Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
563766 | 2m9i RC | 19295 | cing | 1-original | 3 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 H1 LYS 1 H1 LYS 1 -12.290 -0.397 -2.744
2 H2 LYS 1 H2 LYS 1 -11.383 0.779 -1.993
3 H3 LYS 1 H3 LYS 1 -10.653 -0.456 -2.731
4 HA LYS 1 HA LYS 1 -12.453 1.274 -4.276
5 HB2 LYS 1 HB2 LYS 1 -9.623 1.982 -3.489
6 HB3 LYS 1 HB3 LYS 1 -10.419 2.658 -4.924
7 HG2 LYS 1 HG2 LYS 1 -12.230 3.584 -3.596
8 HG3 LYS 1 HG3 LYS 1 -11.599 2.894 -2.126
9 HD2 LYS 1 HD2 LYS 1 -10.536 5.192 -3.750
10 HD3 LYS 1 HD3 LYS 1 -10.975 5.157 -2.048
11 HE2 LYS 1 HE2 LYS 1 -8.489 3.946 -3.334
12 HE3 LYS 1 HE3 LYS 1 -8.569 5.397 -2.344
13 HZ1 LYS 1 HZ1 LYS 1 -9.320 3.900 -0.463
14 HZ2 LYS 1 HZ2 LYS 1 -9.077 2.632 -1.344
15 HZ3 LYS 1 HZ3 LYS 1 -7.760 3.626 -1.031
16 H LEU 2 H LEU 2 -9.020 0.380 -4.919
17 HA LEU 2 HA LEU 2 -9.691 -0.801 -7.416
18 HB2 LEU 2 HB2 LEU 2 -7.064 -1.244 -6.003
19 HB3 LEU 2 HB3 LEU 2 -7.360 -1.304 -7.638
20 HG LEU 2 HG LEU 2 -7.608 1.070 -7.907
21 HD11 LEU 2 HD11 LEU 2 -8.319 2.059 -5.872
22 HD12 LEU 2 HD12 LEU 2 -7.020 1.271 -4.924
23 HD13 LEU 2 HD13 LEU 2 -6.660 2.566 -6.073
24 HD21 LEU 2 HD21 LEU 2 -5.450 -0.090 -8.174
25 HD22 LEU 2 HD22 LEU 2 -5.207 1.547 -7.561
26 HD23 LEU 2 HD23 LEU 2 -5.077 0.159 -6.460
27 HA PRO 3 HA PRO 3 -10.745 -4.921 -6.962
28 HB2 PRO 3 HB2 PRO 3 -8.023 -5.725 -8.067
29 HB3 PRO 3 HB3 PRO 3 -9.620 -6.372 -8.576
30 HG2 PRO 3 HG2 PRO 3 -8.493 -4.504 -10.078
31 HG3 PRO 3 HG3 PRO 3 -10.199 -4.210 -9.557
32 HD2 PRO 3 HD2 PRO 3 -7.636 -3.220 -8.252
33 HD3 PRO 3 HD3 PRO 3 -9.066 -2.271 -8.702
34 HA PRO 4 HA PRO 4 -9.040 -7.690 -3.794
35 HB2 PRO 4 HB2 PRO 4 -10.055 -10.110 -4.632
36 HB3 PRO 4 HB3 PRO 4 -11.038 -8.865 -3.802
37 HG2 PRO 4 HG2 PRO 4 -10.808 -9.380 -6.779
38 HG3 PRO 4 HG3 PRO 4 -12.295 -9.132 -5.808
39 HD2 PRO 4 HD2 PRO 4 -11.189 -7.121 -7.226
40 HD3 PRO 4 HD3 PRO 4 -11.886 -6.809 -5.614
41 H GLY 5 H GLY 5 -7.127 -8.902 -3.701
42 HA2 GLY 5 HA2 GLY 5 -5.359 -10.247 -4.833
43 HA3 GLY 5 HA3 GLY 5 -5.691 -9.325 -6.290
44 H TRP 6 H TRP 6 -5.985 -6.584 -4.914
45 HA TRP 6 HA TRP 6 -3.181 -5.968 -4.552
46 HB2 TRP 6 HB2 TRP 6 -5.785 -4.520 -4.037
47 HB3 TRP 6 HB3 TRP 6 -4.192 -3.840 -3.735
48 HD1 TRP 6 HD1 TRP 6 -6.593 -4.413 -6.555
49 HE1 TRP 6 HE1 TRP 6 -5.693 -3.235 -8.644
50 HE3 TRP 6 HE3 TRP 6 -1.908 -3.387 -4.894
51 HZ2 TRP 6 HZ2 TRP 6 -3.170 -2.117 -9.546
52 HZ3 TRP 6 HZ3 TRP 6 -0.311 -2.236 -6.314
53 HH2 TRP 6 HH2 TRP 6 -0.882 -1.620 -8.679
54 H GLU 7 H GLU 7 -1.944 -6.298 -2.782
55 HA GLU 7 HA GLU 7 -3.208 -6.445 -0.086
56 HB2 GLU 7 HB2 GLU 7 -2.708 -8.647 -1.461
57 HB3 GLU 7 HB3 GLU 7 -1.037 -8.350 -1.013
58 HG2 GLU 7 HG2 GLU 7 -3.395 -8.645 0.914
59 HG3 GLU 7 HG3 GLU 7 -2.308 -9.953 0.448
60 H LYS 8 H LYS 8 -1.765 -5.996 1.667
61 HA LYS 8 HA LYS 8 -0.091 -3.711 1.260
62 HB2 LYS 8 HB2 LYS 8 -1.312 -3.706 3.188
63 HB3 LYS 8 HB3 LYS 8 -1.111 -5.383 3.539
64 HG2 LYS 8 HG2 LYS 8 1.102 -3.325 3.883
65 HG3 LYS 8 HG3 LYS 8 -0.085 -3.717 5.116
66 HD2 LYS 8 HD2 LYS 8 2.178 -5.471 4.137
67 HD3 LYS 8 HD3 LYS 8 1.845 -4.849 5.723
68 HE2 LYS 8 HE2 LYS 8 1.351 -7.083 5.928
69 HE3 LYS 8 HE3 LYS 8 -0.245 -6.347 5.786
70 HZ1 LYS 8 HZ1 LYS 8 -0.535 -7.337 3.678
71 HZ2 LYS 8 HZ2 LYS 8 1.024 -7.321 3.309
72 HZ3 LYS 8 HZ3 LYS 8 0.421 -8.452 4.348
73 H ARG 9 H ARG 9 2.063 -3.403 1.283
74 HA ARG 9 HA ARG 9 3.981 -5.502 2.030
75 HB2 ARG 9 HB2 ARG 9 4.007 -4.116 -0.692
76 HB3 ARG 9 HB3 ARG 9 5.304 -5.139 -0.076
77 HG2 ARG 9 HG2 ARG 9 2.491 -6.024 -0.784
78 HG3 ARG 9 HG3 ARG 9 3.947 -6.295 -1.735
79 HD2 ARG 9 HD2 ARG 9 4.622 -8.078 -0.517
80 HD3 ARG 9 HD3 ARG 9 4.172 -7.350 1.013
81 HE ARG 9 HE ARG 9 1.912 -8.014 0.765
82 HH11 ARG 9 HH11 ARG 9 3.824 -9.399 -1.832
83 HH12 ARG 9 HH12 ARG 9 2.736 -10.747 -2.050
84 HH21 ARG 9 HH21 ARG 9 0.597 -9.698 0.496
85 HH22 ARG 9 HH22 ARG 9 0.863 -10.899 -0.767
86 H MET 10 H MET 10 6.305 -4.453 1.810
87 HA MET 10 HA MET 10 6.210 -1.587 2.574
88 HB2 MET 10 HB2 MET 10 6.234 -2.986 4.624
89 HB3 MET 10 HB3 MET 10 7.725 -3.762 4.062
90 HG2 MET 10 HG2 MET 10 8.832 -1.526 4.027
91 HG3 MET 10 HG3 MET 10 7.359 -0.791 4.649
92 HE1 MET 10 HE1 MET 10 7.231 -1.762 8.336
93 HE2 MET 10 HE2 MET 10 6.809 -0.545 7.113
94 HE3 MET 10 HE3 MET 10 6.212 -2.216 6.952
95 H PHE 11 H PHE 11 7.639 -0.386 1.565
96 HA PHE 11 HA PHE 11 9.344 -1.401 -0.470
97 HB2 PHE 11 HB2 PHE 11 8.053 0.749 -0.400
98 HB3 PHE 11 HB3 PHE 11 9.195 1.345 0.787
99 HD1 PHE 11 HD1 PHE 11 11.255 -0.470 -1.494
100 HD2 PHE 11 HD2 PHE 11 8.855 3.121 -1.202
101 HE1 PHE 11 HE1 PHE 11 12.585 0.569 -3.264
102 HE2 PHE 11 HE2 PHE 11 10.214 4.152 -2.995
