR 30 15.945 -8.276 -1.097
243 HB THR 30 HB THR 30 18.623 -6.846 -1.278
244 HG1 THR 30 HG1 THR 30 17.539 -6.174 -3.054
245 HG21 THR 30 3HG2 THR 30 18.687 -9.237 -0.683
246 HG22 THR 30 1HG2 THR 30 19.376 -8.944 -2.279
247 HG23 THR 30 2HG2 THR 30 17.753 -9.617 -2.129
Start of MODEL 15
1 H1 GLN 1 HT1 GLN 1 -21.381 6.602 0.018
2 H2 GLN 1 HT2 GLN 1 -22.567 5.617 0.735
3 H3 GLN 1 HT3 GLN 1 -22.157 5.408 -0.899
4 HA GLN 1 HA GLN 1 -19.887 4.724 -0.232
5 HB2 GLN 1 HB2 GLN 1 -20.158 6.096 1.924
6 HB3 GLN 1 HB1 GLN 1 -21.061 4.724 2.557
7 HG2 GLN 1 HG2 GLN 1 -18.623 3.754 1.377
8 HG3 GLN 1 HG1 GLN 1 -18.239 5.073 2.479
9 HE21 GLN 1 1HE2 GLN 1 -19.730 1.821 2.327
10 HE22 GLN 1 2HE2 GLN 1 -19.696 1.571 4.004
11 H THR 2 HN THR 2 -19.964 2.743 -1.012
12 HA THR 2 HA THR 2 -22.066 0.835 -0.078
13 HB THR 2 HB THR 2 -20.426 0.844 -2.645
14 HG1 THR 2 HG1 THR 2 -21.776 2.239 -3.407
15 HG21 THR 2 3HG2 THR 2 -23.126 -0.398 -2.470
16 HG22 THR 2 1HG2 THR 2 -21.793 -1.253 -1.692
17 HG23 THR 2 2HG2 THR 2 -21.718 -0.880 -3.411
18 H ASN 3 HN ASN 3 -19.736 -0.879 -1.682
19 HA ASN 3 HA ASN 3 -18.165 -1.408 0.797
20 HB2 ASN 3 HB2 ASN 3 -19.889 -3.129 0.113
21 HB3 ASN 3 HB1 ASN 3 -18.934 -3.402 -1.343
22 HD21 ASN 3 1HD2 ASN 3 -18.238 -5.569 -0.790
23 HD22 ASN 3 2HD2 ASN 3 -17.211 -5.874 0.527
24 H TRP 4 HN TRP 4 -18.063 -1.113 -2.693
25 HA TRP 4 HA TRP 4 -15.365 -1.846 -3.230
26 HB2 TRP 4 HB2 TRP 4 -17.359 0.087 -4.428
27 HB3 TRP 4 HB1 TRP 4 -15.729 -0.016 -5.078
28 HD1 TRP 4 HD1 TRP 4 -18.997 -1.386 -5.663
29 HE1 TRP 4 HE1 TRP 4 -18.900 -3.644 -6.896
30 HE3 TRP 4 HE3 TRP 4 -14.070 -2.523 -5.015
31 HZ2 TRP 4 HZ2 TRP 4 -16.983 -5.671 -7.525
32 HZ3 TRP 4 HZ3 TRP 4 -13.128 -4.622 -5.939
33 HH2 TRP 4 HH2 TRP 4 -14.572 -6.196 -7.192
34 H GLN 5 HN GLN 5 -16.793 1.271 -2.290
35 HA GLN 5 HA GLN 5 -14.485 2.917 -2.269
36 HB2 GLN 5 HB2 GLN 5 -17.189 2.865 -1.078
37 HB3 GLN 5 HB1 GLN 5 -16.031 3.832 -0.175
38 HG2 GLN 5 HG2 GLN 5 -15.862 4.257 -3.076
39 HG3 GLN 5 HG1 GLN 5 -17.434 4.686 -2.404
40 HE21 GLN 5 1HE2 GLN 5 -17.387 6.292 -0.509
41 HE22 GLN 5 2HE2 GLN 5 -16.099 7.396 -0.444
42 H LYS 6 HN LYS 6 -15.722 0.653 0.203
43 HA LYS 6 HA LYS 6 -13.818 1.320 2.268
44 HB2 LYS 6 HB2 LYS 6 -16.098 -0.079 2.213
45 HB3 LYS 6 HB1 LYS 6 -14.986 -1.430 1.983
46 HG2 LYS 6 HG2 LYS 6 -13.753 -0.779 4.009
47 HG3 LYS 6 HG1 LYS 6 -14.841 0.590 4.241
48 HD2 LYS 6 HD2 LYS 6 -16.756 -1.040 4.342
49 HD3 LYS 6 HD1 LYS 6 -15.575 -2.348 4.325
50 HE2 LYS 6 HE2 LYS 6 -15.102 -2.072 6.523
51 HE3 LYS 6 HE1 LYS 6 -14.911 -0.322 6.335
52 HZ1 LYS 6 HZ1 LYS 6 -17.320 -0.084 6.307
53 HZ2 LYS 6 HZ2 LYS 6 -16.810 -0.834 7.739
54 HZ3 LYS 6 HZ3 LYS 6 -17.514 -1.758 6.501
55 H LEU 7 HN LEU 7 -13.852 -1.032 -0.420
56 HA LEU 7 HA LEU 7 -11.371 -2.345 0.288
57 HB2 LEU 7 HB2 LEU 7 -13.335 -3.154 -1.198
58 HB3 LEU 7 HB1 LEU 7 -12.593 -2.181 -2.467
59 HG LEU 7 HG LEU 7 -10.419 -3.430 -1.975
60 HD11 LEU 7 1HD1 LEU 7 -10.691 -5.667 -0.942
61 HD12 LEU 7 2HD1 LEU 7 -12.354 -5.257 -0.521
62 HD13 LEU 7 3HD1 LEU 7 -11.014 -4.368 0.205
63 HD21 LEU 7 3HD2 LEU 7 -11.872 -3.878 -3.943
64 HD22 LEU 7 1HD2 LEU 7 -12.770 -5.060 -2.990
65 HD23 LEU 7 2HD2 LEU 7 -11.071 -5.337 -3.365
66 H GLU 8 HN GLU 8 -12.159 0.550 -1.629
67 HA GLU 8 HA GLU 8 -9.610 0.755 -2.983
68 HB2 GLU 8 HB2 GLU 8 -11.757 2.792 -2.266
69 HB3 GLU 8 HB1 GLU 8 -10.400 3.125 -3.345
70 HG2 GLU 8 HG2 GLU 8 -11.338 0.824 -4.451
71 HG3 GLU 8 HG1 GLU 8 -12.833 1.500 -3.822
72 H VAL 9 HN VAL 9 -10.930 2.076 0.050
73 HA VAL 9 HA VAL 9 -8.612 3.600 0.848
74 HB VAL 9 HB VAL 9 -10.913 2.291 2.363
75 HG11 VAL 9 1HG1 VAL 9 -10.184 4.257 4.029
76 HG12 VAL 9 2HG1 VAL 9 -8.600 3.911 3.335
77 HG13 VAL 9 3HG1 VAL 9 -9.503 2.636 4.152
78 HG21 VAL 9 3HG2 VAL 9 -11.858 4.533 2.400
79 HG22 VAL 9 1HG2 VAL 9 -11.482 4.102 0.732
80 HG23 VAL 9 2HG2 VAL 9 -10.417 5.189 1.622
81 H PHE 10 HN PHE 10 -9.764 0.301 1.464
82 HA PHE 10 HA PHE 10 -7.674 -0.669 3.154
83 HB2 PHE 10 HB2 PHE 10 -9.686 -1.929 2.990
84 HB3 PHE 10 HB1 PHE 10 -9.698 -1.827 1.241
85 HD1 PHE 10 HD1 PHE 10 -7.719 -3.286 4.070
86 HD2 PHE 10 HD2 PHE 10 -8.895 -3.601 -0.048
87 HE1 PHE 10 HE1 PHE 10 -6.598 -5.495 3.921
88 HE2 PHE 10 HE2 PHE 10 -7.777 -5.812 -0.198
89 HZ PHE 10 HZ PHE 10 -6.628 -6.758 1.785
90 H TRP 11 HN TRP 11 -8.115 -0.694 -0.384
91 HA TRP 11 HA TRP 11 -5.845 -2.142 -1.190
92 HB2 TRP 11 HB2 TRP 11 -7.913 -0.758 -2.413
93 HB3 TRP 11 HB1 TRP 11 -6.496 0.145 -2.906
94 HD1 TRP 11 HD1 TRP 11 -8.326 -1.650 -4.763
95 HE1 TRP 11 HE1 TRP 11 -7.245 -3.536 -6.158
96 HE3 TRP 11 HE3 TRP 11 -4.007 -2.352 -2.123
97 HZ2 TRP 11 HZ2 TRP 11 -4.876 -5.120 -6.149
98 HZ3 TRP 11 HZ3 TRP 11 -2.364 -4.045 -2.833
99 HH2 TRP 11 HH2 TRP 11 -2.783 -5.435 -4.844
100 H ALA 12 HN ALA 12 -6.140 1.463 -1.014
101 HA ALA 12 HA ALA 12 -3.477 2.054 -1.672
102 HB1 ALA 12 HB1 ALA 12 -3.969 4.223 -0.971
103 HB2 ALA 12 HB2 ALA 12 -4.909 3.673 0.414
104 HB3 ALA 12 HB3 ALA 12 -5.590 3.567 -1.211
105 H LYS 13 HN LYS 13 -4.833 1.252 1.524
106 HA LYS 13 HA LYS 13 -2.453 1.734 3.076
107 HB2 LYS 13 HB2 LYS 13 -4.757 1.556 3.972
108 HB3 LYS 13 HB1 LYS 13 -4.812 -0.139 3.498
109 HG2 LYS 13 HG2 LYS 13 -3.415 -0.813 5.192
110 HG3 LYS 13 HG1 LYS 13 -2.530 0.710 5.220
111 HD2 LYS 13 HD2 LYS 13 -5.367 0.957 5.988
112 HD3 LYS 13 HD1 LYS 13 -4.411 -0.037 7.082
113 HE2 LYS 13 HE2 LYS 13 -3.374 2.651 6.179
114 HE3 LYS 13 HE1 LYS 13 -4.505 2.527 7.537
115 HZ1 LYS 13 HZ1 LYS 13 -3.038 0.970 8.625
116 HZ2 LYS 13 HZ2 LYS 13 -2.178 2.386 8.256
117 HZ3 LYS 13 HZ3 LYS 13 -1.963 0.991 7.313
118 H HIS 14 HN HIS 14 -3.772 -1.144 1.453
119 HA HIS 14 HA HIS 14 -1.716 -3.011 2.276
120 HB2 HIS 14 HB2 HIS 14 -4.180 -3.266 1.312
121 HB3 HIS 14 HB1 HIS 14 -3.347 -3.263 -0.239
122 HD1 HIS 14 HD1 HIS 14 -4.256 -5.443 2.530
123 HD2 HIS 14 HD2 HIS 14 -1.253 -5.391 -0.361
124 HE1 HIS 14 HE1 HIS 14 -3.281 -7.779 2.470
125 H MET 15 HN MET 15 -2.336 -1.142 -0.701
126 HA MET 15 HA MET 15 -0.057 -1.996 -2.203
127 HB2 MET 15 HB2 MET 15 -2.259 -0.201 -2.477
128 HB3 MET 15 HB1 MET 15 -0.806 0.724 -2.824
129 HG2 MET 15 HG2 MET 15 -1.694 -1.850 -4.146
130 HG3 MET 15 HG1 MET 15 -1.592 -0.257 -4.884
131 HE1 MET 15 HE1 MET 15 -0.290 -2.845 -6.176
132 HE2 MET 15 HE2 MET 15 -0.191 -3.521 -4.554
133 HE3 MET 15 HE3 MET 15 1.275 -3.355 -5.514
134 H TRP 16 HN TRP 16 -0.514 0.938 -0.143
135 HA TRP 16 HA TRP 16 2.122 1.957 -0.489
136 HB2 TRP 16 HB2 TRP 16 -0.090 2.891 0.712
137 HB3 TRP 16 HB1 TRP 16 0.751 2.305 2.146
138 HD1 TRP 16 HD1 TRP 16 1.771 4.399 3.198
139 HE1 TRP 16 HE1 TRP 16 3.281 6.322 2.380
140 HE3 TRP 16 HE3 TRP 16 1.870 3.350 -1.773
141 HZ2 TRP 16 HZ2 TRP 16 4.391 7.287 -0.087
142 HZ3 TRP 16 HZ3 TRP 16 3.157 4.778 -3.348
143 HH2 TRP 16 HH2 TRP 16 4.414 6.740 -2.509
144 H ASN 17 HN ASN 17 0.913 -0.636 1.576
145 HA ASN 17 HA ASN 17 3.191 -0.836 3.326
146 HB2 ASN 17 HB2 ASN 17 0.840 -1.889 3.526
147 HB3 ASN 17 HB1 ASN 17 1.394 -3.088 2.358
148 HD21 ASN 17 1HD2 ASN 17 1.858 -1.910 5.684
149 HD22 ASN 17 2HD2 ASN 17 2.767 -3.248 6.196
150 H PHE 18 HN PHE 18 2.322 -2.316 0.203
151 HA PHE 18 HA PHE 18 4.594 -4.012 -0.174
152 HB2 PHE 18 HB2 PHE 18 2.388 -3.890 -1.477
153 HB3 PHE 18 HB1 PHE 18 3.031 -2.461 -2.271
154 HD1 PHE 18 HD2 PHE 18 3.660 -6.089 -1.690
155 HD2 PHE 18 HD1 PHE 18 4.555 -2.637 -4.084
156 HE1 PHE 18 HE2 PHE 18 4.861 -7.528 -3.313
157 HE2 PHE 18 HE1 PHE 18 5.756 -4.078 -5.709
158 HZ PHE 18 HZ PHE 18 5.909 -6.523 -5.323
159 H ILE 19 HN ILE 19 3.949 -0.603 -0.930
160 HA ILE 19 HA ILE 19 6.473 -0.026 -2.217
161 HB ILE 19 HB ILE 19 4.100 1.471 -1.135
162 HG12 ILE 19 2HG1 ILE 19 5.082 2.040 -3.829
163 HG13 ILE 19 1HG1 ILE 19 4.816 0.322 -3.566
164 HG21 ILE 19 1HG2 ILE 19 5.345 3.524 -2.290
165 HG22 ILE 19 2HG2 ILE 19 6.774 2.671 -1.711
166 HG23 ILE 19 3HG2 ILE 19 5.529 3.181 -0.572
167 HD11 ILE 19 3HD1 ILE 19 2.663 0.805 -4.077
168 HD12 ILE 19 1HD1 ILE 19 2.861 2.521 -3.727
169 HD13 ILE 19 2HD1 ILE 19 2.572 1.380 -2.414
170 H SER 20 HN SER 20 5.266 0.280 1.139
171 HA SER 20 HA SER 20 7.451 1.685 2.296
172 HB2 SER 20 HB2 SER 20 5.163 1.069 3.272
173 HB3 SER 20 HB1 SER 20 5.836 -0.522 3.593
174 HG SER 20 HG SER 20 6.250 0.629 5.411
175 H GLY 21 HN GLY 21 6.995 -1.838 1.778
176 HA2 GLY 21 HA2 GLY 21 9.426 -2.673 3.055
177 HA3 GLY 21 HA1 GLY 21 8.514 -3.619 1.873
178 H ILE 22 HN ILE 22 8.598 -2.044 -0.371
179 HA ILE 22 HA ILE 22 11.207 -2.545 -1.453
180 HB ILE 22 HB ILE 22 8.866 -0.852 -2.395
181 HG12 ILE 22 2HG1 ILE 22 9.883 -3.521 -3.416
182 HG13 ILE 22 1HG1 ILE 22 8.633 -3.384 -2.184
183 HG21 ILE 22 1HG2 ILE 22 10.529 0.088 -3.700
184 HG22 ILE 22 2HG2 ILE 22 10.153 -1.325 -4.685
185 HG23 ILE 22 3HG2 ILE 22 11.556 -1.343 -3.618
186 HD11 ILE 22 3HD1 ILE 22 8.409 -2.024 -4.878
187 HD12 ILE 22 1HD1 ILE 22 7.136 -2.288 -3.686
188 HD13 ILE 22 2HD1 ILE 22 7.806 -3.653 -4.581
189 H GLN 23 HN GLN 23 9.678 0.432 -0.194
190 HA GLN 23 HA GLN 23 11.688 2.309 -0.858
191 HB2 GLN 23 HB2 GLN 23 9.300 2.515 0.228
192 HB3 GLN 23 HB1 GLN 23 10.190 2.416 1.743
193 HG2 GLN 23 HG2 GLN 23 10.504 4.633 1.553
194 HG3 GLN 23 HG1 GLN 23 11.642 4.272 0.257
195 HE21 GLN 23 1HE2 GLN 23 11.166 5.503 -1.592
196 HE22 GLN 23 2HE2 GLN 23 9.602 5.928 -2.094
197 H TYR 24 HN TYR 24 11.482 0.077 1.852
198 HA TYR 24 HA TYR 24 13.781 1.069 3.311
199 HB2 TYR 24 HB2 TYR 24 12.177 -0.244 4.502
200 HB3 TYR 24 HB1 TYR 24 12.171 -1.502 3.274
201 HD1 TYR 24 HD1 TYR 24 14.509 0.185 5.684
202 HD2 TYR 24 HD2 TYR 24 13.434 -3.431 3.631
203 HE1 TYR 24 HE1 TYR 24 16.253 -1.048 6.941
204 HE2 TYR 24 HE2 TYR 24 15.179 -4.663 4.887
205 HH TYR 24 HH TYR 24 17.657 -3.263 6.468
206 H LEU 25 HN LEU 25 13.286 -1.719 1.119
207 HA LEU 25 HA LEU 25 15.994 -2.589 0.923
208 HB2 LEU 25 HB2 LEU 25 13.443 -2.917 -0.562
209 HB3 LEU 25 HB1 LEU 25 14.899 -3.218 -1.503
210 HG LEU 25 HG LEU 25 15.594 -4.614 0.658
211 HD11 LEU 25 1HD1 LEU 25 13.392 -3.868 1.761
212 HD12 LEU 25 2HD1 LEU 25 13.782 -5.584 1.834
213 HD13 LEU 25 3HD1 LEU 25 12.598 -4.998 0.665
214 HD21 LEU 25 3HD2 LEU 25 13.594 -5.607 -1.406
215 HD22 LEU 25 1HD2 LEU 25 14.674 -6.618 -0.447
216 HD23 LEU 25 2HD2 LEU 25 15.339 -5.508 -1.643
217 H ALA 26 HN ALA 26 14.192 -0.168 -0.966
218 HA ALA 26 HA ALA 26 16.138 0.429 -2.953
219 HB1 ALA 26 HB1 ALA 26 14.082 2.173 -1.556
220 HB2 ALA 26 HB2 ALA 26 13.826 1.220 -3.016
221 HB3 ALA 26 HB3 ALA 26 14.914 2.609 -3.049
222 H GLY 27 HN GLY 27 15.860 1.516 0.430
223 HA2 GLY 27 HA2 GLY 27 17.934 3.525 0.256
224 HA3 GLY 27 HA1 GLY 27 17.200 2.910 1.733
225 H LEU 28 HN LEU 28 17.995 0.033 0.825
226 HA LEU 28 HA LEU 28 20.831 0.268 1.719
227 HB2 LEU 28 HB2 LEU 28 20.533 -1.943 2.661
228 HB3 LEU 28 HB1 LEU 28 19.268 -0.852 3.200
229 HG LEU 28 HG LEU 28 18.125 -1.993 0.960
230 HD11 LEU 28 1HD1 LEU 28 18.445 -4.462 1.328
231 HD12 LEU 28 2HD1 LEU 28 19.810 -4.076 2.373
232 HD13 LEU 28 3HD1 LEU 28 19.861 -3.649 0.663
233 HD21 LEU 28 3HD2 LEU 28 16.889 -3.403 2.670
234 HD22 LEU 28 1HD2 LEU 28 16.943 -1.678 3.028
235 HD23 LEU 28 2HD2 LEU 28 18.015 -2.787 3.879
236 H SER 29 HN SER 29 19.553 0.102 -1.189
237 HA SER 29 HA SER 29 20.702 -2.281 -2.376
238 HB2 SER 29 HB2 SER 29 19.631 0.339 -3.425
239 HB3 SER 29 HB1 SER 29 20.350 -0.847 -4.501
240 HG SER 29 HG SER 29 18.776 -2.327 -3.826
241 H THR 30 HN THR 30 21.852 1.064 -1.959
242 HA THR 30 HA THR 30 24.502 0.267 -3.083
243 HB THR 30 HB THR 30 23.132 1.943 -4.328
244 HG1 THR 30 HG1 THR 30 25.616 2.737 -3.229
245 HG21 THR 30 3HG2 THR 30 23.205 4.310 -3.337
246 HG22 THR 30 1HG2 THR 30 23.467 3.523 -1.780
247 HG23 THR 30 2HG2 THR 30 21.992 3.206 -2.692
Start of MODEL 16
1 H1 GLN 1 HT1 GLN 1 -22.603 -3.766 4.111
2 H2 GLN 1 HT2 GLN 1 -22.743 -2.408 3.105
3 H3 GLN 1 HT3 GLN 1 -22.259 -2.223 4.721
4 HA GLN 1 HA GLN 1 -20.326 -2.016 3.295
5 HB2 GLN 1 HB2 GLN 1 -20.093 -3.014 5.502
6 HB3 GLN 1 HB1 GLN 1 -20.577 -4.588 4.882
7 HG2 GLN 1 HG2 GLN 1 -18.309 -3.476 3.400
8 HG3 GLN 1 HG1 GLN 1 -17.971 -3.646 5.120
9 HE21 GLN 1 1HE2 GLN 1 -17.419 -5.736 5.843
10 HE22 GLN 1 2HE2 GLN 1 -17.668 -7.149 4.938
11 H THR 2 HN THR 2 -19.388 -2.586 1.338
12 HA THR 2 HA THR 2 -19.963 -5.230 0.138
13 HB THR 2 HB THR 2 -20.560 -2.591 -1.241
14 HG1 THR 2 HG1 THR 2 -22.427 -2.800 -0.351
15 HG21 THR 2 3HG2 THR 2 -21.446 -5.283 -2.214
16 HG22 THR 2 1HG2 THR 2 -19.816 -4.724 -2.590
17 HG23 THR 2 2HG2 THR 2 -21.212 -3.789 -3.119
18 H ASN 3 HN ASN 3 -18.708 -2.728 -1.919
19 HA ASN 3 HA ASN 3 -16.103 -4.115 -1.957
20 HB2 ASN 3 HB2 ASN 3 -17.343 -1.980 -3.704
21 HB3 ASN 3 HB1 ASN 3 -15.743 -2.663 -3.974
22 HD21 ASN 3 1HD2 ASN 3 -19.023 -3.094 -4.813
23 HD22 ASN 3 2HD2 ASN 3 -18.908 -4.706 -5.333
24 H TRP 4 HN TRP 4 -17.360 -1.464 -0.312
25 HA TRP 4 HA TRP 4 -15.152 0.388 -0.406
26 HB2 TRP 4 HB2 TRP 4 -17.277 -0.170 1.699
27 HB3 TRP 4 HB1 TRP 4 -16.221 1.233 1.714
28 HD1 TRP 4 HD1 TRP 4 -19.545 0.839 1.183
29 HE1 TRP 4 HE1 TRP 4 -20.542 2.209 -0.755
30 HE3 TRP 4 HE3 TRP 4 -15.284 1.921 -1.419
31 HZ2 TRP 4 HZ2 TRP 4 -19.650 3.586 -3.105
32 HZ3 TRP 4 HZ3 TRP 4 -15.386 3.257 -3.495
33 HH2 TRP 4 HH2 TRP 4 -17.558 4.091 -4.343
34 H GLN 5 HN GLN 5 -16.078 -2.054 2.050
35 HA GLN 5 HA GLN 5 -13.733 -1.877 3.646
36 HB2 GLN 5 HB2 GLN 5 -15.942 -3.783 3.185
37 HB3 GLN 5 HB1 GLN 5 -14.459 -4.538 3.771
38 HG2 GLN 5 HG2 GLN 5 -14.698 -2.216 5.314
39 HG3 GLN 5 HG1 GLN 5 -16.341 -2.843 5.205
40 HE21 GLN 5 1HE2 GLN 5 -12.985 -3.961 5.959
41 HE22 GLN 5 2HE2 GLN 5 -13.488 -5.142 7.067
42 H LYS 6 HN LYS 6 -14.357 -3.730 0.666
43 HA LYS 6 HA LYS 6 -11.878 -5.192 0.575
44 HB2 LYS 6 HB2 LYS 6 -13.739 -4.217 -1.630
45 HB3 LYS 6 HB1 LYS 6 -12.471 -5.418 -1.846
46 HG2 LYS 6 HG2 LYS 6 -13.621 -6.779 -0.019
47 HG3 LYS 6 HG1 LYS 6 -14.975 -5.659 -0.163
48 HD2 LYS 6 HD2 LYS 6 -15.244 -6.214 -2.521
49 HD3 LYS 6 HD1 LYS 6 -13.828 -7.264 -2.464
50 HE2 LYS 6 HE2 LYS 6 -15.177 -8.438 -0.493
51 HE3 LYS 6 HE1 LYS 6 -16.567 -7.724 -1.330
52 HZ1 LYS 6 HZ1 LYS 6 -16.026 -9.913 -2.225
53 HZ2 LYS 6 HZ2 LYS 6 -14.460 -9.389 -2.613
54 HZ3 LYS 6 HZ3 LYS 6 -15.812 -8.707 -3.394
55 H LEU 7 HN LEU 7 -12.927 -2.026 -0.697
56 HA LEU 7 HA LEU 7 -10.484 -1.305 -2.050
57 HB2 LEU 7 HB2 LEU 7 -12.785 -0.318 -2.404
58 HB3 LEU 7 HB1 LEU 7 -12.650 0.440 -0.826
59 HG LEU 7 HG LEU 7 -10.314 0.982 -2.505
60 HD11 LEU 7 1HD1 LEU 7 -11.416 2.477 -4.080
61 HD12 LEU 7 2HD1 LEU 7 -12.996 2.074 -3.411
62 HD13 LEU 7 3HD1 LEU 7 -12.068 0.851 -4.280
63 HD21 LEU 7 3HD2 LEU 7 -12.247 3.036 -1.472
64 HD22 LEU 7 1HD2 LEU 7 -10.486 3.087 -1.527
65 HD23 LEU 7 2HD2 LEU 7 -11.301 2.098 -0.317
66 H GLU 8 HN GLU 8 -11.741 -0.768 1.262
67 HA GLU 8 HA GLU 8 -9.719 1.012 2.209
68 HB2 GLU 8 HB2 GLU 8 -11.579 -1.015 3.467
69 HB3 GLU 8 HB1 GLU 8 -10.440 -0.104 4.456
70 HG2 GLU 8 HG2 GLU 8 -11.552 1.876 4.173
71 HG3 GLU 8 HG1 GLU 8 -12.039 1.490 2.530
72 H VAL 9 HN VAL 9 -9.907 -2.562 2.254
73 HA VAL 9 HA VAL 9 -7.364 -3.033 3.529
74 HB VAL 9 HB VAL 9 -9.091 -4.690 1.640
75 HG11 VAL 9 1HG1 VAL 9 -6.854 -5.656 3.449
76 HG12 VAL 9 2HG1 VAL 9 -6.727 -5.507 1.696
77 HG13 VAL 9 3HG1 VAL 9 -7.866 -6.652 2.403
78 HG21 VAL 9 3HG2 VAL 9 -9.902 -5.765 3.650
79 HG22 VAL 9 1HG2 VAL 9 -10.084 -4.024 3.856
80 HG23 VAL 9 2HG2 VAL 9 -8.754 -4.870 4.646
81 H PHE 10 HN PHE 10 -8.417 -2.790 0.145
82 HA PHE 10 HA PHE 10 -5.957 -3.315 -1.199
83 HB2 PHE 10 HB2 PHE 10 -7.953 -3.337 -2.474
84 HB3 PHE 10 HB1 PHE 10 -8.527 -1.852 -1.755
85 HD1 PHE 10 HD1 PHE 10 -5.751 -3.125 -3.939
86 HD2 PHE 10 HD2 PHE 10 -8.344 0.145 -2.925
87 HE1 PHE 10 HE1 PHE 10 -4.863 -1.827 -5.859
88 HE2 PHE 10 HE2 PHE 10 -7.457 1.444 -4.846
89 HZ PHE 10 HZ PHE 10 -5.716 0.458 -6.311
90 H TRP 11 HN TRP 11 -7.475 -0.256 -0.193
91 HA TRP 11 HA TRP 11 -5.539 1.610 -1.040
92 HB2 TRP 11 HB2 TRP 11 -7.952 1.667 0.250
93 HB3 TRP 11 HB1 TRP 11 -6.872 2.126 1.549
94 HD1 TRP 11 HD1 TRP 11 -9.015 4.009 0.308
95 HE1 TRP 11 HE1 TRP 11 -8.329 6.261 -0.746
96 HE3 TRP 11 HE3 TRP 11 -4.099 3.065 -0.695
97 HZ2 TRP 11 HZ2 TRP 11 -6.008 7.491 -1.861
98 HZ3 TRP 11 HZ3 TRP 11 -2.679 4.782 -1.745
99 HH2 TRP 11 HH2 TRP 11 -3.620 7.000 -2.334
100 H ALA 12 HN ALA 12 -5.831 -0.008 2.187
101 HA ALA 12 HA ALA 12 -3.592 1.261 3.358
102 HB1 ALA 12 HB1 ALA 12 -5.436 -0.335 4.345
103 HB2 ALA 12 HB2 ALA 12 -3.835 -0.308 5.085
104 HB3 ALA 12 HB3 ALA 12 -4.270 -1.608 3.977
105 H LYS 13 HN LYS 13 -3.719 -1.824 1.537
106 HA LYS 13 HA LYS 13 -0.927 -2.476 1.713
107 HB2 LYS 13 HB2 LYS 13 -2.704 -4.058 1.058
108 HB3 LYS 13 HB1 LYS 13 -3.055 -3.093 -0.370
109 HG2 LYS 13 HG2 LYS 13 -1.713 -4.919 -1.120
110 HG3 LYS 13 HG1 LYS 13 -0.659 -3.513 -1.110
111 HD2 LYS 13 HD2 LYS 13 0.690 -5.076 -0.056
112 HD3 LYS 13 HD1 LYS 13 -0.084 -4.326 1.337
113 HE2 LYS 13 HE2 LYS 13 -1.803 -6.430 0.421
114 HE3 LYS 13 HE1 LYS 13 -0.161 -7.080 0.555
115 HZ1 LYS 13 HZ1 LYS 13 0.025 -6.334 2.771
116 HZ2 LYS 13 HZ2 LYS 13 -1.489 -7.096 2.665
117 HZ3 LYS 13 HZ3 LYS 13 -1.390 -5.404 2.679
118 H HIS 14 HN HIS 14 -2.845 -0.670 -0.682
119 HA HIS 14 HA HIS 14 -0.794 -0.040 -2.564
120 HB2 HIS 14 HB2 HIS 14 -3.351 0.171 -2.706
121 HB3 HIS 14 HB1 HIS 14 -3.178 1.669 -1.799
122 HD1 HIS 14 HD1 HIS 14 -2.667 0.169 -5.156
123 HD2 HIS 14 HD2 HIS 14 -1.806 3.767 -3.240
124 HE1 HIS 14 HE1 HIS 14 -2.023 1.810 -6.976
125 H MET 15 HN MET 15 -2.080 1.849 0.198
126 HA MET 15 HA MET 15 -0.265 4.059 0.021
127 HB2 MET 15 HB2 MET 15 -2.502 3.589 1.420
128 HB3 MET 15 HB1 MET 15 -1.345 3.112 2.655
129 HG2 MET 15 HG2 MET 15 -1.140 5.285 3.178
130 HG3 MET 15 HG1 MET 15 -0.303 5.503 1.645
131 HE1 MET 15 HE1 MET 15 -1.016 8.004 1.331
132 HE2 MET 15 HE2 MET 15 -2.261 8.112 0.092
133 HE3 MET 15 HE3 MET 15 -0.966 6.936 -0.085
134 H TRP 16 HN TRP 16 -0.116 1.005 1.921
135 HA TRP 16 HA TRP 16 2.371 1.614 3.224
136 HB2 TRP 16 HB2 TRP 16 0.497 -0.411 3.395
137 HB3 TRP 16 HB1 TRP 16 1.860 -1.235 2.644
138 HD1 TRP 16 HD1 TRP 16 2.881 -2.522 4.593
139 HE1 TRP 16 HE1 TRP 16 3.842 -1.893 6.908
140 HE3 TRP 16 HE3 TRP 16 1.516 2.376 4.787
141 HZ2 TRP 16 HZ2 TRP 16 4.004 0.412 8.615
142 HZ3 TRP 16 HZ3 TRP 16 2.078 3.774 6.757
143 HH2 TRP 16 HH2 TRP 16 3.319 2.800 8.668
144 H ASN 17 HN ASN 17 1.615 0.193 0.060
145 HA ASN 17 HA ASN 17 4.275 -0.699 -0.544
146 HB2 ASN 17 HB2 ASN 17 1.923 -1.136 -1.672
147 HB3 ASN 17 HB1 ASN 17 2.297 0.310 -2.598
148 HD21 ASN 17 1HD2 ASN 17 2.415 -1.034 -4.595
149 HD22 ASN 17 2HD2 ASN 17 3.767 -2.020 -4.868
150 H PHE 18 HN PHE 18 2.557 2.378 -0.910
151 HA PHE 18 HA PHE 18 4.547 3.825 -2.415
152 HB2 PHE 18 HB2 PHE 18 2.072 4.318 -2.095
153 HB3 PHE 18 HB1 PHE 18 2.466 4.855 -0.468
154 HD1 PHE 18 HD2 PHE 18 3.393 5.438 -4.050
155 HD2 PHE 18 HD1 PHE 18 3.147 7.066 -0.084
156 HE1 PHE 18 HE2 PHE 18 4.020 7.670 -4.930
157 HE2 PHE 18 HE1 PHE 18 3.774 9.298 -0.963
158 HZ PHE 18 HZ PHE 18 4.210 9.602 -3.386
159 H ILE 19 HN ILE 19 4.428 2.784 0.893
160 HA ILE 19 HA ILE 19 6.426 4.803 1.769
161 HB ILE 19 HB ILE 19 4.081 3.419 2.903
162 HG12 ILE 19 2HG1 ILE 19 4.277 5.482 4.429
163 HG13 ILE 19 1HG1 ILE 19 5.590 5.985 3.368
164 HG21 ILE 19 1HG2 ILE 19 4.951 3.516 5.252
165 HG22 ILE 19 2HG2 ILE 19 6.577 3.688 4.592
166 HG23 ILE 19 3HG2 ILE 19 5.650 2.220 4.282
167 HD11 ILE 19 3HD1 ILE 19 2.792 5.296 2.427
168 HD12 ILE 19 1HD1 ILE 19 4.097 5.961 1.446
169 HD13 ILE 19 2HD1 ILE 19 3.368 6.936 2.721
170 H SER 20 HN SER 20 5.751 1.255 1.727
171 HA SER 20 HA SER 20 8.360 0.545 2.820
172 HB2 SER 20 HB2 SER 20 6.135 -0.972 1.432
173 HB3 SER 20 HB1 SER 20 7.607 -1.750 1.996
174 HG SER 20 HG SER 20 5.434 -1.064 3.377
175 H GLY 21 HN GLY 21 6.895 0.380 -0.458
176 HA2 GLY 21 HA2 GLY 21 9.171 -0.597 -1.838
177 HA3 GLY 21 HA1 GLY 21 7.872 0.344 -2.580
178 H ILE 22 HN ILE 22 8.083 2.746 -1.223
179 HA ILE 22 HA ILE 22 10.268 4.044 -2.570
180 HB ILE 22 HB ILE 22 8.073 4.766 -0.661
181 HG12 ILE 22 2HG1 ILE 22 7.730 6.522 -2.463
182 HG13 ILE 22 1HG1 ILE 22 9.032 5.746 -3.355
183 HG21 ILE 22 1HG2 ILE 22 10.421 6.591 -1.246
184 HG22 ILE 22 2HG2 ILE 22 9.873 6.046 0.339
185 HG23 ILE 22 3HG2 ILE 22 8.869 7.139 -0.611
186 HD11 ILE 22 3HD1 ILE 22 7.778 3.831 -3.777
187 HD12 ILE 22 1HD1 ILE 22 6.532 5.075 -3.822
188 HD13 ILE 22 2HD1 ILE 22 6.731 4.079 -2.381
189 H GLN 23 HN GLN 23 9.758 3.178 0.887
190 HA GLN 23 HA GLN 23 12.216 4.207 1.891
191 HB2 GLN 23 HB2 GLN 23 10.220 3.427 3.212
192 HB3 GLN 23 HB1 GLN 23 10.704 1.769 2.859
193 HG2 GLN 23 HG2 GLN 23 11.743 2.065 4.902
194 HG3 GLN 23 HG1 GLN 23 13.036 2.608 3.834
195 HE21 GLN 23 1HE2 GLN 23 10.284 3.877 5.783
196 HE22 GLN 23 2HE2 GLN 23 10.987 5.403 6.037
197 H TYR 24 HN TYR 24 11.411 1.032 0.600
198 HA TYR 24 HA TYR 24 13.873 -0.337 1.027
199 HB2 TYR 24 HB2 TYR 24 11.868 -1.504 0.356
200 HB3 TYR 24 HB1 TYR 24 11.734 -0.542 -1.111
201 HD1 TYR 24 HD2 TYR 24 14.167 -2.811 0.631
202 HD2 TYR 24 HD1 TYR 24 12.585 -1.393 -3.102
203 HE1 TYR 24 HE2 TYR 24 15.582 -4.441 -0.586
204 HE2 TYR 24 HE1 TYR 24 14.000 -3.022 -4.321
205 HH TYR 24 HH TYR 24 15.182 -5.564 -3.285
206 H LEU 25 HN LEU 25 12.756 1.553 -1.778
207 HA LEU 25 HA LEU 25 15.094 1.259 -3.398
208 HB2 LEU 25 HB2 LEU 25 12.585 2.740 -3.387
209 HB3 LEU 25 HB1 LEU 25 13.903 3.682 -4.072
210 HG LEU 25 HG LEU 25 14.390 1.307 -5.274
211 HD11 LEU 25 1HD1 LEU 25 12.399 0.278 -4.186
212 HD12 LEU 25 2HD1 LEU 25 12.300 0.263 -5.946
213 HD13 LEU 25 3HD1 LEU 25 11.373 1.445 -5.021
214 HD21 LEU 25 3HD2 LEU 25 12.344 3.350 -6.214
215 HD22 LEU 25 1HD2 LEU 25 13.240 2.234 -7.245
216 HD23 LEU 25 2HD2 LEU 25 14.092 3.513 -6.383
217 H ALA 26 HN ALA 26 14.395 3.564 -0.825
218 HA ALA 26 HA ALA 26 15.994 5.733 -1.116
219 HB1 ALA 26 HB1 ALA 26 16.008 3.940 1.321
220 HB2 ALA 26 HB2 ALA 26 14.703 5.049 0.901
221 HB3 ALA 26 HB3 ALA 26 16.303 5.678 1.296
222 H GLY 27 HN GLY 27 17.212 2.564 -0.177
223 HA2 GLY 27 HA2 GLY 27 19.684 2.658 -1.573
224 HA3 GLY 27 HA1 GLY 27 19.981 3.115 0.115
225 H LEU 28 HN LEU 28 17.708 0.784 -1.383
226 HA LEU 28 HA LEU 28 17.206 -1.425 -0.874
227 HB2 LEU 28 HB2 LEU 28 19.757 -1.346 -1.664
228 HB3 LEU 28 HB1 LEU 28 20.060 -1.800 0.012
229 HG LEU 28 HG LEU 28 18.166 -3.587 -0.455
230 HD11 LEU 28 1HD1 LEU 28 19.307 -3.071 -3.218
231 HD12 LEU 28 2HD1 LEU 28 17.645 -2.756 -2.719
232 HD13 LEU 28 3HD1 LEU 28 18.249 -4.411 -2.776
233 HD21 LEU 28 3HD2 LEU 28 20.442 -4.172 0.169
234 HD22 LEU 28 1HD2 LEU 28 21.029 -3.773 -1.446
235 HD23 LEU 28 2HD2 LEU 28 19.971 -5.165 -1.210
236 H SER 29 HN SER 29 16.538 0.400 1.051
237 HA SER 29 HA SER 29 17.581 -0.362 3.667
238 HB2 SER 29 HB2 SER 29 15.153 1.348 3.137
239 HB3 SER 29 HB1 SER 29 16.271 1.418 4.485
240 HG SER 29 HG SER 29 17.875 2.079 2.906
241 H THR 30 HN THR 30 14.037 -0.160 3.121
242 HA THR 30 HA THR 30 13.858 -3.015 3.974
243 HB THR 30 HB THR 30 12.149 -0.779 5.084
244 HG1 THR 30 HG1 THR 30 14.407 -1.980 6.322
245 HG21 THR 30 3HG2 THR 30 11.391 -2.355 6.654
246 HG22 THR 30 1HG2 THR 30 12.711 -3.473 6.309
247 HG23 THR 30 2HG2 THR 30 11.420 -3.241 5.131
Start of MODEL 17
1 H1 GLN 1 HT1 GLN 1 23.983 -2.326 -3.946
2 H2 GLN 1 HT2 GLN 1 22.708 -1.916 -4.988
3 H3 GLN 1 HT3 GLN 1 23.227 -3.528 -4.874
4 HA GLN 1 HA GLN 1 21.174 -3.291 -3.656
5 HB2 GLN 1 HB2 GLN 1 23.109 -4.732 -2.872
6 HB3 GLN 1 HB1 GLN 1 23.543 -3.429 -1.771
7 HG2 GLN 1 HG2 GLN 1 22.229 -4.870 -0.450
8 HG3 GLN 1 HG1 GLN 1 21.106 -3.596 -0.915
9 HE21 GLN 1 1HE2 GLN 1 22.053 -6.975 -1.679
10 HE22 GLN 1 2HE2 GLN 1 20.585 -7.368 -2.434
11 H THR 2 HN THR 2 19.844 -1.668 -2.956
12 HA THR 2 HA THR 2 21.037 0.680 -1.534
13 HB THR 2 HB THR 2 18.400 0.544 -2.994
14 HG1 THR 2 HG1 THR 2 19.792 1.810 -4.577
15 HG21 THR 2 3HG2 THR 2 20.005 3.033 -2.589
16 HG22 THR 2 1HG2 THR 2 19.111 2.383 -1.216
17 HG23 THR 2 2HG2 THR 2 18.259 2.826 -2.692
18 H ASN 3 HN ASN 3 18.213 -1.420 -1.582
19 HA ASN 3 HA ASN 3 16.847 -2.255 0.074
20 HB2 ASN 3 HB2 ASN 3 19.088 -2.067 1.446
21 HB3 ASN 3 HB1 ASN 3 18.289 -0.686 2.196
22 HD21 ASN 3 1HD2 ASN 3 18.295 -4.209 2.006
23 HD22 ASN 3 2HD2 ASN 3 17.075 -4.443 3.160
24 H TRP 4 HN TRP 4 17.642 1.143 0.705
25 HA TRP 4 HA TRP 4 15.097 1.952 1.716
26 HB2 TRP 4 HB2 TRP 4 16.949 3.420 1.966
27 HB3 TRP 4 HB1 TRP 4 17.384 3.302 0.268
28 HD1 TRP 4 HD1 TRP 4 16.489 5.107 -1.293
29 HE1 TRP 4 HE1 TRP 4 14.835 7.069 -1.058
30 HE3 TRP 4 HE3 TRP 4 14.595 4.120 3.349
31 HZ2 TRP 4 HZ2 TRP 4 12.962 8.085 0.841
32 HZ3 TRP 4 HZ3 TRP 4 12.878 5.599 4.343
33 HH2 TRP 4 HH2 TRP 4 12.057 7.578 3.100
34 H GLN 5 HN GLN 5 16.375 1.877 -1.612
35 HA GLN 5 HA GLN 5 14.122 2.889 -3.021
36 HB2 GLN 5 HB2 GLN 5 16.566 1.319 -3.562
37 HB3 GLN 5 HB1 GLN 5 15.257 1.003 -4.694
38 HG2 GLN 5 HG2 GLN 5 15.423 3.843 -4.243
39 HG3 GLN 5 HG1 GLN 5 17.021 3.227 -4.659
40 HE21 GLN 5 1HE2 GLN 5 13.597 2.724 -5.802
41 HE22 GLN 5 2HE2 GLN 5 14.031 2.700 -7.442
42 H LYS 6 HN LYS 6 14.836 -0.358 -1.746
43 HA LYS 6 HA LYS 6 12.505 -1.641 -2.974
44 HB2 LYS 6 HB2 LYS 6 14.437 -2.492 -0.784
45 HB3 LYS 6 HB1 LYS 6 13.253 -3.544 -1.551
46 HG2 LYS 6 HG2 LYS 6 15.038 -2.101 -3.421
47 HG3 LYS 6 HG1 LYS 6 15.833 -3.293 -2.396
48 HD2 LYS 6 HD2 LYS 6 14.394 -5.049 -3.161
49 HD3 LYS 6 HD1 LYS 6 13.328 -3.911 -3.979
50 HE2 LYS 6 HE2 LYS 6 16.246 -4.143 -4.745
51 HE3 LYS 6 HE1 LYS 6 15.016 -5.201 -5.456
52 HZ1 LYS 6 HZ1 LYS 6 13.721 -3.158 -5.994
53 HZ2 LYS 6 HZ2 LYS 6 15.188 -3.288 -6.835
54 HZ3 LYS 6 HZ3 LYS 6 15.056 -2.231 -5.508
55 H LEU 7 HN LEU 7 13.436 -0.328 0.209
56 HA LEU 7 HA LEU 7 11.170 -1.135 1.734
57 HB2 LEU 7 HB2 LEU 7 13.363 -0.250 2.567
58 HB3 LEU 7 HB1 LEU 7 12.883 1.348 2.006
59 HG LEU 7 HG LEU 7 10.821 0.104 3.666
60 HD11 LEU 7 1HD1 LEU 7 13.517 0.680 4.932
61 HD12 LEU 7 2HD1 LEU 7 12.785 -0.917 4.763
62 HD13 LEU 7 3HD1 LEU 7 12.029 0.295 5.796
63 HD21 LEU 7 3HD2 LEU 7 11.440 2.619 2.911
64 HD22 LEU 7 1HD2 LEU 7 12.277 2.582 4.463
65 HD23 LEU 7 2HD2 LEU 7 10.543 2.270 4.386
66 H GLU 8 HN GLU 8 11.665 1.727 -0.370
67 HA GLU 8 HA GLU 8 9.261 3.116 0.444
68 HB2 GLU 8 HB2 GLU 8 10.959 3.198 -2.078
69 HB3 GLU 8 HB1 GLU 8 9.689 4.364 -1.709
70 HG2 GLU 8 HG2 GLU 8 11.145 4.402 0.617
71 HG3 GLU 8 HG1 GLU 8 12.404 4.120 -0.579
72 H VAL 9 HN VAL 9 10.027 0.922 -2.267
73 HA VAL 9 HA VAL 9 7.400 0.841 -3.446
74 HB VAL 9 HB VAL 9 9.747 -1.104 -3.388
75 HG11 VAL 9 1HG1 VAL 9 7.528 -2.201 -3.981
76 HG12 VAL 9 2HG1 VAL 9 8.776 -2.300 -5.220
77 HG13 VAL 9 3HG1 VAL 9 7.468 -1.130 -5.381
78 HG21 VAL 9 3HG2 VAL 9 8.867 1.116 -5.221
79 HG22 VAL 9 1HG2 VAL 9 9.871 -0.201 -5.829
80 HG23 VAL 9 2HG2 VAL 9 10.458 0.821 -4.520
81 H PHE 10 HN PHE 10 9.065 -1.080 -0.965
82 HA PHE 10 HA PHE 10 7.043 -3.023 -0.400
83 HB2 PHE 10 HB2 PHE 10 9.275 -3.378 0.378
84 HB3 PHE 10 HB1 PHE 10 9.366 -1.770 1.069
85 HD1 PHE 10 HD2 PHE 10 7.442 -4.965 1.411
86 HD2 PHE 10 HD1 PHE 10 9.007 -1.468 3.351
87 HE1 PHE 10 HE2 PHE 10 6.706 -5.858 3.608
88 HE2 PHE 10 HE1 PHE 10 8.270 -2.360 5.549
89 HZ PHE 10 HZ PHE 10 7.121 -4.552 5.676
90 H TRP 11 HN TRP 11 7.829 0.095 1.180
91 HA TRP 11 HA TRP 11 5.766 0.148 3.110
92 HB2 TRP 11 HB2 TRP 11 7.845 1.793 2.356
93 HB3 TRP 11 HB1 TRP 11 6.451 2.743 1.883
94 HD1 TRP 11 HD1 TRP 11 8.423 3.512 4.194
95 HE1 TRP 11 HE1 TRP 11 7.535 3.867 6.587
96 HE3 TRP 11 HE3 TRP 11 4.058 0.876 3.919
97 HZ2 TRP 11 HZ2 TRP 11 5.274 3.130 8.168
98 HZ3 TRP 11 HZ3 TRP 11 2.560 0.719 5.872
99 HH2 TRP 11 HH2 TRP 11 3.154 1.840 7.999
100 H ALA 12 HN ALA 12 5.821 1.678 -0.153
101 HA ALA 12 HA ALA 12 3.202 2.712 -0.096
102 HB1 ALA 12 HB1 ALA 12 3.414 2.838 -2.529
103 HB2 ALA 12 HB2 ALA 12 4.720 1.655 -2.495
104 HB3 ALA 12 HB3 ALA 12 4.955 3.248 -1.774
105 H LYS 13 HN LYS 13 4.245 -0.615 -0.874
106 HA LYS 13 HA LYS 13 1.737 -1.501 -1.990
107 HB2 LYS 13 HB2 LYS 13 4.108 -2.574 -2.034
108 HB3 LYS 13 HB1 LYS 13 3.705 -3.210 -0.441
109 HG2 LYS 13 HG2 LYS 13 1.597 -3.628 -2.458
110 HG3 LYS 13 HG1 LYS 13 3.110 -4.445 -2.829
111 HD2 LYS 13 HD2 LYS 13 2.197 -4.676 -0.014
112 HD3 LYS 13 HD1 LYS 13 1.199 -5.496 -1.214
113 HE2 LYS 13 HE2 LYS 13 3.359 -6.517 -2.131
114 HE3 LYS 13 HE1 LYS 13 4.146 -5.928 -0.657
115 HZ1 LYS 13 HZ1 LYS 13 1.697 -7.619 -0.680
116 HZ2 LYS 13 HZ2 LYS 13 2.580 -7.120 0.685
117 HZ3 LYS 13 HZ3 LYS 13 3.264 -8.206 -0.424
118 H HIS 14 HN HIS 14 3.120 -1.636 1.306
119 HA HIS 14 HA HIS 14 0.799 -2.827 2.568
120 HB2 HIS 14 HB2 HIS 14 3.209 -2.766 3.414
121 HB3 HIS 14 HB1 HIS 14 2.948 -1.065 3.802
122 HD1 HIS 14 HD1 HIS 14 2.201 -4.499 4.980
123 HD2 HIS 14 HD2 HIS 14 0.962 -0.624 5.886
124 HE1 HIS 14 HE1 HIS 14 0.975 -4.638 7.191
125 H MET 15 HN MET 15 1.990 0.512 2.151
126 HA MET 15 HA MET 15 -0.041 1.886 3.627
127 HB2 MET 15 HB2 MET 15 2.011 2.498 1.551
128 HB3 MET 15 HB1 MET 15 0.702 3.662 1.692
129 HG2 MET 15 HG2 MET 15 2.101 2.696 4.171
130 HG3 MET 15 HG1 MET 15 2.840 3.949 3.178
131 HE1 MET 15 HE1 MET 15 -0.383 2.978 5.331
132 HE2 MET 15 HE2 MET 15 -0.220 4.411 6.338
133 HE3 MET 15 HE3 MET 15 1.162 3.344 6.122
134 H TRP 16 HN TRP 16 0.181 1.162 0.096
135 HA TRP 16 HA TRP 16 -2.431 2.203 -0.507
136 HB2 TRP 16 HB2 TRP 16 -0.332 1.444 -2.028
137 HB3 TRP 16 HB1 TRP 16 -1.307 -0.019 -2.161
138 HD1 TRP 16 HD1 TRP 16 -2.463 0.170 -4.438
139 HE1 TRP 16 HE1 TRP 16 -3.901 1.949 -5.623
140 HE3 TRP 16 HE3 TRP 16 -2.031 3.977 -1.100
141 HZ2 TRP 16 HZ2 TRP 16 -4.763 4.659 -5.197
142 HZ3 TRP 16 HZ3 TRP 16 -3.165 6.152 -1.498
143 HH2 TRP 16 HH2 TRP 16 -4.527 6.494 -3.539
144 H ASN 17 HN ASN 17 -1.294 -0.944 0.647
145 HA ASN 17 HA ASN 17 -3.700 -2.425 0.155
146 HB2 ASN 17 HB2 ASN 17 -1.599 -3.549 0.673
147 HB3 ASN 17 HB1 ASN 17 -1.455 -2.670 2.192
148 HD21 ASN 17 1HD2 ASN 17 -3.908 -4.838 0.596
149 HD22 ASN 17 2HD2 ASN 17 -4.260 -5.670 2.031
150 H PHE 18 HN PHE 18 -2.575 -0.356 2.828
151 HA PHE 18 HA PHE 18 -4.751 -0.795 4.657
152 HB2 PHE 18 HB2 PHE 18 -2.495 0.357 5.070
153 HB3 PHE 18 HB1 PHE 18 -3.126 1.739 4.188
154 HD1 PHE 18 HD2 PHE 18 -3.685 -0.392 7.199
155 HD2 PHE 18 HD1 PHE 18 -4.630 3.285 5.187
156 HE1 PHE 18 HE2 PHE 18 -4.816 0.436 9.242
157 HE2 PHE 18 HE1 PHE 18 -5.759 4.112 7.233
158 HZ PHE 18 HZ PHE 18 -5.853 2.688 9.262
159 H ILE 19 HN ILE 19 -4.155 1.542 2.042
160 HA ILE 19 HA ILE 19 -6.632 3.003 2.198
161 HB ILE 19 HB ILE 19 -4.476 2.541 0.132
162 HG12 ILE 19 2HG1 ILE 19 -3.943 3.915 2.118
163 HG13 ILE 19 1HG1 ILE 19 -3.866 4.844 0.629
164 HG21 ILE 19 1HG2 ILE 19 -5.530 4.589 -1.050
165 HG22 ILE 19 2HG2 ILE 19 -7.012 4.107 -0.228
166 HG23 ILE 19 3HG2 ILE 19 -6.220 2.994 -1.342
167 HD11 ILE 19 3HD1 ILE 19 -6.122 4.859 2.658
168 HD12 ILE 19 1HD1 ILE 19 -6.182 5.690 1.104
169 HD13 ILE 19 2HD1 ILE 19 -4.998 6.171 2.316
170 H SER 20 HN SER 20 -5.571 0.158 0.359
171 HA SER 20 HA SER 20 -7.762 -0.276 -1.366
172 HB2 SER 20 HB2 SER 20 -5.639 -1.429 -1.545
173 HB3 SER 20 HB1 SER 20 -5.816 -2.108 0.057
174 HG SER 20 HG SER 20 -7.217 -3.546 -0.716
175 H GLY 21 HN GLY 21 -7.314 -1.377 2.029
176 HA2 GLY 21 HA2 GLY 21 -9.788 -2.841 2.184
177 HA3 GLY 21 HA1 GLY 21 -8.823 -2.300 3.561
178 H ILE 22 HN ILE 22 -8.830 0.429 3.278
179 HA ILE 22 HA ILE 22 -11.362 1.246 4.333
180 HB ILE 22 HB ILE 22 -9.071 2.799 3.083
181 HG12 ILE 22 2HG1 ILE 22 -8.386 1.511 5.048
182 HG13 ILE 22 1HG1 ILE 22 -8.415 3.223 5.436
183 HG21 ILE 22 1HG2 ILE 22 -11.580 3.725 4.403
184 HG22 ILE 22 2HG2 ILE 22 -10.651 4.464 3.100
185 HG23 ILE 22 3HG2 ILE 22 -10.091 4.597 4.765
186 HD11 ILE 22 3HD1 ILE 22 -9.745 2.734 7.182
187 HD12 ILE 22 1HD1 ILE 22 -9.874 1.055 6.663
188 HD13 ILE 22 2HD1 ILE 22 -11.003 2.258 6.042
189 H GLN 23 HN GLN 23 -9.929 1.674 1.091
190 HA GLN 23 HA GLN 23 -12.111 3.046 -0.137
191 HB2 GLN 23 HB2 GLN 23 -9.763 2.874 -0.970
192 HB3 GLN 23 HB1 GLN 23 -10.058 1.184 -1.361
193 HG2 GLN 23 HG2 GLN 23 -11.061 1.732 -3.300
194 HG3 GLN 23 HG1 GLN 23 -12.135 2.873 -2.496
195 HE21 GLN 23 1HE2 GLN 23 -9.478 2.676 -4.667
196 HE22 GLN 23 2HE2 GLN 23 -9.037 4.315 -4.620
197 H TYR 24 HN TYR 24 -11.376 -0.381 0.182
198 HA TYR 24 HA TYR 24 -13.552 -1.364 -1.445
199 HB2 TYR 24 HB2 TYR 24 -11.677 -2.790 -1.100
200 HB3 TYR 24 HB1 TYR 24 -11.729 -2.570 0.644
201 HD1 TYR 24 HD1 TYR 24 -14.302 -3.505 -1.939
202 HD2 TYR 24 HD2 TYR 24 -12.302 -4.553 1.718
203 HE1 TYR 24 HE1 TYR 24 -15.744 -5.509 -1.726
204 HE2 TYR 24 HE2 TYR 24 -13.744 -6.555 1.930
205 HH TYR 24 HH TYR 24 -16.244 -7.132 0.969
206 H LEU 25 HN LEU 25 -13.164 -1.069 2.120
207 HA LEU 25 HA LEU 25 -15.782 -2.019 2.775
208 HB2 LEU 25 HB2 LEU 25 -13.494 -0.805 4.093
209 HB3 LEU 25 HB1 LEU 25 -15.009 -0.199 4.750
210 HG LEU 25 HG LEU 25 -15.582 -2.861 4.558
211 HD11 LEU 25 1HD1 LEU 25 -13.431 -3.604 3.866
212 HD12 LEU 25 2HD1 LEU 25 -13.529 -3.983 5.585
213 HD13 LEU 25 3HD1 LEU 25 -12.613 -2.578 5.043
214 HD21 LEU 25 3HD2 LEU 25 -15.776 -1.257 6.536
215 HD22 LEU 25 1HD2 LEU 25 -14.108 -1.674 6.929
216 HD23 LEU 25 2HD2 LEU 25 -15.356 -2.918 6.949
217 H ALA 26 HN ALA 26 -14.753 1.170 1.714
218 HA ALA 26 HA ALA 26 -16.672 2.934 2.616
219 HB1 ALA 26 HB1 ALA 26 -16.374 4.062 0.412
220 HB2 ALA 26 HB2 ALA 26 -15.574 2.608 -0.184
221 HB3 ALA 26 HB3 ALA 26 -14.850 3.537 1.128
222 H GLY 27 HN GLY 27 -17.092 0.588 0.012
223 HA2 GLY 27 HA2 GLY 27 -19.857 0.100 0.401
224 HA3 GLY 27 HA1 GLY 27 -19.694 1.295 -0.898
225 H LEU 28 HN LEU 28 -17.796 -1.581 0.071
226 HA LEU 28 HA LEU 28 -16.961 -3.367 -1.136
227 HB2 LEU 28 HB2 LEU 28 -19.619 -3.378 -1.478
228 HB3 LEU 28 HB1 LEU 28 -19.161 -3.067 -3.152
229 HG LEU 28 HG LEU 28 -17.511 -5.045 -2.851
230 HD11 LEU 28 1HD1 LEU 28 -18.088 -6.671 -1.165
231 HD12 LEU 28 2HD1 LEU 28 -19.492 -5.729 -0.662
232 HD13 LEU 28 3HD1 LEU 28 -17.866 -5.124 -0.347
233 HD21 LEU 28 3HD2 LEU 28 -19.306 -6.656 -3.427
234 HD22 LEU 28 1HD2 LEU 28 -19.518 -5.125 -4.274
235 HD23 LEU 28 2HD2 LEU 28 -20.514 -5.500 -2.868
236 H SER 29 HN SER 29 -15.845 -0.867 -1.660
237 HA SER 29 HA SER 29 -14.344 0.171 -3.045
238 HB2 SER 29 HB2 SER 29 -14.706 -2.476 -4.391
239 HB3 SER 29 HB1 SER 29 -13.902 -1.200 -5.290
240 HG SER 29 HG SER 29 -12.241 -1.378 -3.980
241 H THR 30 HN THR 30 -16.743 -1.221 -5.343
242 HA THR 30 HA THR 30 -17.307 1.568 -6.253
243 HB THR 30 HB THR 30 -15.898 0.142 -7.770
244 HG1 THR 30 HG1 THR 30 -17.443 1.847 -8.454
245 HG21 THR 30 3HG2 THR 30 -17.083 -1.587 -9.117
246 HG22 THR 30 1HG2 THR 30 -18.448 -1.470 -8.008
247 HG23 THR 30 2HG2 THR 30 -16.887 -2.045 -7.425
Start of MODEL 18
1 H1 GLN 1 HT1 GLN 1 -23.268 -2.287 3.603
2 H2 GLN 1 HT2 GLN 1 -23.396 -0.597 3.707
3 H3 GLN 1 HT3 GLN 1 -22.742 -1.484 4.999
4 HA GLN 1 HA GLN 1 -20.936 -0.430 3.801
5 HB2 GLN 1 HB2 GLN 1 -21.366 -3.404 3.679
6 HB3 GLN 1 HB1 GLN 1 -19.904 -2.717 2.986
7 HG2 GLN 1 HG2 GLN 1 -19.020 -2.726 5.057
8 HG3 GLN 1 HG1 GLN 1 -20.155 -1.447 5.475
9 HE21 GLN 1 1HE2 GLN 1 -21.601 -1.957 7.168
10 HE22 GLN 1 2HE2 GLN 1 -21.958 -3.537 7.673
11 H THR 2 HN THR 2 -19.922 0.090 1.891
12 HA THR 2 HA THR 2 -21.128 -0.772 -0.685
13 HB THR 2 HB THR 2 -20.687 2.147 0.007
14 HG1 THR 2 HG1 THR 2 -22.683 2.274 0.767
15 HG21 THR 2 3HG2 THR 2 -20.904 1.433 -2.398
16 HG22 THR 2 1HG2 THR 2 -22.139 2.570 -1.859
17 HG23 THR 2 2HG2 THR 2 -22.525 0.857 -2.015
18 H ASN 3 HN ASN 3 -19.211 1.922 -1.208
19 HA ASN 3 HA ASN 3 -17.028 0.292 -2.212
20 HB2 ASN 3 HB2 ASN 3 -17.900 2.315 -3.372
21 HB3 ASN 3 HB1 ASN 3 -17.258 3.306 -2.058
22 HD21 ASN 3 1HD2 ASN 3 -15.129 4.043 -2.375
23 HD22 ASN 3 2HD2 ASN 3 -14.007 3.323 -3.425
24 H TRP 4 HN TRP 4 -17.620 1.537 0.876
25 HA TRP 4 HA TRP 4 -14.990 2.388 1.688
26 HB2 TRP 4 HB2 TRP 4 -17.390 1.189 3.098
27 HB3 TRP 4 HB1 TRP 4 -15.947 1.670 3.973
28 HD1 TRP 4 HD1 TRP 4 -18.241 3.168 4.932
29 HE1 TRP 4 HE1 TRP 4 -18.733 5.638 4.407
30 HE3 TRP 4 HE3 TRP 4 -15.517 3.754 0.623
31 HZ2 TRP 4 HZ2 TRP 4 -18.077 7.597 2.444
32 HZ3 TRP 4 HZ3 TRP 4 -15.479 5.927 -0.536
33 HH2 TRP 4 HH2 TRP 4 -16.751 7.852 0.360
34 H GLN 5 HN GLN 5 -16.654 -0.739 1.815
35 HA GLN 5 HA GLN 5 -14.575 -2.357 2.917
36 HB2 GLN 5 HB2 GLN 5 -16.768 -2.930 0.886
37 HB3 GLN 5 HB1 GLN 5 -15.825 -4.186 1.670
38 HG2 GLN 5 HG2 GLN 5 -17.087 -2.205 3.488
39 HG3 GLN 5 HG1 GLN 5 -18.189 -3.272 2.625
40 HE21 GLN 5 1HE2 GLN 5 -18.753 -4.876 4.163
41 HE22 GLN 5 2HE2 GLN 5 -17.616 -5.748 5.069
42 H LYS 6 HN LYS 6 -15.359 -1.458 -0.449
43 HA LYS 6 HA LYS 6 -13.208 -2.887 -1.732
44 HB2 LYS 6 HB2 LYS 6 -15.399 -1.980 -2.703
45 HB3 LYS 6 HB1 LYS 6 -14.632 -0.395 -2.697
46 HG2 LYS 6 HG2 LYS 6 -14.167 -1.133 -4.851
47 HG3 LYS 6 HG1 LYS 6 -12.704 -1.610 -3.996
48 HD2 LYS 6 HD2 LYS 6 -14.845 -3.634 -3.904
49 HD3 LYS 6 HD1 LYS 6 -14.258 -3.292 -5.528
50 HE2 LYS 6 HE2 LYS 6 -12.171 -4.154 -5.113
51 HE3 LYS 6 HE1 LYS 6 -12.179 -3.645 -3.415
52 HZ1 LYS 6 HZ1 LYS 6 -12.476 -6.135 -3.951
53 HZ2 LYS 6 HZ2 LYS 6 -14.069 -5.719 -4.354
54 HZ3 LYS 6 HZ3 LYS 6 -13.481 -5.435 -2.783
55 H LEU 7 HN LEU 7 -13.545 0.456 -0.502
56 HA LEU 7 HA LEU 7 -11.074 1.498 -1.498
57 HB2 LEU 7 HB2 LEU 7 -12.982 2.845 -0.654
58 HB3 LEU 7 HB1 LEU 7 -12.676 2.248 0.973
59 HG LEU 7 HG LEU 7 -10.388 3.511 -0.476
60 HD11 LEU 7 1HD1 LEU 7 -12.568 4.935 -0.741
61 HD12 LEU 7 2HD1 LEU 7 -11.085 5.714 -0.193
62 HD13 LEU 7 3HD1 LEU 7 -12.334 5.283 0.973
63 HD21 LEU 7 3HD2 LEU 7 -11.098 2.736 2.212
64 HD22 LEU 7 1HD2 LEU 7 -10.754 4.466 2.179
65 HD23 LEU 7 2HD2 LEU 7 -9.548 3.317 1.605
66 H GLU 8 HN GLU 8 -11.874 -0.227 1.567
67 HA GLU 8 HA GLU 8 -9.348 0.168 2.838
68 HB2 GLU 8 HB2 GLU 8 -11.732 -1.512 3.149
69 HB3 GLU 8 HB1 GLU 8 -10.263 -2.366 3.618
70 HG2 GLU 8 HG2 GLU 8 -9.770 -0.895 5.330
71 HG3 GLU 8 HG1 GLU 8 -10.594 0.453 4.557
72 H VAL 9 HN VAL 9 -10.437 -2.329 0.534
73 HA VAL 9 HA VAL 9 -7.991 -3.870 0.499
74 HB VAL 9 HB VAL 9 -10.129 -3.453 -1.638
75 HG11 VAL 9 1HG1 VAL 9 -8.196 -5.759 -1.238
76 HG12 VAL 9 2HG1 VAL 9 -8.046 -4.516 -2.479
77 HG13 VAL 9 3HG1 VAL 9 -9.414 -5.627 -2.507
78 HG21 VAL 9 3HG2 VAL 9 -9.984 -5.156 0.822
79 HG22 VAL 9 1HG2 VAL 9 -10.756 -5.835 -0.610
80 HG23 VAL 9 2HG2 VAL 9 -11.374 -4.347 0.101
81 H PHE 10 HN PHE 10 -9.253 -1.165 -1.426
82 HA PHE 10 HA PHE 10 -7.087 -0.837 -3.272
83 HB2 PHE 10 HB2 PHE 10 -9.163 0.201 -3.769
84 HB3 PHE 10 HB1 PHE 10 -9.318 0.855 -2.151
85 HD1 PHE 10 HD2 PHE 10 -7.096 1.095 -5.170
86 HD2 PHE 10 HD1 PHE 10 -8.776 3.087 -1.754
87 HE1 PHE 10 HE2 PHE 10 -6.086 3.232 -5.919
88 HE2 PHE 10 HE1 PHE 10 -7.764 5.224 -2.505
89 HZ PHE 10 HZ PHE 10 -6.419 5.296 -4.586
90 H TRP 11 HN TRP 11 -7.793 0.703 -0.128
91 HA TRP 11 HA TRP 11 -5.556 2.444 0.002
92 HB2 TRP 11 HB2 TRP 11 -7.773 2.005 1.517
93 HB3 TRP 11 HB1 TRP 11 -6.540 1.276 2.546
94 HD1 TRP 11 HD1 TRP 11 -6.800 4.456 0.412
95 HE1 TRP 11 HE1 TRP 11 -5.844 6.447 1.756
96 HE3 TRP 11 HE3 TRP 11 -5.453 2.036 4.689
97 HZ2 TRP 11 HZ2 TRP 11 -4.663 6.930 4.316
98 HZ3 TRP 11 HZ3 TRP 11 -4.415 3.276 6.563
99 HH2 TRP 11 HH2 TRP 11 -4.017 5.715 6.387
100 H ALA 12 HN ALA 12 -5.933 -0.909 1.234
101 HA ALA 12 HA ALA 12 -3.398 -1.095 2.509
102 HB1 ALA 12 HB1 ALA 12 -4.860 -3.332 1.075
103 HB2 ALA 12 HB2 ALA 12 -5.373 -2.703 2.642
104 HB3 ALA 12 HB3 ALA 12 -3.796 -3.478 2.472
105 H LYS 13 HN LYS 13 -4.376 -1.751 -0.849
106 HA LYS 13 HA LYS 13 -1.879 -2.744 -1.859
107 HB2 LYS 13 HB2 LYS 13 -4.312 -1.374 -3.029
108 HB3 LYS 13 HB1 LYS 13 -2.935 -1.775 -4.050
109 HG2 LYS 13 HG2 LYS 13 -3.125 -4.155 -3.235
110 HG3 LYS 13 HG1 LYS 13 -4.627 -3.700 -2.433
111 HD2 LYS 13 HD2 LYS 13 -4.536 -2.842 -5.237
112 HD3 LYS 13 HD1 LYS 13 -4.391 -4.587 -5.049
113 HE2 LYS 13 HE2 LYS 13 -6.423 -4.403 -3.455
114 HE3 LYS 13 HE1 LYS 13 -6.663 -2.797 -4.167
115 HZ1 LYS 13 HZ1 LYS 13 -6.403 -5.329 -5.712
116 HZ2 LYS 13 HZ2 LYS 13 -6.655 -3.782 -6.367
117 HZ3 LYS 13 HZ3 LYS 13 -7.857 -4.514 -5.420
118 H HIS 14 HN HIS 14 -3.304 0.516 -1.695
119 HA HIS 14 HA HIS 14 -1.165 1.983 -2.922
120 HB2 HIS 14 HB2 HIS 14 -3.417 2.843 -2.710
121 HB3 HIS 14 HB1 HIS 14 -3.378 2.666 -0.961
122 HD1 HIS 14 HD1 HIS 14 -2.087 4.829 -3.756
123 HD2 HIS 14 HD2 HIS 14 -2.022 4.744 0.411
124 HE1 HIS 14 HE1 HIS 14 -1.203 7.080 -3.011
125 H MET 15 HN MET 15 -1.958 1.388 0.528
126 HA MET 15 HA MET 15 0.333 2.733 1.629
127 HB2 MET 15 HB2 MET 15 -1.986 1.520 2.576
128 HB3 MET 15 HB1 MET 15 -0.716 0.465 3.187
129 HG2 MET 15 HG2 MET 15 -0.975 2.118 4.862
130 HG3 MET 15 HG1 MET 15 0.459 2.623 3.970
131 HE1 MET 15 HE1 MET 15 -0.548 6.107 4.410
132 HE2 MET 15 HE2 MET 15 0.462 4.739 4.862
133 HE3 MET 15 HE3 MET 15 -1.066 5.001 5.695
134 H TRP 16 HN TRP 16 -0.217 -0.714 0.778
135 HA TRP 16 HA TRP 16 2.301 -1.720 1.684
136 HB2 TRP 16 HB2 TRP 16 0.193 -2.982 0.937
137 HB3 TRP 16 HB1 TRP 16 0.727 -2.693 -0.718
138 HD1 TRP 16 HD1 TRP 16 1.788 -4.797 -1.597
139 HE1 TRP 16 HE1 TRP 16 3.441 -6.568 -0.708
140 HE3 TRP 16 HE3 TRP 16 2.380 -3.116 3.177
141 HZ2 TRP 16 HZ2 TRP 16 4.831 -7.185 1.721
142 HZ3 TRP 16 HZ3 TRP 16 3.866 -4.306 4.759
143 HH2 TRP 16 HH2 TRP 16 5.092 -6.335 4.040
144 H ASN 17 HN ASN 17 1.314 -0.094 -1.310
145 HA ASN 17 HA ASN 17 3.687 -0.542 -2.860
146 HB2 ASN 17 HB2 ASN 17 1.391 0.332 -3.596
147 HB3 ASN 17 HB1 ASN 17 1.857 1.884 -2.904
148 HD21 ASN 17 1HD2 ASN 17 3.503 3.144 -4.030
149 HD22 ASN 17 2HD2 ASN 17 4.049 2.704 -5.576
150 H PHE 18 HN PHE 18 2.706 2.000 -0.555
151 HA PHE 18 HA PHE 18 4.976 3.731 -0.750
152 HB2 PHE 18 HB2 PHE 18 2.875 4.329 0.405
153 HB3 PHE 18 HB1 PHE 18 3.095 3.002 1.530
154 HD1 PHE 18 HD2 PHE 18 4.791 6.127 0.348
155 HD2 PHE 18 HD1 PHE 18 4.193 3.334 3.556
156 HE1 PHE 18 HE2 PHE 18 6.101 7.589 1.866
157 HE2 PHE 18 HE1 PHE 18 5.503 4.795 5.073
158 HZ PHE 18 HZ PHE 18 6.456 6.923 4.227
159 H ILE 19 HN ILE 19 4.256 0.853 1.190
160 HA ILE 19 HA ILE 19 6.718 0.756 2.683
161 HB ILE 19 HB ILE 19 4.278 -0.867 2.211
162 HG12 ILE 19 2HG1 ILE 19 4.828 -1.223 4.768
163 HG13 ILE 19 1HG1 ILE 19 5.934 0.118 4.499
164 HG21 ILE 19 1HG2 ILE 19 5.511 -2.760 3.612
165 HG22 ILE 19 2HG2 ILE 19 6.905 -2.201 2.693
166 HG23 ILE 19 3HG2 ILE 19 5.473 -2.794 1.852
167 HD11 ILE 19 3HD1 ILE 19 2.936 0.073 4.133
168 HD12 ILE 19 1HD1 ILE 19 3.946 1.348 3.451
169 HD13 ILE 19 2HD1 ILE 19 3.887 1.108 5.196
170 H SER 20 HN SER 20 5.671 -0.657 -0.440
171 HA SER 20 HA SER 20 7.928 -2.325 -0.933
172 HB2 SER 20 HB2 SER 20 5.679 -2.081 -2.219
173 HB3 SER 20 HB1 SER 20 6.473 -0.761 -3.068
174 HG SER 20 HG SER 20 7.153 -2.401 -4.269
175 H GLY 21 HN GLY 21 7.425 1.165 -1.614
176 HA2 GLY 21 HA2 GLY 21 9.875 1.605 -3.023
177 HA3 GLY 21 HA1 GLY 21 8.956 2.850 -2.170
178 H ILE 22 HN ILE 22 9.021 1.891 0.434
179 HA ILE 22 HA ILE 22 11.639 2.697 1.353
180 HB ILE 22 HB ILE 22 9.256 1.387 2.714
181 HG12 ILE 22 2HG1 ILE 22 10.248 4.247 2.898
182 HG13 ILE 22 1HG1 ILE 22 9.031 3.733 1.734
183 HG21 ILE 22 1HG2 ILE 22 10.521 2.573 4.761
184 HG22 ILE 22 2HG2 ILE 22 11.930 2.193 3.770
185 HG23 ILE 22 3HG2 ILE 22 10.848 0.904 4.299
186 HD11 ILE 22 3HD1 ILE 22 8.689 3.155 4.675
187 HD12 ILE 22 1HD1 ILE 22 7.461 3.227 3.411
188 HD13 ILE 22 2HD1 ILE 22 8.216 4.710 3.992
189 H GLN 23 HN GLN 23 9.954 -0.458 1.230
190 HA GLN 23 HA GLN 23 12.065 -2.059 2.286
191 HB2 GLN 23 HB2 GLN 23 9.586 -2.600 1.990
192 HB3 GLN 23 HB1 GLN 23 9.957 -2.927 0.300
193 HG2 GLN 23 HG2 GLN 23 10.959 -4.904 0.773
194 HG3 GLN 23 HG1 GLN 23 11.774 -4.267 2.199
195 HE21 GLN 23 1HE2 GLN 23 9.092 -6.215 1.152
196 HE22 GLN 23 2HE2 GLN 23 8.365 -6.388 2.675
197 H TYR 24 HN TYR 24 11.444 -0.883 -0.945
198 HA TYR 24 HA TYR 24 13.235 -2.564 -2.435
199 HB2 TYR 24 HB2 TYR 24 11.492 -1.221 -3.487
200 HB3 TYR 24 HB1 TYR 24 12.175 0.258 -2.829
201 HD1 TYR 24 HD2 TYR 24 12.621 -2.441 -5.324
202 HD2 TYR 24 HD1 TYR 24 14.077 1.326 -3.860
203 HE1 TYR 24 HE2 TYR 24 14.013 -2.184 -7.361
204 HE2 TYR 24 HE1 TYR 24 15.467 1.583 -5.896
205 HH TYR 24 HH TYR 24 16.358 -0.726 -7.818
206 H LEU 25 HN LEU 25 13.688 0.806 -1.244
207 HA LEU 25 HA LEU 25 16.514 0.915 -1.743
208 HB2 LEU 25 HB2 LEU 25 14.489 2.454 -0.162
209 HB3 LEU 25 HB1 LEU 25 16.187 2.743 0.191
210 HG LEU 25 HG LEU 25 16.085 2.754 -2.600
211 HD11 LEU 25 1HD1 LEU 25 14.285 4.592 -2.900
212 HD12 LEU 25 2HD1 LEU 25 13.595 3.965 -1.405
213 HD13 LEU 25 3HD1 LEU 25 13.746 2.917 -2.814
214 HD21 LEU 25 3HD2 LEU 25 15.947 5.089 -0.659
215 HD22 LEU 25 1HD2 LEU 25 16.480 5.185 -2.338
216 HD23 LEU 25 2HD2 LEU 25 17.416 4.257 -1.168
217 H ALA 26 HN ALA 26 14.678 0.165 1.243
218 HA ALA 26 HA ALA 26 16.886 -0.250 2.995
219 HB1 ALA 26 HB1 ALA 26 15.240 -1.572 4.303
220 HB2 ALA 26 HB2 ALA 26 14.161 -1.585 2.908
221 HB3 ALA 26 HB3 ALA 26 14.541 -0.064 3.714
222 H GLY 27 HN GLY 27 15.314 -2.459 0.675
223 HA2 GLY 27 HA2 GLY 27 16.925 -4.760 1.463
224 HA3 GLY 27 HA1 GLY 27 15.787 -4.686 0.121
225 H LEU 28 HN LEU 28 17.305 -2.108 -0.810
226 HA LEU 28 HA LEU 28 19.452 -3.575 -2.281
227 HB2 LEU 28 HB2 LEU 28 17.576 -1.299 -2.789
228 HB3 LEU 28 HB1 LEU 28 19.141 -1.246 -3.578
229 HG LEU 28 HG LEU 28 18.737 -3.403 -4.641
230 HD11 LEU 28 1HD1 LEU 28 16.467 -4.459 -4.455
231 HD12 LEU 28 2HD1 LEU 28 16.106 -3.360 -3.126
232 HD13 LEU 28 3HD1 LEU 28 17.397 -4.549 -2.961
233 HD21 LEU 28 3HD2 LEU 28 16.389 -1.508 -4.884
234 HD22 LEU 28 1HD2 LEU 28 16.835 -2.734 -6.072
235 HD23 LEU 28 2HD2 LEU 28 17.920 -1.380 -5.752
236 H SER 29 HN SER 29 20.134 -2.951 0.323
237 HA SER 29 HA SER 29 21.629 -0.381 0.311
238 HB2 SER 29 HB2 SER 29 20.091 -1.204 2.181
239 HB3 SER 29 HB1 SER 29 21.327 -2.403 2.536
240 HG SER 29 HG SER 29 22.717 -0.785 3.081
241 H THR 30 HN THR 30 22.286 -3.840 1.047
242 HA THR 30 HA THR 30 25.072 -3.474 0.040