103 HZ PHE 11 HZ PHE 11 12.084 2.880 -4.031
104 H ARG 12 H ARG 12 10.949 -2.678 0.213
105 HA ARG 12 HA ARG 12 12.555 -2.583 2.460
106 HB2 ARG 12 HB2 ARG 12 13.318 -3.438 -0.368
107 HB3 ARG 12 HB3 ARG 12 14.238 -3.834 1.088
108 HG2 ARG 12 HG2 ARG 12 12.284 -5.077 2.005
109 HG3 ARG 12 HG3 ARG 12 11.348 -4.673 0.561
110 HD2 ARG 12 HD2 ARG 12 12.151 -6.906 0.287
111 HD3 ARG 12 HD3 ARG 12 13.023 -5.861 -0.847
112 HE ARG 12 HE ARG 12 14.378 -6.281 1.718
113 HH11 ARG 12 HH11 ARG 12 14.022 -7.652 -1.477
114 HH12 ARG 12 HH12 ARG 12 15.550 -8.488 -1.418
115 HH21 ARG 12 HH21 ARG 12 16.343 -7.357 1.765
116 HH22 ARG 12 HH22 ARG 12 16.828 -8.314 0.403
117 H SER 13 H SER 13 14.588 -1.847 2.975
118 HA SER 13 HA SER 13 16.199 -0.367 3.311
119 HB2 SER 13 HB2 SER 13 16.960 -1.034 1.044
120 HB3 SER 13 HB3 SER 13 16.092 0.368 0.374
121 HG SER 13 HG SER 13 17.297 1.580 2.051
122 H ASN 14 H ASN 14 13.097 0.785 2.737
123 HA ASN 14 HA ASN 14 13.981 3.254 4.109
124 HB2 ASN 14 HB2 ASN 14 12.583 4.721 2.753
125 HB3 ASN 14 HB3 ASN 14 13.851 3.969 1.793
126 HD21 ASN 14 HD22 ASN 14 13.252 2.675 0.003
127 HD22 ASN 14 HD21 ASN 14 11.579 2.461 -0.434
128 H GLY 15 H GLY 15 11.220 1.078 3.328
129 HA2 GLY 15 HA2 GLY 15 9.972 0.174 5.109
130 HA3 GLY 15 HA3 GLY 15 10.246 1.603 6.093
131 H THR 16 H THR 16 9.388 2.573 2.919
132 HA THR 16 HA THR 16 6.879 3.667 3.694
133 HB THR 16 HB THR 16 7.749 3.005 0.854
134 HG1 THR 16 HG1 THR 16 9.372 4.192 1.695
135 HG21 THR 16 HG21 THR 16 5.899 5.143 1.980
136 HG22 THR 16 HG22 THR 16 6.386 4.976 0.279
137 HG23 THR 16 HG23 THR 16 5.401 3.715 1.040
138 H VAL 17 H VAL 17 5.045 2.515 4.200
139 HA VAL 17 HA VAL 17 4.636 -0.153 3.052
140 HB VAL 17 HB VAL 17 3.001 1.545 4.937
141 HG11 VAL 17 HG11 VAL 17 1.310 0.342 3.643
142 HG12 VAL 17 HG12 VAL 17 2.218 -1.178 3.819
143 HG13 VAL 17 HG13 VAL 17 1.475 -0.403 5.232
144 HG21 VAL 17 HG21 VAL 17 3.526 -0.312 6.492
145 HG22 VAL 17 HG22 VAL 17 4.330 -1.197 5.175
146 HG23 VAL 17 HG23 VAL 17 5.024 0.326 5.791
147 H TYR 18 H TYR 18 3.207 -0.769 1.598
148 HA TYR 18 HA TYR 18 1.617 1.120 0.020
149 HB2 TYR 18 HB2 TYR 18 2.882 1.083 -1.931
150 HB3 TYR 18 HB3 TYR 18 4.082 1.344 -0.687
151 HD1 TYR 18 HD1 TYR 18 5.520 -0.624 0.072
152 HD2 TYR 18 HD2 TYR 18 3.058 -0.669 -3.440
153 HE1 TYR 18 HE1 TYR 18 6.818 -2.603 -0.827
154 HE2 TYR 18 HE2 TYR 18 4.286 -2.661 -4.304
155 HH TYR 18 HH TYR 18 6.065 -4.047 -3.981
156 H TYR 19 H TYR 19 0.942 -0.351 -2.167
157 HA TYR 19 HA TYR 19 0.310 -3.080 -1.159
158 HB2 TYR 19 HB2 TYR 19 -1.536 -1.009 -2.297
159 HB3 TYR 19 HB3 TYR 19 -1.812 -2.690 -2.673
160 HD1 TYR 19 HD2 TYR 19 -0.952 -0.785 0.503
161 HD2 TYR 19 HD1 TYR 19 -3.429 -3.744 -1.416
162 HE1 TYR 19 HE2 TYR 19 -2.140 -1.210 2.644
163 HE2 TYR 19 HE1 TYR 19 -4.703 -4.047 0.684
164 HH TYR 19 HH TYR 19 -5.175 -2.727 2.797
165 H PHE 20 H PHE 20 0.149 -4.666 -2.565
166 HA PHE 20 HA PHE 20 1.383 -4.399 -5.273
167 HB2 PHE 20 HB2 PHE 20 3.017 -5.154 -3.670
168 HB3 PHE 20 HB3 PHE 20 1.876 -6.310 -2.969
169 HD1 PHE 20 HD2 PHE 20 4.114 -5.640 -5.820
170 HD2 PHE 20 HD1 PHE 20 1.479 -8.527 -3.973
171 HE1 PHE 20 HE2 PHE 20 5.021 -7.409 -7.282
172 HE2 PHE 20 HE1 PHE 20 2.473 -10.303 -5.389
173 HZ PHE 20 HZ PHE 20 4.182 -9.747 -7.085
174 H ASN 21 H ASN 21 0.224 -5.434 -6.855
175 HA ASN 21 HA ASN 21 -2.195 -6.916 -6.038
176 HB2 ASN 21 HB2 ASN 21 -2.197 -5.263 -7.933
177 HB3 ASN 21 HB3 ASN 21 -1.191 -6.397 -8.827
178 HD21 ASN 21 HD22 ASN 21 -4.459 -5.551 -8.090
179 HD22 ASN 21 HD21 ASN 21 -5.140 -7.094 -8.596
180 H HIS 22 H HIS 22 -1.795 -8.883 -5.230
181 HA HIS 22 HA HIS 22 0.462 -10.447 -6.101
182 HB2 HIS 22 HB2 HIS 22 -0.004 -11.807 -4.324
183 HB3 HIS 22 HB3 HIS 22 -0.655 -10.287 -3.768
184 HD1 HIS 22 HD1 HIS 22 -2.070 -13.389 -5.594
185 HD2 HIS 22 HD2 HIS 22 -3.066 -10.481 -2.732
186 HE1 HIS 22 HE1 HIS 22 -4.403 -14.033 -4.654
187 H ILE 23 H ILE 23 -2.305 -9.921 -7.808
188 HA ILE 23 HA ILE 23 -2.369 -12.650 -8.991
189 HB ILE 23 HB ILE 23 -4.417 -10.406 -9.165
190 HG12 ILE 23 HG12 ILE 23 -4.396 -12.970 -7.504
191 HG13 ILE 23 HG13 ILE 23 -4.308 -11.325 -6.881
192 HG21 ILE 23 HG21 ILE 23 -5.877 -12.074 -10.191
193 HG22 ILE 23 HG22 ILE 23 -4.421 -11.894 -11.152
194 HG23 ILE 23 HG23 ILE 23 -4.595 -13.302 -10.078
195 HD11 ILE 23 HD11 ILE 23 -6.520 -12.055 -6.503
196 HD12 ILE 23 HD12 ILE 23 -6.607 -10.897 -7.847
197 HD13 ILE 23 HD13 ILE 23 -6.714 -12.649 -8.156
198 H THR 24 H THR 24 -1.714 -9.214 -9.695
199 HA THR 24 HA THR 24 -0.915 -9.974 -12.483
200 HB THR 24 HB THR 24 -1.244 -7.700 -13.076
201 HG1 THR 24 HG1 THR 24 -2.081 -6.229 -11.570
202 HG21 THR 24 HG21 THR 24 -3.292 -9.142 -13.027