243 HB THR 30 HB THR 30 25.692 -5.019 2.023
244 HG1 THR 30 HG1 THR 30 23.577 -5.513 2.665
245 HG21 THR 30 3HG2 THR 30 26.021 -3.122 3.500
246 HG22 THR 30 1HG2 THR 30 24.802 -2.194 2.626
247 HG23 THR 30 2HG2 THR 30 26.316 -2.628 1.832
Start of MODEL 19
1 H1 GLN 1 HT1 GLN 1 -22.858 3.927 -0.317
2 H2 GLN 1 HT2 GLN 1 -23.158 2.299 0.071
3 H3 GLN 1 HT3 GLN 1 -21.898 2.706 -0.990
4 HA GLN 1 HA GLN 1 -20.648 3.748 0.766
5 HB2 GLN 1 HB2 GLN 1 -23.322 3.492 2.054
6 HB3 GLN 1 HB1 GLN 1 -21.931 3.295 3.112
7 HG2 GLN 1 HG2 GLN 1 -22.129 5.576 3.241
8 HG3 GLN 1 HG1 GLN 1 -21.108 5.490 1.811
9 HE21 GLN 1 1HE2 GLN 1 -23.695 7.204 2.849
10 HE22 GLN 1 2HE2 GLN 1 -24.552 7.363 1.394
11 H THR 2 HN THR 2 -20.077 1.526 -0.443
12 HA THR 2 HA THR 2 -20.158 -0.708 1.507
13 HB THR 2 HB THR 2 -19.009 -1.878 -0.530
14 HG1 THR 2 HG1 THR 2 -18.956 -0.760 -2.275
15 HG21 THR 2 3HG2 THR 2 -21.395 -2.182 -1.503
16 HG22 THR 2 1HG2 THR 2 -21.892 -1.167 -0.148
17 HG23 THR 2 2HG2 THR 2 -21.061 -2.693 0.151
18 H ASN 3 HN ASN 3 -18.516 -1.190 2.665
19 HA ASN 3 HA ASN 3 -16.075 0.259 2.848
20 HB2 ASN 3 HB2 ASN 3 -15.372 -1.605 4.348
21 HB3 ASN 3 HB1 ASN 3 -16.994 -1.031 4.715
22 HD21 ASN 3 1HD2 ASN 3 -18.772 -2.533 4.406
23 HD22 ASN 3 2HD2 ASN 3 -18.520 -4.141 3.931
24 H TRP 4 HN TRP 4 -16.910 -2.494 0.916
25 HA TRP 4 HA TRP 4 -14.326 -3.476 0.195
26 HB2 TRP 4 HB2 TRP 4 -16.957 -3.348 -1.330
27 HB3 TRP 4 HB1 TRP 4 -15.573 -4.306 -1.839
28 HD1 TRP 4 HD1 TRP 4 -18.668 -4.742 -0.120
29 HE1 TRP 4 HE1 TRP 4 -18.636 -6.751 1.499
30 HE3 TRP 4 HE3 TRP 4 -13.639 -5.554 0.165
31 HZ2 TRP 4 HZ2 TRP 4 -16.722 -8.475 2.749
32 HZ3 TRP 4 HZ3 TRP 4 -12.738 -7.379 1.571
33 HH2 TRP 4 HH2 TRP 4 -14.266 -8.841 2.862
34 H GLN 5 HN GLN 5 -16.462 -1.143 -1.485
35 HA GLN 5 HA GLN 5 -14.783 -0.340 -3.580
36 HB2 GLN 5 HB2 GLN 5 -16.967 0.912 -1.964
37 HB3 GLN 5 HB1 GLN 5 -16.027 1.984 -2.999
38 HG2 GLN 5 HG2 GLN 5 -16.412 0.323 -4.887
39 HG3 GLN 5 HG1 GLN 5 -17.577 -0.475 -3.838
40 HE21 GLN 5 1HE2 GLN 5 -19.270 1.265 -2.837
41 HE22 GLN 5 2HE2 GLN 5 -19.868 2.377 -3.972
42 H LYS 6 HN LYS 6 -14.769 0.831 -0.188
43 HA LYS 6 HA LYS 6 -12.604 2.734 -0.607
44 HB2 LYS 6 HB2 LYS 6 -14.399 2.701 1.232
45 HB3 LYS 6 HB1 LYS 6 -13.458 1.412 1.986
46 HG2 LYS 6 HG2 LYS 6 -11.451 2.970 1.879
47 HG3 LYS 6 HG1 LYS 6 -12.576 4.253 1.436
48 HD2 LYS 6 HD2 LYS 6 -13.862 3.818 3.520
49 HD3 LYS 6 HD1 LYS 6 -12.679 2.594 3.972
50 HE2 LYS 6 HE2 LYS 6 -11.828 4.440 5.111
51 HE3 LYS 6 HE1 LYS 6 -10.953 4.589 3.578
52 HZ1 LYS 6 HZ1 LYS 6 -12.700 6.050 2.749
53 HZ2 LYS 6 HZ2 LYS 6 -12.016 6.678 4.169
54 HZ3 LYS 6 HZ3 LYS 6 -13.536 5.926 4.218
55 H LEU 7 HN LEU 7 -12.848 -0.608 0.628
56 HA LEU 7 HA LEU 7 -10.133 -1.039 1.377
57 HB2 LEU 7 HB2 LEU 7 -12.041 -2.427 2.048
58 HB3 LEU 7 HB1 LEU 7 -12.298 -2.908 0.379
59 HG LEU 7 HG LEU 7 -9.560 -3.418 1.359
60 HD11 LEU 7 1HD1 LEU 7 -10.328 -5.476 2.608
61 HD12 LEU 7 2HD1 LEU 7 -11.959 -4.808 2.582
62 HD13 LEU 7 3HD1 LEU 7 -10.668 -3.953 3.430
63 HD21 LEU 7 3HD2 LEU 7 -11.487 -5.454 0.262
64 HD22 LEU 7 1HD2 LEU 7 -9.753 -5.299 -0.014
65 HD23 LEU 7 2HD2 LEU 7 -10.872 -4.192 -0.804
66 H GLU 8 HN GLU 8 -11.763 -1.375 -1.790
67 HA GLU 8 HA GLU 8 -9.615 -2.724 -3.157
68 HB2 GLU 8 HB2 GLU 8 -12.109 -1.226 -3.845
69 HB3 GLU 8 HB1 GLU 8 -10.921 -1.412 -5.128
70 HG2 GLU 8 HG2 GLU 8 -11.910 -3.415 -5.489
71 HG3 GLU 8 HG1 GLU 8 -10.988 -3.953 -4.092
72 H VAL 9 HN VAL 9 -10.500 0.734 -2.864
73 HA VAL 9 HA VAL 9 -8.292 1.784 -4.410
74 HB VAL 9 HB VAL 9 -10.002 2.970 -2.174
75 HG11 VAL 9 1HG1 VAL 9 -8.407 4.509 -4.236
76 HG12 VAL 9 2HG1 VAL 9 -7.791 4.167 -2.620
77 HG13 VAL 9 3HG1 VAL 9 -9.244 5.142 -2.821
78 HG21 VAL 9 3HG2 VAL 9 -10.210 3.494 -5.146
79 HG22 VAL 9 1HG2 VAL 9 -11.379 3.888 -3.887
80 HG23 VAL 9 2HG2 VAL 9 -11.123 2.208 -4.357
81 H PHE 10 HN PHE 10 -8.882 1.225 -0.951
82 HA PHE 10 HA PHE 10 -6.401 2.078 0.165
83 HB2 PHE 10 HB2 PHE 10 -8.299 1.653 1.568
84 HB3 PHE 10 HB1 PHE 10 -8.531 0.063 0.873
85 HD1 PHE 10 HD1 PHE 10 -6.079 2.044 2.886
86 HD2 PHE 10 HD2 PHE 10 -7.628 -1.841 1.901
87 HE1 PHE 10 HE1 PHE 10 -4.692 1.038 4.680
88 HE2 PHE 10 HE2 PHE 10 -6.242 -2.844 3.694
89 HZ PHE 10 HZ PHE 10 -4.774 -1.408 5.084
90 H TRP 11 HN TRP 11 -7.458 -1.036 -1.191
91 HA TRP 11 HA TRP 11 -5.449 -2.784 -0.499
92 HB2 TRP 11 HB2 TRP 11 -7.603 -2.878 -2.140
93 HB3 TRP 11 HB1 TRP 11 -6.308 -2.917 -3.333
94 HD1 TRP 11 HD1 TRP 11 -7.548 -4.725 -0.239
95 HE1 TRP 11 HE1 TRP 11 -6.671 -7.161 -0.265
96 HE3 TRP 11 HE3 TRP 11 -4.519 -4.501 -4.325
97 HZ2 TRP 11 HZ2 TRP 11 -4.909 -8.783 -1.828
98 HZ3 TRP 11 HZ3 TRP 11 -3.250 -6.494 -5.067
99 HH2 TRP 11 HH2 TRP 11 -3.437 -8.631 -3.829
100 H ALA 12 HN ALA 12 -5.381 -0.837 -3.547
101 HA ALA 12 HA ALA 12 -2.681 -1.637 -4.142
102 HB1 ALA 12 HB1 ALA 12 -4.437 -0.737 -5.763
103 HB2 ALA 12 HB2 ALA 12 -2.820 -0.057 -5.949
104 HB3 ALA 12 HB3 ALA 12 -4.075 0.869 -5.128
105 H LYS 13 HN LYS 13 -4.056 1.161 -2.408
106 HA LYS 13 HA LYS 13 -1.647 2.708 -2.181
107 HB2 LYS 13 HB2 LYS 13 -4.271 3.052 -1.513
108 HB3 LYS 13 HB1 LYS 13 -3.610 2.681 0.075
109 HG2 LYS 13 HG2 LYS 13 -1.951 4.590 -1.407
110 HG3 LYS 13 HG1 LYS 13 -3.595 5.171 -1.153
111 HD2 LYS 13 HD2 LYS 13 -3.385 4.694 1.269
112 HD3 LYS 13 HD1 LYS 13 -1.735 4.139 1.006
113 HE2 LYS 13 HE2 LYS 13 -1.279 6.330 1.580
114 HE3 LYS 13 HE1 LYS 13 -1.522 6.559 -0.158
115 HZ1 LYS 13 HZ1 LYS 13 -3.815 7.119 0.216
116 HZ2 LYS 13 HZ2 LYS 13 -2.854 8.096 1.212
117 HZ3 LYS 13 HZ3 LYS 13 -3.694 6.781 1.873
118 H HIS 14 HN HIS 14 -3.155 0.290 -0.028
119 HA HIS 14 HA HIS 14 -1.091 0.170 1.965
120 HB2 HIS 14 HB2 HIS 14 -3.419 -0.658 2.216
121 HB3 HIS 14 HB1 HIS 14 -3.116 -1.880 0.992
122 HD1 HIS 14 HD1 HIS 14 -3.943 -3.272 3.318
123 HD2 HIS 14 HD2 HIS 14 -0.025 -1.876 3.144
124 HE1 HIS 14 HE1 HIS 14 -2.638 -4.602 5.024
125 H MET 15 HN MET 15 -1.753 -1.818 -0.941
126 HA MET 15 HA MET 15 0.451 -3.614 -0.764
127 HB2 MET 15 HB2 MET 15 -1.447 -2.630 -2.831
128 HB3 MET 15 HB1 MET 15 0.026 -3.363 -3.438
129 HG2 MET 15 HG2 MET 15 -1.504 -4.765 -1.270
130 HG3 MET 15 HG1 MET 15 -2.077 -4.864 -2.932
131 HE1 MET 15 HE1 MET 15 0.697 -5.589 -0.394
132 HE2 MET 15 HE2 MET 15 1.201 -7.176 -0.963
133 HE3 MET 15 HE3 MET 15 -0.483 -6.905 -0.539
134 H TRP 16 HN TRP 16 0.220 -0.492 -2.557
135 HA TRP 16 HA TRP 16 2.963 -0.559 -3.437
136 HB2 TRP 16 HB2 TRP 16 0.755 0.983 -4.023
137 HB3 TRP 16 HB1 TRP 16 1.730 2.105 -3.072
138 HD1 TRP 16 HD1 TRP 16 2.865 3.578 -4.818
139 HE1 TRP 16 HE1 TRP 16 4.345 3.158 -6.895
140 HE3 TRP 16 HE3 TRP 16 2.508 -1.482 -5.109
141 HZ2 TRP 16 HZ2 TRP 16 5.256 0.932 -8.475
142 HZ3 TRP 16 HZ3 TRP 16 3.681 -2.742 -6.898
143 HH2 TRP 16 HH2 TRP 16 5.053 -1.541 -8.577
144 H ASN 17 HN ASN 17 1.367 0.619 -0.502
145 HA ASN 17 HA ASN 17 3.562 2.134 0.529
146 HB2 ASN 17 HB2 ASN 17 1.085 1.975 1.319
147 HB3 ASN 17 HB1 ASN 17 1.588 0.525 2.185
148 HD21 ASN 17 1HD2 ASN 17 2.112 4.067 1.997
149 HD22 ASN 17 2HD2 ASN 17 2.806 4.189 3.541
150 H PHE 18 HN PHE 18 2.710 -1.317 0.618
151 HA PHE 18 HA PHE 18 4.766 -2.243 2.401
152 HB2 PHE 18 HB2 PHE 18 2.713 -3.520 1.599
153 HB3 PHE 18 HB1 PHE 18 3.465 -3.622 0.015
154 HD1 PHE 18 HD1 PHE 18 4.053 -4.505 3.610
155 HD2 PHE 18 HD2 PHE 18 4.997 -5.311 -0.503
156 HE1 PHE 18 HE1 PHE 18 5.347 -6.503 4.297
157 HE2 PHE 18 HE2 PHE 18 6.290 -7.312 0.186
158 HZ PHE 18 HZ PHE 18 6.466 -7.907 2.588
159 H ILE 19 HN ILE 19 4.539 -1.931 -1.146
160 HA ILE 19 HA ILE 19 7.178 -2.788 -1.835
161 HB ILE 19 HB ILE 19 5.081 -1.027 -3.125
162 HG12 ILE 19 2HG1 ILE 19 4.516 -3.398 -2.913
163 HG13 ILE 19 1HG1 ILE 19 4.773 -2.979 -4.599
164 HG21 ILE 19 1HG2 ILE 19 7.793 -1.765 -4.189
165 HG22 ILE 19 2HG2 ILE 19 6.966 -0.208 -4.230
166 HG23 ILE 19 3HG2 ILE 19 6.431 -1.517 -5.283
167 HD11 ILE 19 3HD1 ILE 19 6.581 -4.552 -2.763
168 HD12 ILE 19 1HD1 ILE 19 7.195 -3.816 -4.243
169 HD13 ILE 19 2HD1 ILE 19 5.919 -5.029 -4.325
170 H SER 20 HN SER 20 5.862 0.414 -0.939
171 HA SER 20 HA SER 20 8.159 2.007 -1.527
172 HB2 SER 20 HB2 SER 20 5.633 2.488 -0.671
173 HB3 SER 20 HB1 SER 20 6.490 2.646 0.855
174 HG SER 20 HG SER 20 6.688 4.136 -1.517
175 H GLY 21 HN GLY 21 7.238 0.217 1.441
176 HA2 GLY 21 HA2 GLY 21 9.465 1.078 3.039
177 HA3 GLY 21 HA1 GLY 21 8.468 -0.346 3.348
178 H ILE 22 HN ILE 22 8.902 -1.794 0.994
179 HA ILE 22 HA ILE 22 11.409 -3.110 1.509
180 HB ILE 22 HB ILE 22 9.512 -3.180 -0.862
181 HG12 ILE 22 2HG1 ILE 22 8.476 -3.844 1.290
182 HG13 ILE 22 1HG1 ILE 22 8.586 -5.192 0.170
183 HG21 ILE 22 1HG2 ILE 22 10.479 -5.366 -1.407
184 HG22 ILE 22 2HG2 ILE 22 11.655 -5.184 -0.107
185 HG23 ILE 22 3HG2 ILE 22 11.700 -4.098 -1.497
186 HD11 ILE 22 3HD1 ILE 22 9.218 -5.827 2.482
187 HD12 ILE 22 1HD1 ILE 22 10.533 -4.654 2.436
188 HD13 ILE 22 2HD1 ILE 22 10.554 -6.046 1.353
189 H GLN 23 HN GLN 23 10.358 -0.846 -1.051
190 HA GLN 23 HA GLN 23 12.731 -0.744 -2.586
191 HB2 GLN 23 HB2 GLN 23 10.410 0.214 -3.056
192 HB3 GLN 23 HB1 GLN 23 10.868 1.570 -2.030
193 HG2 GLN 23 HG2 GLN 23 11.716 2.502 -3.899
194 HG3 GLN 23 HG1 GLN 23 13.035 1.345 -3.747
195 HE21 GLN 23 1HE2 GLN 23 12.670 -0.823 -4.955
196 HE22 GLN 23 2HE2 GLN 23 11.756 -0.767 -6.383
197 H TYR 24 HN TYR 24 11.877 0.932 0.364
198 HA TYR 24 HA TYR 24 14.156 2.735 0.463
199 HB2 TYR 24 HB2 TYR 24 12.312 3.461 1.678
200 HB3 TYR 24 HB1 TYR 24 11.896 1.848 2.218
201 HD1 TYR 24 HD2 TYR 24 14.369 4.606 2.692
202 HD2 TYR 24 HD1 TYR 24 12.571 1.082 4.366
203 HE1 TYR 24 HE2 TYR 24 15.481 5.070 4.853
204 HE2 TYR 24 HE1 TYR 24 13.685 1.550 6.532
205 HH TYR 24 HH TYR 24 14.739 4.236 7.521
206 H LEU 25 HN LEU 25 13.362 -0.387 1.993
207 HA LEU 25 HA LEU 25 15.593 -0.742 3.656
208 HB2 LEU 25 HB2 LEU 25 13.430 -2.296 2.571
209 HB3 LEU 25 HB1 LEU 25 14.906 -3.255 2.600
210 HG LEU 25 HG LEU 25 15.068 -2.042 5.033
211 HD11 LEU 25 1HD1 LEU 25 12.925 -1.950 6.087
212 HD12 LEU 25 2HD1 LEU 25 12.128 -2.653 4.679
213 HD13 LEU 25 3HD1 LEU 25 12.789 -1.021 4.595
214 HD21 LEU 25 3HD2 LEU 25 15.297 -4.463 4.563
215 HD22 LEU 25 1HD2 LEU 25 13.545 -4.594 4.398
216 HD23 LEU 25 2HD2 LEU 25 14.257 -4.182 5.957
217 H ALA 26 HN ALA 26 15.554 -1.147 0.148
218 HA ALA 26 HA ALA 26 17.641 -2.843 -0.425
219 HB1 ALA 26 HB1 ALA 26 16.653 -1.898 -2.279
220 HB2 ALA 26 HB2 ALA 26 18.160 -0.983 -2.243
221 HB3 ALA 26 HB3 ALA 26 16.683 -0.272 -1.597
222 H GLY 27 HN GLY 27 17.996 0.458 0.761
223 HA2 GLY 27 HA2 GLY 27 20.464 0.066 2.109
224 HA3 GLY 27 HA1 GLY 27 20.806 0.807 0.536
225 H LEU 28 HN LEU 28 18.173 1.206 2.944
226 HA LEU 28 HA LEU 28 17.185 3.105 3.847
227 HB2 LEU 28 HB2 LEU 28 19.600 3.143 4.727
228 HB3 LEU 28 HB1 LEU 28 19.922 4.356 3.492
229 HG LEU 28 HG LEU 28 17.569 5.231 4.748
230 HD11 LEU 28 1HD1 LEU 28 17.846 3.785 6.637
231 HD12 LEU 28 2HD1 LEU 28 18.390 5.382 7.147
232 HD13 LEU 28 3HD1 LEU 28 19.571 4.139 6.738
233 HD21 LEU 28 3HD2 LEU 28 20.463 6.058 5.141
234 HD22 LEU 28 1HD2 LEU 28 19.068 7.033 5.601
235 HD23 LEU 28 2HD2 LEU 28 19.363 6.665 3.903
236 H SER 29 HN SER 29 16.934 2.748 0.998
237 HA SER 29 HA SER 29 16.182 3.872 -0.893
238 HB2 SER 29 HB2 SER 29 14.930 4.999 1.072
239 HB3 SER 29 HB1 SER 29 16.048 6.336 0.847
240 HG SER 29 HG SER 29 14.687 6.902 -0.671
241 H THR 30 HN THR 30 16.653 6.555 -1.746
242 HA THR 30 HA THR 30 19.623 6.528 -2.120
243 HB THR 30 HB THR 30 17.470 7.724 -3.894
244 HG1 THR 30 HG1 THR 30 17.123 5.606 -4.099
245 HG21 THR 30 3HG2 THR 30 19.705 8.684 -4.206
246 HG22 THR 30 1HG2 THR 30 19.247 7.701 -5.597
247 HG23 THR 30 2HG2 THR 30 20.381 7.067 -4.404
Start of MODEL 20
1 H1 GLN 1 HT1 GLN 1 22.990 3.301 2.546
2 H2 GLN 1 HT2 GLN 1 24.599 3.300 2.017
3 H3 GLN 1 HT3 GLN 1 24.141 2.368 3.362
4 HA GLN 1 HA GLN 1 23.123 1.914 0.593
5 HB2 GLN 1 HB2 GLN 1 25.529 0.985 2.109
6 HB3 GLN 1 HB1 GLN 1 24.703 -0.189 1.090
7 HG2 GLN 1 HG2 GLN 1 24.937 1.271 -0.855
8 HG3 GLN 1 HG1 GLN 1 25.678 2.523 0.142
9 HE21 GLN 1 1HE2 GLN 1 26.214 -0.805 -1.100
10 HE22 GLN 1 2HE2 GLN 1 27.898 -0.760 -0.895
11 H THR 2 HN THR 2 21.189 2.100 2.323
12 HA THR 2 HA THR 2 20.650 -0.660 3.337
13 HB THR 2 HB THR 2 18.813 0.769 4.610
14 HG1 THR 2 HG1 THR 2 19.256 2.783 3.901
15 HG21 THR 2 3HG2 THR 2 21.698 0.322 5.309
16 HG22 THR 2 1HG2 THR 2 20.265 -0.534 5.877
17 HG23 THR 2 2HG2 THR 2 20.599 1.098 6.451
18 H ASN 3 HN ASN 3 18.960 -1.692 2.521
19 HA ASN 3 HA ASN 3 17.446 -0.476 0.303
20 HB2 ASN 3 HB2 ASN 3 17.988 -3.194 1.348
21 HB3 ASN 3 HB1 ASN 3 16.393 -2.975 0.634
22 HD21 ASN 3 1HD2 ASN 3 19.496 -3.876 -0.210
23 HD22 ASN 3 2HD2 ASN 3 19.463 -3.423 -1.845
24 H TRP 4 HN TRP 4 16.998 -0.628 3.649
25 HA TRP 4 HA TRP 4 14.190 -1.069 3.914
26 HB2 TRP 4 HB2 TRP 4 16.404 0.170 5.475
27 HB3 TRP 4 HB1 TRP 4 14.782 0.687 5.910
28 HD1 TRP 4 HD1 TRP 4 14.824 -0.557 8.194
29 HE1 TRP 4 HE1 TRP 4 14.607 -3.035 8.853
30 HE3 TRP 4 HE3 TRP 4 15.587 -2.780 3.641
31 HZ2 TRP 4 HZ2 TRP 4 14.738 -5.608 7.627
32 HZ3 TRP 4 HZ3 TRP 4 15.534 -5.235 3.425
33 HH2 TRP 4 HH2 TRP 4 15.110 -6.659 5.408
34 H GLN 5 HN GLN 5 16.056 1.931 3.328
35 HA GLN 5 HA GLN 5 13.942 3.801 3.348
36 HB2 GLN 5 HB2 GLN 5 15.408 5.072 1.747
37 HB3 GLN 5 HB1 GLN 5 16.249 4.508 3.191
38 HG2 GLN 5 HG2 GLN 5 16.810 2.453 1.583
39 HG3 GLN 5 HG1 GLN 5 16.525 3.654 0.337
40 HE21 GLN 5 1HE2 GLN 5 18.661 4.062 -0.341
41 HE22 GLN 5 2HE2 GLN 5 19.884 4.631 0.690
42 H LYS 6 HN LYS 6 15.138 1.820 0.637
43 HA LYS 6 HA LYS 6 13.135 2.685 -1.271
44 HB2 LYS 6 HB2 LYS 6 15.408 0.837 -1.116
45 HB3 LYS 6 HB1 LYS 6 14.086 0.195 -2.085
46 HG2 LYS 6 HG2 LYS 6 14.449 1.668 -3.757
47 HG3 LYS 6 HG1 LYS 6 14.579 3.024 -2.642
48 HD2 LYS 6 HD2 LYS 6 16.718 2.899 -3.606
49 HD3 LYS 6 HD1 LYS 6 16.914 2.083 -2.061
50 HE2 LYS 6 HE2 LYS 6 17.741 0.321 -3.227
51 HE3 LYS 6 HE1 LYS 6 16.091 0.040 -3.803
52 HZ1 LYS 6 HZ1 LYS 6 17.780 0.364 -5.591
53 HZ2 LYS 6 HZ2 LYS 6 17.948 1.977 -5.089
54 HZ3 LYS 6 HZ3 LYS 6 16.456 1.412 -5.684
55 H LEU 7 HN LEU 7 13.413 -0.052 0.988
56 HA LEU 7 HA LEU 7 11.123 -1.559 0.146
57 HB2 LEU 7 HB2 LEU 7 13.005 -2.362 1.579
58 HB3 LEU 7 HB1 LEU 7 12.452 -1.296 2.864
59 HG LEU 7 HG LEU 7 10.275 -2.959 1.897
60 HD11 LEU 7 1HD1 LEU 7 12.136 -4.531 1.382
61 HD12 LEU 7 2HD1 LEU 7 11.090 -5.118 2.673
62 HD13 LEU 7 3HD1 LEU 7 12.661 -4.420 3.062
63 HD21 LEU 7 3HD2 LEU 7 10.063 -3.455 4.289
64 HD22 LEU 7 1HD2 LEU 7 10.360 -1.732 4.061
65 HD23 LEU 7 2HD2 LEU 7 11.668 -2.789 4.592
66 H GLU 8 HN GLU 8 11.525 1.165 2.425
67 HA GLU 8 HA GLU 8 8.856 1.090 3.522
68 HB2 GLU 8 HB2 GLU 8 10.959 3.269 3.264
69 HB3 GLU 8 HB1 GLU 8 9.464 3.473 4.173
70 HG2 GLU 8 HG2 GLU 8 11.258 1.125 4.749
71 HG3 GLU 8 HG1 GLU 8 11.629 2.703 5.432
72 H VAL 9 HN VAL 9 10.368 2.854 0.794
73 HA VAL 9 HA VAL 9 8.026 4.338 -0.007
74 HB VAL 9 HB VAL 9 10.410 3.319 -1.622
75 HG11 VAL 9 1HG1 VAL 9 8.500 5.602 -2.213
76 HG12 VAL 9 2HG1 VAL 9 8.531 4.053 -3.057
77 HG13 VAL 9 3HG1 VAL 9 9.906 5.151 -3.178
78 HG21 VAL 9 3HG2 VAL 9 10.133 5.435 0.369
79 HG22 VAL 9 1HG2 VAL 9 10.677 6.071 -1.183
80 HG23 VAL 9 2HG2 VAL 9 11.590 4.795 -0.386
81 H PHE 10 HN PHE 10 9.424 1.210 -0.947
82 HA PHE 10 HA PHE 10 7.536 0.328 -2.890
83 HB2 PHE 10 HB2 PHE 10 9.568 -0.896 -2.658
84 HB3 PHE 10 HB1 PHE 10 9.437 -0.930 -0.915
85 HD1 PHE 10 HD2 PHE 10 7.644 -2.194 -3.964
86 HD2 PHE 10 HD1 PHE 10 8.710 -2.869 0.142
87 HE1 PHE 10 HE2 PHE 10 6.607 -4.445 -4.065
88 HE2 PHE 10 HE1 PHE 10 7.674 -5.120 0.040
89 HZ PHE 10 HZ PHE 10 6.623 -5.908 -2.062
90 H TRP 11 HN TRP 11 7.701 -0.126 0.632
91 HA TRP 11 HA TRP 11 5.391 -1.653 1.128
92 HB2 TRP 11 HB2 TRP 11 7.374 -0.410 2.611
93 HB3 TRP 11 HB1 TRP 11 5.940 0.472 3.087
94 HD1 TRP 11 HD1 TRP 11 7.632 -1.487 4.903
95 HE1 TRP 11 HE1 TRP 11 6.449 -3.465 6.069
96 HE3 TRP 11 HE3 TRP 11 3.488 -1.918 1.946
97 HZ2 TRP 11 HZ2 TRP 11 4.064 -5.015 5.780
98 HZ3 TRP 11 HZ3 TRP 11 1.786 -3.639 2.408
99 HH2 TRP 11 HH2 TRP 11 2.062 -5.192 4.323
100 H ALA 12 HN ALA 12 5.750 1.935 1.235
101 HA ALA 12 HA ALA 12 3.079 2.564 1.839
102 HB1 ALA 12 HB1 ALA 12 5.203 4.057 1.646
103 HB2 ALA 12 HB2 ALA 12 3.648 4.774 1.223
104 HB3 ALA 12 HB3 ALA 12 4.741 4.233 -0.048
105 H LYS 13 HN LYS 13 4.541 2.014 -1.386
106 HA LYS 13 HA LYS 13 2.257 2.667 -2.986
107 HB2 LYS 13 HB2 LYS 13 4.656 2.294 -3.714
108 HB3 LYS 13 HB1 LYS 13 4.396 0.564 -3.487
109 HG2 LYS 13 HG2 LYS 13 2.564 0.612 -5.128
110 HG3 LYS 13 HG1 LYS 13 2.809 2.342 -5.365
111 HD2 LYS 13 HD2 LYS 13 5.333 1.481 -5.804
112 HD3 LYS 13 HD1 LYS 13 4.447 0.047 -6.311
113 HE2 LYS 13 HE2 LYS 13 4.537 1.283 -8.303
114 HE3 LYS 13 HE1 LYS 13 2.965 1.775 -7.650
115 HZ1 LYS 13 HZ1 LYS 13 3.969 3.699 -6.644
116 HZ2 LYS 13 HZ2 LYS 13 4.360 3.682 -8.295
117 HZ3 LYS 13 HZ3 LYS 13 5.517 3.222 -7.142
118 H HIS 14 HN HIS 14 3.382 -0.411 -1.591
119 HA HIS 14 HA HIS 14 1.215 -2.086 -2.485
120 HB2 HIS 14 HB2 HIS 14 3.614 -2.585 -1.532
121 HB3 HIS 14 HB1 HIS 14 2.826 -2.490 0.037
122 HD1 HIS 14 HD1 HIS 14 3.995 -5.051 -1.785
123 HD2 HIS 14 HD2 HIS 14 0.067 -4.185 -0.678
124 HE1 HIS 14 HE1 HIS 14 2.722 -7.232 -1.898
125 H MET 15 HN MET 15 1.868 -0.400 0.594
126 HA MET 15 HA MET 15 -0.472 -1.168 2.035
127 HB2 MET 15 HB2 MET 15 1.726 0.771 2.228
128 HB3 MET 15 HB1 MET 15 0.238 1.380 2.931
129 HG2 MET 15 HG2 MET 15 1.297 -1.376 3.575
130 HG3 MET 15 HG1 MET 15 1.780 0.051 4.485
131 HE1 MET 15 HE1 MET 15 -1.415 -2.414 3.739
132 HE2 MET 15 HE2 MET 15 -1.386 -2.639 5.484
133 HE3 MET 15 HE3 MET 15 0.109 -2.782 4.569
134 H TRP 16 HN TRP 16 0.147 1.730 -0.006
135 HA TRP 16 HA TRP 16 -2.437 2.923 0.346
136 HB2 TRP 16 HB2 TRP 16 -0.065 3.521 -1.051
137 HB3 TRP 16 HB1 TRP 16 -1.291 3.362 -2.304
138 HD1 TRP 16 HD1 TRP 16 -1.933 5.759 -2.857
139 HE1 TRP 16 HE1 TRP 16 -2.760 7.807 -1.506
140 HE3 TRP 16 HE3 TRP 16 -1.375 3.940 1.843
141 HZ2 TRP 16 HZ2 TRP 16 -3.131 8.554 1.251
142 HZ3 TRP 16 HZ3 TRP 16 -1.963 5.317 3.828
143 HH2 TRP 16 HH2 TRP 16 -2.840 7.617 3.533
144 H ASN 17 HN ASN 17 -1.219 0.470 -1.924
145 HA ASN 17 HA ASN 17 -3.553 0.383 -3.575
146 HB2 ASN 17 HB2 ASN 17 -1.170 -0.601 -3.941
147 HB3 ASN 17 HB1 ASN 17 -1.737 -1.966 -2.986
148 HD21 ASN 17 1HD2 ASN 17 -1.364 -3.197 -5.119
149 HD22 ASN 17 2HD2 ASN 17 -2.617 -3.176 -6.260
150 H PHE 18 HN PHE 18 -2.601 -1.304 -0.596
151 HA PHE 18 HA PHE 18 -4.728 -3.189 -0.348
152 HB2 PHE 18 HB2 PHE 18 -2.701 -3.205 1.033
153 HB3 PHE 18 HB1 PHE 18 -3.079 -1.614 1.663
154 HD1 PHE 18 HD1 PHE 18 -4.386 -5.121 1.525
155 HD2 PHE 18 HD2 PHE 18 -4.355 -1.362 3.606
156 HE1 PHE 18 HE1 PHE 18 -5.669 -6.138 3.386
157 HE2 PHE 18 HE2 PHE 18 -5.638 -2.381 5.467
158 HZ PHE 18 HZ PHE 18 -6.295 -4.770 5.357
159 H ILE 19 HN ILE 19 -4.425 0.223 0.574
160 HA ILE 19 HA ILE 19 -6.990 0.542 1.844
161 HB ILE 19 HB ILE 19 -4.721 2.205 0.843
162 HG12 ILE 19 2HG1 ILE 19 -5.880 3.023 3.343
163 HG13 ILE 19 1HG1 ILE 19 -5.747 1.268 3.314
164 HG21 ILE 19 1HG2 ILE 19 -7.430 3.415 1.438
165 HG22 ILE 19 2HG2 ILE 19 -6.520 3.540 -0.068
166 HG23 ILE 19 3HG2 ILE 19 -5.918 4.323 1.392
167 HD11 ILE 19 3HD1 ILE 19 -3.404 2.830 2.329
168 HD12 ILE 19 1HD1 ILE 19 -3.453 1.300 3.206
169 HD13 ILE 19 2HD1 ILE 19 -3.707 2.819 4.065
170 H SER 20 HN SER 20 -5.837 0.976 -1.519
171 HA SER 20 HA SER 20 -8.201 2.116 -2.639
172 HB2 SER 20 HB2 SER 20 -6.004 0.362 -3.776
173 HB3 SER 20 HB1 SER 20 -7.276 1.060 -4.768
174 HG SER 20 HG SER 20 -5.048 2.206 -3.755
175 H GLY 21 HN GLY 21 -7.251 -1.302 -2.142
176 HA2 GLY 21 HA2 GLY 21 -9.483 -2.507 -3.460
177 HA3 GLY 21 HA1 GLY 21 -8.515 -3.275 -2.192
178 H ILE 22 HN ILE 22 -8.908 -1.589 -0.049
179 HA ILE 22 HA ILE 22 -11.487 -2.385 0.954
180 HB ILE 22 HB ILE 22 -9.418 -0.367 1.904
181 HG12 ILE 22 2HG1 ILE 22 -10.125 -3.097 3.019
182 HG13 ILE 22 1HG1 ILE 22 -8.856 -2.855 1.823
183 HG21 ILE 22 1HG2 ILE 22 -12.083 -1.129 3.027
184 HG22 ILE 22 2HG2 ILE 22 -11.221 0.407 3.116
185 HG23 ILE 22 3HG2 ILE 22 -10.747 -0.929 4.162
186 HD11 ILE 22 3HD1 ILE 22 -8.411 -2.792 4.496
187 HD12 ILE 22 1HD1 ILE 22 -8.729 -1.082 4.199
188 HD13 ILE 22 2HD1 ILE 22 -7.435 -1.901 3.328
189 H GLN 23 HN GLN 23 -10.257 0.647 -0.461
190 HA GLN 23 HA GLN 23 -12.464 2.353 0.010
191 HB2 GLN 23 HB2 GLN 23 -10.073 2.704 -1.051
192 HB3 GLN 23 HB1 GLN 23 -10.919 2.403 -2.565
193 HG2 GLN 23 HG2 GLN 23 -11.515 4.567 -2.567
194 HG3 GLN 23 HG1 GLN 23 -12.554 4.225 -1.186
195 HE21 GLN 23 1HE2 GLN 23 -9.015 4.852 -1.787
196 HE22 GLN 23 2HE2 GLN 23 -8.835 5.826 -0.409
197 H TYR 24 HN TYR 24 -11.906 0.012 -2.558
198 HA TYR 24 HA TYR 24 -14.255 0.587 -4.139
199 HB2 TYR 24 HB2 TYR 24 -12.465 -0.613 -5.165
200 HB3 TYR 24 HB1 TYR 24 -12.364 -1.762 -3.837
201 HD1 TYR 24 HD2 TYR 24 -14.660 -0.598 -6.564
202 HD2 TYR 24 HD1 TYR 24 -13.496 -3.811 -3.963
203 HE1 TYR 24 HE2 TYR 24 -16.196 -2.127 -7.763
204 HE2 TYR 24 HE1 TYR 24 -15.033 -5.340 -5.162
205 HH TYR 24 HH TYR 24 -17.460 -4.343 -7.149
206 H LEU 25 HN LEU 25 -13.549 -1.845 -1.615
207 HA LEU 25 HA LEU 25 -16.157 -3.040 -1.500
208 HB2 LEU 25 HB2 LEU 25 -13.657 -2.989 0.093
209 HB3 LEU 25 HB1 LEU 25 -15.111 -3.336 1.022
210 HG LEU 25 HG LEU 25 -15.607 -4.975 -1.021
211 HD11 LEU 25 1HD1 LEU 25 -12.591 -5.088 -0.908
212 HD12 LEU 25 2HD1 LEU 25 -13.440 -4.137 -2.123
213 HD13 LEU 25 3HD1 LEU 25 -13.677 -5.882 -2.049
214 HD21 LEU 25 3HD2 LEU 25 -14.467 -6.778 0.284
215 HD22 LEU 25 1HD2 LEU 25 -15.412 -5.698 1.308
216 HD23 LEU 25 2HD2 LEU 25 -13.656 -5.539 1.240
217 H ALA 26 HN ALA 26 -14.707 -0.284 0.224
218 HA ALA 26 HA ALA 26 -16.759 0.277 2.101
219 HB1 ALA 26 HB1 ALA 26 -15.025 2.237 0.563
220 HB2 ALA 26 HB2 ALA 26 -14.475 1.307 1.957
221 HB3 ALA 26 HB3 ALA 26 -15.761 2.501 2.144
222 H GLY 27 HN GLY 27 -16.491 1.148 -1.354
223 HA2 GLY 27 HA2 GLY 27 -18.886 2.802 -1.360
224 HA3 GLY 27 HA1 GLY 27 -17.966 2.293 -2.773
225 H LEU 28 HN LEU 28 -18.287 -0.631 -1.636
226 HA LEU 28 HA LEU 28 -20.939 -1.107 -2.907
227 HB2 LEU 28 HB2 LEU 28 -18.310 -2.469 -2.712
228 HB3 LEU 28 HB1 LEU 28 -19.711 -3.530 -2.625
229 HG LEU 28 HG LEU 28 -20.525 -2.087 -4.702
230 HD11 LEU 28 1HD1 LEU 28 -18.665 -1.412 -6.131
231 HD12 LEU 28 2HD1 LEU 28 -17.502 -1.940 -4.916
232 HD13 LEU 28 3HD1 LEU 28 -18.553 -0.560 -4.591
233 HD21 LEU 28 3HD2 LEU 28 -18.355 -4.193 -4.958
234 HD22 LEU 28 1HD2 LEU 28 -19.595 -3.808 -6.152
235 HD23 LEU 28 2HD2 LEU 28 -20.049 -4.546 -4.616
236 H SER 29 HN SER 29 -21.180 -0.102 -0.367
237 HA SER 29 HA SER 29 -21.522 -2.389 1.508
238 HB2 SER 29 HB2 SER 29 -20.393 0.017 1.863
239 HB3 SER 29 HB1 SER 29 -22.052 0.452 2.252
240 HG SER 29 HG SER 29 -20.385 -0.626 3.871
241 H THR 30 HN THR 30 -23.619 -1.269 3.075
242 HA THR 30 HA THR 30 -25.956 -1.979 1.433
243 HB THR 30 HB THR 30 -27.107 -1.737 3.684
244 HG1 THR 30 HG1 THR 30 -25.440 -0.277 4.510
245 HG21 THR 30 3HG2 THR 30 -24.734 -3.546 3.951
246 HG22 THR 30 1HG2 THR 30 -25.924 -3.836 2.683
247 HG23 THR 30 2HG2 THR 30 -26.419 -3.843 4.376
Start of MODEL 21
1 H1 GLN 1 HT1 GLN 1 24.110 0.423 -1.413
2 H2 GLN 1 HT2 GLN 1 23.072 1.546 -2.151
3 H3 GLN 1 HT3 GLN 1 24.631 1.307 -2.761
4 HA GLN 1 HA GLN 1 22.760 0.230 -4.053
5 HB2 GLN 1 HB2 GLN 1 24.150 -1.715 -4.506
6 HB3 GLN 1 HB1 GLN 1 25.150 -0.289 -4.286
7 HG2 GLN 1 HG2 GLN 1 26.275 -1.303 -2.617
8 HG3 GLN 1 HG1 GLN 1 24.778 -1.572 -1.728
9 HE21 GLN 1 1HE2 GLN 1 26.491 -2.994 -4.605
10 HE22 GLN 1 2HE2 GLN 1 26.082 -4.591 -4.206
11 H THR 2 HN THR 2 21.854 0.117 -1.067
12 HA THR 2 HA THR 2 21.010 -2.690 -0.841
13 HB THR 2 HB THR 2 19.651 -1.494 1.106
14 HG1 THR 2 HG1 THR 2 21.055 0.264 1.878
15 HG21 THR 2 3HG2 THR 2 21.187 -3.152 1.667
16 HG22 THR 2 1HG2 THR 2 21.829 -1.730 2.488
17 HG23 THR 2 2HG2 THR 2 22.549 -2.274 0.971
18 H ASN 3 HN ASN 3 19.140 -3.461 -1.480
19 HA ASN 3 HA ASN 3 17.243 -1.826 -3.000
20 HB2 ASN 3 HB2 ASN 3 18.147 -4.342 -3.245
21 HB3 ASN 3 HB1 ASN 3 16.717 -4.674 -2.279
22 HD21 ASN 3 1HD2 ASN 3 16.354 -5.859 -4.564
23 HD22 ASN 3 2HD2 ASN 3 15.472 -4.952 -5.693
24 H TRP 4 HN TRP 4 17.553 -2.455 0.292
25 HA TRP 4 HA TRP 4 14.879 -2.899 1.187
26 HB2 TRP 4 HB2 TRP 4 17.432 -1.783 2.305
27 HB3 TRP 4 HB1 TRP 4 15.951 -1.481 3.205
28 HD1 TRP 4 HD1 TRP 4 18.615 -3.838 3.160
29 HE1 TRP 4 HE1 TRP 4 17.913 -6.146 4.072
30 HE3 TRP 4 HE3 TRP 4 13.533 -3.354 2.976
31 HZ2 TRP 4 HZ2 TRP 4 15.521 -7.591 4.643
32 HZ3 TRP 4 HZ3 TRP 4 12.068 -5.207 3.707
33 HH2 TRP 4 HH2 TRP 4 13.048 -7.325 4.541
34 H GLN 5 HN GLN 5 16.708 0.075 0.522
35 HA GLN 5 HA GLN 5 14.859 2.047 1.292
36 HB2 GLN 5 HB2 GLN 5 15.927 3.384 -0.576
37 HB3 GLN 5 HB1 GLN 5 17.054 2.688 0.584
38 HG2 GLN 5 HG2 GLN 5 18.163 1.979 -1.256
39 HG3 GLN 5 HG1 GLN 5 16.930 0.737 -1.352
40 HE21 GLN 5 1HE2 GLN 5 16.888 4.277 -2.253
41 HE22 GLN 5 2HE2 GLN 5 16.341 3.973 -3.828
42 H LYS 6 HN LYS 6 15.062 0.256 -1.781
43 HA LYS 6 HA LYS 6 12.834 1.527 -3.084
44 HB2 LYS 6 HB2 LYS 6 14.762 -0.516 -3.617
45 HB3 LYS 6 HB1 LYS 6 13.172 -1.208 -3.921
46 HG2 LYS 6 HG2 LYS 6 12.606 0.688 -5.386
47 HG3 LYS 6 HG1 LYS 6 14.181 1.410 -5.064
48 HD2 LYS 6 HD2 LYS 6 14.790 0.306 -6.958
49 HD3 LYS 6 HD1 LYS 6 14.970 -1.055 -5.860
50 HE2 LYS 6 HE2 LYS 6 13.382 -2.184 -6.995
51 HE3 LYS 6 HE1 LYS 6 12.204 -0.914 -6.628
52 HZ1 LYS 6 HZ1 LYS 6 12.536 -1.165 -9.025
53 HZ2 LYS 6 HZ2 LYS 6 14.188 -0.814 -8.842
54 HZ3 LYS 6 HZ3 LYS 6 13.017 0.370 -8.495
55 H LEU 7 HN LEU 7 13.092 -1.399 -1.029
56 HA LEU 7 HA LEU 7 10.378 -2.278 -1.268
57 HB2 LEU 7 HB2 LEU 7 12.529 -3.401 -0.263
58 HB3 LEU 7 HB1 LEU 7 12.033 -2.612 1.231
59 HG LEU 7 HG LEU 7 9.978 -4.175 -0.291
60 HD11 LEU 7 1HD1 LEU 7 11.118 -6.099 -0.163
61 HD12 LEU 7 2HD1 LEU 7 11.089 -5.950 1.592
62 HD13 LEU 7 3HD1 LEU 7 12.455 -5.315 0.677
63 HD21 LEU 7 3HD2 LEU 7 9.069 -3.178 1.624
64 HD22 LEU 7 1HD2 LEU 7 10.550 -3.390 2.559
65 HD23 LEU 7 2HD2 LEU 7 9.508 -4.773 2.230
66 H GLU 8 HN GLU 8 11.926 0.083 0.931
67 HA GLU 8 HA GLU 8 9.691 0.481 2.693
68 HB2 GLU 8 HB2 GLU 8 12.295 1.679 2.123
69 HB3 GLU 8 HB1 GLU 8 11.088 2.914 2.476
70 HG2 GLU 8 HG2 GLU 8 11.315 0.481 4.232
71 HG3 GLU 8 HG1 GLU 8 12.405 1.845 4.457
72 H VAL 9 HN VAL 9 10.671 2.057 -0.356
73 HA VAL 9 HA VAL 9 8.529 3.991 -0.463
74 HB VAL 9 HB VAL 9 10.179 2.651 -2.656
75 HG11 VAL 9 1HG1 VAL 9 9.549 4.451 -4.108
76 HG12 VAL 9 2HG1 VAL 9 8.747 5.316 -2.798
77 HG13 VAL 9 3HG1 VAL 9 8.053 3.820 -3.420
78 HG21 VAL 9 3HG2 VAL 9 11.122 5.210 -2.396
79 HG22 VAL 9 1HG2 VAL 9 11.839 3.807 -1.606
80 HG23 VAL 9 2HG2 VAL 9 10.705 4.830 -0.726
81 H PHE 10 HN PHE 10 8.991 0.726 -1.788
82 HA PHE 10 HA PHE 10 6.494 0.342 -3.109
83 HB2 PHE 10 HB2 PHE 10 8.262 -1.213 -3.517
84 HB3 PHE 10 HB1 PHE 10 8.577 -1.413 -1.806
85 HD1 PHE 10 HD1 PHE 10 5.800 -1.950 -4.283
86 HD2 PHE 10 HD2 PHE 10 7.799 -3.320 -0.736
87 HE1 PHE 10 HE1 PHE 10 4.324 -3.941 -4.221
88 HE2 PHE 10 HE2 PHE 10 6.321 -5.313 -0.675
89 HZ PHE 10 HZ PHE 10 4.585 -5.622 -2.416
90 H TRP 11 HN TRP 11 7.566 -0.421 0.202
91 HA TRP 11 HA TRP 11 5.279 -1.617 1.277
92 HB2 TRP 11 HB2 TRP 11 7.753 -0.746 2.202
93 HB3 TRP 11 HB1 TRP 11 6.605 0.201 3.141
94 HD1 TRP 11 HD1 TRP 11 6.765 -3.453 1.950
95 HE1 TRP 11 HE1 TRP 11 6.142 -4.986 3.932
96 HE3 TRP 11 HE3 TRP 11 5.923 0.075 5.524
97 HZ2 TRP 11 HZ2 TRP 11 5.382 -4.732 6.686
98 HZ3 TRP 11 HZ3 TRP 11 5.251 -0.587 7.817
99 HH2 TRP 11 HH2 TRP 11 4.978 -2.979 8.403
100 H ALA 12 HN ALA 12 6.048 1.920 1.247
101 HA ALA 12 HA ALA 12 3.694 2.660 2.670
102 HB1 ALA 12 HB1 ALA 12 4.226 4.896 2.025
103 HB2 ALA 12 HB2 ALA 12 4.996 4.365 0.532
104 HB3 ALA 12 HB3 ALA 12 5.784 4.069 2.084
105 H LYS 13 HN LYS 13 4.316 2.311 -0.828
106 HA LYS 13 HA LYS 13 1.703 3.129 -1.760
107 HB2 LYS 13 HB2 LYS 13 3.881 2.935 -3.071
108 HB3 LYS 13 HB1 LYS 13 3.679 1.187 -3.010
109 HG2 LYS 13 HG2 LYS 13 2.634 1.559 -5.012
110 HG3 LYS 13 HG1 LYS 13 1.248 1.838 -3.960
111 HD2 LYS 13 HD2 LYS 13 1.440 4.185 -4.122
112 HD3 LYS 13 HD1 LYS 13 3.100 4.099 -4.704
113 HE2 LYS 13 HE2 LYS 13 2.046 4.483 -6.724
114 HE3 LYS 13 HE1 LYS 13 1.911 2.717 -6.693
115 HZ1 LYS 13 HZ1 LYS 13 -0.248 3.626 -7.095
116 HZ2 LYS 13 HZ2 LYS 13 -0.127 4.672 -5.766
117 HZ3 LYS 13 HZ3 LYS 13 -0.246 2.993 -5.524
118 H HIS 14 HN HIS 14 3.164 0.010 -0.867
119 HA HIS 14 HA HIS 14 0.977 -1.728 -1.538
120 HB2 HIS 14 HB2 HIS 14 3.400 -2.311 -1.088
121 HB3 HIS 14 HB1 HIS 14 3.101 -2.007 0.621
122 HD1 HIS 14 HD1 HIS 14 2.371 -4.413 -2.137
123 HD2 HIS 14 HD2 HIS 14 1.488 -3.989 1.913
124 HE1 HIS 14 HE1 HIS 14 1.385 -6.624 -1.385
125 H MET 15 HN MET 15 2.001 -0.288 1.590
126 HA MET 15 HA MET 15 -0.233 -1.187 3.146
127 HB2 MET 15 HB2 MET 15 2.141 0.059 3.673
128 HB3 MET 15 HB1 MET 15 1.043 1.426 3.808
129 HG2 MET 15 HG2 MET 15 0.510 0.736 5.876
130 HG3 MET 15 HG1 MET 15 -0.226 -0.699 5.173
131 HE1 MET 15 HE1 MET 15 0.897 -2.576 4.399
132 HE2 MET 15 HE2 MET 15 1.986 -3.482 5.441
133 HE3 MET 15 HE3 MET 15 2.650 -2.508 4.135
134 H TRP 16 HN TRP 16 0.317 1.753 1.201
135 HA TRP 16 HA TRP 16 -2.091 3.159 1.921
136 HB2 TRP 16 HB2 TRP 16 -0.342 4.371 0.801
137 HB3 TRP 16 HB1 TRP 16 -0.220 3.160 -0.471
138 HD1 TRP 16 HD1 TRP 16 -2.381 6.029 0.720
139 HE1 TRP 16 HE1 TRP 16 -3.941 6.796 -1.192
140 HE3 TRP 16 HE3 TRP 16 -1.403 2.383 -2.637
141 HZ2 TRP 16 HZ2 TRP 16 -4.666 5.926 -3.845
142 HZ3 TRP 16 HZ3 TRP 16 -2.521 2.342 -4.857
143 HH2 TRP 16 HH2 TRP 16 -4.151 4.109 -5.459
144 H ASN 17 HN ASN 17 -1.237 0.912 -0.739
145 HA ASN 17 HA ASN 17 -3.738 0.904 -2.040
146 HB2 ASN 17 HB2 ASN 17 -1.323 -0.206 -2.514
147 HB3 ASN 17 HB1 ASN 17 -2.153 -1.638 -1.913
148 HD21 ASN 17 1HD2 ASN 17 -4.144 -2.330 -3.118
149 HD22 ASN 17 2HD2 ASN 17 -4.332 -1.858 -4.736
150 H PHE 18 HN PHE 18 -2.513 -1.062 0.675
151 HA PHE 18 HA PHE 18 -4.683 -2.875 1.042
152 HB2 PHE 18 HB2 PHE 18 -2.585 -3.131 2.218
153 HB3 PHE 18 HB1 PHE 18 -2.681 -1.510 2.871
154 HD1 PHE 18 HD2 PHE 18 -4.082 -4.930 3.085
155 HD2 PHE 18 HD1 PHE 18 -3.942 -1.025 4.869
156 HE1 PHE 18 HE2 PHE 18 -5.194 -5.817 5.116
157 HE2 PHE 18 HE1 PHE 18 -5.052 -1.911 6.898
158 HZ PHE 18 HZ PHE 18 -5.679 -4.307 7.023
159 H ILE 19 HN ILE 19 -4.102 0.405 2.216
160 HA ILE 19 HA ILE 19 -6.520 0.766 3.730
161 HB ILE 19 HB ILE 19 -4.046 2.048 3.163
162 HG12 ILE 19 2HG1 ILE 19 -4.863 3.511 5.118
163 HG13 ILE 19 1HG1 ILE 19 -6.293 2.480 5.109
164 HG21 ILE 19 1HG2 ILE 19 -6.353 3.927 2.662
165 HG22 ILE 19 2HG2 ILE 19 -5.024 3.551 1.569
166 HG23 ILE 19 3HG2 ILE 19 -4.710 4.433 3.058
167 HD11 ILE 19 3HD1 ILE 19 -5.155 0.696 5.950
168 HD12 ILE 19 1HD1 ILE 19 -4.003 1.918 6.486
169 HD13 ILE 19 2HD1 ILE 19 -3.715 1.034 4.988
170 H SER 20 HN SER 20 -5.570 1.665 0.405
171 HA SER 20 HA SER 20 -7.960 3.016 -0.396
172 HB2 SER 20 HB2 SER 20 -5.687 2.927 -1.540
173 HB3 SER 20 HB1 SER 20 -6.107 1.313 -2.089
174 HG SER 20 HG SER 20 -7.644 2.160 -3.379
175 H GLY 21 HN GLY 21 -7.089 -0.468 -0.496
176 HA2 GLY 21 HA2 GLY 21 -9.388 -1.373 -1.934
177 HA3 GLY 21 HA1 GLY 21 -8.402 -2.371 -0.862
178 H ILE 22 HN ILE 22 -8.736 -1.197 1.583
179 HA ILE 22 HA ILE 22 -11.343 -2.101 2.425
180 HB ILE 22 HB ILE 22 -9.137 -0.480 3.744
181 HG12 ILE 22 2HG1 ILE 22 -9.950 -3.295 4.431
182 HG13 ILE 22 1HG1 ILE 22 -8.936 -3.005 3.020
183 HG21 ILE 22 1HG2 ILE 22 -10.981 0.099 5.075
184 HG22 ILE 22 2HG2 ILE 22 -10.353 -1.331 5.893
185 HG23 ILE 22 3HG2 ILE 22 -11.764 -1.464 4.844
186 HD11 ILE 22 3HD1 ILE 22 -7.261 -3.193 4.558
187 HD12 ILE 22 1HD1 ILE 22 -8.291 -2.705 5.904
188 HD13 ILE 22 2HD1 ILE 22 -7.614 -1.487 4.819
189 H GLN 23 HN GLN 23 -9.927 1.108 1.852
190 HA GLN 23 HA GLN 23 -12.051 2.781 2.687
191 HB2 GLN 23 HB2 GLN 23 -9.870 3.648 2.218
192 HB3 GLN 23 HB1 GLN 23 -9.874 2.966 0.601
193 HG2 GLN 23 HG2 GLN 23 -12.037 4.598 0.434
194 HG3 GLN 23 HG1 GLN 23 -11.062 5.493 1.599
195 HE21 GLN 23 1HE2 GLN 23 -9.890 7.069 0.472
196 HE22 GLN 23 2HE2 GLN 23 -9.122 6.813 -1.019
197 H TYR 24 HN TYR 24 -11.442 1.256 -0.429
198 HA TYR 24 HA TYR 24 -13.638 2.316 -1.924
199 HB2 TYR 24 HB2 TYR 24 -11.801 1.242 -3.029
200 HB3 TYR 24 HB1 TYR 24 -11.993 -0.223 -2.077
201 HD1 TYR 24 HD1 TYR 24 -13.822 1.927 -4.544
202 HD2 TYR 24 HD2 TYR 24 -13.263 -2.006 -2.913
203 HE1 TYR 24 HE1 TYR 24 -15.336 0.996 -6.271
204 HE2 TYR 24 HE2 TYR 24 -14.776 -2.938 -4.640
205 HH TYR 24 HH TYR 24 -15.468 -1.760 -7.302
206 H LEU 25 HN LEU 25 -13.345 -0.711 -0.053
207 HA LEU 25 HA LEU 25 -16.007 -1.690 -0.466
208 HB2 LEU 25 HB2 LEU 25 -13.668 -2.242 1.254
209 HB3 LEU 25 HB1 LEU 25 -15.213 -2.703 1.957
210 HG LEU 25 HG LEU 25 -15.649 -3.738 -0.438
211 HD11 LEU 25 1HD1 LEU 25 -13.378 -2.739 -1.184
212 HD12 LEU 25 2HD1 LEU 25 -13.751 -4.397 -1.650
213 HD13 LEU 25 3HD1 LEU 25 -12.661 -4.084 -0.298
214 HD21 LEU 25 3HD2 LEU 25 -13.760 -5.016 1.572
215 HD22 LEU 25 1HD2 LEU 25 -14.725 -5.877 0.375
216 HD23 LEU 25 2HD2 LEU 25 -15.520 -5.013 1.690
217 H ALA 26 HN ALA 26 -14.646 0.481 1.994
218 HA ALA 26 HA ALA 26 -16.813 0.582 3.832
219 HB1 ALA 26 HB1 ALA 26 -14.437 1.581 3.953
220 HB2 ALA 26 HB2 ALA 26 -15.741 2.557 4.627
221 HB3 ALA 26 HB3 ALA 26 -15.088 2.939 3.035
222 H GLY 27 HN GLY 27 -16.170 2.593 0.927
223 HA2 GLY 27 HA2 GLY 27 -18.686 4.039 1.131
224 HA3 GLY 27 HA1 GLY 27 -17.558 4.102 -0.224
225 H LEU 28 HN LEU 28 -17.612 1.080 -0.495
226 HA LEU 28 HA LEU 28 -20.303 0.816 -1.776
227 HB2 LEU 28 HB2 LEU 28 -17.694 0.790 -2.832
228 HB3 LEU 28 HB1 LEU 28 -18.176 -0.901 -2.796
229 HG LEU 28 HG LEU 28 -20.039 1.200 -3.889
230 HD11 LEU 28 1HD1 LEU 28 -17.754 -0.194 -5.303
231 HD12 LEU 28 2HD1 LEU 28 -18.032 1.542 -5.166
232 HD13 LEU 28 3HD1 LEU 28 -19.105 0.553 -6.155
233 HD21 LEU 28 3HD2 LEU 28 -20.781 -0.798 -5.244
234 HD22 LEU 28 1HD2 LEU 28 -21.000 -1.002 -3.506
235 HD23 LEU 28 2HD2 LEU 28 -19.644 -1.781 -4.320
236 H SER 29 HN SER 29 -20.447 0.153 0.746
237 HA SER 29 HA SER 29 -19.510 -2.450 1.547
238 HB2 SER 29 HB2 SER 29 -20.989 -2.115 3.449
239 HB3 SER 29 HB1 SER 29 -20.168 -0.612 3.064
240 HG SER 29 HG SER 29 -22.857 -1.377 2.705
241 H THR 30 HN THR 30 -22.603 -1.382 0.134
242 HA THR 30 HA THR 30 -24.375 -2.512 -0.806
243 HB THR 30 HB THR 30 -22.423 -4.797 -1.199
244 HG1 THR 30 HG1 THR 30 -21.225 -3.202 -1.983
245 HG21 THR 30 3HG2 THR 30 -24.696 -5.186 -1.998
246 HG22 THR 30 1HG2 THR 30 -23.598 -4.992 -3.363
247 HG23 THR 30 2HG2 THR 30 -24.662 -3.668 -2.892
Start of MODEL 22
1 H1 GLN 1 HT1 GLN 1 -21.883 6.233 4.053
2 H2 GLN 1 HT2 GLN 1 -22.505 4.651 4.040
3 H3 GLN 1 HT3 GLN 1 -21.849 5.322 2.629
4 HA GLN 1 HA GLN 1 -19.672 5.190 3.380
5 HB2 GLN 1 HB2 GLN 1 -19.170 4.767 5.771
6 HB3 GLN 1 HB1 GLN 1 -20.095 6.237 5.528
7 HG2 GLN 1 HG2 GLN 1 -22.000 4.170 5.926
8 HG3 GLN 1 HG1 GLN 1 -20.735 3.909 7.117
9 HE21 GLN 1 1HE2 GLN 1 -23.647 5.219 7.145
10 HE22 GLN 1 2HE2 GLN 1 -23.384 6.614 8.074
11 H THR 2 HN THR 2 -20.495 3.390 1.847
12 HA THR 2 HA THR 2 -20.605 0.741 3.204
13 HB THR 2 HB THR 2 -21.321 1.636 0.397
14 HG1 THR 2 HG1 THR 2 -23.161 2.109 1.254
15 HG21 THR 2 3HG2 THR 2 -21.449 -1.028 1.789
16 HG22 THR 2 1HG2 THR 2 -20.878 -0.651 0.164
17 HG23 THR 2 2HG2 THR 2 -22.605 -0.625 0.521
18 H ASN 3 HN ASN 3 -19.409 1.200 -0.073
19 HA ASN 3 HA ASN 3 -17.075 -0.399 0.551
20 HB2 ASN 3 HB2 ASN 3 -16.768 -0.547 -1.735
21 HB3 ASN 3 HB1 ASN 3 -18.497 -0.243 -1.639
22 HD21 ASN 3 1HD2 ASN 3 -19.230 2.027 -2.178
23 HD22 ASN 3 2HD2 ASN 3 -18.224 3.017 -3.112
24 H TRP 4 HN TRP 4 -17.550 2.879 1.057
25 HA TRP 4 HA TRP 4 -15.007 3.967 0.226
26 HB2 TRP 4 HB2 TRP 4 -16.846 4.799 2.498
27 HB3 TRP 4 HB1 TRP 4 -15.602 5.797 1.777
28 HD1 TRP 4 HD1 TRP 4 -18.887 6.196 1.904
29 HE1 TRP 4 HE1 TRP 4 -20.089 6.803 -0.290
30 HE3 TRP 4 HE3 TRP 4 -15.373 4.664 -1.491
31 HZ2 TRP 4 HZ2 TRP 4 -19.628 6.658 -3.106
32 HZ3 TRP 4 HZ3 TRP 4 -15.788 4.914 -3.910
33 HH2 TRP 4 HH2 TRP 4 -17.905 5.907 -4.728
34 H GLN 5 HN GLN 5 -16.183 3.000 3.456
35 HA GLN 5 HA GLN 5 -13.693 3.100 4.843
36 HB2 GLN 5 HB2 GLN 5 -16.142 1.330 5.204
37 HB3 GLN 5 HB1 GLN 5 -14.843 1.465 6.386
38 HG2 GLN 5 HG2 GLN 5 -15.513 4.119 5.850
39 HG3 GLN 5 HG1 GLN 5 -17.068 3.288 5.868
40 HE21 GLN 5 1HE2 GLN 5 -14.018 3.373 7.838
41 HE22 GLN 5 2HE2 GLN 5 -14.830 3.238 9.322
42 H LYS 6 HN LYS 6 -15.299 0.500 3.019
43 HA LYS 6 HA LYS 6 -13.360 -1.570 3.435
44 HB2 LYS 6 HB2 LYS 6 -15.748 -1.776 2.629
45 HB3 LYS 6 HB1 LYS 6 -15.213 -1.136 1.076
46 HG2 LYS 6 HG2 LYS 6 -13.394 -3.123 1.425
47 HG3 LYS 6 HG1 LYS 6 -14.775 -3.815 2.272
48 HD2 LYS 6 HD2 LYS 6 -15.728 -2.654 -0.163
49 HD3 LYS 6 HD1 LYS 6 -14.330 -3.652 -0.548
50 HE2 LYS 6 HE2 LYS 6 -16.367 -4.797 1.325
51 HE3 LYS 6 HE1 LYS 6 -16.776 -4.714 -0.396
52 HZ1 LYS 6 HZ1 LYS 6 -14.255 -5.882 0.679
53 HZ2 LYS 6 HZ2 LYS 6 -14.747 -5.858 -0.949
54 HZ3 LYS 6 HZ3 LYS 6 -15.604 -6.777 0.190
55 H LEU 7 HN LEU 7 -13.614 1.047 0.983
56 HA LEU 7 HA LEU 7 -11.548 0.083 -0.763
57 HB2 LEU 7 HB2 LEU 7 -13.255 1.866 -1.296
58 HB3 LEU 7 HB1 LEU 7 -12.372 2.956 -0.229
59 HG LEU 7 HG LEU 7 -10.847 1.542 -2.381
60 HD11 LEU 7 1HD1 LEU 7 -11.365 3.391 -3.959
61 HD12 LEU 7 2HD1 LEU 7 -12.604 3.964 -2.845
62 HD13 LEU 7 3HD1 LEU 7 -12.769 2.383 -3.612
63 HD21 LEU 7 3HD2 LEU 7 -10.523 3.849 -0.598
64 HD22 LEU 7 1HD2 LEU 7 -10.115 4.221 -2.273
65 HD23 LEU 7 2HD2 LEU 7 -9.300 2.900 -1.440
66 H GLU 8 HN GLU 8 -11.443 2.290 2.081
67 HA GLU 8 HA GLU 8 -8.663 2.956 1.837
68 HB2 GLU 8 HB2 GLU 8 -10.566 2.812 4.199
69 HB3 GLU 8 HB1 GLU 8 -8.950 3.514 4.298
70 HG2 GLU 8 HG2 GLU 8 -9.479 5.252 2.778
71 HG3 GLU 8 HG1 GLU 8 -10.926 4.429 2.205
72 H VAL 9 HN VAL 9 -10.316 0.353 3.658
73 HA VAL 9 HA VAL 9 -7.957 -0.851 4.786
74 HB VAL 9 HB VAL 9 -10.642 -2.054 3.989
75 HG11 VAL 9 1HG1 VAL 9 -8.696 -3.667 4.473
76 HG12 VAL 9 2HG1 VAL 9 -10.171 -3.891 5.409
77 HG13 VAL 9 3HG1 VAL 9 -8.782 -3.085 6.136
78 HG21 VAL 9 3HG2 VAL 9 -9.823 -0.284 6.168
79 HG22 VAL 9 1HG2 VAL 9 -10.535 -1.782 6.767
80 HG23 VAL 9 2HG2 VAL 9 -11.442 -0.759 5.659
81 H PHE 10 HN PHE 10 -9.781 -1.371 1.794
82 HA PHE 10 HA PHE 10 -8.318 -3.529 0.624
83 HB2 PHE 10 HB2 PHE 10 -10.485 -2.880 -0.190
84 HB3 PHE 10 HB1 PHE 10 -9.994 -1.213 -0.356
85 HD1 PHE 10 HD1 PHE 10 -9.505 -4.621 -1.756
86 HD2 PHE 10 HD2 PHE 10 -9.055 -0.395 -2.390
87 HE1 PHE 10 HE1 PHE 10 -8.951 -5.038 -4.137
88 HE2 PHE 10 HE2 PHE 10 -8.501 -0.814 -4.770
89 HZ PHE 10 HZ PHE 10 -8.448 -3.132 -5.643
90 H TRP 11 HN TRP 11 -8.095 -0.011 0.157
91 HA TRP 11 HA TRP 11 -5.901 0.157 -1.604
92 HB2 TRP 11 HB2 TRP 11 -7.623 1.899 -0.475
93 HB3 TRP 11 HB1 TRP 11 -6.207 2.225 0.516
94 HD1 TRP 11 HD1 TRP 11 -6.703 1.545 -3.233
95 HE1 TRP 11 HE1 TRP 11 -5.457 3.373 -4.570
96 HE3 TRP 11 HE3 TRP 11 -4.872 4.327 0.623
97 HZ2 TRP 11 HZ2 TRP 11 -3.894 5.712 -4.051
98 HZ3 TRP 11 HZ3 TRP 11 -3.509 6.348 0.182
99 HH2 TRP 11 HH2 TRP 11 -3.016 7.046 -2.143
100 H ALA 12 HN ALA 12 -5.899 0.109 1.994
101 HA ALA 12 HA ALA 12 -3.220 0.703 2.495
102 HB1 ALA 12 HB1 ALA 12 -3.522 -0.602 4.570
103 HB2 ALA 12 HB2 ALA 12 -4.960 -1.352 3.882
104 HB3 ALA 12 HB3 ALA 12 -4.945 0.381 4.220
105 H LYS 13 HN LYS 13 -4.581 -2.420 1.446
106 HA LYS 13 HA LYS 13 -2.241 -4.044 1.774
107 HB2 LYS 13 HB2 LYS 13 -4.562 -4.838 1.383
108 HB3 LYS 13 HB1 LYS 13 -4.522 -4.151 -0.235
109 HG2 LYS 13 HG2 LYS 13 -2.441 -5.688 -0.582
110 HG3 LYS 13 HG1 LYS 13 -3.050 -6.549 0.835
111 HD2 LYS 13 HD2 LYS 13 -5.095 -7.093 -0.218
112 HD3 LYS 13 HD1 LYS 13 -4.860 -5.896 -1.486
113 HE2 LYS 13 HE2 LYS 13 -4.219 -7.750 -2.687
114 HE3 LYS 13 HE1 LYS 13 -2.659 -7.426 -1.913
115 HZ1 LYS 13 HZ1 LYS 13 -4.777 -9.238 -0.863
116 HZ2 LYS 13 HZ2 LYS 13 -3.312 -8.880 -0.077
117 HZ3 LYS 13 HZ3 LYS 13 -3.309 -9.717 -1.552
118 H HIS 14 HN HIS 14 -3.455 -2.159 -1.000
119 HA HIS 14 HA HIS 14 -1.231 -2.690 -2.801
120 HB2 HIS 14 HB2 HIS 14 -3.190 -0.370 -2.749
121 HB3 HIS 14 HB1 HIS 14 -2.270 -0.908 -4.138
122 HD1 HIS 14 HD1 HIS 14 -2.969 -3.402 -5.064
123 HD2 HIS 14 HD2 HIS 14 -5.555 -1.591 -2.349
124 HE1 HIS 14 HE1 HIS 14 -5.156 -4.670 -5.222
125 H MET 15 HN MET 15 -2.204 0.080 -0.794
126 HA MET 15 HA MET 15 -0.026 1.824 -1.302
127 HB2 MET 15 HB2 MET 15 -2.368 1.742 0.247
128 HB3 MET 15 HB1 MET 15 -1.079 1.992 1.411
129 HG2 MET 15 HG2 MET 15 -1.601 3.651 -1.069
130 HG3 MET 15 HG1 MET 15 -1.929 4.137 0.591
131 HE1 MET 15 HE1 MET 15 0.020 5.429 -1.879
132 HE2 MET 15 HE2 MET 15 0.475 3.771 -2.253
133 HE3 MET 15 HE3 MET 15 1.714 4.918 -1.758
134 H TRP 16 HN TRP 16 -0.365 -0.697 1.261
135 HA TRP 16 HA TRP 16 2.173 -0.119 2.484
136 HB2 TRP 16 HB2 TRP 16 0.083 -1.683 3.196
137 HB3 TRP 16 HB1 TRP 16 1.138 -2.924 2.516
138 HD1 TRP 16 HD1 TRP 16 2.247 -4.027 4.552
139 HE1 TRP 16 HE1 TRP 16 3.562 -3.182 6.603
140 HE3 TRP 16 HE3 TRP 16 1.636 0.981 3.950
141 HZ2 TRP 16 HZ2 TRP 16 4.264 -0.677 7.829
142 HZ3 TRP 16 HZ3 TRP 16 2.631 2.588 5.562
143 HH2 TRP 16 HH2 TRP 16 3.942 1.763 7.496
144 H ASN 17 HN ASN 17 1.221 -2.088 -0.296
145 HA ASN 17 HA ASN 17 3.711 -3.472 -0.629
146 HB2 ASN 17 HB2 ASN 17 1.324 -3.780 -1.725
147 HB3 ASN 17 HB1 ASN 17 1.936 -2.647 -2.930
148 HD21 ASN 17 1HD2 ASN 17 2.358 -5.916 -1.607
149 HD22 ASN 17 2HD2 ASN 17 3.409 -6.447 -2.829
150 H PHE 18 HN PHE 18 2.556 -0.245 -1.546
151 HA PHE 18 HA PHE 18 4.717 0.474 -3.321
152 HB2 PHE 18 HB2 PHE 18 2.577 1.722 -3.200
153 HB3 PHE 18 HB1 PHE 18 2.874 2.096 -1.511
154 HD1 PHE 18 HD1 PHE 18 4.302 2.609 -4.939
155 HD2 PHE 18 HD2 PHE 18 4.081 3.992 -0.878
156 HE1 PHE 18 HE1 PHE 18 5.560 4.651 -5.564
157 HE2 PHE 18 HE2 PHE 18 5.338 6.033 -1.503
158 HZ PHE 18 HZ PHE 18 6.079 6.364 -3.848
159 H ILE 19 HN ILE 19 4.096 0.912 0.168
160 HA ILE 19 HA ILE 19 6.593 2.153 0.847
161 HB ILE 19 HB ILE 19 4.306 0.811 2.256
162 HG12 ILE 19 2HG1 ILE 19 4.871 3.204 3.486
163 HG13 ILE 19 1HG1 ILE 19 5.401 3.511 1.836
164 HG21 ILE 19 1HG2 ILE 19 5.960 -0.046 3.698
165 HG22 ILE 19 2HG2 ILE 19 5.491 1.473 4.456
166 HG23 ILE 19 3HG2 ILE 19 6.983 1.380 3.521
167 HD11 ILE 19 3HD1 ILE 19 2.711 2.283 2.453
168 HD12 ILE 19 1HD1 ILE 19 3.249 3.029 0.949
169 HD13 ILE 19 2HD1 ILE 19 2.952 4.027 2.371
170 H SER 20 HN SER 20 5.551 -1.286 0.787
171 HA SER 20 HA SER 20 7.976 -2.334 1.891
172 HB2 SER 20 HB2 SER 20 7.086 -4.465 1.282
173 HB3 SER 20 HB1 SER 20 5.726 -3.456 1.721
174 HG SER 20 HG SER 20 6.571 -4.408 -0.794
175 H GLY 21 HN GLY 21 7.130 -1.477 -1.468
176 HA2 GLY 21 HA2 GLY 21 9.353 -2.799 -2.723
177 HA3 GLY 21 HA1 GLY 21 8.460 -1.433 -3.403
178 H ILE 22 HN ILE 22 8.864 0.566 -1.628
179 HA ILE 22 HA ILE 22 11.520 1.500 -2.202
180 HB ILE 22 HB ILE 22 9.129 2.379 -0.616
181 HG12 ILE 22 2HG1 ILE 22 10.033 4.511 -2.058
182 HG13 ILE 22 1HG1 ILE 22 10.646 3.177 -3.028
183 HG21 ILE 22 1HG2 ILE 22 10.864 2.982 0.963
184 HG22 ILE 22 2HG2 ILE 22 10.347 4.440 0.119
185 HG23 ILE 22 3HG2 ILE 22 11.861 3.653 -0.328
186 HD11 ILE 22 3HD1 ILE 22 8.421 3.790 -3.803
187 HD12 ILE 22 1HD1 ILE 22 7.770 3.608 -2.175
188 HD13 ILE 22 2HD1 ILE 22 8.352 2.195 -3.056
189 H GLN 23 HN GLN 23 10.031 0.176 0.773
190 HA GLN 23 HA GLN 23 12.312 0.360 2.472
191 HB2 GLN 23 HB2 GLN 23 9.736 -0.308 2.807
192 HB3 GLN 23 HB1 GLN 23 10.419 -1.928 2.739
193 HG2 GLN 23 HG2 GLN 23 11.025 -1.724 4.885
194 HG3 GLN 23 HG1 GLN 23 12.115 -0.414 4.438
195 HE21 GLN 23 1HE2 GLN 23 11.694 1.427 5.701
196 HE22 GLN 23 2HE2 GLN 23 10.152 1.917 6.212
197 H TYR 24 HN TYR 24 11.253 -2.199 0.294
198 HA TYR 24 HA TYR 24 13.169 -4.213 0.911
199 HB2 TYR 24 HB2 TYR 24 11.296 -4.797 -0.426
200 HB3 TYR 24 HB1 TYR 24 11.571 -3.470 -1.543
201 HD1 TYR 24 HD2 TYR 24 13.193 -6.620 -0.297
202 HD2 TYR 24 HD1 TYR 24 12.703 -3.855 -3.545
203 HE1 TYR 24 HE2 TYR 24 14.515 -8.112 -1.767
204 HE2 TYR 24 HE1 TYR 24 14.025 -5.346 -5.017
205 HH TYR 24 HH TYR 24 15.925 -7.859 -3.887
206 H LEU 25 HN LEU 25 13.318 -1.533 -1.462
207 HA LEU 25 HA LEU 25 15.910 -2.165 -2.520
208 HB2 LEU 25 HB2 LEU 25 13.966 0.056 -2.585
209 HB3 LEU 25 HB1 LEU 25 15.641 0.573 -2.760
210 HG LEU 25 HG LEU 25 15.746 -1.472 -4.455
211 HD11 LEU 25 1HD1 LEU 25 12.882 -0.597 -4.830
212 HD12 LEU 25 2HD1 LEU 25 13.296 -2.003 -3.851
213 HD13 LEU 25 3HD1 LEU 25 13.721 -1.965 -5.561
214 HD21 LEU 25 3HD2 LEU 25 15.245 0.113 -6.270
215 HD22 LEU 25 1HD2 LEU 25 16.161 0.915 -4.995
216 HD23 LEU 25 2HD2 LEU 25 14.421 1.178 -5.131
217 H ALA 26 HN ALA 26 14.899 -0.108 0.211
218 HA ALA 26 HA ALA 26 17.444 0.998 0.881
219 HB1 ALA 26 HB1 ALA 26 15.623 1.976 1.970
220 HB2 ALA 26 HB2 ALA 26 16.263 0.952 3.254
221 HB3 ALA 26 HB3 ALA 26 14.866 0.423 2.318
222 H GLY 27 HN GLY 27 15.866 -2.056 1.884
223 HA2 GLY 27 HA2 GLY 27 18.048 -2.895 3.606
224 HA3 GLY 27 HA1 GLY 27 16.690 -3.891 3.087
225 H LEU 28 HN LEU 28 17.201 -3.399 0.192
226 HA LEU 28 HA LEU 28 19.439 -5.326 -0.151
227 HB2 LEU 28 HB2 LEU 28 16.953 -5.487 -1.007
228 HB3 LEU 28 HB1 LEU 28 17.523 -4.415 -2.282
229 HG LEU 28 HG LEU 28 19.507 -6.380 -2.103
230 HD11 LEU 28 1HD1 LEU 28 17.934 -8.430 -2.540
231 HD12 LEU 28 2HD1 LEU 28 16.773 -7.510 -1.584
232 HD13 LEU 28 3HD1 LEU 28 18.323 -7.972 -0.883
233 HD21 LEU 28 3HD2 LEU 28 18.313 -7.183 -4.271
234 HD22 LEU 28 1HD2 LEU 28 18.911 -5.526 -4.217
235 HD23 LEU 28 2HD2 LEU 28 17.194 -5.854 -3.973
236 H SER 29 HN SER 29 20.292 -2.719 0.467
237 HA SER 29 HA SER 29 20.816 -1.119 -1.901
238 HB2 SER 29 HB2 SER 29 21.858 -1.172 0.935
239 HB3 SER 29 HB1 SER 29 22.490 -0.049 -0.255
240 HG SER 29 HG SER 29 19.906 -0.248 0.871
241 H THR 30 HN THR 30 22.241 -1.691 -3.444
242 HA THR 30 HA THR 30 24.900 -2.745 -2.792
243 HB THR 30 HB THR 30 23.409 -4.711 -2.781