203 HG22 THR 24 HG22 THR 24 -3.661 -8.514 -11.406
204 HG23 THR 24 HG23 THR 24 -3.644 -7.418 -12.806
205 H ASN 25 H ASN 25 0.481 -8.918 -9.553
206 HA ASN 25 HA ASN 25 2.521 -8.347 -8.901
207 HB2 ASN 25 HB2 ASN 25 3.217 -9.941 -10.848
208 HB3 ASN 25 HB3 ASN 25 3.684 -8.459 -11.679
209 HD21 ASN 25 HD22 ASN 25 5.083 -6.952 -10.086
210 HD22 ASN 25 HD21 ASN 25 6.441 -7.874 -9.397
211 H ALA 26 H ALA 26 0.439 -6.394 -10.365
212 HA ALA 26 HA ALA 26 2.033 -4.038 -10.843
213 HB1 ALA 26 HB1 ALA 26 -0.101 -2.856 -10.673
214 HB2 ALA 26 HB2 ALA 26 -0.290 -4.330 -11.634
215 HB3 ALA 26 HB3 ALA 26 -0.868 -4.287 -9.952
216 H SER 27 H SER 27 1.944 -2.015 -9.410
217 HA SER 27 HA SER 27 1.828 -2.528 -6.495
218 HB2 SER 27 HB2 SER 27 4.303 -1.659 -8.010
219 HB3 SER 27 HB3 SER 27 4.071 -1.387 -6.267
220 HG SER 27 HG SER 27 3.527 -3.929 -7.296
221 H GLN 28 H GLN 28 1.188 -0.732 -5.322
222 HA GLN 28 HA GLN 28 1.283 1.977 -6.458
223 HB2 GLN 28 HB2 GLN 28 -1.298 0.453 -5.841
224 HB3 GLN 28 HB3 GLN 28 -1.226 2.206 -5.765
225 HG2 GLN 28 HG2 GLN 28 -0.710 0.567 -8.263
226 HG3 GLN 28 HG3 GLN 28 -2.162 1.481 -7.884
227 HE21 GLN 28 HE22 GLN 28 1.216 1.700 -8.921
228 HE22 GLN 28 HE21 GLN 28 1.094 3.418 -9.352
229 H PHE 29 H PHE 29 0.932 3.621 -4.908
230 HA PHE 29 HA PHE 29 1.283 2.868 -2.096
231 HB2 PHE 29 HB2 PHE 29 1.085 5.580 -3.417
232 HB3 PHE 29 HB3 PHE 29 1.506 5.276 -1.734
233 HD1 PHE 29 HD2 PHE 29 3.481 3.317 -1.530
234 HD2 PHE 29 HD1 PHE 29 2.942 6.095 -4.789
235 HE1 PHE 29 HE2 PHE 29 5.863 3.060 -2.142
236 HE2 PHE 29 HE1 PHE 29 5.331 5.828 -5.398
237 HZ PHE 29 HZ PHE 29 6.795 4.311 -4.078
238 H GLU 30 H GLU 30 -1.411 3.537 -4.184
239 HA GLU 30 HA GLU 30 -3.176 4.253 -2.021
240 HB2 GLU 30 HB2 GLU 30 -3.610 5.058 -4.260
241 HB3 GLU 30 HB3 GLU 30 -3.903 3.405 -4.822
242 HG2 GLU 30 HG2 GLU 30 -5.983 4.780 -4.294
243 HG3 GLU 30 HG3 GLU 30 -5.883 3.228 -3.465
244 H ARG 31 H ARG 31 -4.458 3.040 -0.842
245 HA ARG 31 HA ARG 31 -3.870 0.134 -0.634
246 HB2 ARG 31 HB2 ARG 31 -5.181 2.071 1.327
247 HB3 ARG 31 HB3 ARG 31 -4.879 0.369 1.602
248 HG2 ARG 31 HG2 ARG 31 -2.916 0.835 2.453
249 HG3 ARG 31 HG3 ARG 31 -2.329 1.415 0.902
250 HD2 ARG 31 HD2 ARG 31 -3.790 3.175 2.936
251 HD3 ARG 31 HD3 ARG 31 -2.062 2.872 3.001
252 HE ARG 31 HE ARG 31 -1.698 4.050 0.972
253 HH11 ARG 31 HH21 ARG 31 -5.126 4.103 1.676
254 HH12 ARG 31 HH22 ARG 31 -5.411 4.969 0.184
255 HH21 ARG 31 HH11 ARG 31 -2.113 5.636 -0.426
256 HH22 ARG 31 HH12 ARG 31 -3.796 6.069 -0.767
257 HA PRO 32 HA PRO 32 -7.986 0.161 -2.474
258 HB2 PRO 32 HB2 PRO 32 -7.541 -2.713 -3.255
259 HB3 PRO 32 HB3 PRO 32 -8.042 -1.312 -4.132
260 HG2 PRO 32 HG2 PRO 32 -5.581 -2.225 -4.438
261 HG3 PRO 32 HG3 PRO 32 -5.781 -0.507 -4.387
262 HD2 PRO 32 HD2 PRO 32 -5.163 -2.270 -1.986
263 HD3 PRO 32 HD3 PRO 32 -4.263 -0.830 -2.530
264 H SER 33 H SER 33 -6.976 -1.775 -0.200
265 HA SER 33 HA SER 33 -9.491 -3.035 0.759
266 HB2 SER 33 HB2 SER 33 -8.274 -3.755 2.703
267 HB3 SER 33 HB3 SER 33 -7.212 -3.998 1.301
268 HG SER 33 HG SER 33 -7.272 -1.717 2.969
269 H GLY 34 H GLY 34 -10.283 -0.698 0.208
270 HA2 GLY 34 HA2 GLY 34 -11.733 0.767 1.773
271 HA3 GLY 34 HA3 GLY 34 -10.161 1.235 2.454
Start of MODEL 2
1 H1 LYS 1 H1 LYS 1 -10.593 -9.320 4.931
2 H2 LYS 1 H2 LYS 1 -11.016 -9.347 3.332
3 H3 LYS 1 H3 LYS 1 -11.501 -8.103 4.267
4 HA LYS 1 HA LYS 1 -9.219 -7.400 4.608
5 HB2 LYS 1 HB2 LYS 1 -8.479 -9.898 3.941
6 HB3 LYS 1 HB3 LYS 1 -8.425 -9.205 2.323
7 HG2 LYS 1 HG2 LYS 1 -6.930 -7.329 3.500
8 HG3 LYS 1 HG3 LYS 1 -6.792 -8.516 4.794
9 HD2 LYS 1 HD2 LYS 1 -5.886 -10.168 3.148
10 HD3 LYS 1 HD3 LYS 1 -6.052 -8.953 1.861
11 HE2 LYS 1 HE2 LYS 1 -4.522 -7.437 3.180
12 HE3 LYS 1 HE3 LYS 1 -4.270 -8.759 4.332
13 HZ1 LYS 1 HZ1 LYS 1 -2.509 -8.744 2.678
14 HZ2 LYS 1 HZ2 LYS 1 -3.430 -10.088 2.456
15 HZ3 LYS 1 HZ3 LYS 1 -3.628 -8.815 1.434
16 H LEU 2 H LEU 2 -7.894 -6.565 2.280
17 HA LEU 2 HA LEU 2 -9.822 -4.953 0.846
18 HB2 LEU 2 HB2 LEU 2 -6.830 -5.494 0.476
19 HB3 LEU 2 HB3 LEU 2 -7.748 -4.298 -0.398
20 HG LEU 2 HG LEU 2 -6.653 -3.035 1.143
21 HD11 LEU 2 HD11 LEU 2 -9.115 -2.547 1.146
22 HD12 LEU 2 HD12 LEU 2 -9.267 -3.515 2.629
23 HD13 LEU 2 HD13 LEU 2 -8.267 -2.048 2.614
24 HD21 LEU 2 HD21 LEU 2 -7.386 -4.824 3.479
25 HD22 LEU 2 HD22 LEU 2 -5.847 -4.911 2.576
26 HD23 LEU 2 HD23 LEU 2 -6.296 -3.439 3.442
27 HA PRO 3 HA PRO 3 -11.002 -7.358 -2.447
28 HB2 PRO 3 HB2 PRO 3 -9.531 -5.704 -4.518
29 HB3 PRO 3 HB3 PRO 3 -11.243 -6.233 -4.512
30 HG2 PRO 3 HG2 PRO 3 -10.673 -3.744 -3.733
31 HG3 PRO 3 HG3 PRO 3 -11.771 -4.721 -2.715
32 HD2 PRO 3 HD2 PRO 3 -8.791 -4.250 -2.369
33 HD3 PRO 3 HD3 PRO 3 -10.098 -4.054 -1.171