244 HG1 THR 30 HG1 THR 30 25.260 -4.545 -4.922
245 HG21 THR 30 3HG2 THR 30 21.713 -3.937 -4.375
246 HG22 THR 30 1HG2 THR 30 22.371 -5.499 -4.863
247 HG23 THR 30 2HG2 THR 30 22.891 -4.028 -5.685
Start of MODEL 23
1 H1 GLN 1 HT1 GLN 1 -17.575 -2.180 -1.950
2 H2 GLN 1 HT2 GLN 1 -19.052 -1.572 -1.378
3 H3 GLN 1 HT3 GLN 1 -18.563 -1.267 -2.976
4 HA GLN 1 HA GLN 1 -19.118 -4.002 -1.928
5 HB2 GLN 1 HB2 GLN 1 -20.848 -1.918 -3.247
6 HB3 GLN 1 HB1 GLN 1 -21.208 -3.629 -3.421
7 HG2 GLN 1 HG2 GLN 1 -22.233 -3.601 -1.422
8 HG3 GLN 1 HG1 GLN 1 -20.705 -3.172 -0.655
9 HE21 GLN 1 1HE2 GLN 1 -23.812 -1.891 -1.701
10 HE22 GLN 1 2HE2 GLN 1 -23.548 -0.311 -1.143
11 H THR 2 HN THR 2 -19.738 -5.380 -3.910
12 HA THR 2 HA THR 2 -19.088 -6.452 -5.851
13 HB THR 2 HB THR 2 -18.896 -3.617 -6.904
14 HG1 THR 2 HG1 THR 2 -21.128 -3.737 -7.109
15 HG21 THR 2 3HG2 THR 2 -19.884 -6.162 -8.212
16 HG22 THR 2 1HG2 THR 2 -18.264 -5.499 -8.437
17 HG23 THR 2 2HG2 THR 2 -19.672 -4.587 -8.978
18 H ASN 3 HN ASN 3 -17.051 -3.887 -6.959
19 HA ASN 3 HA ASN 3 -14.647 -5.577 -6.536
20 HB2 ASN 3 HB2 ASN 3 -13.694 -4.284 -8.356
21 HB3 ASN 3 HB1 ASN 3 -15.306 -4.792 -8.841
22 HD21 ASN 3 1HD2 ASN 3 -13.377 -2.168 -9.169
23 HD22 ASN 3 2HD2 ASN 3 -14.531 -0.928 -9.074
24 H TRP 4 HN TRP 4 -16.056 -2.544 -5.630
25 HA TRP 4 HA TRP 4 -13.801 -1.091 -4.693
26 HB2 TRP 4 HB2 TRP 4 -16.630 -1.258 -3.615
27 HB3 TRP 4 HB1 TRP 4 -15.494 0.016 -3.225
28 HD1 TRP 4 HD1 TRP 4 -18.376 0.010 -4.960
29 HE1 TRP 4 HE1 TRP 4 -18.374 1.298 -7.186
30 HE3 TRP 4 HE3 TRP 4 -13.343 0.278 -5.834
31 HZ2 TRP 4 HZ2 TRP 4 -16.493 2.313 -9.090
32 HZ3 TRP 4 HZ3 TRP 4 -12.482 1.407 -7.854
33 HH2 TRP 4 HH2 TRP 4 -14.044 2.425 -9.484
34 H GLN 5 HN GLN 5 -15.912 -3.395 -2.984
35 HA GLN 5 HA GLN 5 -14.740 -3.425 -0.436
36 HB2 GLN 5 HB2 GLN 5 -15.363 -5.897 -0.434
37 HB3 GLN 5 HB1 GLN 5 -16.673 -4.774 -0.777
38 HG2 GLN 5 HG2 GLN 5 -16.108 -5.261 -3.279
39 HG3 GLN 5 HG1 GLN 5 -15.199 -6.628 -2.649
40 HE21 GLN 5 1HE2 GLN 5 -16.441 -8.492 -2.838
41 HE22 GLN 5 2HE2 GLN 5 -18.110 -8.576 -2.537
42 H LYS 6 HN LYS 6 -13.712 -5.333 -3.282
43 HA LYS 6 HA LYS 6 -11.401 -6.534 -2.029
44 HB2 LYS 6 HB2 LYS 6 -12.611 -7.399 -4.030
45 HB3 LYS 6 HB1 LYS 6 -12.029 -6.018 -4.956
46 HG2 LYS 6 HG2 LYS 6 -9.844 -7.379 -3.584
47 HG3 LYS 6 HG1 LYS 6 -10.729 -8.477 -4.643
48 HD2 LYS 6 HD2 LYS 6 -10.377 -7.076 -6.550
49 HD3 LYS 6 HD1 LYS 6 -9.770 -5.754 -5.557
50 HE2 LYS 6 HE2 LYS 6 -8.337 -8.390 -5.433
51 HE3 LYS 6 HE1 LYS 6 -8.080 -7.352 -6.843
52 HZ1 LYS 6 HZ1 LYS 6 -7.776 -6.512 -4.005
53 HZ2 LYS 6 HZ2 LYS 6 -7.563 -5.507 -5.361
54 HZ3 LYS 6 HZ3 LYS 6 -6.508 -6.811 -5.088
55 H LEU 7 HN LEU 7 -11.901 -3.616 -4.013
56 HA LEU 7 HA LEU 7 -9.146 -2.853 -4.324
57 HB2 LEU 7 HB2 LEU 7 -11.099 -2.110 -5.693
58 HB3 LEU 7 HB1 LEU 7 -11.676 -1.189 -4.311
59 HG LEU 7 HG LEU 7 -8.897 -0.551 -4.872
60 HD11 LEU 7 1HD1 LEU 7 -9.233 0.559 -7.030
61 HD12 LEU 7 2HD1 LEU 7 -10.892 -0.033 -7.100
62 HD13 LEU 7 3HD1 LEU 7 -9.545 -1.169 -7.190
63 HD21 LEU 7 3HD2 LEU 7 -10.547 0.791 -3.542
64 HD22 LEU 7 1HD2 LEU 7 -11.426 1.129 -5.034
65 HD23 LEU 7 2HD2 LEU 7 -9.778 1.724 -4.825
66 H GLU 8 HN GLU 8 -11.588 -2.068 -1.818
67 HA GLU 8 HA GLU 8 -10.064 -0.050 -0.449
68 HB2 GLU 8 HB2 GLU 8 -12.306 -1.938 0.316
69 HB3 GLU 8 HB1 GLU 8 -11.660 -0.754 1.453
70 HG2 GLU 8 HG2 GLU 8 -12.332 1.078 0.117
71 HG3 GLU 8 HG1 GLU 8 -12.562 0.069 -1.307
72 H VAL 9 HN VAL 9 -10.412 -3.568 0.113
73 HA VAL 9 HA VAL 9 -8.590 -3.763 2.334
74 HB VAL 9 HB VAL 9 -9.467 -5.746 0.191
75 HG11 VAL 9 1HG1 VAL 9 -7.664 -6.044 2.530
76 HG12 VAL 9 2HG1 VAL 9 -7.738 -6.975 1.035
77 HG13 VAL 9 3HG1 VAL 9 -8.885 -7.302 2.333
78 HG21 VAL 9 3HG2 VAL 9 -11.408 -5.801 1.316
79 HG22 VAL 9 1HG2 VAL 9 -10.809 -4.587 2.443
80 HG23 VAL 9 2HG2 VAL 9 -10.551 -6.300 2.774
81 H PHE 10 HN PHE 10 -8.244 -4.062 -1.183
82 HA PHE 10 HA PHE 10 -5.466 -4.709 -1.380
83 HB2 PHE 10 HB2 PHE 10 -6.861 -4.954 -3.300
84 HB3 PHE 10 HB1 PHE 10 -7.531 -3.348 -3.115
85 HD1 PHE 10 HD2 PHE 10 -4.376 -5.163 -3.936
86 HD2 PHE 10 HD1 PHE 10 -6.583 -1.487 -4.215
87 HE1 PHE 10 HE2 PHE 10 -2.664 -4.252 -5.484
88 HE2 PHE 10 HE1 PHE 10 -4.869 -0.578 -5.761
89 HZ PHE 10 HZ PHE 10 -2.911 -1.958 -6.395
90 H TRP 11 HN TRP 11 -7.224 -1.618 -1.375
91 HA TRP 11 HA TRP 11 -5.218 0.242 -1.834
92 HB2 TRP 11 HB2 TRP 11 -7.875 0.300 -1.151
93 HB3 TRP 11 HB1 TRP 11 -7.124 1.010 0.271
94 HD1 TRP 11 HD1 TRP 11 -6.500 1.335 -3.522
95 HE1 TRP 11 HE1 TRP 11 -6.292 3.844 -4.095
96 HE3 TRP 11 HE3 TRP 11 -7.185 3.336 1.114
97 HZ2 TRP 11 HZ2 TRP 11 -6.402 6.372 -2.747
98 HZ3 TRP 11 HZ3 TRP 11 -7.129 5.790 1.447
99 HH2 TRP 11 HH2 TRP 11 -6.738 7.309 -0.470
100 H ALA 12 HN ALA 12 -6.138 -1.060 1.413
101 HA ALA 12 HA ALA 12 -4.273 0.520 2.868
102 HB1 ALA 12 HB1 ALA 12 -4.641 -1.052 4.671
103 HB2 ALA 12 HB2 ALA 12 -5.119 -2.318 3.543
104 HB3 ALA 12 HB3 ALA 12 -6.164 -0.917 3.792
105 H LYS 13 HN LYS 13 -3.923 -2.742 1.437
106 HA LYS 13 HA LYS 13 -1.179 -3.156 2.233
107 HB2 LYS 13 HB2 LYS 13 -3.150 -4.357 0.327
108 HB3 LYS 13 HB1 LYS 13 -1.446 -4.713 0.044
109 HG2 LYS 13 HG2 LYS 13 -1.362 -5.267 2.581
110 HG3 LYS 13 HG1 LYS 13 -3.120 -5.358 2.461
111 HD2 LYS 13 HD2 LYS 13 -2.844 -7.000 0.576
112 HD3 LYS 13 HD1 LYS 13 -1.111 -6.987 0.883
113 HE2 LYS 13 HE2 LYS 13 -1.764 -8.828 2.160
114 HE3 LYS 13 HE1 LYS 13 -1.868 -7.543 3.374
115 HZ1 LYS 13 HZ1 LYS 13 -4.135 -8.422 1.657
116 HZ2 LYS 13 HZ2 LYS 13 -4.198 -7.272 2.906
117 HZ3 LYS 13 HZ3 LYS 13 -3.901 -8.905 3.262
118 H HIS 14 HN HIS 14 -2.714 -1.856 -0.714
119 HA HIS 14 HA HIS 14 -0.381 -1.406 -2.295
120 HB2 HIS 14 HB2 HIS 14 -2.866 -1.310 -2.908
121 HB3 HIS 14 HB1 HIS 14 -2.895 0.295 -2.183
122 HD1 HIS 14 HD1 HIS 14 -0.769 -1.563 -4.751
123 HD2 HIS 14 HD2 HIS 14 -2.323 2.244 -4.054
124 HE1 HIS 14 HE1 HIS 14 -0.092 -0.140 -6.732
125 H MET 15 HN MET 15 -2.125 0.739 -0.027
126 HA MET 15 HA MET 15 -0.331 2.984 -0.192
127 HB2 MET 15 HB2 MET 15 -2.788 2.513 0.901
128 HB3 MET 15 HB1 MET 15 -1.794 2.432 2.351
129 HG2 MET 15 HG2 MET 15 -2.485 4.716 2.099
130 HG3 MET 15 HG1 MET 15 -0.778 4.649 1.665
131 HE1 MET 15 HE1 MET 15 -1.293 7.108 -1.027
132 HE2 MET 15 HE2 MET 15 -0.254 6.393 0.200
133 HE3 MET 15 HE3 MET 15 -1.752 7.179 0.684
134 H TRP 16 HN TRP 16 -0.524 0.199 2.080
135 HA TRP 16 HA TRP 16 1.693 0.982 3.709
136 HB2 TRP 16 HB2 TRP 16 -0.181 -0.972 3.852
137 HB3 TRP 16 HB1 TRP 16 1.186 -1.921 3.272
138 HD1 TRP 16 HD1 TRP 16 1.988 -3.119 5.365
139 HE1 TRP 16 HE1 TRP 16 2.788 -2.398 7.709
140 HE3 TRP 16 HE3 TRP 16 0.850 1.840 5.177
141 HZ2 TRP 16 HZ2 TRP 16 2.922 -0.013 9.296
142 HZ3 TRP 16 HZ3 TRP 16 1.318 3.319 7.111
143 HH2 TRP 16 HH2 TRP 16 2.352 2.401 9.166
144 H ASN 17 HN ASN 17 1.524 -0.693 0.589
145 HA ASN 17 HA ASN 17 4.221 -1.670 0.524
146 HB2 ASN 17 HB2 ASN 17 2.232 -2.199 -1.037
147 HB3 ASN 17 HB1 ASN 17 2.596 -0.671 -1.842
148 HD21 ASN 17 1HD2 ASN 17 4.707 -0.506 -2.991
149 HD22 ASN 17 2HD2 ASN 17 5.561 -1.914 -3.404
150 H PHE 18 HN PHE 18 2.700 1.409 -0.406
151 HA PHE 18 HA PHE 18 4.990 2.755 -1.492
152 HB2 PHE 18 HB2 PHE 18 2.493 3.368 -1.587
153 HB3 PHE 18 HB1 PHE 18 2.658 3.931 0.069
154 HD1 PHE 18 HD2 PHE 18 3.657 4.526 -3.434
155 HD2 PHE 18 HD1 PHE 18 3.881 5.961 0.608
156 HE1 PHE 18 HE2 PHE 18 4.522 6.701 -4.257
157 HE2 PHE 18 HE1 PHE 18 4.745 8.136 -0.214
158 HZ PHE 18 HZ PHE 18 5.066 8.506 -2.645
159 H ILE 19 HN ILE 19 3.621 2.444 1.771
160 HA ILE 19 HA ILE 19 5.515 4.113 3.168
161 HB ILE 19 HB ILE 19 3.525 1.957 3.892
162 HG12 ILE 19 2HG1 ILE 19 2.684 4.161 3.140
163 HG13 ILE 19 1HG1 ILE 19 2.242 3.814 4.803
164 HG21 ILE 19 1HG2 ILE 19 4.742 1.612 5.770
165 HG22 ILE 19 2HG2 ILE 19 3.940 3.089 6.299
166 HG23 ILE 19 3HG2 ILE 19 5.579 3.159 5.655
167 HD11 ILE 19 3HD1 ILE 19 2.959 6.073 4.819
168 HD12 ILE 19 1HD1 ILE 19 4.346 5.730 3.787
169 HD13 ILE 19 2HD1 ILE 19 4.332 5.175 5.461
170 H SER 20 HN SER 20 5.380 0.626 2.382
171 HA SER 20 HA SER 20 7.569 -0.268 3.961
172 HB2 SER 20 HB2 SER 20 5.756 -1.506 2.457
173 HB3 SER 20 HB1 SER 20 7.032 -1.424 1.248
174 HG SER 20 HG SER 20 7.454 -3.264 2.364
175 H GLY 21 HN GLY 21 7.510 1.173 0.683
176 HA2 GLY 21 HA2 GLY 21 10.316 0.767 0.140
177 HA3 GLY 21 HA1 GLY 21 9.268 1.935 -0.682
178 H ILE 22 HN ILE 22 8.385 3.422 1.511
179 HA ILE 22 HA ILE 22 10.548 5.281 1.922
180 HB ILE 22 HB ILE 22 7.791 4.936 3.130
181 HG12 ILE 22 2HG1 ILE 22 7.861 5.494 0.729
182 HG13 ILE 22 1HG1 ILE 22 7.200 6.818 1.674
183 HG21 ILE 22 1HG2 ILE 22 8.130 7.435 3.738
184 HG22 ILE 22 2HG2 ILE 22 9.852 7.068 3.640
185 HG23 ILE 22 3HG2 ILE 22 8.830 6.208 4.792
186 HD11 ILE 22 3HD1 ILE 22 10.034 7.194 1.511
187 HD12 ILE 22 1HD1 ILE 22 8.756 8.194 0.819
188 HD13 ILE 22 2HD1 ILE 22 9.431 6.857 -0.111
189 H GLN 23 HN GLN 23 8.946 2.909 4.088
190 HA GLN 23 HA GLN 23 10.485 3.470 6.400
191 HB2 GLN 23 HB2 GLN 23 9.380 1.657 7.340
192 HB3 GLN 23 HB1 GLN 23 8.300 2.096 6.030
193 HG2 GLN 23 HG2 GLN 23 8.402 -0.113 5.532
194 HG3 GLN 23 HG1 GLN 23 9.937 0.301 4.775
195 HE21 GLN 23 1HE2 GLN 23 8.510 -0.990 7.799
196 HE22 GLN 23 2HE2 GLN 23 9.936 -1.748 8.318
197 H TYR 24 HN TYR 24 11.297 1.552 3.613
198 HA TYR 24 HA TYR 24 13.474 0.028 4.701
199 HB2 TYR 24 HB2 TYR 24 12.303 -0.284 2.471
200 HB3 TYR 24 HB1 TYR 24 13.152 1.144 1.889
201 HD1 TYR 24 HD1 TYR 24 13.588 -2.329 3.130
202 HD2 TYR 24 HD2 TYR 24 15.476 1.060 1.285
203 HE1 TYR 24 HE1 TYR 24 15.562 -3.725 2.581
204 HE2 TYR 24 HE2 TYR 24 17.448 -0.335 0.737
205 HH TYR 24 HH TYR 24 18.396 -2.757 1.992
206 H LEU 25 HN LEU 25 13.343 3.201 3.046
207 HA LEU 25 HA LEU 25 16.174 3.777 3.508
208 HB2 LEU 25 HB2 LEU 25 13.782 5.133 2.325
209 HB3 LEU 25 HB1 LEU 25 15.111 6.155 2.856
210 HG LEU 25 HG LEU 25 16.500 4.240 1.516
211 HD11 LEU 25 1HD1 LEU 25 14.476 3.057 0.799
212 HD12 LEU 25 2HD1 LEU 25 15.276 3.782 -0.594
213 HD13 LEU 25 3HD1 LEU 25 13.839 4.541 0.089
214 HD21 LEU 25 3HD2 LEU 25 16.689 5.862 -0.290
215 HD22 LEU 25 1HD2 LEU 25 16.591 6.735 1.237
216 HD23 LEU 25 2HD2 LEU 25 15.177 6.633 0.187
217 H ALA 26 HN ALA 26 13.072 4.778 4.976
218 HA ALA 26 HA ALA 26 14.079 6.683 6.846
219 HB1 ALA 26 HB1 ALA 26 11.952 6.298 7.984
220 HB2 ALA 26 HB2 ALA 26 11.755 4.758 7.148
221 HB3 ALA 26 HB3 ALA 26 11.690 6.267 6.239
222 H GLY 27 HN GLY 27 13.808 3.128 7.066
223 HA2 GLY 27 HA2 GLY 27 14.885 3.096 9.804
224 HA3 GLY 27 HA1 GLY 27 14.291 1.714 8.900
225 H LEU 28 HN LEU 28 16.104 2.470 6.505
226 HA LEU 28 HA LEU 28 18.673 1.541 7.747
227 HB2 LEU 28 HB2 LEU 28 16.948 0.359 5.859
228 HB3 LEU 28 HB1 LEU 28 18.366 0.880 4.956
229 HG LEU 28 HG LEU 28 19.654 -0.213 7.014
230 HD11 LEU 28 1HD1 LEU 28 18.465 -2.200 7.845
231 HD12 LEU 28 2HD1 LEU 28 17.035 -1.743 6.920
232 HD13 LEU 28 3HD1 LEU 28 17.577 -0.734 8.260
233 HD21 LEU 28 3HD2 LEU 28 18.415 -1.503 4.588
234 HD22 LEU 28 1HD2 LEU 28 19.406 -2.461 5.690
235 HD23 LEU 28 2HD2 LEU 28 20.100 -1.064 4.869
236 H SER 29 HN SER 29 17.762 4.397 7.008
237 HA SER 29 HA SER 29 18.690 6.321 6.131
238 HB2 SER 29 HB2 SER 29 20.729 4.698 7.134
239 HB3 SER 29 HB1 SER 29 21.322 5.201 5.559
240 HG SER 29 HG SER 29 20.742 6.682 7.849
241 H THR 30 HN THR 30 20.548 6.795 4.112
242 HA THR 30 HA THR 30 19.100 5.754 1.719
243 HB THR 30 HB THR 30 20.965 8.131 1.984
244 HG1 THR 30 HG1 THR 30 19.365 9.114 2.897
245 HG21 THR 30 3HG2 THR 30 20.619 7.349 -0.310
246 HG22 THR 30 1HG2 THR 30 19.811 8.896 -0.056
247 HG23 THR 30 2HG2 THR 30 18.872 7.403 -0.078
Start of MODEL 24
1 H1 GLN 1 HT1 GLN 1 -23.407 -0.732 2.674
2 H2 GLN 1 HT2 GLN 1 -24.006 -0.679 1.084
3 H3 GLN 1 HT3 GLN 1 -23.305 0.701 1.778
4 HA GLN 1 HA GLN 1 -21.132 -0.378 1.844
5 HB2 GLN 1 HB2 GLN 1 -22.900 -2.669 1.184
6 HB3 GLN 1 HB1 GLN 1 -21.355 -2.639 0.342
7 HG2 GLN 1 HG2 GLN 1 -20.706 -3.746 2.250
8 HG3 GLN 1 HG1 GLN 1 -20.436 -2.092 2.790
9 HE21 GLN 1 1HE2 GLN 1 -21.737 -4.918 3.915
10 HE22 GLN 1 2HE2 GLN 1 -22.957 -4.287 4.910
11 H THR 2 HN THR 2 -19.742 -0.070 0.125
12 HA THR 2 HA THR 2 -20.593 0.018 -2.650
13 HB THR 2 HB THR 2 -21.651 2.049 -1.923
14 HG1 THR 2 HG1 THR 2 -20.866 3.199 -3.474
15 HG21 THR 2 3HG2 THR 2 -19.420 2.276 -0.107
16 HG22 THR 2 1HG2 THR 2 -20.956 3.140 -0.097
17 HG23 THR 2 2HG2 THR 2 -19.601 3.762 -1.034
18 H ASN 3 HN ASN 3 -18.262 2.333 -2.320
19 HA ASN 3 HA ASN 3 -16.141 0.600 -3.236
20 HB2 ASN 3 HB2 ASN 3 -14.809 2.626 -3.300
21 HB3 ASN 3 HB1 ASN 3 -16.411 2.947 -3.940
22 HD21 ASN 3 1HD2 ASN 3 -14.507 4.921 -2.789
23 HD22 ASN 3 2HD2 ASN 3 -15.297 5.626 -1.465
24 H TRP 4 HN TRP 4 -17.199 1.256 -0.084
25 HA TRP 4 HA TRP 4 -14.833 1.277 1.477
26 HB2 TRP 4 HB2 TRP 4 -17.700 0.605 1.822
27 HB3 TRP 4 HB1 TRP 4 -16.621 -0.203 2.954
28 HD1 TRP 4 HD1 TRP 4 -18.434 2.930 2.514
29 HE1 TRP 4 HE1 TRP 4 -17.550 4.744 4.121
30 HE3 TRP 4 HE3 TRP 4 -14.084 0.722 4.021
31 HZ2 TRP 4 HZ2 TRP 4 -15.281 5.197 5.824
32 HZ3 TRP 4 HZ3 TRP 4 -12.584 1.857 5.626
33 HH2 TRP 4 HH2 TRP 4 -13.174 4.089 6.531
34 H GLN 5 HN GLN 5 -16.691 -1.460 0.126
35 HA GLN 5 HA GLN 5 -15.257 -3.629 1.268
36 HB2 GLN 5 HB2 GLN 5 -16.896 -3.120 -1.190
37 HB3 GLN 5 HB1 GLN 5 -15.969 -4.614 -1.137
38 HG2 GLN 5 HG2 GLN 5 -17.023 -4.788 1.301
39 HG3 GLN 5 HG1 GLN 5 -18.251 -3.743 0.590
40 HE21 GLN 5 1HE2 GLN 5 -19.530 -4.633 -1.244
41 HE22 GLN 5 2HE2 GLN 5 -19.556 -6.305 -1.527
42 H LYS 6 HN LYS 6 -14.675 -1.839 -1.778
43 HA LYS 6 HA LYS 6 -12.203 -3.239 -2.405
44 HB2 LYS 6 HB2 LYS 6 -13.897 -2.010 -3.946
45 HB3 LYS 6 HB1 LYS 6 -13.030 -0.546 -3.477
46 HG2 LYS 6 HG2 LYS 6 -11.036 -2.444 -4.109
47 HG3 LYS 6 HG1 LYS 6 -12.253 -2.587 -5.374
48 HD2 LYS 6 HD2 LYS 6 -11.965 -0.396 -6.100
49 HD3 LYS 6 HD1 LYS 6 -11.361 0.150 -4.537
50 HE2 LYS 6 HE2 LYS 6 -9.439 0.121 -5.932
51 HE3 LYS 6 HE1 LYS 6 -9.316 -1.381 -5.003
52 HZ1 LYS 6 HZ1 LYS 6 -10.330 -1.051 -7.774
53 HZ2 LYS 6 HZ2 LYS 6 -10.572 -2.470 -6.872
54 HZ3 LYS 6 HZ3 LYS 6 -9.000 -1.962 -7.263
55 H LEU 7 HN LEU 7 -13.015 -0.331 -0.560
56 HA LEU 7 HA LEU 7 -10.492 0.988 -0.532
57 HB2 LEU 7 HB2 LEU 7 -12.769 1.807 0.266
58 HB3 LEU 7 HB1 LEU 7 -12.523 0.841 1.715
59 HG LEU 7 HG LEU 7 -10.403 2.799 0.876
60 HD11 LEU 7 1HD1 LEU 7 -13.013 3.438 2.266
61 HD12 LEU 7 2HD1 LEU 7 -12.340 4.197 0.823
62 HD13 LEU 7 3HD1 LEU 7 -11.584 4.463 2.392
63 HD21 LEU 7 3HD2 LEU 7 -9.554 1.946 2.797
64 HD22 LEU 7 1HD2 LEU 7 -11.078 1.165 3.216
65 HD23 LEU 7 2HD2 LEU 7 -10.805 2.855 3.641
66 H GLU 8 HN GLU 8 -11.774 -1.663 1.528
67 HA GLU 8 HA GLU 8 -9.568 -1.721 3.386
68 HB2 GLU 8 HB2 GLU 8 -11.796 -3.547 2.537
69 HB3 GLU 8 HB1 GLU 8 -10.479 -4.234 3.488
70 HG2 GLU 8 HG2 GLU 8 -11.644 -1.655 4.436
71 HG3 GLU 8 HG1 GLU 8 -12.614 -3.110 4.647
72 H VAL 9 HN VAL 9 -10.260 -3.520 0.380
73 HA VAL 9 HA VAL 9 -7.842 -5.084 0.312
74 HB VAL 9 HB VAL 9 -9.533 -4.031 -1.998
75 HG11 VAL 9 1HG1 VAL 9 -7.155 -5.346 -2.180
76 HG12 VAL 9 2HG1 VAL 9 -8.440 -5.480 -3.379
77 HG13 VAL 9 3HG1 VAL 9 -8.272 -6.709 -2.127
78 HG21 VAL 9 3HG2 VAL 9 -10.034 -6.137 0.029
79 HG22 VAL 9 1HG2 VAL 9 -10.323 -6.626 -1.640
80 HG23 VAL 9 2HG2 VAL 9 -11.178 -5.241 -0.967
81 H PHE 10 HN PHE 10 -8.774 -1.911 -0.977
82 HA PHE 10 HA PHE 10 -6.343 -1.199 -2.320
83 HB2 PHE 10 HB2 PHE 10 -8.286 0.084 -2.809
84 HB3 PHE 10 HB1 PHE 10 -8.716 0.216 -1.120
85 HD1 PHE 10 HD1 PHE 10 -6.233 1.395 -3.654
86 HD2 PHE 10 HD2 PHE 10 -8.021 2.045 0.199
87 HE1 PHE 10 HE1 PHE 10 -5.111 3.597 -3.503
88 HE2 PHE 10 HE2 PHE 10 -6.897 4.248 0.347
89 HZ PHE 10 HZ PHE 10 -5.442 5.025 -1.503
90 H TRP 11 HN TRP 11 -7.539 -0.608 0.983
91 HA TRP 11 HA TRP 11 -5.550 1.002 2.053
92 HB2 TRP 11 HB2 TRP 11 -7.781 -0.287 3.003
93 HB3 TRP 11 HB1 TRP 11 -6.489 -1.096 3.885
94 HD1 TRP 11 HD1 TRP 11 -7.193 2.554 2.864
95 HE1 TRP 11 HE1 TRP 11 -6.741 4.072 4.898
96 HE3 TRP 11 HE3 TRP 11 -5.785 -0.967 6.273
97 HZ2 TRP 11 HZ2 TRP 11 -5.887 3.819 7.621
98 HZ3 TRP 11 HZ3 TRP 11 -5.157 -0.306 8.577
99 HH2 TRP 11 HH2 TRP 11 -5.205 2.076 9.257
100 H ALA 12 HN ALA 12 -5.471 -2.625 2.112
101 HA ALA 12 HA ALA 12 -2.908 -2.687 3.416
102 HB1 ALA 12 HB1 ALA 12 -4.021 -4.803 1.550
103 HB2 ALA 12 HB2 ALA 12 -4.613 -4.581 3.199
104 HB3 ALA 12 HB3 ALA 12 -2.932 -5.036 2.916
105 H LYS 13 HN LYS 13 -3.848 -2.748 -0.032
106 HA LYS 13 HA LYS 13 -1.187 -3.116 -1.090
107 HB2 LYS 13 HB2 LYS 13 -3.439 -3.444 -2.253
108 HB3 LYS 13 HB1 LYS 13 -3.533 -1.687 -2.381
109 HG2 LYS 13 HG2 LYS 13 -1.424 -1.643 -3.637
110 HG3 LYS 13 HG1 LYS 13 -1.288 -3.395 -3.495
111 HD2 LYS 13 HD2 LYS 13 -3.889 -2.692 -4.545
112 HD3 LYS 13 HD1 LYS 13 -2.623 -1.942 -5.514
113 HE2 LYS 13 HE2 LYS 13 -1.502 -4.137 -5.761
114 HE3 LYS 13 HE1 LYS 13 -2.799 -4.897 -4.820
115 HZ1 LYS 13 HZ1 LYS 13 -3.173 -3.366 -7.346
116 HZ2 LYS 13 HZ2 LYS 13 -4.413 -4.084 -6.428
117 HZ3 LYS 13 HZ3 LYS 13 -3.246 -5.049 -7.193
118 H HIS 14 HN HIS 14 -3.191 -0.219 -0.465
119 HA HIS 14 HA HIS 14 -1.290 1.733 -1.374
120 HB2 HIS 14 HB2 HIS 14 -3.807 1.957 -0.951
121 HB3 HIS 14 HB1 HIS 14 -3.414 2.080 0.763
122 HD1 HIS 14 HD1 HIS 14 -2.810 3.861 -2.531
123 HD2 HIS 14 HD2 HIS 14 -2.418 4.572 1.561
124 HE1 HIS 14 HE1 HIS 14 -2.236 6.313 -2.280
125 H MET 15 HN MET 15 -1.968 0.352 1.875
126 HA MET 15 HA MET 15 -0.024 1.927 3.299
127 HB2 MET 15 HB2 MET 15 -1.941 -0.027 3.913
128 HB3 MET 15 HB1 MET 15 -0.423 -0.796 4.341
129 HG2 MET 15 HG2 MET 15 -1.478 1.861 5.338
130 HG3 MET 15 HG1 MET 15 -1.272 0.386 6.273
131 HE1 MET 15 HE1 MET 15 1.365 3.691 6.589
132 HE2 MET 15 HE2 MET 15 -0.188 3.166 7.227
133 HE3 MET 15 HE3 MET 15 -0.069 3.675 5.547
134 H TRP 16 HN TRP 16 0.176 -1.393 1.899
135 HA TRP 16 HA TRP 16 2.959 -1.756 2.496
136 HB2 TRP 16 HB2 TRP 16 1.006 -3.390 1.628
137 HB3 TRP 16 HB1 TRP 16 1.756 -3.035 0.072
138 HD1 TRP 16 HD1 TRP 16 3.157 -5.104 -0.427
139 HE1 TRP 16 HE1 TRP 16 5.002 -6.418 0.803
140 HE3 TRP 16 HE3 TRP 16 3.005 -2.775 4.092
141 HZ2 TRP 16 HZ2 TRP 16 6.254 -6.468 3.387
142 HZ3 TRP 16 HZ3 TRP 16 4.526 -3.464 5.927
143 HH2 TRP 16 HH2 TRP 16 6.148 -5.306 5.578
144 H ASN 17 HN ASN 17 1.269 -0.158 -0.165
145 HA ASN 17 HA ASN 17 3.482 0.106 -1.967
146 HB2 ASN 17 HB2 ASN 17 1.008 0.512 -2.424
147 HB3 ASN 17 HB1 ASN 17 1.156 2.021 -1.524
148 HD21 ASN 17 1HD2 ASN 17 2.343 3.789 -2.538
149 HD22 ASN 17 2HD2 ASN 17 2.809 3.714 -4.168
150 H PHE 18 HN PHE 18 2.313 2.037 0.791
151 HA PHE 18 HA PHE 18 4.147 4.244 0.597
152 HB2 PHE 18 HB2 PHE 18 2.022 4.021 2.005
153 HB3 PHE 18 HB1 PHE 18 2.924 2.955 3.069
154 HD1 PHE 18 HD1 PHE 18 2.871 6.418 1.672
155 HD2 PHE 18 HD2 PHE 18 4.372 3.805 4.733
156 HE1 PHE 18 HE1 PHE 18 3.783 8.373 2.892
157 HE2 PHE 18 HE2 PHE 18 5.283 5.762 5.955
158 HZ PHE 18 HZ PHE 18 4.989 8.047 5.034
159 H ILE 19 HN ILE 19 4.236 1.071 2.184
160 HA ILE 19 HA ILE 19 6.808 1.315 3.460
161 HB ILE 19 HB ILE 19 4.936 -0.925 2.690
162 HG12 ILE 19 2HG1 ILE 19 4.327 0.597 4.553
163 HG13 ILE 19 1HG1 ILE 19 4.537 -1.066 5.077
164 HG21 ILE 19 1HG2 ILE 19 7.711 -1.194 3.757
165 HG22 ILE 19 2HG2 ILE 19 6.824 -2.227 2.638
166 HG23 ILE 19 3HG2 ILE 19 6.460 -2.282 4.360
167 HD11 ILE 19 3HD1 ILE 19 6.896 0.781 5.243
168 HD12 ILE 19 1HD1 ILE 19 6.467 -0.592 6.263
169 HD13 ILE 19 2HD1 ILE 19 5.612 0.939 6.438
170 H SER 20 HN SER 20 5.744 -0.016 0.297
171 HA SER 20 HA SER 20 8.297 -1.026 -0.496
172 HB2 SER 20 HB2 SER 20 7.261 -1.380 -2.585
173 HB3 SER 20 HB1 SER 20 5.948 -1.468 -1.432
174 HG SER 20 HG SER 20 5.561 0.801 -1.982
175 H GLY 21 HN GLY 21 6.905 2.248 -0.783
176 HA2 GLY 21 HA2 GLY 21 8.959 3.311 -2.503
177 HA3 GLY 21 HA1 GLY 21 7.881 4.266 -1.477
178 H ILE 22 HN ILE 22 8.483 3.263 1.037
179 HA ILE 22 HA ILE 22 10.910 4.655 1.733
180 HB ILE 22 HB ILE 22 9.087 2.735 3.225
181 HG12 ILE 22 2HG1 ILE 22 9.412 5.731 3.559
182 HG13 ILE 22 1HG1 ILE 22 8.227 5.022 2.466
183 HG21 ILE 22 1HG2 ILE 22 10.257 4.030 5.241
184 HG22 ILE 22 2HG2 ILE 22 11.589 4.133 4.091
185 HG23 ILE 22 3HG2 ILE 22 10.959 2.558 4.571
186 HD11 ILE 22 3HD1 ILE 22 7.532 5.631 4.927
187 HD12 ILE 22 1HD1 ILE 22 8.317 4.101 5.323
188 HD13 ILE 22 2HD1 ILE 22 6.959 4.130 4.199
189 H GLN 23 HN GLN 23 10.074 1.186 1.456
190 HA GLN 23 HA GLN 23 12.582 0.090 2.251
191 HB2 GLN 23 HB2 GLN 23 10.324 -1.044 1.968
192 HB3 GLN 23 HB1 GLN 23 10.628 -1.037 0.234
193 HG2 GLN 23 HG2 GLN 23 12.182 -2.701 0.363
194 HG3 GLN 23 HG1 GLN 23 12.819 -2.141 1.908
195 HE21 GLN 23 1HE2 GLN 23 11.040 -4.663 0.526
196 HE22 GLN 23 2HE2 GLN 23 10.248 -5.206 1.925
197 H TYR 24 HN TYR 24 11.364 1.047 -0.907
198 HA TYR 24 HA TYR 24 13.491 0.189 -2.586
199 HB2 TYR 24 HB2 TYR 24 11.198 1.097 -3.206
200 HB3 TYR 24 HB1 TYR 24 11.830 2.707 -2.896
201 HD1 TYR 24 HD1 TYR 24 13.879 3.487 -4.240
202 HD2 TYR 24 HD2 TYR 24 11.586 -0.006 -5.244
203 HE1 TYR 24 HE1 TYR 24 14.822 3.525 -6.531
204 HE2 TYR 24 HE2 TYR 24 12.532 0.034 -7.536
205 HH TYR 24 HH TYR 24 15.134 1.387 -8.415
206 H LEU 25 HN LEU 25 13.005 3.395 -1.042
207 HA LEU 25 HA LEU 25 15.609 4.402 -1.872
208 HB2 LEU 25 HB2 LEU 25 13.249 5.300 -0.314
209 HB3 LEU 25 HB1 LEU 25 14.775 6.093 0.050
210 HG LEU 25 HG LEU 25 14.922 6.188 -2.630
211 HD11 LEU 25 1HD1 LEU 25 11.949 6.254 -2.036
212 HD12 LEU 25 2HD1 LEU 25 12.785 4.994 -2.945
213 HD13 LEU 25 3HD1 LEU 25 12.700 6.633 -3.585
214 HD21 LEU 25 3HD2 LEU 25 13.219 8.090 -0.976
215 HD22 LEU 25 1HD2 LEU 25 14.021 8.474 -2.499
216 HD23 LEU 25 2HD2 LEU 25 14.981 8.128 -1.062
217 H ALA 26 HN ALA 26 14.392 2.941 1.114
218 HA ALA 26 HA ALA 26 16.142 3.518 3.101
219 HB1 ALA 26 HB1 ALA 26 15.971 1.033 3.704
220 HB2 ALA 26 HB2 ALA 26 15.082 0.847 2.193
221 HB3 ALA 26 HB3 ALA 26 14.454 1.898 3.461
222 H GLY 27 HN GLY 27 16.899 1.115 0.605
223 HA2 GLY 27 HA2 GLY 27 19.711 1.844 0.499
224 HA3 GLY 27 HA1 GLY 27 19.454 0.284 1.299
225 H LEU 28 HN LEU 28 17.703 1.802 -1.425
226 HA LEU 28 HA LEU 28 17.157 1.010 -3.538
227 HB2 LEU 28 HB2 LEU 28 19.810 1.119 -3.415
228 HB3 LEU 28 HB1 LEU 28 19.670 -0.635 -3.526
229 HG LEU 28 HG LEU 28 18.044 -0.132 -5.511
230 HD11 LEU 28 1HD1 LEU 28 19.688 2.417 -5.431
231 HD12 LEU 28 2HD1 LEU 28 17.955 2.311 -5.122
232 HD13 LEU 28 3HD1 LEU 28 18.590 1.934 -6.723
233 HD21 LEU 28 3HD2 LEU 28 20.349 -1.179 -5.604
234 HD22 LEU 28 1HD2 LEU 28 21.000 0.437 -5.880
235 HD23 LEU 28 2HD2 LEU 28 19.893 -0.282 -7.051
236 H SER 29 HN SER 29 16.257 -0.481 -1.160
237 HA SER 29 HA SER 29 16.422 -3.328 -1.857
238 HB2 SER 29 HB2 SER 29 14.596 -2.046 0.184
239 HB3 SER 29 HB1 SER 29 15.245 -3.675 0.176
240 HG SER 29 HG SER 29 16.249 -1.646 1.416
241 H THR 30 HN THR 30 15.469 -3.552 -3.834
242 HA THR 30 HA THR 30 12.719 -2.572 -4.326
243 HB THR 30 HB THR 30 13.249 -3.486 -6.630
244 HG1 THR 30 HG1 THR 30 14.789 -5.039 -5.944