34 HA PRO 4 HA PRO 4 -8.800 -10.835 -3.540
35 HB2 PRO 4 HB2 PRO 4 -9.388 -10.524 -6.474
36 HB3 PRO 4 HB3 PRO 4 -9.538 -11.982 -5.447
37 HG2 PRO 4 HG2 PRO 4 -11.743 -10.515 -6.024
38 HG3 PRO 4 HG3 PRO 4 -11.480 -11.122 -4.357
39 HD2 PRO 4 HD2 PRO 4 -10.991 -8.356 -5.454
40 HD3 PRO 4 HD3 PRO 4 -11.697 -8.846 -3.884
41 H GLY 5 H GLY 5 -6.744 -11.181 -3.477
42 HA2 GLY 5 HA2 GLY 5 -4.563 -11.456 -4.284
43 HA3 GLY 5 HA3 GLY 5 -4.876 -10.290 -5.566
44 H TRP 6 H TRP 6 -5.945 -8.406 -3.104
45 HA TRP 6 HA TRP 6 -3.470 -6.961 -3.169
46 HB2 TRP 6 HB2 TRP 6 -6.082 -6.529 -1.739
47 HB3 TRP 6 HB3 TRP 6 -4.698 -5.479 -1.491
48 HD1 TRP 6 HD1 TRP 6 -7.583 -5.764 -3.632
49 HE1 TRP 6 HE1 TRP 6 -7.505 -3.980 -5.494
50 HE3 TRP 6 HE3 TRP 6 -2.653 -4.536 -3.327
51 HZ2 TRP 6 HZ2 TRP 6 -5.500 -2.431 -6.831
52 HZ3 TRP 6 HZ3 TRP 6 -1.709 -2.803 -4.813
53 HH2 TRP 6 HH2 TRP 6 -3.104 -1.769 -6.602
54 H GLU 7 H GLU 7 -1.725 -6.944 -1.985
55 HA GLU 7 HA GLU 7 -1.914 -7.698 0.853
56 HB2 GLU 7 HB2 GLU 7 -0.796 -9.325 -1.151
57 HB3 GLU 7 HB3 GLU 7 0.603 -8.501 -0.470
58 HG2 GLU 7 HG2 GLU 7 -1.465 -10.165 1.029
59 HG3 GLU 7 HG3 GLU 7 0.195 -10.622 0.669
60 H LYS 8 H LYS 8 -0.758 -6.636 2.233
61 HA LYS 8 HA LYS 8 0.368 -4.028 1.590
62 HB2 LYS 8 HB2 LYS 8 -0.620 -4.008 3.622
63 HB3 LYS 8 HB3 LYS 8 -0.254 -5.643 4.033
64 HG2 LYS 8 HG2 LYS 8 1.757 -3.352 4.100
65 HG3 LYS 8 HG3 LYS 8 0.749 -3.838 5.453
66 HD2 LYS 8 HD2 LYS 8 3.098 -5.351 4.287
67 HD3 LYS 8 HD3 LYS 8 2.869 -4.699 5.880
68 HE2 LYS 8 HE2 LYS 8 2.690 -7.002 6.140
69 HE3 LYS 8 HE3 LYS 8 1.033 -6.412 6.283
70 HZ1 LYS 8 HZ1 LYS 8 0.496 -7.430 4.215
71 HZ2 LYS 8 HZ2 LYS 8 1.996 -7.342 3.638
72 HZ3 LYS 8 HZ3 LYS 8 1.606 -8.469 4.736
73 H ARG 9 H ARG 9 2.427 -3.433 1.429
74 HA ARG 9 HA ARG 9 4.644 -5.447 1.641
75 HB2 ARG 9 HB2 ARG 9 3.960 -3.741 -0.793
76 HB3 ARG 9 HB3 ARG 9 5.501 -4.564 -0.578
77 HG2 ARG 9 HG2 ARG 9 2.809 -5.966 -0.828
78 HG3 ARG 9 HG3 ARG 9 3.990 -5.684 -2.097
79 HD2 ARG 9 HD2 ARG 9 4.677 -7.726 -1.656
80 HD3 ARG 9 HD3 ARG 9 5.635 -6.941 -0.396
81 HE ARG 9 HE ARG 9 3.237 -7.570 0.878
82 HH11 ARG 9 HH11 ARG 9 5.663 -9.435 -0.825
83 HH12 ARG 9 HH12 ARG 9 5.266 -10.924 -0.011
84 HH21 ARG 9 HH21 ARG 9 2.633 -9.589 1.816
85 HH22 ARG 9 HH22 ARG 9 3.639 -10.971 1.486
86 H MET 10 H MET 10 6.838 -4.335 1.459
87 HA MET 10 HA MET 10 6.772 -1.533 2.423
88 HB2 MET 10 HB2 MET 10 6.816 -3.053 4.393
89 HB3 MET 10 HB3 MET 10 8.319 -3.765 3.782
90 HG2 MET 10 HG2 MET 10 9.397 -1.516 3.907
91 HG3 MET 10 HG3 MET 10 7.884 -0.829 4.491
92 HE1 MET 10 HE1 MET 10 11.063 -2.894 5.282
93 HE2 MET 10 HE2 MET 10 10.733 -3.573 6.891
94 HE3 MET 10 HE3 MET 10 9.867 -4.199 5.474
95 H PHE 11 H PHE 11 8.187 -0.276 1.464
96 HA PHE 11 HA PHE 11 9.981 -1.194 -0.562
97 HB2 PHE 11 HB2 PHE 11 8.646 0.929 -0.465
98 HB3 PHE 11 HB3 PHE 11 9.727 1.502 0.787
99 HD1 PHE 11 HD2 PHE 11 12.015 -0.108 -1.344
100 HD2 PHE 11 HD1 PHE 11 9.323 3.276 -1.270
101 HE1 PHE 11 HE2 PHE 11 13.380 1.018 -3.038
102 HE2 PHE 11 HE1 PHE 11 10.716 4.399 -2.981
103 HZ PHE 11 HZ PHE 11 12.748 3.274 -3.871
104 H ARG 12 H ARG 12 11.381 -2.644 0.459
105 HA ARG 12 HA ARG 12 13.083 -2.344 2.581
106 HB2 ARG 12 HB2 ARG 12 14.799 -3.651 1.170
107 HB3 ARG 12 HB3 ARG 12 13.255 -4.371 1.560
108 HG2 ARG 12 HG2 ARG 12 14.014 -4.878 -0.721
109 HG3 ARG 12 HG3 ARG 12 12.423 -4.148 -0.656
110 HD2 ARG 12 HD2 ARG 12 13.786 -3.346 -2.568
111 HD3 ARG 12 HD3 ARG 12 13.246 -2.056 -1.509
112 HE ARG 12 HE ARG 12 15.377 -1.614 -0.811
113 HH11 ARG 12 HH21 ARG 12 15.547 -4.337 -3.018
114 HH12 ARG 12 HH22 ARG 12 17.289 -4.302 -3.103
115 HH21 ARG 12 HH11 ARG 12 17.579 -1.751 -0.762
116 HH22 ARG 12 HH12 ARG 12 18.432 -2.776 -1.899
117 H SER 13 H SER 13 14.998 -1.485 3.116
118 HA SER 13 HA SER 13 16.740 -0.092 3.244
119 HB2 SER 13 HB2 SER 13 16.416 0.684 0.331
120 HB3 SER 13 HB3 SER 13 17.797 0.998 1.379
121 HG SER 13 HG SER 13 18.150 -1.208 1.546
122 H ASN 14 H ASN 14 13.583 1.031 2.678
123 HA ASN 14 HA ASN 14 14.404 3.431 4.203
124 HB2 ASN 14 HB2 ASN 14 13.011 4.951 2.900
125 HB3 ASN 14 HB3 ASN 14 14.316 4.274 1.937
126 HD21 ASN 14 HD22 ASN 14 13.759 3.376 -0.039
127 HD22 ASN 14 HD21 ASN 14 12.113 2.993 -0.480
128 H GLY 15 H GLY 15 11.745 1.201 3.306
129 HA2 GLY 15 HA2 GLY 15 10.451 0.218 5.002
130 HA3 GLY 15 HA3 GLY 15 10.693 1.600 6.059
131 H THR 16 H THR 16 9.887 2.704 2.910
132 HA THR 16 HA THR 16 7.346 3.732 3.654
133 HB THR 16 HB THR 16 8.236 3.107 0.813
134 HG1 THR 16 HG1 THR 16 9.833 4.316 1.693
135 HG21 THR 16 HG21 THR 16 5.877 3.760 0.994
136 HG22 THR 16 HG22 THR 16 6.333 5.186 1.957
137 HG23 THR 16 HG23 THR 16 6.833 5.057 0.257
138 H VAL 17 H VAL 17 5.548 2.541 4.158
139 HA VAL 17 HA VAL 17 5.201 -0.132 3.018
140 HB VAL 17 HB VAL 17 3.570 1.540 4.933
141 HG11 VAL 17 HG11 VAL 17 2.789 -1.195 3.840
142 HG12 VAL 17 HG12 VAL 17 2.069 -0.416 5.264
143 HG13 VAL 17 HG13 VAL 17 1.864 0.316 3.674
144 HG21 VAL 17 HG21 VAL 17 4.144 -0.305 6.478
145 HG22 VAL 17 HG22 VAL 17 4.932 -1.187 5.150
146 HG23 VAL 17 HG23 VAL 17 5.623 0.341 5.747
147 H TYR 18 H TYR 18 3.680 -0.814 1.647
148 HA TYR 18 HA TYR 18 1.974 1.030 0.164
149 HB2 TYR 18 HB2 TYR 18 2.971 0.734 -1.959
150 HB3 TYR 18 HB3 TYR 18 4.238 1.253 -0.891
151 HD1 TYR 18 HD1 TYR 18 5.980 -0.465 -0.122
152 HD2 TYR 18 HD2 TYR 18 3.105 -1.223 -3.243
153 HE1 TYR 18 HE1 TYR 18 7.442 -2.284 -1.064
154 HE2 TYR 18 HE2 TYR 18 4.531 -3.027 -4.148
155 HH TYR 18 HH TYR 18 6.561 -4.111 -3.972
156 H TYR 19 H TYR 19 1.038 -0.507 -1.834
157 HA TYR 19 HA TYR 19 0.581 -3.246 -0.776
158 HB2 TYR 19 HB2 TYR 19 -1.399 -1.120 -1.436
159 HB3 TYR 19 HB3 TYR 19 -1.761 -2.708 -2.035
160 HD1 TYR 19 HD1 TYR 19 -0.963 -0.891 1.158
161 HD2 TYR 19 HD2 TYR 19 -2.608 -4.426 -0.686
162 HE1 TYR 19 HE1 TYR 19 -2.087 -1.486 3.279
163 HE2 TYR 19 HE2 TYR 19 -3.687 -5.053 1.469
164 HH TYR 19 HH TYR 19 -3.395 -3.008 4.380
165 H PHE 20 H PHE 20 0.156 -4.788 -2.188
166 HA PHE 20 HA PHE 20 0.690 -4.379 -5.094
167 HB2 PHE 20 HB2 PHE 20 2.743 -4.943 -3.897
168 HB3 PHE 20 HB3 PHE 20 1.973 -6.372 -3.186
169 HD1 PHE 20 HD1 PHE 20 3.390 -4.858 -6.193
170 HD2 PHE 20 HD2 PHE 20 1.683 -8.452 -4.540
171 HE1 PHE 20 HE1 PHE 20 4.096 -6.122 -8.221
172 HE2 PHE 20 HE2 PHE 20 2.503 -9.730 -6.508
173 HZ PHE 20 HZ PHE 20 3.637 -8.571 -8.372
174 H ASN 21 H ASN 21 -0.849 -5.353 -6.285
175 HA ASN 21 HA ASN 21 -2.646 -7.353 -5.089
176 HB2 ASN 21 HB2 ASN 21 -3.508 -5.474 -6.539
177 HB3 ASN 21 HB3 ASN 21 -2.596 -6.153 -7.867
178 HD21 ASN 21 HD22 ASN 21 -5.472 -6.472 -5.824
179 HD22 ASN 21 HD21 ASN 21 -6.054 -7.960 -6.527
180 H HIS 22 H HIS 22 -1.660 -9.311 -4.871
181 HA HIS 22 HA HIS 22 0.409 -10.191 -6.639
182 HB2 HIS 22 HB2 HIS 22 0.742 -11.893 -5.119
183 HB3 HIS 22 HB3 HIS 22 0.119 -10.602 -4.123
184 HD1 HIS 22 HD1 HIS 22 -1.413 -13.628 -5.976
185 HD2 HIS 22 HD2 HIS 22 -1.721 -11.402 -2.426
186 HE1 HIS 22 HE1 HIS 22 -3.207 -14.803 -4.507
187 H ILE 23 H ILE 23 -2.710 -10.054 -7.530
188 HA ILE 23 HA ILE 23 -2.605 -12.587 -9.124
189 HB ILE 23 HB ILE 23 -4.917 -10.775 -8.347
190 HG12 ILE 23 HG12 ILE 23 -4.269 -13.692 -7.681
191 HG13 ILE 23 HG13 ILE 23 -4.107 -12.331 -6.579
192 HG21 ILE 23 HG21 ILE 23 -6.395 -12.350 -9.561
193 HG22 ILE 23 HG22 ILE 23 -5.284 -11.561 -10.658
194 HG23 ILE 23 HG23 ILE 23 -4.968 -13.235 -10.150
195 HD11 ILE 23 HD11 ILE 23 -6.683 -13.520 -7.638
196 HD12 ILE 23 HD12 ILE 23 -6.112 -13.409 -5.968
197 HD13 ILE 23 HD13 ILE 23 -6.611 -11.938 -6.828
198 H THR 24 H THR 24 -2.604 -9.073 -9.275
199 HA THR 24 HA THR 24 -2.573 -9.167 -12.280
200 HB THR 24 HB THR 24 -3.430 -6.867 -12.180
201 HG1 THR 24 HG1 THR 24 -3.754 -7.321 -9.422
202 HG21 THR 24 HG21 THR 24 -5.127 -8.695 -12.196
203 HG22 THR 24 HG22 THR 24 -5.131 -8.691 -10.415
204 HG23 THR 24 HG23 THR 24 -5.672 -7.258 -11.301
205 H ASN 25 H ASN 25 -0.705 -8.148 -9.524
206 HA ASN 25 HA ASN 25 1.299 -7.277 -9.241
207 HB2 ASN 25 HB2 ASN 25 1.622 -6.624 -12.175
208 HB3 ASN 25 HB3 ASN 25 2.859 -6.659 -10.934
209 HD21 ASN 25 HD22 ASN 25 0.808 -8.625 -12.989
210 HD22 ASN 25 HD21 ASN 25 1.753 -10.112 -12.762
211 H ALA 26 H ALA 26 -1.492 -5.674 -9.997
212 HA ALA 26 HA ALA 26 -0.691 -2.997 -10.382
213 HB1 ALA 26 HB1 ALA 26 -3.040 -3.803 -10.465
214 HB2 ALA 26 HB2 ALA 26 -3.016 -4.039 -8.704
215 HB3 ALA 26 HB3 ALA 26 -2.849 -2.412 -9.381
216 H SER 27 H SER 27 0.162 -1.413 -9.043
217 HA SER 27 HA SER 27 0.943 -2.205 -6.265
218 HB2 SER 27 HB2 SER 27 2.718 -1.188 -8.523
219 HB3 SER 27 HB3 SER 27 3.214 -1.417 -6.838
220 HG SER 27 HG SER 27 2.280 -3.507 -8.589
221 H GLN 28 H GLN 28 0.616 -0.533 -4.827
222 HA GLN 28 HA GLN 28 0.773 2.270 -5.734
223 HB2 GLN 28 HB2 GLN 28 -1.532 2.760 -4.893
224 HB3 GLN 28 HB3 GLN 28 -1.486 1.801 -6.370
225 HG2 GLN 28 HG2 GLN 28 -1.973 -0.257 -5.099
226 HG3 GLN 28 HG3 GLN 28 -1.949 0.641 -3.584
227 HE21 GLN 28 HE22 GLN 28 -3.785 1.889 -2.997
228 HE22 GLN 28 HE21 GLN 28 -5.224 1.942 -4.035
229 H PHE 29 H PHE 29 0.999 3.789 -4.004
230 HA PHE 29 HA PHE 29 2.066 2.672 -1.545
231 HB2 PHE 29 HB2 PHE 29 1.621 5.467 -2.583
232 HB3 PHE 29 HB3 PHE 29 2.105 5.159 -0.925
233 HD1 PHE 29 HD1 PHE 29 3.651 2.743 -3.229
234 HD2 PHE 29 HD2 PHE 29 3.975 6.713 -1.546
235 HE1 PHE 29 HE1 PHE 29 6.045 2.781 -3.766
236 HE2 PHE 29 HE2 PHE 29 6.385 6.741 -2.118