245 HG21 THR 30 3HG2 THR 30 14.265 -1.542 -7.187
246 HG22 THR 30 1HG2 THR 30 15.581 -1.786 -6.040
247 HG23 THR 30 2HG2 THR 30 14.038 -1.143 -5.483
Start of MODEL 25
1 H1 GLN 1 HT1 GLN 1 -21.785 -2.524 -1.303
2 H2 GLN 1 HT2 GLN 1 -22.955 -1.388 -0.846
3 H3 GLN 1 HT3 GLN 1 -22.738 -2.804 0.066
4 HA GLN 1 HA GLN 1 -20.626 -0.725 -0.250
5 HB2 GLN 1 HB2 GLN 1 -23.087 -0.826 1.327
6 HB3 GLN 1 HB1 GLN 1 -21.663 -0.655 2.343
7 HG2 GLN 1 HG2 GLN 1 -21.975 1.069 -0.103
8 HG3 GLN 1 HG1 GLN 1 -22.807 1.488 1.388
9 HE21 GLN 1 1HE2 GLN 1 -20.925 3.329 0.557
10 HE22 GLN 1 2HE2 GLN 1 -19.526 3.223 1.508
11 H THR 2 HN THR 2 -20.030 -3.449 -0.588
12 HA THR 2 HA THR 2 -18.931 -4.266 2.065
13 HB THR 2 HB THR 2 -18.603 -6.440 0.594
14 HG1 THR 2 HG1 THR 2 -19.430 -5.793 -1.319
15 HG21 THR 2 3HG2 THR 2 -19.924 -6.145 2.680
16 HG22 THR 2 1HG2 THR 2 -20.631 -7.300 1.548
17 HG23 THR 2 2HG2 THR 2 -21.304 -5.671 1.686
18 H ASN 3 HN ASN 3 -16.851 -4.155 2.317
19 HA ASN 3 HA ASN 3 -14.582 -3.717 1.963
20 HB2 ASN 3 HB2 ASN 3 -15.146 -6.129 1.079
21 HB3 ASN 3 HB1 ASN 3 -14.791 -5.427 -0.501
22 HD21 ASN 3 1HD2 ASN 3 -12.572 -5.353 -1.075
23 HD22 ASN 3 2HD2 ASN 3 -11.300 -5.537 0.031
24 H TRP 4 HN TRP 4 -16.482 -1.881 0.673
25 HA TRP 4 HA TRP 4 -14.929 -0.869 -1.680
26 HB2 TRP 4 HB2 TRP 4 -17.734 -0.339 -0.594
27 HB3 TRP 4 HB1 TRP 4 -17.054 0.482 -1.982
28 HD1 TRP 4 HD1 TRP 4 -19.678 -1.408 -1.899
29 HE1 TRP 4 HE1 TRP 4 -19.848 -3.365 -3.556
30 HE3 TRP 4 HE3 TRP 4 -14.749 -2.018 -3.055
31 HZ2 TRP 4 HZ2 TRP 4 -18.124 -4.982 -5.162
32 HZ3 TRP 4 HZ3 TRP 4 -14.037 -3.771 -4.650
33 HH2 TRP 4 HH2 TRP 4 -15.716 -5.256 -5.704
34 H GLN 5 HN GLN 5 -16.650 0.062 1.267
35 HA GLN 5 HA GLN 5 -15.685 2.688 1.691
36 HB2 GLN 5 HB2 GLN 5 -17.053 0.541 3.125
37 HB3 GLN 5 HB1 GLN 5 -15.981 1.420 4.200
38 HG2 GLN 5 HG2 GLN 5 -17.649 3.074 2.379
39 HG3 GLN 5 HG1 GLN 5 -18.500 2.207 3.657
40 HE21 GLN 5 1HE2 GLN 5 -16.106 4.768 3.046
41 HE22 GLN 5 2HE2 GLN 5 -16.083 5.341 4.642
42 H LYS 6 HN LYS 6 -14.295 -0.497 2.616
43 HA LYS 6 HA LYS 6 -11.976 0.696 3.952
44 HB2 LYS 6 HB2 LYS 6 -13.005 -2.037 3.300
45 HB3 LYS 6 HB1 LYS 6 -11.298 -1.860 3.705
46 HG2 LYS 6 HG2 LYS 6 -11.741 -1.071 5.859
47 HG3 LYS 6 HG1 LYS 6 -13.374 -0.557 5.444
48 HD2 LYS 6 HD2 LYS 6 -13.899 -2.479 6.582
49 HD3 LYS 6 HD1 LYS 6 -13.675 -3.175 4.979
50 HE2 LYS 6 HE2 LYS 6 -11.286 -3.664 5.567
51 HE3 LYS 6 HE1 LYS 6 -11.618 -3.100 7.216
52 HZ1 LYS 6 HZ1 LYS 6 -13.081 -5.280 5.815
53 HZ2 LYS 6 HZ2 LYS 6 -13.404 -4.718 7.390
54 HZ3 LYS 6 HZ3 LYS 6 -11.935 -5.491 7.043
55 H LEU 7 HN LEU 7 -12.732 -0.259 0.652
56 HA LEU 7 HA LEU 7 -10.172 -0.859 -0.375
57 HB2 LEU 7 HB2 LEU 7 -12.365 -1.207 -1.472
58 HB3 LEU 7 HB1 LEU 7 -12.496 0.528 -1.724
59 HG LEU 7 HG LEU 7 -9.948 -0.536 -2.690
60 HD11 LEU 7 1HD1 LEU 7 -10.754 -1.855 -4.511
61 HD12 LEU 7 2HD1 LEU 7 -12.433 -1.455 -4.151
62 HD13 LEU 7 3HD1 LEU 7 -11.522 -2.504 -3.063
63 HD21 LEU 7 3HD2 LEU 7 -12.107 0.747 -4.353
64 HD22 LEU 7 1HD2 LEU 7 -10.358 0.952 -4.451
65 HD23 LEU 7 2HD2 LEU 7 -11.261 1.700 -3.135
66 H GLU 8 HN GLU 8 -11.624 2.402 0.165
67 HA GLU 8 HA GLU 8 -9.618 3.833 -1.337
68 HB2 GLU 8 HB2 GLU 8 -11.559 4.537 0.875
69 HB3 GLU 8 HB1 GLU 8 -10.418 5.733 0.260
70 HG2 GLU 8 HG2 GLU 8 -11.545 4.532 -2.029
71 HG3 GLU 8 HG1 GLU 8 -12.891 4.801 -0.928
72 H VAL 9 HN VAL 9 -9.930 3.155 2.164
73 HA VAL 9 HA VAL 9 -7.401 4.250 2.972
74 HB VAL 9 HB VAL 9 -9.180 2.065 4.131
75 HG11 VAL 9 1HG1 VAL 9 -6.621 3.258 5.119
76 HG12 VAL 9 2HG1 VAL 9 -7.250 1.623 5.321
77 HG13 VAL 9 3HG1 VAL 9 -7.892 2.941 6.300
78 HG21 VAL 9 3HG2 VAL 9 -9.877 3.863 5.682
79 HG22 VAL 9 1HG2 VAL 9 -10.229 4.286 4.007
80 HG23 VAL 9 2HG2 VAL 9 -8.836 4.999 4.824
81 H PHE 10 HN PHE 10 -8.449 1.025 1.908
82 HA PHE 10 HA PHE 10 -5.993 -0.408 2.247
83 HB2 PHE 10 HB2 PHE 10 -8.012 -1.644 1.916
84 HB3 PHE 10 HB1 PHE 10 -8.454 -0.680 0.519
85 HD1 PHE 10 HD2 PHE 10 -5.796 -3.042 1.700
86 HD2 PHE 10 HD1 PHE 10 -7.988 -1.449 -1.632
87 HE1 PHE 10 HE2 PHE 10 -4.703 -4.686 0.198
88 HE2 PHE 10 HE1 PHE 10 -6.892 -3.093 -3.137
89 HZ PHE 10 HZ PHE 10 -5.251 -4.710 -2.222
90 H TRP 11 HN TRP 11 -7.343 1.462 -0.493
91 HA TRP 11 HA TRP 11 -5.479 0.866 -2.493
92 HB2 TRP 11 HB2 TRP 11 -7.623 2.564 -2.228
93 HB3 TRP 11 HB1 TRP 11 -6.285 3.703 -2.349
94 HD1 TRP 11 HD1 TRP 11 -7.269 0.429 -4.130
95 HE1 TRP 11 HE1 TRP 11 -6.886 0.733 -6.664
96 HE3 TRP 11 HE3 TRP 11 -5.495 5.208 -4.168
97 HZ2 TRP 11 HZ2 TRP 11 -5.944 2.753 -8.468
98 HZ3 TRP 11 HZ3 TRP 11 -4.862 6.300 -6.299
99 HH2 TRP 11 HH2 TRP 11 -5.082 5.084 -8.445
100 H ALA 12 HN ALA 12 -5.233 3.465 -0.007
101 HA ALA 12 HA ALA 12 -2.633 4.309 -0.960
102 HB1 ALA 12 HB1 ALA 12 -2.593 5.666 1.086
103 HB2 ALA 12 HB2 ALA 12 -3.920 4.726 1.762
104 HB3 ALA 12 HB3 ALA 12 -4.195 5.758 0.355
105 H LYS 13 HN LYS 13 -3.754 2.105 1.611
106 HA LYS 13 HA LYS 13 -1.197 1.561 2.804
107 HB2 LYS 13 HB2 LYS 13 -3.941 0.714 3.035
108 HB3 LYS 13 HB1 LYS 13 -2.928 -0.719 2.947
109 HG2 LYS 13 HG2 LYS 13 -2.474 -0.433 5.124
110 HG3 LYS 13 HG1 LYS 13 -1.548 0.998 4.681
111 HD2 LYS 13 HD2 LYS 13 -3.157 2.429 5.417
112 HD3 LYS 13 HD1 LYS 13 -4.476 1.412 4.839
113 HE2 LYS 13 HE2 LYS 13 -4.517 0.117 6.790
114 HE3 LYS 13 HE1 LYS 13 -2.840 0.509 7.207
115 HZ1 LYS 13 HZ1 LYS 13 -4.615 1.711 8.513
116 HZ2 LYS 13 HZ2 LYS 13 -4.960 2.584 7.100
117 HZ3 LYS 13 HZ3 LYS 13 -3.421 2.684 7.817
118 H HIS 14 HN HIS 14 -3.052 -0.085 0.245
119 HA HIS 14 HA HIS 14 -1.150 -2.177 -0.307
120 HB2 HIS 14 HB2 HIS 14 -3.603 -2.119 -0.873
121 HB3 HIS 14 HB1 HIS 14 -3.251 -0.902 -2.094
122 HD1 HIS 14 HD1 HIS 14 -2.429 -4.528 -1.252
123 HD2 HIS 14 HD2 HIS 14 -2.334 -1.926 -4.514
124 HE1 HIS 14 HE1 HIS 14 -1.855 -5.932 -3.273
125 H MET 15 HN MET 15 -1.783 1.003 -1.879
126 HA MET 15 HA MET 15 0.295 0.805 -3.852
127 HB2 MET 15 HB2 MET 15 -1.731 2.513 -3.465
128 HB3 MET 15 HB1 MET 15 -0.480 3.447 -2.655
129 HG2 MET 15 HG2 MET 15 0.324 4.132 -4.631
130 HG3 MET 15 HG1 MET 15 0.592 2.464 -5.130
131 HE1 MET 15 HE1 MET 15 -0.112 2.392 -7.649
132 HE2 MET 15 HE2 MET 15 -1.764 1.804 -7.787
133 HE3 MET 15 HE3 MET 15 -0.707 1.133 -6.551
134 H TRP 16 HN TRP 16 0.278 2.261 -0.556
135 HA TRP 16 HA TRP 16 3.031 3.086 -0.654
136 HB2 TRP 16 HB2 TRP 16 1.115 3.814 0.961
137 HB3 TRP 16 HB1 TRP 16 1.574 2.389 1.902
138 HD1 TRP 16 HD1 TRP 16 3.200 3.065 3.751
139 HE1 TRP 16 HE1 TRP 16 5.206 4.680 3.943
140 HE3 TRP 16 HE3 TRP 16 3.110 5.086 -0.899
141 HZ2 TRP 16 HZ2 TRP 16 6.593 6.601 2.305
142 HZ3 TRP 16 HZ3 TRP 16 4.771 6.811 -1.581
143 HH2 TRP 16 HH2 TRP 16 6.506 7.563 0.018
144 H ASN 17 HN ASN 17 1.429 0.055 0.223
145 HA ASN 17 HA ASN 17 3.634 -1.237 1.506
146 HB2 ASN 17 HB2 ASN 17 1.333 -2.101 1.581
147 HB3 ASN 17 HB1 ASN 17 1.310 -2.280 -0.168
148 HD21 ASN 17 1HD2 ASN 17 2.485 -3.738 2.842
149 HD22 ASN 17 2HD2 ASN 17 3.052 -5.162 2.116
150 H PHE 18 HN PHE 18 2.638 -0.894 -1.888
151 HA PHE 18 HA PHE 18 4.610 -2.529 -3.163
152 HB2 PHE 18 HB2 PHE 18 2.510 -1.479 -4.146
153 HB3 PHE 18 HB1 PHE 18 3.320 0.075 -4.079
154 HD1 PHE 18 HD1 PHE 18 3.657 -3.369 -5.525
155 HD2 PHE 18 HD2 PHE 18 4.705 0.787 -5.816
156 HE1 PHE 18 HE1 PHE 18 4.714 -3.789 -7.727
157 HE2 PHE 18 HE2 PHE 18 5.764 0.366 -8.019
158 HZ PHE 18 HZ PHE 18 5.768 -1.923 -8.975
159 H ILE 19 HN ILE 19 4.525 0.923 -2.261
160 HA ILE 19 HA ILE 19 7.168 1.643 -3.116
161 HB ILE 19 HB ILE 19 5.155 2.759 -1.157
162 HG12 ILE 19 2HG1 ILE 19 4.588 2.904 -3.541
163 HG13 ILE 19 1HG1 ILE 19 4.886 4.500 -2.871
164 HG21 ILE 19 1HG2 ILE 19 7.953 3.658 -1.623
165 HG22 ILE 19 2HG2 ILE 19 6.952 3.774 -0.177
166 HG23 ILE 19 3HG2 ILE 19 6.708 4.901 -1.509
167 HD11 ILE 19 3HD1 ILE 19 6.111 4.644 -4.829
168 HD12 ILE 19 1HD1 ILE 19 6.517 2.929 -4.829
169 HD13 ILE 19 2HD1 ILE 19 7.357 4.035 -3.742
170 H SER 20 HN SER 20 5.891 0.396 -0.015
171 HA SER 20 HA SER 20 8.193 0.696 1.622
172 HB2 SER 20 HB2 SER 20 5.808 -0.046 2.219
173 HB3 SER 20 HB1 SER 20 6.266 -1.640 1.644
174 HG SER 20 HG SER 20 6.848 -0.386 3.994
175 H GLY 21 HN GLY 21 7.311 -1.951 -0.635
176 HA2 GLY 21 HA2 GLY 21 9.573 -3.628 -0.067
177 HA3 GLY 21 HA1 GLY 21 8.578 -3.708 -1.526
178 H ILE 22 HN ILE 22 8.928 -1.175 -2.589
179 HA ILE 22 HA ILE 22 11.435 -1.358 -3.968
180 HB ILE 22 HB ILE 22 9.525 0.976 -3.582
181 HG12 ILE 22 2HG1 ILE 22 9.773 -0.732 -6.056
182 HG13 ILE 22 1HG1 ILE 22 8.748 -1.253 -4.719
183 HG21 ILE 22 1HG2 ILE 22 11.810 0.565 -5.530
184 HG22 ILE 22 2HG2 ILE 22 11.611 1.875 -4.365
185 HG23 ILE 22 3HG2 ILE 22 10.543 1.770 -5.763
186 HD11 ILE 22 3HD1 ILE 22 7.846 1.241 -4.885
187 HD12 ILE 22 1HD1 ILE 22 7.216 -0.031 -5.929
188 HD13 ILE 22 2HD1 ILE 22 8.428 1.094 -6.544
189 H GLN 23 HN GLN 23 10.363 0.658 -1.221
190 HA GLN 23 HA GLN 23 12.698 2.228 -0.888
191 HB2 GLN 23 HB2 GLN 23 10.318 2.336 0.188
192 HB3 GLN 23 HB1 GLN 23 11.018 1.282 1.414
193 HG2 GLN 23 HG2 GLN 23 11.623 3.239 2.393
194 HG3 GLN 23 HG1 GLN 23 12.963 3.178 1.251
195 HE21 GLN 23 1HE2 GLN 23 12.156 4.154 -1.097
196 HE22 GLN 23 2HE2 GLN 23 11.332 5.629 -0.959
197 H TYR 24 HN TYR 24 12.005 -1.029 0.209
198 HA TYR 24 HA TYR 24 14.315 -1.277 1.969
199 HB2 TYR 24 HB2 TYR 24 12.485 -2.732 2.390
200 HB3 TYR 24 HB1 TYR 24 12.321 -3.161 0.693
201 HD1 TYR 24 HD2 TYR 24 14.633 -3.459 3.611
202 HD2 TYR 24 HD1 TYR 24 13.387 -5.096 -0.160
203 HE1 TYR 24 HE2 TYR 24 16.093 -5.425 3.985
204 HE2 TYR 24 HE1 TYR 24 14.847 -7.063 0.215
205 HH TYR 24 HH TYR 24 17.182 -7.339 1.825
206 H LEU 25 HN LEU 25 13.636 -2.117 -1.422
207 HA LEU 25 HA LEU 25 16.297 -3.265 -1.860
208 HB2 LEU 25 HB2 LEU 25 13.740 -3.236 -3.097
209 HB3 LEU 25 HB1 LEU 25 14.888 -2.556 -4.248
210 HG LEU 25 HG LEU 25 16.212 -4.763 -3.100
211 HD11 LEU 25 1HD1 LEU 25 13.925 -5.444 -2.286
212 HD12 LEU 25 2HD1 LEU 25 14.703 -6.618 -3.346
213 HD13 LEU 25 3HD1 LEU 25 13.429 -5.571 -3.973
214 HD21 LEU 25 3HD2 LEU 25 16.199 -3.842 -5.488
215 HD22 LEU 25 1HD2 LEU 25 14.716 -4.766 -5.736
216 HD23 LEU 25 2HD2 LEU 25 16.220 -5.599 -5.342
217 H ALA 26 HN ALA 26 15.107 -0.056 -1.833
218 HA ALA 26 HA ALA 26 16.922 1.035 -3.848
219 HB1 ALA 26 HB1 ALA 26 15.945 3.195 -2.905
220 HB2 ALA 26 HB2 ALA 26 14.982 2.179 -1.833
221 HB3 ALA 26 HB3 ALA 26 14.783 2.053 -3.581
222 H GLY 27 HN GLY 27 18.374 -0.407 -1.877
223 HA2 GLY 27 HA2 GLY 27 20.602 0.161 -1.105
224 HA3 GLY 27 HA1 GLY 27 20.006 1.754 -0.651
225 H LEU 28 HN LEU 28 18.333 -1.312 0.105
226 HA LEU 28 HA LEU 28 17.634 -2.179 2.148
227 HB2 LEU 28 HB2 LEU 28 20.203 -2.533 1.908
228 HB3 LEU 28 HB1 LEU 28 20.328 -1.322 3.183
229 HG LEU 28 HG LEU 28 18.444 -2.902 4.285
230 HD11 LEU 28 1HD1 LEU 28 18.992 -5.257 3.873
231 HD12 LEU 28 2HD1 LEU 28 20.185 -4.784 2.665
232 HD13 LEU 28 3HD1 LEU 28 18.471 -4.483 2.377
233 HD21 LEU 28 3HD2 LEU 28 20.523 -2.265 5.382
234 HD22 LEU 28 1HD2 LEU 28 21.449 -3.337 4.331
235 HD23 LEU 28 2HD2 LEU 28 20.327 -4.011 5.514
236 H SER 29 HN SER 29 16.718 0.470 1.794
237 HA SER 29 HA SER 29 17.240 1.996 4.264
238 HB2 SER 29 HB2 SER 29 15.869 2.391 1.661
239 HB3 SER 29 HB1 SER 29 15.177 3.259 3.018
240 HG SER 29 HG SER 29 17.813 3.362 1.966
241 H THR 30 HN THR 30 15.832 2.153 6.009
242 HA THR 30 HA THR 30 13.239 0.675 5.892
243 HB THR 30 HB THR 30 13.870 -0.115 8.260
244 HG1 THR 30 HG1 THR 30 15.678 1.256 8.503
245 HG21 THR 30 3HG2 THR 30 13.818 -1.580 6.264
246 HG22 THR 30 1HG2 THR 30 15.079 -2.044 7.408
247 HG23 THR 30 2HG2 THR 30 15.501 -1.163 5.940
Start of MODEL 26
1 H1 GLN 1 HT1 GLN 1 22.635 -4.042 -3.522
2 H2 GLN 1 HT2 GLN 1 22.046 -4.760 -4.941
3 H3 GLN 1 HT3 GLN 1 22.609 -5.727 -3.662
4 HA GLN 1 HA GLN 1 20.261 -3.904 -3.466
5 HB2 GLN 1 HB2 GLN 1 18.902 -5.910 -3.726
6 HB3 GLN 1 HB1 GLN 1 19.943 -5.711 -5.124
7 HG2 GLN 1 HG2 GLN 1 21.040 -7.657 -4.721
8 HG3 GLN 1 HG1 GLN 1 21.139 -7.362 -2.986
9 HE21 GLN 1 1HE2 GLN 1 19.036 -7.797 -1.715
10 HE22 GLN 1 2HE2 GLN 1 18.006 -9.010 -2.302
11 H THR 2 HN THR 2 19.099 -4.115 -1.515
12 HA THR 2 HA THR 2 19.980 -5.856 0.635
13 HB THR 2 HB THR 2 21.801 -4.333 0.745
14 HG1 THR 2 HG1 THR 2 21.610 -4.038 2.789
15 HG21 THR 2 3HG2 THR 2 19.758 -2.228 0.198
16 HG22 THR 2 1HG2 THR 2 21.382 -2.424 -0.460
17 HG23 THR 2 2HG2 THR 2 21.162 -1.791 1.169
18 H ASN 3 HN ASN 3 18.886 -3.008 1.990
19 HA ASN 3 HA ASN 3 16.331 -4.118 2.720
20 HB2 ASN 3 HB2 ASN 3 17.843 -1.612 3.215
21 HB3 ASN 3 HB1 ASN 3 16.108 -1.581 3.519
22 HD21 ASN 3 1HD2 ASN 3 19.141 -3.208 4.501
23 HD22 ASN 3 2HD2 ASN 3 18.498 -3.862 5.928
24 H TRP 4 HN TRP 4 17.068 -2.777 -0.242
25 HA TRP 4 HA TRP 4 14.866 -1.033 -0.786
26 HB2 TRP 4 HB2 TRP 4 16.608 -2.873 -2.446
27 HB3 TRP 4 HB1 TRP 4 15.325 -1.924 -3.188
28 HD1 TRP 4 HD1 TRP 4 18.847 -1.710 -2.566
29 HE1 TRP 4 HE1 TRP 4 19.689 0.723 -2.498
30 HE3 TRP 4 HE3 TRP 4 14.396 0.753 -2.089
31 HZ2 TRP 4 HZ2 TRP 4 18.617 3.370 -2.272
32 HZ3 TRP 4 HZ3 TRP 4 14.338 3.221 -1.950
33 HH2 TRP 4 HH2 TRP 4 16.436 4.534 -2.040
34 H GLN 5 HN GLN 5 15.277 -4.530 -1.177
35 HA GLN 5 HA GLN 5 12.733 -5.265 -2.206
36 HB2 GLN 5 HB2 GLN 5 15.034 -6.491 -0.845
37 HB3 GLN 5 HB1 GLN 5 13.526 -7.290 -0.432
38 HG2 GLN 5 HG2 GLN 5 13.580 -6.761 -3.271
39 HG3 GLN 5 HG1 GLN 5 15.050 -7.606 -2.794
40 HE21 GLN 5 1HE2 GLN 5 11.458 -7.840 -2.437
41 HE22 GLN 5 2HE2 GLN 5 11.454 -9.533 -2.326
42 H LYS 6 HN LYS 6 13.853 -4.814 1.150
43 HA LYS 6 HA LYS 6 11.373 -5.455 2.481
44 HB2 LYS 6 HB2 LYS 6 13.993 -4.165 3.151
45 HB3 LYS 6 HB1 LYS 6 12.654 -3.919 4.264
46 HG2 LYS 6 HG2 LYS 6 12.971 -6.713 3.378
47 HG3 LYS 6 HG1 LYS 6 14.335 -6.090 4.303
48 HD2 LYS 6 HD2 LYS 6 12.943 -5.518 6.162
49 HD3 LYS 6 HD1 LYS 6 11.471 -5.789 5.228
50 HE2 LYS 6 HE2 LYS 6 11.970 -8.189 5.074
51 HE3 LYS 6 HE1 LYS 6 13.486 -7.948 5.963
52 HZ1 LYS 6 HZ1 LYS 6 11.808 -8.600 7.515
53 HZ2 LYS 6 HZ2 LYS 6 10.737 -7.407 6.963
54 HZ3 LYS 6 HZ3 LYS 6 12.156 -6.968 7.792
55 H LEU 7 HN LEU 7 12.840 -2.403 1.342
56 HA LEU 7 HA LEU 7 10.915 -0.580 2.416
57 HB2 LEU 7 HB2 LEU 7 13.184 -0.018 1.559
58 HB3 LEU 7 HB1 LEU 7 12.635 -0.382 -0.074
59 HG LEU 7 HG LEU 7 10.911 1.526 1.370
60 HD11 LEU 7 1HD1 LEU 7 13.104 2.239 2.241
61 HD12 LEU 7 2HD1 LEU 7 12.459 3.422 1.104
62 HD13 LEU 7 3HD1 LEU 7 13.735 2.317 0.595
63 HD21 LEU 7 3HD2 LEU 7 12.297 2.074 -1.231
64 HD22 LEU 7 1HD2 LEU 7 10.636 2.419 -0.752
65 HD23 LEU 7 2HD2 LEU 7 11.105 0.776 -1.185
66 H GLU 8 HN GLU 8 10.973 -2.426 -0.652
67 HA GLU 8 HA GLU 8 8.704 -1.081 -1.849
68 HB2 GLU 8 HB2 GLU 8 9.923 -3.828 -2.308
69 HB3 GLU 8 HB1 GLU 8 8.764 -3.053 -3.383
70 HG2 GLU 8 HG2 GLU 8 11.326 -1.644 -2.653
71 HG3 GLU 8 HG1 GLU 8 11.314 -2.859 -3.922
72 H VAL 9 HN VAL 9 9.077 -4.107 0.018
73 HA VAL 9 HA VAL 9 6.309 -4.900 0.022
74 HB VAL 9 HB VAL 9 8.654 -5.385 1.909
75 HG11 VAL 9 1HG1 VAL 9 7.439 -7.159 2.954
76 HG12 VAL 9 2HG1 VAL 9 6.102 -7.012 1.814
77 HG13 VAL 9 3HG1 VAL 9 6.385 -5.747 3.010
78 HG21 VAL 9 3HG2 VAL 9 7.382 -7.330 -0.016
79 HG22 VAL 9 1HG2 VAL 9 8.972 -7.419 0.740
80 HG23 VAL 9 2HG2 VAL 9 8.664 -6.231 -0.525
81 H PHE 10 HN PHE 10 8.301 -2.890 2.139
82 HA PHE 10 HA PHE 10 6.433 -2.220 4.193
83 HB2 PHE 10 HB2 PHE 10 8.782 -1.824 4.478
84 HB3 PHE 10 HB1 PHE 10 8.904 -1.013 2.938
85 HD1 PHE 10 HD2 PHE 10 7.723 -0.676 6.432
86 HD2 PHE 10 HD1 PHE 10 8.479 1.343 2.716
87 HE1 PHE 10 HE2 PHE 10 7.476 1.513 7.572
88 HE2 PHE 10 HE1 PHE 10 8.233 3.530 3.856
89 HZ PHE 10 HZ PHE 10 7.731 3.617 6.283
90 H TRP 11 HN TRP 11 7.483 -0.307 1.358
91 HA TRP 11 HA TRP 11 5.620 1.793 1.386
92 HB2 TRP 11 HB2 TRP 11 7.627 0.852 -0.298
93 HB3 TRP 11 HB1 TRP 11 6.193 0.729 -1.291
94 HD1 TRP 11 HD1 TRP 11 8.713 2.732 -1.484
95 HE1 TRP 11 HE1 TRP 11 8.251 5.259 -1.720
96 HE3 TRP 11 HE3 TRP 11 3.937 2.923 0.305
97 HZ2 TRP 11 HZ2 TRP 11 6.130 7.106 -1.216
98 HZ3 TRP 11 HZ3 TRP 11 2.720 5.067 0.415
99 HH2 TRP 11 HH2 TRP 11 3.804 7.162 -0.343
100 H ALA 12 HN ALA 12 5.349 -1.338 -0.384
101 HA ALA 12 HA ALA 12 2.864 -0.916 -1.577
102 HB1 ALA 12 HB1 ALA 12 2.694 -3.508 -1.359
103 HB2 ALA 12 HB2 ALA 12 4.282 -3.385 -0.609
104 HB3 ALA 12 HB3 ALA 12 4.043 -2.821 -2.264
105 H LYS 13 HN LYS 13 3.507 -1.839 1.804
106 HA LYS 13 HA LYS 13 0.800 -2.597 2.468
107 HB2 LYS 13 HB2 LYS 13 3.175 -2.835 3.707
108 HB3 LYS 13 HB1 LYS 13 2.642 -1.345 4.480
109 HG2 LYS 13 HG2 LYS 13 1.781 -2.981 5.916
110 HG3 LYS 13 HG1 LYS 13 0.407 -2.615 4.882
111 HD2 LYS 13 HD2 LYS 13 0.332 -4.882 4.654
112 HD3 LYS 13 HD1 LYS 13 1.541 -4.580 3.411
113 HE2 LYS 13 HE2 LYS 13 2.768 -4.779 6.057
114 HE3 LYS 13 HE1 LYS 13 1.859 -6.241 5.642
115 HZ1 LYS 13 HZ1 LYS 13 4.128 -6.312 4.770
116 HZ2 LYS 13 HZ2 LYS 13 3.834 -4.909 3.859
117 HZ3 LYS 13 HZ3 LYS 13 2.988 -6.342 3.520
118 H HIS 14 HN HIS 14 2.610 0.468 2.573
119 HA HIS 14 HA HIS 14 0.465 2.096 3.706
120 HB2 HIS 14 HB2 HIS 14 2.857 2.877 1.999
121 HB3 HIS 14 HB1 HIS 14 1.924 3.969 2.994
122 HD1 HIS 14 HD1 HIS 14 2.149 3.492 5.698
123 HD2 HIS 14 HD2 HIS 14 4.901 1.626 3.197
124 HE1 HIS 14 HE1 HIS 14 4.047 2.727 7.189
125 H MET 15 HN MET 15 1.889 1.634 0.487
126 HA MET 15 HA MET 15 0.188 3.290 -1.062
127 HB2 MET 15 HB2 MET 15 2.318 1.413 -1.395
128 HB3 MET 15 HB1 MET 15 1.068 0.997 -2.547
129 HG2 MET 15 HG2 MET 15 2.098 3.818 -2.196
130 HG3 MET 15 HG1 MET 15 2.798 2.680 -3.342
131 HE1 MET 15 HE1 MET 15 0.485 5.746 -4.283
132 HE2 MET 15 HE2 MET 15 1.476 5.006 -5.534
133 HE3 MET 15 HE3 MET 15 2.136 5.211 -3.917
134 H TRP 16 HN TRP 16 -0.186 -0.218 -0.257
135 HA TRP 16 HA TRP 16 -2.614 -0.482 -1.800
136 HB2 TRP 16 HB2 TRP 16 -0.943 -2.288 -0.656
137 HB3 TRP 16 HB1 TRP 16 -2.210 -2.248 0.572
138 HD1 TRP 16 HD1 TRP 16 -3.668 -4.305 0.103
139 HE1 TRP 16 HE1 TRP 16 -4.864 -5.274 -1.966
140 HE3 TRP 16 HE3 TRP 16 -1.875 -1.162 -3.462
141 HZ2 TRP 16 HZ2 TRP 16 -5.029 -4.764 -4.793
142 HZ3 TRP 16 HZ3 TRP 16 -2.555 -1.409 -5.838
143 HH2 TRP 16 HH2 TRP 16 -4.129 -3.205 -6.504
144 H ASN 17 HN ASN 17 -1.916 0.554 1.513
145 HA ASN 17 HA ASN 17 -4.594 0.438 2.523
146 HB2 ASN 17 HB2 ASN 17 -2.430 0.783 3.827
147 HB3 ASN 17 HB1 ASN 17 -2.405 2.433 3.211
148 HD21 ASN 17 1HD2 ASN 17 -2.713 3.373 5.359
149 HD22 ASN 17 2HD2 ASN 17 -4.203 3.247 6.161
150 H PHE 18 HN PHE 18 -2.767 2.872 0.691
151 HA PHE 18 HA PHE 18 -4.667 5.018 0.690
152 HB2 PHE 18 HB2 PHE 18 -2.258 5.118 -0.039
153 HB3 PHE 18 HB1 PHE 18 -2.660 4.103 -1.413
154 HD1 PHE 18 HD1 PHE 18 -3.486 7.395 0.173
155 HD2 PHE 18 HD2 PHE 18 -3.475 5.019 -3.407
156 HE1 PHE 18 HE1 PHE 18 -4.141 9.385 -1.152
157 HE2 PHE 18 HE2 PHE 18 -4.130 7.009 -4.731
158 HZ PHE 18 HZ PHE 18 -4.464 9.194 -3.603
159 H ILE 19 HN ILE 19 -4.122 2.230 -1.462
160 HA ILE 19 HA ILE 19 -6.291 2.711 -3.296
161 HB ILE 19 HB ILE 19 -4.599 0.330 -2.508
162 HG12 ILE 19 2HG1 ILE 19 -3.494 2.155 -3.742
163 HG13 ILE 19 1HG1 ILE 19 -3.563 0.682 -4.697
164 HG21 ILE 19 1HG2 ILE 19 -5.512 -0.626 -4.771
165 HG22 ILE 19 2HG2 ILE 19 -6.904 0.396 -4.421
166 HG23 ILE 19 3HG2 ILE 19 -6.425 -0.861 -3.282
167 HD11 ILE 19 3HD1 ILE 19 -5.348 3.119 -4.982
168 HD12 ILE 19 1HD1 ILE 19 -5.604 1.604 -5.848
169 HD13 ILE 19 2HD1 ILE 19 -4.142 2.546 -6.130
170 H SER 20 HN SER 20 -6.005 0.865 -0.256
171 HA SER 20 HA SER 20 -8.483 -0.503 -0.226
172 HB2 SER 20 HB2 SER 20 -6.427 -0.582 1.361
173 HB3 SER 20 HB1 SER 20 -7.197 0.757 2.196
174 HG SER 20 HG SER 20 -8.962 -0.569 2.597
175 H GLY 21 HN GLY 21 -7.742 2.780 1.043
176 HA2 GLY 21 HA2 GLY 21 -10.365 3.402 1.971
177 HA3 GLY 21 HA1 GLY 21 -9.135 4.595 1.536
178 H ILE 22 HN ILE 22 -8.736 4.126 -1.127
179 HA ILE 22 HA ILE 22 -10.955 5.421 -2.407
180 HB ILE 22 HB ILE 22 -8.539 3.906 -3.477
181 HG12 ILE 22 2HG1 ILE 22 -9.098 6.889 -3.417
182 HG13 ILE 22 1HG1 ILE 22 -8.207 6.056 -2.147
183 HG21 ILE 22 1HG2 ILE 22 -9.003 5.061 -5.633
184 HG22 ILE 22 2HG2 ILE 22 -10.526 5.655 -4.970
185 HG23 ILE 22 3HG2 ILE 22 -10.280 3.924 -5.203
186 HD11 ILE 22 3HD1 ILE 22 -6.862 7.173 -4.071
187 HD12 ILE 22 1HD1 ILE 22 -7.370 5.782 -5.029
188 HD13 ILE 22 2HD1 ILE 22 -6.410 5.545 -3.569
189 H GLN 23 HN GLN 23 -9.966 2.014 -2.122
190 HA GLN 23 HA GLN 23 -12.281 1.087 -3.733
191 HB2 GLN 23 HB2 GLN 23 -9.923 0.174 -3.924
192 HB3 GLN 23 HB1 GLN 23 -10.087 -0.444 -2.286
193 HG2 GLN 23 HG2 GLN 23 -11.000 -2.305 -3.153
194 HG3 GLN 23 HG1 GLN 23 -12.391 -1.343 -3.644
195 HE21 GLN 23 1HE2 GLN 23 -12.397 -0.487 -5.903
196 HE22 GLN 23 2HE2 GLN 23 -11.394 -1.197 -7.075
197 H TYR 24 HN TYR 24 -13.017 2.479 -1.419
198 HA TYR 24 HA TYR 24 -14.474 0.428 0.098
199 HB2 TYR 24 HB2 TYR 24 -12.523 0.492 1.439
200 HB3 TYR 24 HB1 TYR 24 -12.336 2.231 1.247
201 HD1 TYR 24 HD1 TYR 24 -14.791 -0.284 2.598
202 HD2 TYR 24 HD2 TYR 24 -13.061 3.632 2.961
203 HE1 TYR 24 HE1 TYR 24 -16.081 0.094 4.675
204 HE2 TYR 24 HE2 TYR 24 -14.355 4.007 5.043
205 HH TYR 24 HH TYR 24 -16.646 2.992 5.990
206 H LEU 25 HN LEU 25 -13.674 3.941 0.093
207 HA LEU 25 HA LEU 25 -16.146 4.890 1.113
208 HB2 LEU 25 HB2 LEU 25 -13.781 5.916 -0.261
209 HB3 LEU 25 HB1 LEU 25 -15.237 6.803 -0.684
210 HG LEU 25 HG LEU 25 -15.599 6.662 1.986
211 HD11 LEU 25 1HD1 LEU 25 -13.499 6.878 3.163
212 HD12 LEU 25 2HD1 LEU 25 -12.591 6.842 1.651
213 HD13 LEU 25 3HD1 LEU 25 -13.429 5.397 2.211
214 HD21 LEU 25 3HD2 LEU 25 -14.583 8.928 2.098
215 HD22 LEU 25 1HD2 LEU 25 -15.560 8.733 0.643
216 HD23 LEU 25 2HD2 LEU 25 -13.802 8.646 0.543
217 H ALA 26 HN ALA 26 -15.422 3.811 -2.164
218 HA ALA 26 HA ALA 26 -17.769 5.062 -3.351
219 HB1 ALA 26 HB1 ALA 26 -15.890 2.920 -4.383
220 HB2 ALA 26 HB2 ALA 26 -15.666 4.660 -4.575
221 HB3 ALA 26 HB3 ALA 26 -17.024 3.855 -5.360
222 H GLY 27 HN GLY 27 -18.735 3.726 -1.217
223 HA2 GLY 27 HA2 GLY 27 -20.851 2.539 -1.097
224 HA3 GLY 27 HA1 GLY 27 -20.312 1.510 -2.418
225 H LEU 28 HN LEU 28 -18.536 2.369 0.600
226 HA LEU 28 HA LEU 28 -17.457 0.981 2.134
227 HB2 LEU 28 HB2 LEU 28 -20.243 0.716 2.156
228 HB3 LEU 28 HB1 LEU 28 -19.650 -0.933 2.292
229 HG LEU 28 HG LEU 28 -18.355 1.164 3.990
230 HD11 LEU 28 1HD1 LEU 28 -20.100 0.811 5.730
231 HD12 LEU 28 2HD1 LEU 28 -21.065 -0.076 4.550
232 HD13 LEU 28 3HD1 LEU 28 -20.729 1.638 4.305
233 HD21 LEU 28 3HD2 LEU 28 -19.225 -1.657 4.667
234 HD22 LEU 28 1HD2 LEU 28 -17.993 -0.680 5.464
235 HD23 LEU 28 2HD2 LEU 28 -17.701 -1.318 3.847
236 H SER 29 HN SER 29 -16.561 0.349 -0.425
237 HA SER 29 HA SER 29 -16.763 -2.521 -0.961
238 HB2 SER 29 HB2 SER 29 -16.478 -0.573 -2.602
239 HB3 SER 29 HB1 SER 29 -14.788 -0.564 -2.120
240 HG SER 29 HG SER 29 -14.527 -2.257 -3.352
241 H THR 30 HN THR 30 -14.509 -3.620 -1.458
242 HA THR 30 HA THR 30 -12.548 -3.197 0.751
243 HB THR 30 HB THR 30 -12.616 -5.787 0.921
244 HG1 THR 30 HG1 THR 30 -14.039 -6.022 -0.893
245 HG21 THR 30 3HG2 THR 30 -13.371 -4.176 2.665