237 HZ PHE 29 HZ PHE 29 7.428 4.770 -3.219
238 H GLU 30 H GLU 30 -0.932 4.615 -2.221
239 HA GLU 30 HA GLU 30 -1.789 4.290 0.526
240 HB2 GLU 30 HB2 GLU 30 -2.454 6.246 -0.729
241 HB3 GLU 30 HB3 GLU 30 -3.218 5.250 -1.963
242 HG2 GLU 30 HG2 GLU 30 -4.868 6.330 -0.530
243 HG3 GLU 30 HG3 GLU 30 -4.982 4.583 -0.429
244 H ARG 31 H ARG 31 -3.492 3.062 1.282
245 HA ARG 31 HA ARG 31 -3.411 0.319 0.516
246 HB2 ARG 31 HB2 ARG 31 -5.493 1.614 2.302
247 HB3 ARG 31 HB3 ARG 31 -4.956 -0.076 2.311
248 HG2 ARG 31 HG2 ARG 31 -3.215 0.295 3.630
249 HG3 ARG 31 HG3 ARG 31 -2.718 1.780 2.869
250 HD2 ARG 31 HD2 ARG 31 -5.049 1.459 4.826
251 HD3 ARG 31 HD3 ARG 31 -3.419 1.992 5.272
252 HE ARG 31 HE ARG 31 -4.133 3.810 3.313
253 HH11 ARG 31 HH11 ARG 31 -5.550 2.994 6.398
254 HH12 ARG 31 HH12 ARG 31 -6.276 4.575 6.579
255 HH21 ARG 31 HH22 ARG 31 -5.139 5.751 3.503
256 HH22 ARG 31 HH21 ARG 31 -6.005 6.124 4.970
257 HA PRO 32 HA PRO 32 -6.327 0.443 -2.757
258 HB2 PRO 32 HB2 PRO 32 -6.903 -2.242 -3.107
259 HB3 PRO 32 HB3 PRO 32 -5.362 -1.477 -3.554
260 HG2 PRO 32 HG2 PRO 32 -6.012 -3.094 -1.121
261 HG3 PRO 32 HG3 PRO 32 -4.504 -3.079 -2.038
262 HD2 PRO 32 HD2 PRO 32 -4.738 -1.727 0.299
263 HD3 PRO 32 HD3 PRO 32 -3.704 -1.186 -1.063
264 H SER 33 H SER 33 -8.462 0.192 -3.459
265 HA SER 33 HA SER 33 -10.499 -0.856 -1.581
266 HB2 SER 33 HB2 SER 33 -10.252 1.535 -1.035
267 HB3 SER 33 HB3 SER 33 -10.547 1.958 -2.736
268 HG SER 33 HG SER 33 -12.524 0.643 -2.441
269 H GLY 34 H GLY 34 -9.328 -1.429 -4.500
270 HA2 GLY 34 HA2 GLY 34 -11.851 -2.264 -5.643
271 HA3 GLY 34 HA3 GLY 34 -10.872 -1.165 -6.641
Start of MODEL 3
1 H1 LYS 1 H1 LYS 1 -10.917 -0.529 -2.568
2 H2 LYS 1 H2 LYS 1 -12.419 -0.678 -3.219
3 H3 LYS 1 H3 LYS 1 -12.096 0.521 -2.135
4 HA LYS 1 HA LYS 1 -12.237 1.453 -4.298
5 HB2 LYS 1 HB2 LYS 1 -9.266 1.429 -3.687
6 HB3 LYS 1 HB3 LYS 1 -10.246 2.679 -4.442
7 HG2 LYS 1 HG2 LYS 1 -11.377 2.949 -2.147
8 HG3 LYS 1 HG3 LYS 1 -10.131 1.846 -1.520
9 HD2 LYS 1 HD2 LYS 1 -8.405 3.486 -2.618
10 HD3 LYS 1 HD3 LYS 1 -9.775 4.591 -2.774
11 HE2 LYS 1 HE2 LYS 1 -9.045 5.293 -0.723
12 HE3 LYS 1 HE3 LYS 1 -10.100 3.982 -0.179
13 HZ1 LYS 1 HZ1 LYS 1 -7.943 2.564 -0.300
14 HZ2 LYS 1 HZ2 LYS 1 -7.134 3.971 -0.428
15 HZ3 LYS 1 HZ3 LYS 1 -8.036 3.663 0.908
16 H LEU 2 H LEU 2 -9.005 0.236 -5.011
17 HA LEU 2 HA LEU 2 -9.802 -0.970 -7.455
18 HB2 LEU 2 HB2 LEU 2 -7.141 -1.399 -6.091
19 HB3 LEU 2 HB3 LEU 2 -7.478 -1.529 -7.720
20 HG LEU 2 HG LEU 2 -7.712 0.823 -8.097
21 HD11 LEU 2 HD11 LEU 2 -8.357 1.908 -6.077
22 HD12 LEU 2 HD12 LEU 2 -7.008 1.178 -5.153
23 HD13 LEU 2 HD13 LEU 2 -6.713 2.409 -6.386
24 HD21 LEU 2 HD21 LEU 2 -5.297 1.287 -7.842
25 HD22 LEU 2 HD22 LEU 2 -5.150 -0.054 -6.683
26 HD23 LEU 2 HD23 LEU 2 -5.577 -0.371 -8.373
27 HA PRO 3 HA PRO 3 -10.902 -5.067 -6.809
28 HB2 PRO 3 HB2 PRO 3 -8.213 -5.918 -7.961
29 HB3 PRO 3 HB3 PRO 3 -9.825 -6.583 -8.407
30 HG2 PRO 3 HG2 PRO 3 -8.744 -4.777 -10.008
31 HG3 PRO 3 HG3 PRO 3 -10.426 -4.442 -9.436
32 HD2 PRO 3 HD2 PRO 3 -7.807 -3.460 -8.238
33 HD3 PRO 3 HD3 PRO 3 -9.221 -2.494 -8.678
34 HA PRO 4 HA PRO 4 -9.098 -7.785 -3.640
35 HB2 PRO 4 HB2 PRO 4 -10.158 -10.213 -4.393
36 HB3 PRO 4 HB3 PRO 4 -11.107 -8.945 -3.554
37 HG2 PRO 4 HG2 PRO 4 -10.983 -9.522 -6.527
38 HG3 PRO 4 HG3 PRO 4 -12.434 -9.244 -5.509
39 HD2 PRO 4 HD2 PRO 4 -11.368 -7.270 -7.006
40 HD3 PRO 4 HD3 PRO 4 -12.005 -6.921 -5.376
41 H GLY 5 H GLY 5 -7.180 -9.009 -3.602
42 HA2 GLY 5 HA2 GLY 5 -5.465 -10.376 -4.804
43 HA3 GLY 5 HA3 GLY 5 -5.863 -9.463 -6.248
44 H TRP 6 H TRP 6 -6.103 -6.722 -4.873
45 HA TRP 6 HA TRP 6 -3.274 -6.100 -4.659
46 HB2 TRP 6 HB2 TRP 6 -5.843 -4.618 -4.063
47 HB3 TRP 6 HB3 TRP 6 -4.234 -3.953 -3.831
48 HD1 TRP 6 HD1 TRP 6 -6.733 -4.579 -6.555
49 HE1 TRP 6 HE1 TRP 6 -5.900 -3.459 -8.710
50 HE3 TRP 6 HE3 TRP 6 -1.985 -3.541 -5.094
51 HZ2 TRP 6 HZ2 TRP 6 -3.439 -2.281 -9.692
52 HZ3 TRP 6 HZ3 TRP 6 -0.428 -2.443 -6.600
53 HH2 TRP 6 HH2 TRP 6 -1.115 -1.779 -8.923
54 H GLU 7 H GLU 7 -1.970 -6.444 -2.949
55 HA GLU 7 HA GLU 7 -3.128 -6.486 -0.207
56 HB2 GLU 7 HB2 GLU 7 -2.674 -8.739 -1.594
57 HB3 GLU 7 HB3 GLU 7 -1.026 -8.485 -1.045
58 HG2 GLU 7 HG2 GLU 7 -3.494 -8.606 0.764
59 HG3 GLU 7 HG3 GLU 7 -2.492 -10.000 0.362
60 H LYS 8 H LYS 8 -1.645 -6.029 1.470
61 HA LYS 8 HA LYS 8 -0.041 -3.729 0.955
62 HB2 LYS 8 HB2 LYS 8 -1.146 -3.634 2.917
63 HB3 LYS 8 HB3 LYS 8 -1.016 -5.311 3.292
64 HG2 LYS 8 HG2 LYS 8 1.277 -3.333 3.592
65 HG3 LYS 8 HG3 LYS 8 0.087 -3.673 4.837
66 HD2 LYS 8 HD2 LYS 8 2.306 -5.482 3.877
67 HD3 LYS 8 HD3 LYS 8 1.958 -4.870 5.464
68 HE2 LYS 8 HE2 LYS 8 1.425 -7.109 5.623
69 HE3 LYS 8 HE3 LYS 8 -0.154 -6.333 5.488