246 HG22 THR 30 1HG2 THR 30 -14.298 -5.676 2.647
247 HG23 THR 30 2HG2 THR 30 -14.981 -4.210 1.946
Start of MODEL 27
1 H1 GLN 1 HT1 GLN 1 22.505 2.212 3.757
2 H2 GLN 1 HT2 GLN 1 23.599 3.195 4.597
3 H3 GLN 1 HT3 GLN 1 23.428 3.349 2.913
4 HA GLN 1 HA GLN 1 21.143 3.817 4.746
5 HB2 GLN 1 HB2 GLN 1 21.755 6.198 4.727
6 HB3 GLN 1 HB1 GLN 1 23.019 5.229 5.465
7 HG2 GLN 1 HG2 GLN 1 24.533 5.838 3.893
8 HG3 GLN 1 HG1 GLN 1 23.401 5.551 2.573
9 HE21 GLN 1 1HE2 GLN 1 24.618 8.043 4.804
10 HE22 GLN 1 2HE2 GLN 1 23.843 9.336 4.027
11 H THR 2 HN THR 2 20.951 2.473 2.273
12 HA THR 2 HA THR 2 20.214 4.484 0.259
13 HB THR 2 HB THR 2 19.303 2.241 -0.815
14 HG1 THR 2 HG1 THR 2 21.404 1.035 0.545
15 HG21 THR 2 3HG2 THR 2 21.158 3.718 -1.598
16 HG22 THR 2 1HG2 THR 2 21.414 2.008 -1.941
17 HG23 THR 2 2HG2 THR 2 22.270 2.779 -0.604
18 H ASN 3 HN ASN 3 18.217 5.209 -0.096
19 HA ASN 3 HA ASN 3 16.064 4.537 1.782
20 HB2 ASN 3 HB2 ASN 3 16.718 6.853 0.737
21 HB3 ASN 3 HB1 ASN 3 15.742 6.314 -0.626
22 HD21 ASN 3 1HD2 ASN 3 13.395 5.408 0.195
23 HD22 ASN 3 2HD2 ASN 3 12.676 6.369 1.396
24 H TRP 4 HN TRP 4 17.053 3.267 -1.221
25 HA TRP 4 HA TRP 4 14.649 2.663 -2.582
26 HB2 TRP 4 HB2 TRP 4 17.258 1.144 -2.237
27 HB3 TRP 4 HB1 TRP 4 16.001 0.627 -3.353
28 HD1 TRP 4 HD1 TRP 4 19.061 2.464 -3.413
29 HE1 TRP 4 HE1 TRP 4 19.161 4.155 -5.357
30 HE3 TRP 4 HE3 TRP 4 14.125 2.610 -4.697
31 HZ2 TRP 4 HZ2 TRP 4 17.369 5.410 -7.219
32 HZ3 TRP 4 HZ3 TRP 4 13.347 4.052 -6.547
33 HH2 TRP 4 HH2 TRP 4 14.957 5.451 -7.810
34 H GLN 5 HN GLN 5 16.367 0.707 -0.149
35 HA GLN 5 HA GLN 5 14.530 -1.406 0.171
36 HB2 GLN 5 HB2 GLN 5 15.532 -1.576 2.446
37 HB3 GLN 5 HB1 GLN 5 16.748 -1.372 1.182
38 HG2 GLN 5 HG2 GLN 5 16.468 1.184 1.840
39 HG3 GLN 5 HG1 GLN 5 15.888 0.501 3.353
40 HE21 GLN 5 1HE2 GLN 5 17.700 0.993 4.673
41 HE22 GLN 5 2HE2 GLN 5 19.255 0.376 4.382
42 H LYS 6 HN LYS 6 14.609 1.736 1.808
43 HA LYS 6 HA LYS 6 12.275 1.432 3.452
44 HB2 LYS 6 HB2 LYS 6 13.956 3.713 2.433
45 HB3 LYS 6 HB1 LYS 6 12.460 4.054 3.295
46 HG2 LYS 6 HG2 LYS 6 14.409 2.107 4.484
47 HG3 LYS 6 HG1 LYS 6 14.732 3.833 4.618
48 HD2 LYS 6 HD2 LYS 6 13.275 3.983 6.317
49 HD3 LYS 6 HD1 LYS 6 11.981 3.441 5.255
50 HE2 LYS 6 HE2 LYS 6 12.001 1.862 7.040
51 HE3 LYS 6 HE1 LYS 6 12.841 1.042 5.713
52 HZ1 LYS 6 HZ1 LYS 6 14.932 1.522 6.643
53 HZ2 LYS 6 HZ2 LYS 6 13.983 1.029 7.961
54 HZ3 LYS 6 HZ3 LYS 6 14.304 2.674 7.717
55 H LEU 7 HN LEU 7 12.773 2.739 0.151
56 HA LEU 7 HA LEU 7 10.084 3.702 -0.230
57 HB2 LEU 7 HB2 LEU 7 12.184 4.306 -1.554
58 HB3 LEU 7 HB1 LEU 7 12.030 2.742 -2.350
59 HG LEU 7 HG LEU 7 9.608 4.493 -2.275
60 HD11 LEU 7 1HD1 LEU 7 11.855 4.915 -4.261
61 HD12 LEU 7 2HD1 LEU 7 11.491 6.008 -2.922
62 HD13 LEU 7 3HD1 LEU 7 10.312 5.763 -4.209
63 HD21 LEU 7 3HD2 LEU 7 9.033 2.671 -3.519
64 HD22 LEU 7 1HD2 LEU 7 10.710 2.248 -3.857
65 HD23 LEU 7 2HD2 LEU 7 9.903 3.488 -4.814
66 H GLU 8 HN GLU 8 11.691 0.572 -0.965
67 HA GLU 8 HA GLU 8 9.518 -0.617 -2.402
68 HB2 GLU 8 HB2 GLU 8 11.708 -1.818 -0.670
69 HB3 GLU 8 HB1 GLU 8 10.668 -2.758 -1.738
70 HG2 GLU 8 HG2 GLU 8 12.296 -0.430 -2.771
71 HG3 GLU 8 HG1 GLU 8 12.977 -2.047 -2.652
72 H VAL 9 HN VAL 9 10.315 -0.611 1.084
73 HA VAL 9 HA VAL 9 8.069 -2.214 1.949
74 HB VAL 9 HB VAL 9 9.794 -0.109 3.326
75 HG11 VAL 9 1HG1 VAL 9 7.698 -0.390 4.578
76 HG12 VAL 9 2HG1 VAL 9 9.043 -1.117 5.456
77 HG13 VAL 9 3HG1 VAL 9 7.914 -2.142 4.569
78 HG21 VAL 9 3HG2 VAL 9 10.942 -2.182 2.477
79 HG22 VAL 9 1HG2 VAL 9 9.886 -3.132 3.522
80 HG23 VAL 9 2HG2 VAL 9 11.028 -1.987 4.226
81 H PHE 10 HN PHE 10 8.669 1.270 1.631
82 HA PHE 10 HA PHE 10 6.182 2.333 2.530
83 HB2 PHE 10 HB2 PHE 10 7.987 3.837 2.264
84 HB3 PHE 10 HB1 PHE 10 8.441 3.149 0.724
85 HD1 PHE 10 HD1 PHE 10 5.588 5.018 2.308
86 HD2 PHE 10 HD2 PHE 10 7.923 4.285 -1.222
87 HE1 PHE 10 HE1 PHE 10 4.345 6.803 1.116
88 HE2 PHE 10 HE2 PHE 10 6.680 6.072 -2.416
89 HZ PHE 10 HZ PHE 10 4.891 7.330 -1.244
90 H TRP 11 HN TRP 11 7.311 1.436 -0.725
91 HA TRP 11 HA TRP 11 5.010 2.063 -2.250
92 HB2 TRP 11 HB2 TRP 11 7.526 1.099 -2.749
93 HB3 TRP 11 HB1 TRP 11 6.549 -0.332 -3.058
94 HD1 TRP 11 HD1 TRP 11 6.155 3.416 -3.844
95 HE1 TRP 11 HE1 TRP 11 5.442 3.663 -6.313
96 HE3 TRP 11 HE3 TRP 11 6.019 -1.496 -5.192
97 HZ2 TRP 11 HZ2 TRP 11 4.891 1.983 -8.562
98 HZ3 TRP 11 HZ3 TRP 11 5.399 -2.151 -7.499
99 HH2 TRP 11 HH2 TRP 11 4.833 -0.425 -9.185
100 H ALA 12 HN ALA 12 5.921 -1.008 -0.631
101 HA ALA 12 HA ALA 12 3.712 -2.540 -1.573
102 HB1 ALA 12 HB1 ALA 12 5.784 -3.422 -0.449
103 HB2 ALA 12 HB2 ALA 12 4.301 -4.067 0.257
104 HB3 ALA 12 HB3 ALA 12 5.180 -2.781 1.080
105 H LYS 13 HN LYS 13 4.116 -0.476 1.309
106 HA LYS 13 HA LYS 13 1.588 -0.973 2.568
107 HB2 LYS 13 HB2 LYS 13 3.788 1.019 2.675
108 HB3 LYS 13 HB1 LYS 13 2.218 1.644 3.167
109 HG2 LYS 13 HG2 LYS 13 2.471 -0.896 4.394
110 HG3 LYS 13 HG1 LYS 13 4.013 -0.074 4.629
111 HD2 LYS 13 HD2 LYS 13 2.200 1.944 5.136
112 HD3 LYS 13 HD1 LYS 13 1.374 0.530 5.779
113 HE2 LYS 13 HE2 LYS 13 4.271 0.881 6.468
114 HE3 LYS 13 HE1 LYS 13 3.083 1.907 7.286
115 HZ1 LYS 13 HZ1 LYS 13 1.815 -0.070 7.876
116 HZ2 LYS 13 HZ2 LYS 13 3.396 -0.162 8.486
117 HZ3 LYS 13 HZ3 LYS 13 2.960 -1.062 7.114
118 H HIS 14 HN HIS 14 2.676 1.462 0.208
119 HA HIS 14 HA HIS 14 0.225 2.893 -0.140
120 HB2 HIS 14 HB2 HIS 14 2.299 3.832 -0.859
121 HB3 HIS 14 HB1 HIS 14 2.727 2.392 -1.768
122 HD1 HIS 14 HD1 HIS 14 0.513 5.442 -1.915
123 HD2 HIS 14 HD2 HIS 14 1.688 2.298 -4.389
124 HE1 HIS 14 HE1 HIS 14 -0.306 6.015 -4.242
125 H MET 15 HN MET 15 1.650 0.175 -1.992
126 HA MET 15 HA MET 15 -0.498 -0.198 -3.853
127 HB2 MET 15 HB2 MET 15 1.944 -1.107 -3.792
128 HB3 MET 15 HB1 MET 15 1.285 -2.388 -2.781
129 HG2 MET 15 HG2 MET 15 0.961 -3.399 -4.804
130 HG3 MET 15 HG1 MET 15 -0.529 -2.461 -4.774
131 HE1 MET 15 HE1 MET 15 -0.666 -0.446 -7.521
132 HE2 MET 15 HE2 MET 15 -0.124 0.551 -6.177
133 HE3 MET 15 HE3 MET 15 -1.174 -0.825 -5.865
134 H TRP 16 HN TRP 16 0.178 -1.832 -0.710
135 HA TRP 16 HA TRP 16 -2.215 -3.442 -0.805
136 HB2 TRP 16 HB2 TRP 16 0.054 -3.412 0.743
137 HB3 TRP 16 HB1 TRP 16 -1.137 -2.751 1.863
138 HD1 TRP 16 HD1 TRP 16 -1.725 -4.738 3.348
139 HE1 TRP 16 HE1 TRP 16 -2.607 -7.131 2.952
140 HE3 TRP 16 HE3 TRP 16 -1.402 -4.939 -1.724
141 HZ2 TRP 16 HZ2 TRP 16 -3.111 -8.901 0.744
142 HZ3 TRP 16 HZ3 TRP 16 -2.085 -6.978 -2.959
143 HH2 TRP 16 HH2 TRP 16 -2.939 -8.957 -1.734
144 H ASN 17 HN ASN 17 -1.519 -0.185 0.440
145 HA ASN 17 HA ASN 17 -3.957 0.152 1.897
146 HB2 ASN 17 HB2 ASN 17 -1.833 1.627 1.879
147 HB3 ASN 17 HB1 ASN 17 -2.474 2.329 0.392
148 HD21 ASN 17 1HD2 ASN 17 -3.354 1.779 3.845
149 HD22 ASN 17 2HD2 ASN 17 -4.397 3.115 3.932
150 H PHE 18 HN PHE 18 -3.101 0.477 -1.523
151 HA PHE 18 HA PHE 18 -5.498 1.740 -2.487
152 HB2 PHE 18 HB2 PHE 18 -3.231 1.426 -3.643
153 HB3 PHE 18 HB1 PHE 18 -3.666 -0.260 -3.874
154 HD1 PHE 18 HD2 PHE 18 -4.615 3.232 -4.719
155 HD2 PHE 18 HD1 PHE 18 -5.206 -0.935 -5.575
156 HE1 PHE 18 HE2 PHE 18 -5.877 3.832 -6.766
157 HE2 PHE 18 HE1 PHE 18 -6.468 -0.334 -7.624
158 HZ PHE 18 HZ PHE 18 -6.805 2.050 -8.220
159 H ILE 19 HN ILE 19 -4.451 -1.615 -2.003
160 HA ILE 19 HA ILE 19 -6.831 -2.936 -2.962
161 HB ILE 19 HB ILE 19 -4.445 -3.660 -1.244
162 HG12 ILE 19 2HG1 ILE 19 -4.040 -3.309 -3.633
163 HG13 ILE 19 1HG1 ILE 19 -3.808 -4.996 -3.204
164 HG21 ILE 19 1HG2 ILE 19 -6.867 -5.315 -1.778
165 HG22 ILE 19 2HG2 ILE 19 -5.823 -5.260 -0.358
166 HG23 ILE 19 3HG2 ILE 19 -5.288 -6.103 -1.810
167 HD11 ILE 19 3HD1 ILE 19 -6.559 -4.610 -3.960
168 HD12 ILE 19 1HD1 ILE 19 -5.332 -5.613 -4.734
169 HD13 ILE 19 2HD1 ILE 19 -5.517 -3.925 -5.205
170 H SER 20 HN SER 20 -5.643 -2.024 0.299
171 HA SER 20 HA SER 20 -7.860 -3.010 1.820
172 HB2 SER 20 HB2 SER 20 -5.808 -0.826 2.248
173 HB3 SER 20 HB1 SER 20 -6.995 -1.252 3.471
174 HG SER 20 HG SER 20 -6.020 -3.168 3.737
175 H GLY 21 HN GLY 21 -7.252 0.165 0.280
176 HA2 GLY 21 HA2 GLY 21 -9.502 1.571 1.289
177 HA3 GLY 21 HA1 GLY 21 -8.674 1.935 -0.229
178 H ILE 22 HN ILE 22 -9.104 -0.243 -1.786
179 HA ILE 22 HA ILE 22 -11.839 0.033 -2.645
180 HB ILE 22 HB ILE 22 -9.664 -1.977 -3.328
181 HG12 ILE 22 2HG1 ILE 22 -10.696 0.348 -4.979
182 HG13 ILE 22 1HG1 ILE 22 -9.343 0.519 -3.865
183 HG21 ILE 22 1HG2 ILE 22 -12.429 -1.548 -4.447
184 HG22 ILE 22 2HG2 ILE 22 -11.626 -3.064 -4.040
185 HG23 ILE 22 3HG2 ILE 22 -11.139 -2.169 -5.477
186 HD11 ILE 22 3HD1 ILE 22 -9.377 -1.625 -5.993
187 HD12 ILE 22 1HD1 ILE 22 -7.998 -1.004 -5.085
188 HD13 ILE 22 2HD1 ILE 22 -8.769 -0.002 -6.317
189 H GLN 23 HN GLN 23 -10.136 -2.512 -0.780
190 HA GLN 23 HA GLN 23 -12.179 -4.443 -0.611
191 HB2 GLN 23 HB2 GLN 23 -9.810 -4.639 0.204
192 HB3 GLN 23 HB1 GLN 23 -10.246 -3.626 1.577
193 HG2 GLN 23 HG2 GLN 23 -10.803 -5.539 2.634
194 HG3 GLN 23 HG1 GLN 23 -12.224 -5.578 1.597
195 HE21 GLN 23 1HE2 GLN 23 -11.732 -6.686 -0.683
196 HE22 GLN 23 2HE2 GLN 23 -10.736 -8.059 -0.616
197 H TYR 24 HN TYR 24 -11.704 -1.547 1.311
198 HA TYR 24 HA TYR 24 -14.025 -1.975 3.058
199 HB2 TYR 24 HB2 TYR 24 -12.289 -0.784 4.068
200 HB3 TYR 24 HB1 TYR 24 -11.903 0.105 2.604
201 HD1 TYR 24 HD2 TYR 24 -14.697 -0.298 5.080
202 HD2 TYR 24 HD1 TYR 24 -12.558 2.354 2.469
203 HE1 TYR 24 HE2 TYR 24 -16.050 1.597 5.911
204 HE2 TYR 24 HE1 TYR 24 -13.914 4.256 3.301
205 HH TYR 24 HH TYR 24 -15.369 4.494 5.877
206 H LEU 25 HN LEU 25 -13.256 0.215 0.333
207 HA LEU 25 HA LEU 25 -15.754 1.575 0.223
208 HB2 LEU 25 HB2 LEU 25 -13.320 1.380 -1.275
209 HB3 LEU 25 HB1 LEU 25 -14.688 1.318 -2.377
210 HG LEU 25 HG LEU 25 -15.336 3.319 -0.497
211 HD11 LEU 25 1HD1 LEU 25 -13.127 3.580 0.297
212 HD12 LEU 25 2HD1 LEU 25 -13.304 4.851 -0.912
213 HD13 LEU 25 3HD1 LEU 25 -12.431 3.369 -1.308
214 HD21 LEU 25 3HD2 LEU 25 -15.836 3.224 -2.964
215 HD22 LEU 25 1HD2 LEU 25 -14.161 3.686 -3.273
216 HD23 LEU 25 2HD2 LEU 25 -15.240 4.792 -2.421
217 H ALA 26 HN ALA 26 -15.113 -1.698 -0.741
218 HA ALA 26 HA ALA 26 -17.222 -1.848 -2.749
219 HB1 ALA 26 HB1 ALA 26 -16.472 -4.051 -3.033
220 HB2 ALA 26 HB2 ALA 26 -15.956 -4.192 -1.353
221 HB3 ALA 26 HB3 ALA 26 -15.019 -3.214 -2.484
222 H GLY 27 HN GLY 27 -18.348 -0.768 -0.468
223 HA2 GLY 27 HA2 GLY 27 -20.634 -1.183 0.287
224 HA3 GLY 27 HA1 GLY 27 -20.232 -2.891 0.434
225 H LEU 28 HN LEU 28 -18.283 -0.123 1.605
226 HA LEU 28 HA LEU 28 -17.384 0.307 3.697
227 HB2 LEU 28 HB2 LEU 28 -20.123 0.537 3.687
228 HB3 LEU 28 HB1 LEU 28 -19.857 -0.492 5.089
229 HG LEU 28 HG LEU 28 -18.136 1.941 4.740
230 HD11 LEU 28 1HD1 LEU 28 -20.994 1.916 5.745
231 HD12 LEU 28 2HD1 LEU 28 -20.342 2.856 4.403
232 HD13 LEU 28 3HD1 LEU 28 -19.852 3.225 6.055
233 HD21 LEU 28 3HD2 LEU 28 -19.354 0.570 7.164
234 HD22 LEU 28 1HD2 LEU 28 -18.163 1.870 7.195
235 HD23 LEU 28 2HD2 LEU 28 -17.720 0.286 6.563
236 H SER 29 HN SER 29 -16.671 -2.250 2.826
237 HA SER 29 HA SER 29 -17.083 -4.162 5.053
238 HB2 SER 29 HB2 SER 29 -17.136 -4.696 2.549
239 HB3 SER 29 HB1 SER 29 -15.396 -4.451 2.558
240 HG SER 29 HG SER 29 -15.542 -6.561 3.053
241 H THR 30 HN THR 30 -14.436 -5.401 4.862
242 HA THR 30 HA THR 30 -12.626 -3.261 5.881
243 HB THR 30 HB THR 30 -13.142 -5.903 7.275
244 HG1 THR 30 HG1 THR 30 -14.159 -3.298 7.778
245 HG21 THR 30 3HG2 THR 30 -10.953 -5.091 7.767
246 HG22 THR 30 1HG2 THR 30 -11.965 -4.702 9.157
247 HG23 THR 30 2HG2 THR 30 -11.543 -3.445 7.994
Start of MODEL 28
1 H1 GLN 1 HT1 GLN 1 23.820 -0.425 0.363
2 H2 GLN 1 HT2 GLN 1 24.099 1.251 0.434
3 H3 GLN 1 HT3 GLN 1 23.403 0.560 -0.947
4 HA GLN 1 HA GLN 1 21.373 0.125 0.102
5 HB2 GLN 1 HB2 GLN 1 21.129 0.403 2.555
6 HB3 GLN 1 HB1 GLN 1 22.309 -0.826 2.136
7 HG2 GLN 1 HG2 GLN 1 23.862 0.248 3.360
8 HG3 GLN 1 HG1 GLN 1 23.688 1.685 2.356
9 HE21 GLN 1 1HE2 GLN 1 23.215 0.515 5.537
10 HE22 GLN 1 2HE2 GLN 1 22.207 1.765 6.083
11 H THR 2 HN THR 2 19.825 1.644 0.036
12 HA THR 2 HA THR 2 20.132 4.388 0.904
13 HB THR 2 HB THR 2 21.556 4.543 -1.004
14 HG1 THR 2 HG1 THR 2 20.610 6.276 -1.599
15 HG21 THR 2 3HG2 THR 2 19.450 2.967 -2.473
16 HG22 THR 2 1HG2 THR 2 21.171 2.620 -2.301
17 HG23 THR 2 2HG2 THR 2 20.637 3.948 -3.330
18 H ASN 3 HN ASN 3 18.218 4.532 -1.778
19 HA ASN 3 HA ASN 3 15.753 4.679 -0.363
20 HB2 ASN 3 HB2 ASN 3 16.486 4.462 -3.270
21 HB3 ASN 3 HB1 ASN 3 14.799 4.519 -2.762
22 HD21 ASN 3 1HD2 ASN 3 14.181 6.479 -1.352
23 HD22 ASN 3 2HD2 ASN 3 15.008 7.935 -1.631
24 H TRP 4 HN TRP 4 17.368 1.868 -1.527
25 HA TRP 4 HA TRP 4 15.204 0.079 -2.016
26 HB2 TRP 4 HB2 TRP 4 18.078 -0.131 -1.191
27 HB3 TRP 4 HB1 TRP 4 17.072 -1.568 -1.033
28 HD1 TRP 4 HD1 TRP 4 19.044 0.325 -3.495
29 HE1 TRP 4 HE1 TRP 4 18.603 -0.530 -5.884
30 HE3 TRP 4 HE3 TRP 4 14.911 -2.568 -2.659
31 HZ2 TRP 4 HZ2 TRP 4 16.750 -2.216 -7.264
32 HZ3 TRP 4 HZ3 TRP 4 13.836 -3.783 -4.527
33 HH2 TRP 4 HH2 TRP 4 14.744 -3.613 -6.825
34 H GLN 5 HN GLN 5 16.879 0.959 1.001
35 HA GLN 5 HA GLN 5 15.538 -0.806 2.809
36 HB2 GLN 5 HB2 GLN 5 17.082 1.739 2.914
37 HB3 GLN 5 HB1 GLN 5 16.007 1.464 4.279
38 HG2 GLN 5 HG2 GLN 5 17.922 -0.661 3.312
39 HG3 GLN 5 HG1 GLN 5 18.398 0.557 4.493
40 HE21 GLN 5 1HE2 GLN 5 16.669 0.730 6.434
41 HE22 GLN 5 2HE2 GLN 5 16.112 -0.763 7.018
42 H LYS 6 HN LYS 6 14.760 2.475 1.653
43 HA LYS 6 HA LYS 6 12.264 2.755 3.113
44 HB2 LYS 6 HB2 LYS 6 13.813 4.569 2.213
45 HB3 LYS 6 HB1 LYS 6 13.191 4.189 0.610
46 HG2 LYS 6 HG2 LYS 6 10.902 4.719 1.361
47 HG3 LYS 6 HG1 LYS 6 11.510 5.074 2.976
48 HD2 LYS 6 HD2 LYS 6 11.531 7.208 2.145
49 HD3 LYS 6 HD1 LYS 6 13.124 6.706 1.601
50 HE2 LYS 6 HE2 LYS 6 12.362 7.428 -0.437
51 HE3 LYS 6 HE1 LYS 6 11.590 5.835 -0.497
52 HZ1 LYS 6 HZ1 LYS 6 9.974 7.614 -0.884
53 HZ2 LYS 6 HZ2 LYS 6 10.351 8.301 0.620
54 HZ3 LYS 6 HZ3 LYS 6 9.620 6.769 0.539
55 H LEU 7 HN LEU 7 13.171 1.327 0.017
56 HA LEU 7 HA LEU 7 10.748 1.388 -1.426
57 HB2 LEU 7 HB2 LEU 7 13.048 0.726 -2.199
58 HB3 LEU 7 HB1 LEU 7 12.824 -0.808 -1.371
59 HG LEU 7 HG LEU 7 10.585 -0.136 -3.149
60 HD11 LEU 7 1HD1 LEU 7 13.379 -0.501 -4.275
61 HD12 LEU 7 2HD1 LEU 7 12.301 0.871 -4.531
62 HD13 LEU 7 3HD1 LEU 7 11.903 -0.702 -5.219
63 HD21 LEU 7 3HD2 LEU 7 10.793 -2.455 -3.733
64 HD22 LEU 7 1HD2 LEU 7 11.148 -2.358 -2.008
65 HD23 LEU 7 2HD2 LEU 7 12.463 -2.516 -3.171
66 H GLU 8 HN GLU 8 11.815 -0.987 1.065
67 HA GLU 8 HA GLU 8 9.662 -2.847 0.655
68 HB2 GLU 8 HB2 GLU 8 11.647 -2.216 2.806
69 HB3 GLU 8 HB1 GLU 8 10.259 -3.206 3.251
70 HG2 GLU 8 HG2 GLU 8 11.883 -4.775 2.568
71 HG3 GLU 8 HG1 GLU 8 10.818 -4.625 1.176
72 H VAL 9 HN VAL 9 10.005 -0.126 2.952
73 HA VAL 9 HA VAL 9 7.348 -0.334 4.073
74 HB VAL 9 HB VAL 9 9.331 1.974 3.880
75 HG11 VAL 9 1HG1 VAL 9 7.012 2.759 4.366
76 HG12 VAL 9 2HG1 VAL 9 8.105 3.001 5.726
77 HG13 VAL 9 3HG1 VAL 9 6.958 1.662 5.747
78 HG21 VAL 9 3HG2 VAL 9 8.726 0.078 6.171
79 HG22 VAL 9 1HG2 VAL 9 9.944 1.353 6.157
80 HG23 VAL 9 2HG2 VAL 9 10.128 -0.050 5.107
81 H PHE 10 HN PHE 10 8.794 1.556 1.428
82 HA PHE 10 HA PHE 10 6.578 3.153 0.643
83 HB2 PHE 10 HB2 PHE 10 8.760 3.617 -0.204
84 HB3 PHE 10 HB1 PHE 10 8.987 1.958 -0.725
85 HD1 PHE 10 HD2 PHE 10 6.722 4.878 -1.333
86 HD2 PHE 10 HD1 PHE 10 8.680 1.425 -2.969
87 HE1 PHE 10 HE2 PHE 10 5.875 5.472 -3.588
88 HE2 PHE 10 HE1 PHE 10 7.831 2.018 -5.230
89 HZ PHE 10 HZ PHE 10 6.431 4.039 -5.536
90 H TRP 11 HN TRP 11 7.613 -0.080 -0.502
91 HA TRP 11 HA TRP 11 5.586 -0.517 -2.426
92 HB2 TRP 11 HB2 TRP 11 7.744 -1.937 -1.412
93 HB3 TRP 11 HB1 TRP 11 6.368 -2.915 -0.911
94 HD1 TRP 11 HD1 TRP 11 7.448 -1.036 -4.069
95 HE1 TRP 11 HE1 TRP 11 6.919 -2.492 -6.136
96 HE3 TRP 11 HE3 TRP 11 5.318 -5.050 -1.765
97 HZ2 TRP 11 HZ2 TRP 11 5.737 -5.039 -6.718
98 HZ3 TRP 11 HZ3 TRP 11 4.498 -6.974 -3.089
99 HH2 TRP 11 HH2 TRP 11 4.702 -6.977 -5.557
100 H ALA 12 HN ALA 12 5.647 -1.371 1.049
101 HA ALA 12 HA ALA 12 3.106 -2.635 1.122
102 HB1 ALA 12 HB1 ALA 12 4.602 -1.147 3.298
103 HB2 ALA 12 HB2 ALA 12 4.831 -2.843 2.868
104 HB3 ALA 12 HB3 ALA 12 3.302 -2.306 3.565
105 H LYS 13 HN LYS 13 3.968 0.810 1.272
106 HA LYS 13 HA LYS 13 1.451 1.771 2.305
107 HB2 LYS 13 HB2 LYS 13 3.824 2.907 1.958
108 HB3 LYS 13 HB1 LYS 13 3.174 3.327 0.375
109 HG2 LYS 13 HG2 LYS 13 1.580 3.893 2.869
110 HG3 LYS 13 HG1 LYS 13 2.851 4.999 2.351
111 HD2 LYS 13 HD2 LYS 13 1.618 4.769 0.004
112 HD3 LYS 13 HD1 LYS 13 0.249 4.345 1.027
113 HE2 LYS 13 HE2 LYS 13 -0.078 6.605 1.140
114 HE3 LYS 13 HE1 LYS 13 1.225 6.561 2.339
115 HZ1 LYS 13 HZ1 LYS 13 2.839 7.001 0.679
116 HZ2 LYS 13 HZ2 LYS 13 1.596 8.136 0.453
117 HZ3 LYS 13 HZ3 LYS 13 1.724 6.796 -0.583
118 H HIS 14 HN HIS 14 2.738 1.492 -1.030
119 HA HIS 14 HA HIS 14 0.301 2.243 -2.382
120 HB2 HIS 14 HB2 HIS 14 2.776 2.090 -3.211
121 HB3 HIS 14 HB1 HIS 14 2.432 0.384 -3.466
122 HD1 HIS 14 HD1 HIS 14 2.887 2.859 -5.633
123 HD2 HIS 14 HD2 HIS 14 -0.634 0.796 -4.784
124 HE1 HIS 14 HE1 HIS 14 1.396 3.131 -7.651
125 H MET 15 HN MET 15 1.681 -0.869 -1.328
126 HA MET 15 HA MET 15 -0.281 -2.619 -2.486
127 HB2 MET 15 HB2 MET 15 1.773 -2.726 -0.297
128 HB3 MET 15 HB1 MET 15 0.601 -4.031 -0.393
129 HG2 MET 15 HG2 MET 15 1.938 -3.228 -2.936
130 HG3 MET 15 HG1 MET 15 2.914 -4.084 -1.748
131 HE1 MET 15 HE1 MET 15 0.914 -4.342 -4.683
132 HE2 MET 15 HE2 MET 15 -0.551 -4.196 -3.718
133 HE3 MET 15 HE3 MET 15 -0.205 -5.710 -4.544
134 H TRP 16 HN TRP 16 -0.024 -1.239 0.845
135 HA TRP 16 HA TRP 16 -2.538 -2.306 1.730
136 HB2 TRP 16 HB2 TRP 16 -0.477 -1.131 3.003
137 HB3 TRP 16 HB1 TRP 16 -1.531 0.276 2.861
138 HD1 TRP 16 HD1 TRP 16 -2.585 0.496 5.187
139 HE1 TRP 16 HE1 TRP 16 -3.922 -1.059 6.744
140 HE3 TRP 16 HE3 TRP 16 -2.115 -3.885 2.640
141 HZ2 TRP 16 HZ2 TRP 16 -4.696 -3.824 6.885
142 HZ3 TRP 16 HZ3 TRP 16 -3.155 -5.968 3.496
143 HH2 TRP 16 HH2 TRP 16 -4.443 -5.942 5.612
144 H ASN 17 HN ASN 17 -1.681 0.583 -0.104
145 HA ASN 17 HA ASN 17 -4.170 1.991 0.172
146 HB2 ASN 17 HB2 ASN 17 -1.987 2.905 -0.708
147 HB3 ASN 17 HB1 ASN 17 -2.217 1.931 -2.160
148 HD21 ASN 17 1HD2 ASN 17 -3.758 2.685 -3.746
149 HD22 ASN 17 2HD2 ASN 17 -4.576 4.164 -3.576
150 H PHE 18 HN PHE 18 -3.012 -0.598 -1.979
151 HA PHE 18 HA PHE 18 -5.195 -0.699 -3.837
152 HB2 PHE 18 HB2 PHE 18 -2.980 -1.841 -4.100
153 HB3 PHE 18 HB1 PHE 18 -3.369 -2.870 -2.732
154 HD1 PHE 18 HD2 PHE 18 -4.644 -1.900 -6.120
155 HD2 PHE 18 HD1 PHE 18 -4.524 -4.873 -3.021
156 HE1 PHE 18 HE2 PHE 18 -5.834 -3.494 -7.601
157 HE2 PHE 18 HE1 PHE 18 -5.714 -6.466 -4.501
158 HZ PHE 18 HZ PHE 18 -6.369 -5.776 -6.793
159 H ILE 19 HN ILE 19 -4.569 -2.227 -0.690
160 HA ILE 19 HA ILE 19 -7.020 -3.762 -0.539
161 HB ILE 19 HB ILE 19 -4.759 -2.943 1.279
162 HG12 ILE 19 2HG1 ILE 19 -5.237 -5.649 1.532
163 HG13 ILE 19 1HG1 ILE 19 -5.722 -5.336 -0.130
164 HG21 ILE 19 1HG2 ILE 19 -5.891 -4.368 3.088
165 HG22 ILE 19 2HG2 ILE 19 -7.393 -4.093 2.205
166 HG23 ILE 19 3HG2 ILE 19 -6.499 -2.727 2.873
167 HD11 ILE 19 3HD1 ILE 19 -3.596 -4.654 -0.766
168 HD12 ILE 19 1HD1 ILE 19 -3.212 -5.892 0.428
169 HD13 ILE 19 2HD1 ILE 19 -3.140 -4.187 0.872
170 H SER 20 HN SER 20 -5.958 -0.575 0.697
171 HA SER 20 HA SER 20 -8.343 0.150 2.108
172 HB2 SER 20 HB2 SER 20 -6.217 1.787 0.684
173 HB3 SER 20 HB1 SER 20 -7.466 2.483 1.706
174 HG SER 20 HG SER 20 -5.232 0.923 2.349
175 H GLY 21 HN GLY 21 -7.382 0.579 -1.318
176 HA2 GLY 21 HA2 GLY 21 -9.591 2.161 -2.161
177 HA3 GLY 21 HA1 GLY 21 -8.629 1.116 -3.213
178 H ILE 22 HN ILE 22 -9.100 -1.392 -2.247
179 HA ILE 22 HA ILE 22 -11.674 -2.088 -3.287
180 HB ILE 22 HB ILE 22 -9.585 -3.528 -1.635
181 HG12 ILE 22 2HG1 ILE 22 -10.490 -4.071 -4.468
182 HG13 ILE 22 1HG1 ILE 22 -9.269 -2.855 -4.107
183 HG21 ILE 22 1HG2 ILE 22 -11.456 -4.792 -1.022
184 HG22 ILE 22 2HG2 ILE 22 -10.919 -5.623 -2.480
185 HG23 ILE 22 3HG2 ILE 22 -12.281 -4.506 -2.553
186 HD11 ILE 22 3HD1 ILE 22 -8.870 -5.529 -2.862
187 HD12 ILE 22 1HD1 ILE 22 -7.688 -4.407 -3.537
188 HD13 ILE 22 2HD1 ILE 22 -8.646 -5.430 -4.608
189 H GLN 23 HN GLN 23 -10.532 -1.580 0.050
190 HA GLN 23 HA GLN 23 -12.830 -2.477 1.459
191 HB2 GLN 23 HB2 GLN 23 -10.352 -1.389 2.060
192 HB3 GLN 23 HB1 GLN 23 -11.467 -0.155 2.626
193 HG2 GLN 23 HG2 GLN 23 -11.555 -1.434 4.500
194 HG3 GLN 23 HG1 GLN 23 -12.694 -2.405 3.572
195 HE21 GLN 23 1HE2 GLN 23 -9.130 -2.145 4.162
196 HE22 GLN 23 2HE2 GLN 23 -8.846 -3.814 4.036
197 H TYR 24 HN TYR 24 -12.258 0.466 -0.285
198 HA TYR 24 HA TYR 24 -14.681 1.818 0.774
199 HB2 TYR 24 HB2 TYR 24 -12.710 3.176 0.551
200 HB3 TYR 24 HB1 TYR 24 -12.394 2.572 -1.072
201 HD1 TYR 24 HD1 TYR 24 -14.796 4.576 0.957
202 HD2 TYR 24 HD2 TYR 24 -13.361 3.604 -2.970
203 HE1 TYR 24 HE1 TYR 24 -16.154 6.420 0.004
204 HE2 TYR 24 HE2 TYR 24 -14.716 5.448 -3.926
205 HH TYR 24 HH TYR 24 -17.135 6.725 -2.799
206 H LEU 25 HN LEU 25 -13.322 0.678 -2.332
207 HA LEU 25 HA LEU 25 -15.630 1.233 -3.934
208 HB2 LEU 25 HB2 LEU 25 -13.023 -0.031 -4.201
209 HB3 LEU 25 HB1 LEU 25 -14.255 -0.883 -5.119
210 HG LEU 25 HG LEU 25 -14.861 1.734 -5.698
211 HD11 LEU 25 1HD1 LEU 25 -11.842 1.502 -5.536
212 HD12 LEU 25 2HD1 LEU 25 -12.848 2.526 -4.515
213 HD13 LEU 25 3HD1 LEU 25 -12.734 2.849 -6.243
214 HD21 LEU 25 3HD2 LEU 25 -13.737 1.291 -7.873
215 HD22 LEU 25 1HD2 LEU 25 -14.681 -0.096 -7.331
216 HD23 LEU 25 2HD2 LEU 25 -12.925 -0.100 -7.156
217 H ALA 26 HN ALA 26 -14.952 -1.511 -1.856
218 HA ALA 26 HA ALA 26 -16.426 -3.626 -2.865
219 HB1 ALA 26 HB1 ALA 26 -16.288 -2.509 -0.058
220 HB2 ALA 26 HB2 ALA 26 -15.271 -3.765 -0.764
221 HB3 ALA 26 HB3 ALA 26 -16.972 -4.090 -0.436
222 H GLY 27 HN GLY 27 -17.669 -0.754 -1.302
223 HA2 GLY 27 HA2 GLY 27 -20.047 -0.337 -2.624
224 HA3 GLY 27 HA1 GLY 27 -20.487 -1.466 -1.330
225 H LEU 28 HN LEU 28 -18.137 1.248 -1.440
226 HA LEU 28 HA LEU 28 -17.795 3.041 -0.015
227 HB2 LEU 28 HB2 LEU 28 -20.242 3.267 -1.036
228 HB3 LEU 28 HB1 LEU 28 -20.717 3.045 0.648
229 HG LEU 28 HG LEU 28 -18.841 4.867 1.081
230 HD11 LEU 28 1HD1 LEU 28 -18.698 6.500 -0.728
231 HD12 LEU 28 2HD1 LEU 28 -19.752 5.512 -1.740
232 HD13 LEU 28 3HD1 LEU 28 -18.143 4.930 -1.308
233 HD21 LEU 28 3HD2 LEU 28 -20.596 6.593 0.951
234 HD22 LEU 28 1HD2 LEU 28 -21.253 5.092 1.601
235 HD23 LEU 28 2HD2 LEU 28 -21.568 5.539 -0.075
236 H SER 29 HN SER 29 -17.365 0.470 1.178
237 HA SER 29 HA SER 29 -18.664 0.372 3.798
238 HB2 SER 29 HB2 SER 29 -16.191 -1.110 2.871
239 HB3 SER 29 HB1 SER 29 -17.296 -1.565 4.151
240 HG SER 29 HG SER 29 -17.975 -2.719 2.420
241 H THR 30 HN THR 30 -15.260 0.981 2.793
242 HA THR 30 HA THR 30 -14.966 2.874 5.052
243 HB THR 30 HB THR 30 -13.099 0.514 4.599
244 HG1 THR 30 HG1 THR 30 -15.023 0.974 6.643
245 HG21 THR 30 3HG2 THR 30 -11.867 2.321 5.528
246 HG22 THR 30 1HG2 THR 30 -12.246 1.246 6.873