70 HZ1 LYS 8 HZ1 LYS 8 0.488 -8.420 3.994
71 HZ2 LYS 8 HZ2 LYS 8 -0.468 -7.285 3.382
72 HZ3 LYS 8 HZ3 LYS 8 1.106 -7.255 3.002
73 H ARG 9 H ARG 9 2.093 -3.326 0.917
74 HA ARG 9 HA ARG 9 4.106 -5.390 1.584
75 HB2 ARG 9 HB2 ARG 9 3.944 -3.917 -1.085
76 HB3 ARG 9 HB3 ARG 9 5.353 -4.826 -0.545
77 HG2 ARG 9 HG2 ARG 9 2.609 -6.003 -1.118
78 HG3 ARG 9 HG3 ARG 9 4.017 -6.044 -2.184
79 HD2 ARG 9 HD2 ARG 9 5.261 -7.421 -0.631
80 HD3 ARG 9 HD3 ARG 9 3.967 -7.348 0.561
81 HE ARG 9 HE ARG 9 4.025 -8.925 -1.936
82 HH11 ARG 9 HH21 ARG 9 1.947 -7.784 0.636
83 HH12 ARG 9 HH22 ARG 9 0.876 -9.134 0.646
84 HH21 ARG 9 HH11 ARG 9 2.557 -10.677 -2.070
85 HH22 ARG 9 HH12 ARG 9 1.188 -10.668 -0.982
86 H MET 10 H MET 10 6.372 -4.290 1.509
87 HA MET 10 HA MET 10 6.189 -1.464 2.391
88 HB2 MET 10 HB2 MET 10 6.013 -2.975 4.364
89 HB3 MET 10 HB3 MET 10 7.572 -3.695 3.927
90 HG2 MET 10 HG2 MET 10 8.627 -1.450 4.128
91 HG3 MET 10 HG3 MET 10 7.077 -0.764 4.600
92 HE1 MET 10 HE1 MET 10 6.532 -1.868 8.201
93 HE2 MET 10 HE2 MET 10 6.247 -0.610 6.979
94 HE3 MET 10 HE3 MET 10 5.690 -2.278 6.689
95 H PHE 11 H PHE 11 7.813 -0.198 1.703
96 HA PHE 11 HA PHE 11 9.696 -1.243 -0.195
97 HB2 PHE 11 HB2 PHE 11 8.468 0.967 -0.275
98 HB3 PHE 11 HB3 PHE 11 9.579 1.550 0.954
99 HD1 PHE 11 HD1 PHE 11 12.069 1.654 0.418
100 HD2 PHE 11 HD2 PHE 11 9.113 0.740 -2.582
101 HE1 PHE 11 HE1 PHE 11 13.713 2.183 -1.362
102 HE2 PHE 11 HE2 PHE 11 10.765 1.250 -4.360
103 HZ PHE 11 HZ PHE 11 13.066 1.973 -3.757
104 H ARG 12 H ARG 12 11.269 -2.476 0.551
105 HA ARG 12 HA ARG 12 12.763 -2.434 2.845
106 HB2 ARG 12 HB2 ARG 12 14.695 -3.299 1.297
107 HB3 ARG 12 HB3 ARG 12 13.237 -4.227 1.563
108 HG2 ARG 12 HG2 ARG 12 13.880 -4.404 -0.740
109 HG3 ARG 12 HG3 ARG 12 12.333 -3.603 -0.610
110 HD2 ARG 12 HD2 ARG 12 13.508 -2.501 -2.319
111 HD3 ARG 12 HD3 ARG 12 13.514 -1.387 -0.974
112 HE ARG 12 HE ARG 12 15.807 -3.199 -1.694
113 HH11 ARG 12 HH11 ARG 12 14.924 -0.031 -0.492
114 HH12 ARG 12 HH12 ARG 12 16.425 0.701 -1.025
115 HH21 ARG 12 HH21 ARG 12 17.792 -2.286 -2.121
116 HH22 ARG 12 HH22 ARG 12 18.058 -0.607 -1.772
117 H SER 13 H SER 13 14.476 -1.499 3.716
118 HA SER 13 HA SER 13 16.021 -0.026 4.280
119 HB2 SER 13 HB2 SER 13 17.028 -0.469 2.041
120 HB3 SER 13 HB3 SER 13 16.183 0.978 1.436
121 HG SER 13 HG SER 13 17.179 2.029 3.344
122 H ASN 14 H ASN 14 12.948 1.107 3.345
123 HA ASN 14 HA ASN 14 13.562 3.410 5.074
124 HB2 ASN 14 HB2 ASN 14 12.540 5.085 3.751
125 HB3 ASN 14 HB3 ASN 14 13.802 4.315 2.807
126 HD21 ASN 14 HD22 ASN 14 12.999 4.834 0.726
127 HD22 ASN 14 HD21 ASN 14 11.444 4.232 0.188
128 H GLY 15 H GLY 15 11.104 1.129 3.901
129 HA2 GLY 15 HA2 GLY 15 9.606 0.191 5.432
130 HA3 GLY 15 HA3 GLY 15 9.723 1.596 6.484
131 H THR 16 H THR 16 9.275 2.652 3.272
132 HA THR 16 HA THR 16 6.687 3.723 3.717
133 HB THR 16 HB THR 16 7.931 3.095 1.008
134 HG1 THR 16 HG1 THR 16 9.375 4.296 2.134
135 HG21 THR 16 HG21 THR 16 6.622 5.060 0.274
136 HG22 THR 16 HG22 THR 16 5.564 3.766 0.862
137 HG23 THR 16 HG23 THR 16 5.892 5.182 1.890
138 H VAL 17 H VAL 17 4.806 2.590 3.982
139 HA VAL 17 HA VAL 17 4.520 -0.077 2.815
140 HB VAL 17 HB VAL 17 2.682 1.659 4.476
141 HG11 VAL 17 HG11 VAL 17 2.055 -1.100 3.348
142 HG12 VAL 17 HG12 VAL 17 1.155 -0.307 4.658
143 HG13 VAL 17 HG13 VAL 17 1.153 0.403 3.044
144 HG21 VAL 17 HG21 VAL 17 4.599 0.501 5.599
145 HG22 VAL 17 HG22 VAL 17 3.042 -0.151 6.132
146 HG23 VAL 17 HG23 VAL 17 4.016 -1.051 4.947
147 H TYR 18 H TYR 18 3.217 -0.711 1.232
148 HA TYR 18 HA TYR 18 1.676 1.143 -0.426
149 HB2 TYR 18 HB2 TYR 18 2.939 0.909 -2.407
150 HB3 TYR 18 HB3 TYR 18 4.069 1.396 -1.173
151 HD1 TYR 18 HD2 TYR 18 5.706 -0.295 -0.236
152 HD2 TYR 18 HD1 TYR 18 3.202 -1.088 -3.650
153 HE1 TYR 18 HE2 TYR 18 7.206 -2.179 -0.912
154 HE2 TYR 18 HE1 TYR 18 4.672 -3.004 -4.290
155 HH TYR 18 HH TYR 18 7.618 -3.811 -2.444
156 H TYR 19 H TYR 19 1.059 -0.445 -2.575
157 HA TYR 19 HA TYR 19 0.352 -3.112 -1.463
158 HB2 TYR 19 HB2 TYR 19 -1.460 -0.991 -2.540
159 HB3 TYR 19 HB3 TYR 19 -1.792 -2.640 -2.992
160 HD1 TYR 19 HD1 TYR 19 -0.987 -0.734 0.193
161 HD2 TYR 19 HD2 TYR 19 -3.250 -3.869 -1.705
162 HE1 TYR 19 HE1 TYR 19 -2.144 -1.232 2.334
163 HE2 TYR 19 HE2 TYR 19 -4.496 -4.264 0.398
164 HH TYR 19 HH TYR 19 -5.033 -2.762 2.530
165 H PHE 20 H PHE 20 0.055 -4.730 -2.837
166 HA PHE 20 HA PHE 20 1.179 -4.538 -5.598
167 HB2 PHE 20 HB2 PHE 20 2.911 -5.210 -4.066
168 HB3 PHE 20 HB3 PHE 20 1.844 -6.387 -3.289
169 HD1 PHE 20 HD1 PHE 20 3.707 -5.632 -6.426
170 HD2 PHE 20 HD2 PHE 20 1.601 -8.634 -4.139
171 HE1 PHE 20 HE1 PHE 20 4.638 -7.405 -7.887