247 HG23 THR 30 2HG2 THR 30 -13.169 2.731 6.644
Start of MODEL 29
1 H1 GLN 1 HT1 GLN 1 -24.002 2.441 0.434
2 H2 GLN 1 HT2 GLN 1 -23.519 3.186 1.878
3 H3 GLN 1 HT3 GLN 1 -23.792 1.508 1.830
4 HA GLN 1 HA GLN 1 -21.633 2.927 0.335
5 HB2 GLN 1 HB2 GLN 1 -21.754 2.593 3.013
6 HB3 GLN 1 HB1 GLN 1 -21.111 1.018 2.560
7 HG2 GLN 1 HG2 GLN 1 -19.077 1.890 2.173
8 HG3 GLN 1 HG1 GLN 1 -19.744 3.103 1.086
9 HE21 GLN 1 1HE2 GLN 1 -19.990 5.263 1.905
10 HE22 GLN 1 2HE2 GLN 1 -19.566 5.700 3.491
11 H THR 2 HN THR 2 -20.017 1.367 -0.443
12 HA THR 2 HA THR 2 -20.958 -1.384 -0.984
13 HB THR 2 HB THR 2 -21.922 -0.212 -2.799
14 HG1 THR 2 HG1 THR 2 -21.033 -1.787 -3.866
15 HG21 THR 2 3HG2 THR 2 -19.406 1.423 -2.840
16 HG22 THR 2 1HG2 THR 2 -21.087 1.959 -2.823
17 HG23 THR 2 2HG2 THR 2 -20.395 1.276 -4.292
18 H ASN 3 HN ASN 3 -18.520 -0.506 -3.094
19 HA ASN 3 HA ASN 3 -16.528 -2.057 -1.679
20 HB2 ASN 3 HB2 ASN 3 -16.715 -0.590 -4.257
21 HB3 ASN 3 HB1 ASN 3 -15.096 -0.916 -3.641
22 HD21 ASN 3 1HD2 ASN 3 -14.398 -3.181 -3.501
23 HD22 ASN 3 2HD2 ASN 3 -15.307 -4.420 -4.218
24 H TRP 4 HN TRP 4 -17.379 1.215 -1.319
25 HA TRP 4 HA TRP 4 -14.839 2.423 -0.760
26 HB2 TRP 4 HB2 TRP 4 -17.725 2.965 -0.188
27 HB3 TRP 4 HB1 TRP 4 -16.543 3.813 0.801
28 HD1 TRP 4 HD1 TRP 4 -18.178 3.905 -2.526
29 HE1 TRP 4 HE1 TRP 4 -17.098 5.721 -4.007
30 HE3 TRP 4 HE3 TRP 4 -14.028 4.978 0.259
31 HZ2 TRP 4 HZ2 TRP 4 -14.784 7.404 -4.012
32 HZ3 TRP 4 HZ3 TRP 4 -12.411 6.686 -0.506
33 HH2 TRP 4 HH2 TRP 4 -12.779 7.899 -2.632
34 H GLN 5 HN GLN 5 -17.207 0.729 1.315
35 HA GLN 5 HA GLN 5 -15.912 1.027 3.834
36 HB2 GLN 5 HB2 GLN 5 -17.828 -0.900 2.569
37 HB3 GLN 5 HB1 GLN 5 -17.068 -1.391 4.079
38 HG2 GLN 5 HG2 GLN 5 -17.895 1.308 4.426
39 HG3 GLN 5 HG1 GLN 5 -19.241 0.449 3.682
40 HE21 GLN 5 1HE2 GLN 5 -20.642 -0.334 5.303
41 HE22 GLN 5 2HE2 GLN 5 -20.122 -0.965 6.788
42 H LYS 6 HN LYS 6 -15.480 -1.443 1.269
43 HA LYS 6 HA LYS 6 -13.323 -2.805 2.731
44 HB2 LYS 6 HB2 LYS 6 -15.106 -3.760 1.076
45 HB3 LYS 6 HB1 LYS 6 -14.001 -3.191 -0.179
46 HG2 LYS 6 HG2 LYS 6 -12.209 -4.553 0.658
47 HG3 LYS 6 HG1 LYS 6 -13.113 -4.947 2.119
48 HD2 LYS 6 HD2 LYS 6 -14.876 -5.954 0.498
49 HD3 LYS 6 HD1 LYS 6 -13.572 -5.928 -0.691
50 HE2 LYS 6 HE2 LYS 6 -12.292 -7.027 1.481
51 HE3 LYS 6 HE1 LYS 6 -13.927 -7.690 1.653
52 HZ1 LYS 6 HZ1 LYS 6 -13.870 -8.368 -0.671
53 HZ2 LYS 6 HZ2 LYS 6 -12.590 -9.072 0.193
54 HZ3 LYS 6 HZ3 LYS 6 -12.297 -7.754 -0.837
55 H LEU 7 HN LEU 7 -13.547 -0.189 0.412
56 HA LEU 7 HA LEU 7 -11.021 -0.318 -0.859
57 HB2 LEU 7 HB2 LEU 7 -12.795 1.148 -1.621
58 HB3 LEU 7 HB1 LEU 7 -12.807 2.008 -0.089
59 HG LEU 7 HG LEU 7 -10.202 1.957 -1.519
60 HD11 LEU 7 1HD1 LEU 7 -11.061 4.004 -2.861
61 HD12 LEU 7 2HD1 LEU 7 -12.663 3.311 -2.614
62 HD13 LEU 7 3HD1 LEU 7 -11.425 2.394 -3.477
63 HD21 LEU 7 3HD2 LEU 7 -11.680 4.363 -0.465
64 HD22 LEU 7 1HD2 LEU 7 -9.943 4.081 -0.551
65 HD23 LEU 7 2HD2 LEU 7 -10.915 3.238 0.656
66 H GLU 8 HN GLU 8 -11.901 1.155 2.329
67 HA GLU 8 HA GLU 8 -9.406 2.438 2.827
68 HB2 GLU 8 HB2 GLU 8 -11.693 1.399 4.434
69 HB3 GLU 8 HB1 GLU 8 -10.190 1.688 5.309
70 HG2 GLU 8 HG2 GLU 8 -10.490 3.931 3.640
71 HG3 GLU 8 HG1 GLU 8 -12.100 3.615 4.278
72 H VAL 9 HN VAL 9 -10.435 -0.848 3.821
73 HA VAL 9 HA VAL 9 -7.920 -1.705 4.888
74 HB VAL 9 HB VAL 9 -10.297 -3.170 3.677
75 HG11 VAL 9 1HG1 VAL 9 -8.751 -4.887 3.534
76 HG12 VAL 9 2HG1 VAL 9 -9.228 -5.069 5.222
77 HG13 VAL 9 3HG1 VAL 9 -7.734 -4.226 4.813
78 HG21 VAL 9 3HG2 VAL 9 -10.710 -1.896 5.757
79 HG22 VAL 9 1HG2 VAL 9 -9.388 -2.763 6.543
80 HG23 VAL 9 2HG2 VAL 9 -10.835 -3.633 6.028
81 H PHE 10 HN PHE 10 -9.351 -1.956 1.639
82 HA PHE 10 HA PHE 10 -7.292 -3.424 0.312
83 HB2 PHE 10 HB2 PHE 10 -9.420 -3.176 -0.739
84 HB3 PHE 10 HB1 PHE 10 -9.432 -1.448 -0.460
85 HD1 PHE 10 HD1 PHE 10 -7.387 -4.029 -2.263
86 HD2 PHE 10 HD2 PHE 10 -8.943 -0.029 -2.217
87 HE1 PHE 10 HE1 PHE 10 -6.433 -3.635 -4.522
88 HE2 PHE 10 HE2 PHE 10 -7.992 0.368 -4.477
89 HZ PHE 10 HZ PHE 10 -6.737 -1.435 -5.627
90 H TRP 11 HN TRP 11 -7.876 0.068 0.572
91 HA TRP 11 HA TRP 11 -5.730 1.132 -0.879
92 HB2 TRP 11 HB2 TRP 11 -7.835 2.174 0.279
93 HB3 TRP 11 HB1 TRP 11 -6.748 2.409 1.643
94 HD1 TRP 11 HD1 TRP 11 -6.981 3.186 -2.099
95 HE1 TRP 11 HE1 TRP 11 -5.764 5.415 -2.563
96 HE3 TRP 11 HE3 TRP 11 -5.132 4.151 2.556
97 HZ2 TRP 11 HZ2 TRP 11 -4.219 7.341 -1.144
98 HZ3 TRP 11 HZ3 TRP 11 -3.790 6.187 2.976
99 HH2 TRP 11 HH2 TRP 11 -3.327 7.785 1.140
100 H ALA 12 HN ALA 12 -5.842 0.577 2.689
101 HA ALA 12 HA ALA 12 -3.197 1.428 3.253
102 HB1 ALA 12 HB1 ALA 12 -5.022 0.945 4.907
103 HB2 ALA 12 HB2 ALA 12 -3.478 0.209 5.339
104 HB3 ALA 12 HB3 ALA 12 -4.754 -0.778 4.630
105 H LYS 13 HN LYS 13 -4.376 -1.816 2.315
106 HA LYS 13 HA LYS 13 -1.902 -3.235 2.603
107 HB2 LYS 13 HB2 LYS 13 -4.246 -4.156 2.315
108 HB3 LYS 13 HB1 LYS 13 -4.146 -3.717 0.611
109 HG2 LYS 13 HG2 LYS 13 -1.771 -5.162 1.272
110 HG3 LYS 13 HG1 LYS 13 -3.142 -6.073 1.899
111 HD2 LYS 13 HD2 LYS 13 -3.279 -4.955 -0.884
112 HD3 LYS 13 HD1 LYS 13 -2.350 -6.423 -0.591
113 HE2 LYS 13 HE2 LYS 13 -5.099 -6.311 0.581
114 HE3 LYS 13 HE1 LYS 13 -4.969 -6.522 -1.172
115 HZ1 LYS 13 HZ1 LYS 13 -4.897 -8.632 0.160
116 HZ2 LYS 13 HZ2 LYS 13 -3.388 -8.138 0.756
117 HZ3 LYS 13 HZ3 LYS 13 -3.604 -8.417 -0.908
118 H HIS 14 HN HIS 14 -3.369 -1.522 -0.160
119 HA HIS 14 HA HIS 14 -1.230 -2.038 -2.045
120 HB2 HIS 14 HB2 HIS 14 -3.752 -1.267 -2.299
121 HB3 HIS 14 HB1 HIS 14 -3.061 0.347 -2.160
122 HD1 HIS 14 HD1 HIS 14 -3.972 -1.969 -4.661
123 HD2 HIS 14 HD2 HIS 14 -0.628 0.461 -4.112
124 HE1 HIS 14 HE1 HIS 14 -2.869 -1.747 -6.930
125 H MET 15 HN MET 15 -2.067 0.717 0.068
126 HA MET 15 HA MET 15 0.064 2.474 -0.687
127 HB2 MET 15 HB2 MET 15 -2.068 2.340 1.265
128 HB3 MET 15 HB1 MET 15 -0.597 2.880 2.056
129 HG2 MET 15 HG2 MET 15 -1.228 4.118 -0.582
130 HG3 MET 15 HG1 MET 15 -2.246 4.570 0.781
131 HE1 MET 15 HE1 MET 15 1.490 3.960 -0.242
132 HE2 MET 15 HE2 MET 15 2.098 5.600 -0.057
133 HE3 MET 15 HE3 MET 15 0.774 5.289 -1.173
134 H TRP 16 HN TRP 16 -0.149 0.092 2.015
135 HA TRP 16 HA TRP 16 2.481 0.569 3.025
136 HB2 TRP 16 HB2 TRP 16 0.351 -0.946 3.811
137 HB3 TRP 16 HB1 TRP 16 1.419 -2.201 3.189
138 HD1 TRP 16 HD1 TRP 16 2.423 -3.214 5.299
139 HE1 TRP 16 HE1 TRP 16 3.750 -2.313 7.322
140 HE3 TRP 16 HE3 TRP 16 2.019 1.779 4.435
141 HZ2 TRP 16 HZ2 TRP 16 4.537 0.218 8.422
142 HZ3 TRP 16 HZ3 TRP 16 3.059 3.422 5.974
143 HH2 TRP 16 HH2 TRP 16 4.317 2.649 7.964
144 H ASN 17 HN ASN 17 1.329 -1.431 0.330
145 HA ASN 17 HA ASN 17 3.727 -2.937 -0.100
146 HB2 ASN 17 HB2 ASN 17 1.456 -3.345 -1.145
147 HB3 ASN 17 HB1 ASN 17 1.687 -1.896 -2.107
148 HD21 ASN 17 1HD2 ASN 17 1.480 -4.903 -2.861
149 HD22 ASN 17 2HD2 ASN 17 2.832 -5.148 -3.856
150 H PHE 18 HN PHE 18 2.586 0.237 -1.282
151 HA PHE 18 HA PHE 18 4.787 0.912 -2.968
152 HB2 PHE 18 HB2 PHE 18 2.531 2.094 -2.708
153 HB3 PHE 18 HB1 PHE 18 3.145 2.770 -1.205
154 HD1 PHE 18 HD1 PHE 18 3.771 2.602 -4.876
155 HD2 PHE 18 HD2 PHE 18 4.631 4.623 -1.185
156 HE1 PHE 18 HE1 PHE 18 4.927 4.401 -6.131
157 HE2 PHE 18 HE2 PHE 18 5.787 6.424 -2.441
158 HZ PHE 18 HZ PHE 18 5.936 6.312 -4.914
159 H ILE 19 HN ILE 19 4.192 1.442 0.509
160 HA ILE 19 HA ILE 19 6.677 2.759 1.111
161 HB ILE 19 HB ILE 19 4.440 1.414 2.603
162 HG12 ILE 19 2HG1 ILE 19 5.256 4.096 3.387
163 HG13 ILE 19 1HG1 ILE 19 4.992 3.984 1.650
164 HG21 ILE 19 1HG2 ILE 19 5.679 2.451 4.704
165 HG22 ILE 19 2HG2 ILE 19 7.120 2.094 3.752
166 HG23 ILE 19 3HG2 ILE 19 6.006 0.800 4.183
167 HD11 ILE 19 3HD1 ILE 19 2.839 2.589 2.625
168 HD12 ILE 19 1HD1 ILE 19 2.813 4.292 2.170
169 HD13 ILE 19 2HD1 ILE 19 3.054 3.832 3.855
170 H SER 20 HN SER 20 5.674 -0.690 1.308
171 HA SER 20 HA SER 20 8.149 -1.679 2.398
172 HB2 SER 20 HB2 SER 20 5.771 -2.748 2.170
173 HB3 SER 20 HB1 SER 20 6.317 -3.227 0.569
174 HG SER 20 HG SER 20 6.725 -4.777 2.282
175 H GLY 21 HN GLY 21 6.959 -1.416 -0.984
176 HA2 GLY 21 HA2 GLY 21 9.251 -2.559 -2.251
177 HA3 GLY 21 HA1 GLY 21 8.090 -1.475 -3.025
178 H ILE 22 HN ILE 22 8.371 0.838 -1.538
179 HA ILE 22 HA ILE 22 10.746 2.031 -2.628
180 HB ILE 22 HB ILE 22 8.654 2.855 -0.609
181 HG12 ILE 22 2HG1 ILE 22 8.122 2.671 -3.064
182 HG13 ILE 22 1HG1 ILE 22 7.836 4.256 -2.367
183 HG21 ILE 22 1HG2 ILE 22 10.352 4.203 0.205
184 HG22 ILE 22 2HG2 ILE 22 9.653 5.235 -1.042
185 HG23 ILE 22 3HG2 ILE 22 11.143 4.349 -1.365
186 HD11 ILE 22 3HD1 ILE 22 9.360 5.234 -3.728
187 HD12 ILE 22 1HD1 ILE 22 9.285 3.745 -4.668
188 HD13 ILE 22 2HD1 ILE 22 10.549 3.962 -3.459
189 H GLN 23 HN GLN 23 9.928 0.926 0.680
190 HA GLN 23 HA GLN 23 12.311 1.709 2.008
191 HB2 GLN 23 HB2 GLN 23 10.031 0.717 2.835
192 HB3 GLN 23 HB1 GLN 23 10.839 -0.833 2.639
193 HG2 GLN 23 HG2 GLN 23 11.679 -0.529 4.693
194 HG3 GLN 23 HG1 GLN 23 12.691 0.754 4.024
195 HE21 GLN 23 1HE2 GLN 23 12.433 2.712 5.163
196 HE22 GLN 23 2HE2 GLN 23 10.998 3.203 5.919
197 H TYR 24 HN TYR 24 11.565 -1.204 0.178
198 HA TYR 24 HA TYR 24 13.899 -2.754 0.730
199 HB2 TYR 24 HB2 TYR 24 11.766 -3.498 -0.409
200 HB3 TYR 24 HB1 TYR 24 12.291 -2.627 -1.846
201 HD1 TYR 24 HD2 TYR 24 12.933 -5.511 0.347
202 HD2 TYR 24 HD1 TYR 24 14.163 -3.435 -3.208
203 HE1 TYR 24 HE2 TYR 24 14.295 -7.471 -0.328
204 HE2 TYR 24 HE1 TYR 24 15.523 -5.394 -3.881
205 HH TYR 24 HH TYR 24 16.656 -7.501 -2.230
206 H LEU 25 HN LEU 25 13.190 -0.509 -1.973
207 HA LEU 25 HA LEU 25 15.848 -0.630 -3.116
208 HB2 LEU 25 HB2 LEU 25 13.344 0.965 -3.445
209 HB3 LEU 25 HB1 LEU 25 14.830 1.672 -4.072
210 HG LEU 25 HG LEU 25 15.135 -0.814 -5.048
211 HD11 LEU 25 1HD1 LEU 25 13.055 -1.676 -4.096
212 HD12 LEU 25 2HD1 LEU 25 12.942 -1.641 -5.854
213 HD13 LEU 25 3HD1 LEU 25 12.135 -0.401 -4.896
214 HD21 LEU 25 3HD2 LEU 25 13.291 1.213 -6.357
215 HD22 LEU 25 1HD2 LEU 25 14.322 0.032 -7.166
216 HD23 LEU 25 2HD2 LEU 25 15.045 1.384 -6.296
217 H ALA 26 HN ALA 26 14.233 1.698 -0.938
218 HA ALA 26 HA ALA 26 16.324 3.616 -0.716
219 HB1 ALA 26 HB1 ALA 26 14.048 3.972 0.087
220 HB2 ALA 26 HB2 ALA 26 15.180 4.180 1.423
221 HB3 ALA 26 HB3 ALA 26 14.241 2.692 1.287
222 H GLY 27 HN GLY 27 15.870 0.497 0.935
223 HA2 GLY 27 HA2 GLY 27 18.204 0.942 2.679
224 HA3 GLY 27 HA1 GLY 27 17.111 -0.436 2.731
225 H LEU 28 HN LEU 28 17.392 -0.861 -0.279
226 HA LEU 28 HA LEU 28 20.009 -2.282 -0.155
227 HB2 LEU 28 HB2 LEU 28 17.594 -3.246 -0.627
228 HB3 LEU 28 HB1 LEU 28 17.927 -2.690 -2.263
229 HG LEU 28 HG LEU 28 20.281 -3.997 -1.448
230 HD11 LEU 28 1HD1 LEU 28 19.355 -6.272 -0.870
231 HD12 LEU 28 2HD1 LEU 28 17.789 -5.502 -0.610
232 HD13 LEU 28 3HD1 LEU 28 19.166 -5.065 0.402
233 HD21 LEU 28 3HD2 LEU 28 19.098 -3.936 -3.704
234 HD22 LEU 28 1HD2 LEU 28 18.033 -5.202 -3.090
235 HD23 LEU 28 2HD2 LEU 28 19.764 -5.503 -3.248
236 H SER 29 HN SER 29 19.754 0.679 -0.874
237 HA SER 29 HA SER 29 20.383 0.744 -3.755
238 HB2 SER 29 HB2 SER 29 20.570 3.236 -3.226
239 HB3 SER 29 HB1 SER 29 19.000 2.501 -2.964
240 HG SER 29 HG SER 29 21.015 3.132 -1.049
241 H THR 30 HN THR 30 22.446 0.676 -4.531
242 HA THR 30 HA THR 30 24.727 1.169 -2.653
243 HB THR 30 HB THR 30 25.893 -0.514 -4.210
244 HG1 THR 30 HG1 THR 30 24.314 -0.503 -5.847
245 HG21 THR 30 3HG2 THR 30 23.647 -1.256 -2.342
246 HG22 THR 30 1HG2 THR 30 25.378 -1.208 -2.007
247 HG23 THR 30 2HG2 THR 30 24.717 -2.461 -3.058
Start of MODEL 30
1 H1 GLN 1 HT1 GLN 1 23.023 0.957 -1.093
2 H2 GLN 1 HT2 GLN 1 23.146 -0.609 -0.460
3 H3 GLN 1 HT3 GLN 1 23.612 0.732 0.476
4 HA GLN 1 HA GLN 1 20.825 0.186 -0.451
5 HB2 GLN 1 HB2 GLN 1 22.322 -0.307 2.130
6 HB3 GLN 1 HB1 GLN 1 20.566 -0.186 2.089
7 HG2 GLN 1 HG2 GLN 1 20.875 -1.942 0.087
8 HG3 GLN 1 HG1 GLN 1 22.344 -2.316 0.986
9 HE21 GLN 1 1HE2 GLN 1 22.045 -3.025 3.311
10 HE22 GLN 1 2HE2 GLN 1 20.566 -3.717 3.771
11 H THR 2 HN THR 2 19.310 1.724 0.247
12 HA THR 2 HA THR 2 19.988 4.021 1.879
13 HB THR 2 HB THR 2 21.237 4.700 -0.021
14 HG1 THR 2 HG1 THR 2 20.315 6.575 -0.439
15 HG21 THR 2 3HG2 THR 2 19.900 4.909 -2.302
16 HG22 THR 2 1HG2 THR 2 18.993 3.557 -1.624
17 HG23 THR 2 2HG2 THR 2 20.734 3.420 -1.864
18 H ASN 3 HN ASN 3 17.883 5.048 -0.464
19 HA ASN 3 HA ASN 3 15.544 4.966 1.199
20 HB2 ASN 3 HB2 ASN 3 14.473 6.053 -0.677
21 HB3 ASN 3 HB1 ASN 3 16.092 6.711 -0.487
22 HD21 ASN 3 1HD2 ASN 3 14.145 6.175 -2.945
23 HD22 ASN 3 2HD2 ASN 3 15.191 5.487 -4.089
24 H TRP 4 HN TRP 4 16.791 2.646 -1.023
25 HA TRP 4 HA TRP 4 14.430 1.359 -1.954
26 HB2 TRP 4 HB2 TRP 4 17.289 0.604 -1.487
27 HB3 TRP 4 HB1 TRP 4 16.137 -0.705 -1.740
28 HD1 TRP 4 HD1 TRP 4 18.145 1.810 -3.560
29 HE1 TRP 4 HE1 TRP 4 17.516 1.831 -6.058
30 HE3 TRP 4 HE3 TRP 4 13.873 -0.997 -3.423
31 HZ2 TRP 4 HZ2 TRP 4 15.469 0.795 -7.777
32 HZ3 TRP 4 HZ3 TRP 4 12.611 -1.461 -5.498
33 HH2 TRP 4 HH2 TRP 4 13.399 -0.572 -7.671
34 H GLN 5 HN GLN 5 16.312 0.847 1.032
35 HA GLN 5 HA GLN 5 14.817 -1.303 2.161
36 HB2 GLN 5 HB2 GLN 5 16.638 0.866 3.106
37 HB3 GLN 5 HB1 GLN 5 15.601 0.145 4.334
38 HG2 GLN 5 HG2 GLN 5 16.439 -2.119 3.190
39 HG3 GLN 5 HG1 GLN 5 17.809 -1.098 2.755
40 HE21 GLN 5 1HE2 GLN 5 19.256 -0.422 4.472
41 HE22 GLN 5 2HE2 GLN 5 19.079 -0.974 6.066
42 H LYS 6 HN LYS 6 14.390 2.239 2.381
43 HA LYS 6 HA LYS 6 12.022 2.135 4.048
44 HB2 LYS 6 HB2 LYS 6 13.431 4.218 2.375
45 HB3 LYS 6 HB1 LYS 6 11.887 4.577 3.147
46 HG2 LYS 6 HG2 LYS 6 12.744 4.298 5.313
47 HG3 LYS 6 HG1 LYS 6 14.125 3.361 4.752
48 HD2 LYS 6 HD2 LYS 6 14.979 5.442 3.612
49 HD3 LYS 6 HD1 LYS 6 13.676 6.336 4.391
50 HE2 LYS 6 HE2 LYS 6 15.233 6.649 6.043
51 HE3 LYS 6 HE1 LYS 6 14.727 5.032 6.554
52 HZ1 LYS 6 HZ1 LYS 6 16.455 4.108 5.054
53 HZ2 LYS 6 HZ2 LYS 6 17.098 5.055 6.305
54 HZ3 LYS 6 HZ3 LYS 6 16.988 5.684 4.735
55 H LEU 7 HN LEU 7 12.565 2.206 0.513
56 HA LEU 7 HA LEU 7 9.834 2.682 -0.244
57 HB2 LEU 7 HB2 LEU 7 11.989 2.837 -1.649
58 HB3 LEU 7 HB1 LEU 7 11.881 1.084 -1.803
59 HG LEU 7 HG LEU 7 9.334 1.759 -2.443
60 HD11 LEU 7 1HD1 LEU 7 9.259 3.743 -3.774
61 HD12 LEU 7 2HD1 LEU 7 11.003 3.973 -3.651
62 HD13 LEU 7 3HD1 LEU 7 9.980 4.201 -2.232
63 HD21 LEU 7 3HD2 LEU 7 11.559 0.705 -3.747
64 HD22 LEU 7 1HD2 LEU 7 11.086 2.059 -4.774
65 HD23 LEU 7 2HD2 LEU 7 9.925 0.788 -4.398
66 H GLU 8 HN GLU 8 11.646 -0.285 0.551
67 HA GLU 8 HA GLU 8 9.638 -2.172 -0.301
68 HB2 GLU 8 HB2 GLU 8 12.205 -2.136 1.085
69 HB3 GLU 8 HB1 GLU 8 11.094 -3.257 1.867
70 HG2 GLU 8 HG2 GLU 8 11.955 -4.651 0.251
71 HG3 GLU 8 HG1 GLU 8 10.595 -3.981 -0.642
72 H VAL 9 HN VAL 9 10.358 -0.610 2.831
73 HA VAL 9 HA VAL 9 8.230 -1.824 4.354
74 HB VAL 9 HB VAL 9 9.733 0.822 4.616
75 HG11 VAL 9 1HG1 VAL 9 8.129 -0.623 6.749
76 HG12 VAL 9 2HG1 VAL 9 7.576 0.815 5.891
77 HG13 VAL 9 3HG1 VAL 9 8.999 0.900 6.929
78 HG21 VAL 9 3HG2 VAL 9 10.110 -1.787 6.115
79 HG22 VAL 9 1HG2 VAL 9 11.114 -0.344 6.233
80 HG23 VAL 9 2HG2 VAL 9 11.098 -1.286 4.744
81 H PHE 10 HN PHE 10 8.565 1.223 2.547
82 HA PHE 10 HA PHE 10 5.975 2.343 2.896
83 HB2 PHE 10 HB2 PHE 10 7.688 3.699 1.960
84 HB3 PHE 10 HB1 PHE 10 8.166 2.450 0.832
85 HD1 PHE 10 HD1 PHE 10 5.216 4.636 1.630
86 HD2 PHE 10 HD2 PHE 10 7.498 2.592 -1.381
87 HE1 PHE 10 HE1 PHE 10 3.798 5.652 -0.134
88 HE2 PHE 10 HE2 PHE 10 6.080 3.610 -3.147
89 HZ PHE 10 HZ PHE 10 4.232 5.137 -2.522
90 H TRP 11 HN TRP 11 7.264 0.121 0.423
91 HA TRP 11 HA TRP 11 5.082 -0.166 -1.301
92 HB2 TRP 11 HB2 TRP 11 7.567 -1.381 -0.909
93 HB3 TRP 11 HB1 TRP 11 6.423 -2.697 -0.737
94 HD1 TRP 11 HD1 TRP 11 8.490 -2.144 -3.129
95 HE1 TRP 11 HE1 TRP 11 7.595 -2.139 -5.556
96 HE3 TRP 11 HE3 TRP 11 3.540 -1.285 -2.239
97 HZ2 TRP 11 HZ2 TRP 11 5.096 -1.812 -6.920
98 HZ3 TRP 11 HZ3 TRP 11 1.932 -1.134 -4.097
99 HH2 TRP 11 HH2 TRP 11 2.695 -1.395 -6.440
100 H ALA 12 HN ALA 12 5.806 -2.191 1.611
101 HA ALA 12 HA ALA 12 3.509 -3.827 1.373
102 HB1 ALA 12 HB1 ALA 12 5.234 -4.481 2.907
103 HB2 ALA 12 HB2 ALA 12 3.827 -4.120 3.908
104 HB3 ALA 12 HB3 ALA 12 5.137 -2.947 3.776
105 H LYS 13 HN LYS 13 3.959 -0.718 3.057
106 HA LYS 13 HA LYS 13 1.310 -0.496 4.180
107 HB2 LYS 13 HB2 LYS 13 3.728 1.141 3.827
108 HB3 LYS 13 HB1 LYS 13 2.254 2.089 3.667
109 HG2 LYS 13 HG2 LYS 13 2.759 2.153 5.974
110 HG3 LYS 13 HG1 LYS 13 1.467 0.963 5.829
111 HD2 LYS 13 HD2 LYS 13 3.972 -0.384 5.461
112 HD3 LYS 13 HD1 LYS 13 4.082 0.598 6.917
113 HE2 LYS 13 HE2 LYS 13 1.684 -1.172 6.410
114 HE3 LYS 13 HE1 LYS 13 3.145 -1.796 7.192
115 HZ1 LYS 13 HZ1 LYS 13 1.721 -0.981 8.901
116 HZ2 LYS 13 HZ2 LYS 13 1.475 0.493 8.099
117 HZ3 LYS 13 HZ3 LYS 13 2.996 0.121 8.760
118 H HIS 14 HN HIS 14 2.802 0.647 1.152
119 HA HIS 14 HA HIS 14 0.572 2.024 0.023
120 HB2 HIS 14 HB2 HIS 14 3.011 2.059 -0.673
121 HB3 HIS 14 HB1 HIS 14 2.760 0.476 -1.405
122 HD1 HIS 14 HD1 HIS 14 2.198 4.082 -1.936
123 HD2 HIS 14 HD2 HIS 14 0.885 0.521 -3.650
124 HE1 HIS 14 HE1 HIS 14 1.139 4.704 -4.151
125 H MET 15 HN MET 15 1.713 -1.348 -0.484
126 HA MET 15 HA MET 15 -0.411 -2.218 -2.184
127 HB2 MET 15 HB2 MET 15 1.897 -3.316 -1.404
128 HB3 MET 15 HB1 MET 15 0.874 -4.055 -0.179
129 HG2 MET 15 HG2 MET 15 0.095 -5.553 -1.658
130 HG3 MET 15 HG1 MET 15 -0.445 -4.265 -2.731
131 HE1 MET 15 HE1 MET 15 1.641 -4.570 -5.674
132 HE2 MET 15 HE2 MET 15 0.927 -3.279 -4.716
133 HE3 MET 15 HE3 MET 15 0.019 -4.763 -4.982
134 H TRP 16 HN TRP 16 -0.064 -2.301 1.386
135 HA TRP 16 HA TRP 16 -2.596 -3.579 1.880
136 HB2 TRP 16 HB2 TRP 16 -0.475 -3.213 3.394
137 HB3 TRP 16 HB1 TRP 16 -1.264 -1.692 3.813
138 HD1 TRP 16 HD1 TRP 16 -2.260 -2.077 6.093
139 HE1 TRP 16 HE1 TRP 16 -3.827 -3.826 7.165
140 HE3 TRP 16 HE3 TRP 16 -2.555 -5.444 2.275
141 HZ2 TRP 16 HZ2 TRP 16 -5.043 -6.326 6.483
142 HZ3 TRP 16 HZ3 TRP 16 -3.919 -7.497 2.508
143 HH2 TRP 16 HH2 TRP 16 -5.162 -7.942 4.602
144 H ASN 17 HN ASN 17 -1.620 -0.200 1.433
145 HA ASN 17 HA ASN 17 -4.086 1.025 2.283
146 HB2 ASN 17 HB2 ASN 17 -1.778 2.099 1.871
147 HB3 ASN 17 HB1 ASN 17 -2.160 2.021 0.151
148 HD21 ASN 17 1HD2 ASN 17 -3.967 3.397 -0.641
149 HD22 ASN 17 2HD2 ASN 17 -4.535 4.684 0.309
150 H PHE 18 HN PHE 18 -2.882 -0.268 -0.802
151 HA PHE 18 HA PHE 18 -5.043 0.487 -2.522
152 HB2 PHE 18 HB2 PHE 18 -2.828 -0.399 -3.236
153 HB3 PHE 18 HB1 PHE 18 -3.200 -1.934 -2.472
154 HD1 PHE 18 HD2 PHE 18 -4.468 0.411 -5.104
155 HD2 PHE 18 HD1 PHE 18 -4.270 -3.630 -3.663
156 HE1 PHE 18 HE2 PHE 18 -5.574 -0.383 -7.177
157 HE2 PHE 18 HE1 PHE 18 -5.374 -4.424 -5.735
158 HZ PHE 18 HZ PHE 18 -6.027 -2.800 -7.493
159 H ILE 19 HN ILE 19 -4.493 -2.244 -0.342
160 HA ILE 19 HA ILE 19 -6.821 -3.805 -0.941
161 HB ILE 19 HB ILE 19 -4.717 -3.607 1.173
162 HG12 ILE 19 2HG1 ILE 19 -4.285 -4.841 -0.882
163 HG13 ILE 19 1HG1 ILE 19 -4.297 -5.927 0.499
164 HG21 ILE 19 1HG2 ILE 19 -6.208 -4.183 2.783
165 HG22 ILE 19 2HG2 ILE 19 -5.919 -5.790 2.123
166 HG23 ILE 19 3HG2 ILE 19 -7.354 -4.886 1.643
167 HD11 ILE 19 3HD1 ILE 19 -5.577 -7.109 -1.056
168 HD12 ILE 19 1HD1 ILE 19 -6.320 -5.649 -1.707
169 HD13 ILE 19 2HD1 ILE 19 -6.826 -6.271 -0.136
170 H SER 20 HN SER 20 -6.184 -1.392 1.688
171 HA SER 20 HA SER 20 -8.817 -1.585 2.817
172 HB2 SER 20 HB2 SER 20 -8.177 0.606 3.893
173 HB3 SER 20 HB1 SER 20 -7.000 -0.678 4.097
174 HG SER 20 HG SER 20 -5.655 0.669 3.199
175 H GLY 21 HN GLY 21 -7.583 0.319 0.092
176 HA2 GLY 21 HA2 GLY 21 -9.772 2.158 -0.127
177 HA3 GLY 21 HA1 GLY 21 -8.692 1.693 -1.449
178 H ILE 22 HN ILE 22 -9.091 -0.983 -1.705
179 HA ILE 22 HA ILE 22 -11.581 -1.201 -3.130
180 HB ILE 22 HB ILE 22 -9.486 -3.189 -2.182
181 HG12 ILE 22 2HG1 ILE 22 -10.147 -2.271 -4.991
182 HG13 ILE 22 1HG1 ILE 22 -8.983 -1.428 -3.972
183 HG21 ILE 22 1HG2 ILE 22 -12.077 -3.661 -3.609
184 HG22 ILE 22 2HG2 ILE 22 -11.226 -4.691 -2.460
185 HG23 ILE 22 3HG2 ILE 22 -10.665 -4.583 -4.126
186 HD11 ILE 22 3HD1 ILE 22 -8.790 -4.388 -4.580
187 HD12 ILE 22 1HD1 ILE 22 -7.563 -3.355 -3.846
188 HD13 ILE 22 2HD1 ILE 22 -7.988 -3.151 -5.547
189 H GLN 23 HN GLN 23 -10.502 -2.352 0.080
190 HA GLN 23 HA GLN 23 -12.858 -3.762 0.846
191 HB2 GLN 23 HB2 GLN 23 -10.427 -2.677 2.075
192 HB3 GLN 23 HB1 GLN 23 -11.795 -2.648 3.174
193 HG2 GLN 23 HG2 GLN 23 -11.039 -5.112 1.594
194 HG3 GLN 23 HG1 GLN 23 -10.376 -4.771 3.188
195 HE21 GLN 23 1HE2 GLN 23 -12.046 -4.553 5.020
196 HE22 GLN 23 2HE2 GLN 23 -13.496 -5.422 4.875
197 H TYR 24 HN TYR 24 -11.955 -0.388 1.152
198 HA TYR 24 HA TYR 24 -14.255 0.545 2.626
199 HB2 TYR 24 HB2 TYR 24 -12.137 1.746 2.585
200 HB3 TYR 24 HB1 TYR 24 -12.220 1.912 0.835
201 HD1 TYR 24 HD1 TYR 24 -14.162 2.732 3.932
202 HD2 TYR 24 HD2 TYR 24 -13.175 3.838 -0.099
203 HE1 TYR 24 HE1 TYR 24 -15.446 4.834 4.197
204 HE2 TYR 24 HE2 TYR 24 -14.458 5.942 0.166
205 HH TYR 24 HH TYR 24 -15.150 7.366 2.678
206 H LEU 25 HN LEU 25 -13.397 0.761 -0.862
207 HA LEU 25 HA LEU 25 -15.873 1.922 -1.710
208 HB2 LEU 25 HB2 LEU 25 -13.472 0.732 -2.919
209 HB3 LEU 25 HB1 LEU 25 -14.929 0.470 -3.872
210 HG LEU 25 HG LEU 25 -15.299 3.067 -3.259
211 HD11 LEU 25 1HD1 LEU 25 -12.297 2.684 -3.340
212 HD12 LEU 25 2HD1 LEU 25 -13.243 3.280 -1.977
213 HD13 LEU 25 3HD1 LEU 25 -13.121 4.239 -3.450
214 HD21 LEU 25 3HD2 LEU 25 -15.100 1.876 -5.540
215 HD22 LEU 25 1HD2 LEU 25 -13.388 2.298 -5.480
216 HD23 LEU 25 2HD2 LEU 25 -14.610 3.568 -5.485
217 H ALA 26 HN ALA 26 -14.874 -1.490 -1.351
218 HA ALA 26 HA ALA 26 -17.033 -2.799 -2.613
219 HB1 ALA 26 HB1 ALA 26 -15.422 -3.476 -0.138
220 HB2 ALA 26 HB2 ALA 26 -15.120 -4.008 -1.791
221 HB3 ALA 26 HB3 ALA 26 -16.525 -4.613 -0.914
222 H GLY 27 HN GLY 27 -16.888 -1.340 0.641
223 HA2 GLY 27 HA2 GLY 27 -19.663 -2.161 1.241
224 HA3 GLY 27 HA1 GLY 27 -18.545 -1.381 2.357
225 H LEU 28 HN LEU 28 -17.801 0.788 0.480
226 HA LEU 28 HA LEU 28 -20.206 2.490 0.845
227 HB2 LEU 28 HB2 LEU 28 -17.709 2.865 1.592
228 HB3 LEU 28 HB1 LEU 28 -17.516 3.442 -0.059
229 HG LEU 28 HG LEU 28 -19.915 4.597 0.962
230 HD11 LEU 28 1HD1 LEU 28 -17.606 4.575 2.886
231 HD12 LEU 28 2HD1 LEU 28 -19.329 4.392 3.214
232 HD13 LEU 28 3HD1 LEU 28 -18.674 5.975 2.802
233 HD21 LEU 28 3HD2 LEU 28 -17.198 5.894 0.574
234 HD22 LEU 28 1HD2 LEU 28 -18.777 6.672 0.461
235 HD23 LEU 28 2HD2 LEU 28 -18.287 5.493 -0.754
236 H SER 29 HN SER 29 -19.870 0.527 -1.518
237 HA SER 29 HA SER 29 -20.378 0.433 -3.746
238 HB2 SER 29 HB2 SER 29 -22.285 1.766 -3.084
239 HB3 SER 29 HB1 SER 29 -21.335 3.239 -3.129
240 HG SER 29 HG SER 29 -22.206 1.577 -5.252
241 H THR 30 HN THR 30 -19.600 3.875 -4.166
242 HA THR 30 HA THR 30 -17.030 3.090 -5.472
243 HB THR 30 HB THR 30 -19.008 3.342 -7.006
244 HG1 THR 30 HG1 THR 30 -16.755 3.789 -7.623
245 HG21 THR 30 3HG2 THR 30 -20.058 5.246 -5.754
246 HG22 THR 30 1HG2 THR 30 -19.906 5.515 -7.491
247 HG23 THR 30 2HG2 THR 30 -18.778 6.287 -6.376