172 HE2 PHE 20 HE2 PHE 20 2.582 -10.403 -5.580
173 HZ PHE 20 HZ PHE 20 4.096 -9.796 -7.444
174 H ASN 21 H ASN 21 -0.118 -5.478 -7.058
175 HA ASN 21 HA ASN 21 -2.445 -7.048 -6.209
176 HB2 ASN 21 HB2 ASN 21 -2.528 -5.372 -8.087
177 HB3 ASN 21 HB3 ASN 21 -1.455 -6.416 -8.989
178 HD21 ASN 21 HD22 ASN 21 -4.765 -5.984 -7.758
179 HD22 ASN 21 HD21 ASN 21 -5.383 -7.434 -8.536
180 H HIS 22 H HIS 22 -1.869 -8.977 -5.369
181 HA HIS 22 HA HIS 22 0.394 -10.461 -6.311
182 HB2 HIS 22 HB2 HIS 22 0.008 -11.853 -4.521
183 HB3 HIS 22 HB3 HIS 22 -0.662 -10.341 -3.955
184 HD1 HIS 22 HD1 HIS 22 -2.032 -13.504 -5.705
185 HD2 HIS 22 HD2 HIS 22 -3.062 -10.568 -2.885
186 HE1 HIS 22 HE1 HIS 22 -4.337 -14.186 -4.722
187 H ILE 23 H ILE 23 -2.393 -10.075 -7.992
188 HA ILE 23 HA ILE 23 -2.513 -12.868 -9.026
189 HB ILE 23 HB ILE 23 -4.507 -10.575 -9.248
190 HG12 ILE 23 HG12 ILE 23 -4.501 -13.058 -7.468
191 HG13 ILE 23 HG13 ILE 23 -4.362 -11.386 -6.931
192 HG21 ILE 23 HG21 ILE 23 -4.814 -13.505 -10.013
193 HG22 ILE 23 HG22 ILE 23 -6.054 -12.236 -10.148
194 HG23 ILE 23 HG23 ILE 23 -4.625 -12.160 -11.163
195 HD11 ILE 23 HD11 ILE 23 -6.579 -12.056 -6.455
196 HD12 ILE 23 HD12 ILE 23 -6.685 -10.963 -7.850
197 HD13 ILE 23 HD13 ILE 23 -6.830 -12.725 -8.070
198 H THR 24 H THR 24 -1.776 -9.536 -9.853
199 HA THR 24 HA THR 24 -1.107 -10.300 -12.683
200 HB THR 24 HB THR 24 -1.407 -7.917 -13.205
201 HG1 THR 24 HG1 THR 24 -2.390 -7.704 -10.580
202 HG21 THR 24 HG21 THR 24 -3.426 -9.347 -13.394
203 HG22 THR 24 HG22 THR 24 -3.844 -8.986 -11.706
204 HG23 THR 24 HG23 THR 24 -3.824 -7.685 -12.909
205 H ASN 25 H ASN 25 0.280 -9.158 -9.753
206 HA ASN 25 HA ASN 25 2.205 -8.541 -9.048
207 HB2 ASN 25 HB2 ASN 25 4.081 -9.319 -9.873
208 HB3 ASN 25 HB3 ASN 25 3.084 -10.078 -11.100
209 HD21 ASN 25 HD22 ASN 25 2.639 -8.324 -13.046
210 HD22 ASN 25 HD21 ASN 25 4.174 -7.605 -13.588
211 H ALA 26 H ALA 26 0.220 -6.637 -10.703
212 HA ALA 26 HA ALA 26 1.798 -4.306 -11.171
213 HB1 ALA 26 HB1 ALA 26 -0.501 -4.679 -12.024
214 HB2 ALA 26 HB2 ALA 26 -1.134 -4.529 -10.369
215 HB3 ALA 26 HB3 ALA 26 -0.356 -3.141 -11.155
216 H SER 27 H SER 27 1.788 -2.259 -9.932
217 HA SER 27 HA SER 27 1.911 -2.615 -6.966
218 HB2 SER 27 HB2 SER 27 4.001 -1.337 -7.051
219 HB3 SER 27 HB3 SER 27 4.139 -2.815 -8.027
220 HG SER 27 HG SER 27 3.295 -0.364 -9.170
221 H GLN 28 H GLN 28 1.096 -0.901 -5.749
222 HA GLN 28 HA GLN 28 0.689 1.763 -6.956
223 HB2 GLN 28 HB2 GLN 28 -1.341 0.536 -7.530
224 HB3 GLN 28 HB3 GLN 28 -1.499 -0.072 -5.884
225 HG2 GLN 28 HG2 GLN 28 -3.123 1.708 -6.465
226 HG3 GLN 28 HG3 GLN 28 -2.154 2.050 -5.044
227 HE21 GLN 28 HE22 GLN 28 -2.183 2.771 -8.644
228 HE22 GLN 28 HE21 GLN 28 -1.543 4.381 -8.360
229 H PHE 29 H PHE 29 0.303 3.412 -5.246
230 HA PHE 29 HA PHE 29 1.511 2.621 -2.658
231 HB2 PHE 29 HB2 PHE 29 0.907 5.347 -3.812
232 HB3 PHE 29 HB3 PHE 29 1.777 5.012 -2.315
233 HD1 PHE 29 HD1 PHE 29 3.790 3.152 -2.699
234 HD2 PHE 29 HD2 PHE 29 2.274 5.909 -5.651
235 HE1 PHE 29 HE1 PHE 29 5.913 2.967 -3.962
236 HE2 PHE 29 HE2 PHE 29 4.403 5.720 -6.911
237 HZ PHE 29 HZ PHE 29 6.223 4.249 -6.071
238 H GLU 30 H GLU 30 -1.556 3.991 -3.979
239 HA GLU 30 HA GLU 30 -2.693 4.159 -1.312
240 HB2 GLU 30 HB2 GLU 30 -3.557 4.836 -4.006
241 HB3 GLU 30 HB3 GLU 30 -4.820 3.928 -3.199
242 HG2 GLU 30 HG2 GLU 30 -3.450 6.440 -2.135
243 HG3 GLU 30 HG3 GLU 30 -5.084 6.344 -2.806
244 H ARG 31 H ARG 31 -4.426 2.968 -0.518
245 HA ARG 31 HA ARG 31 -3.821 0.045 -0.586
246 HB2 ARG 31 HB2 ARG 31 -5.326 1.696 1.447
247 HB3 ARG 31 HB3 ARG 31 -4.803 0.039 1.670
248 HG2 ARG 31 HG2 ARG 31 -2.493 0.709 1.930
249 HG3 ARG 31 HG3 ARG 31 -2.731 2.233 1.244
250 HD2 ARG 31 HD2 ARG 31 -3.720 1.269 3.950
251 HD3 ARG 31 HD3 ARG 31 -2.476 2.489 3.647
252 HE ARG 31 HE ARG 31 -5.397 2.764 3.573
253 HH11 ARG 31 HH12 ARG 31 -2.487 4.365 2.226
254 HH12 ARG 31 HH11 ARG 31 -3.581 5.491 1.368
255 HH21 ARG 31 HH21 ARG 31 -6.482 4.371 2.526
256 HH22 ARG 31 HH22 ARG 31 -5.507 5.497 1.518
257 HA PRO 32 HA PRO 32 -7.857 0.219 -2.598
258 HB2 PRO 32 HB2 PRO 32 -7.557 -2.722 -3.232
259 HB3 PRO 32 HB3 PRO 32 -8.063 -1.374 -4.182
260 HG2 PRO 32 HG2 PRO 32 -5.631 -2.322 -4.496
261 HG3 PRO 32 HG3 PRO 32 -5.817 -0.609 -4.540
262 HD2 PRO 32 HD2 PRO 32 -5.017 -2.213 -2.091
263 HD3 PRO 32 HD3 PRO 32 -4.247 -0.734 -2.738
264 H SER 33 H SER 33 -6.974 -1.792 -0.281
265 HA SER 33 HA SER 33 -9.480 -2.818 0.814
266 HB2 SER 33 HB2 SER 33 -8.186 -3.310 2.848
267 HB3 SER 33 HB3 SER 33 -7.322 -3.835 1.393
268 HG SER 33 HG SER 33 -6.851 -1.475 2.925
269 H GLY 34 H GLY 34 -7.919 0.362 1.134
270 HA2 GLY 34 HA2 GLY 34 -9.784 1.933 2.282
271 HA3 GLY 34 HA3 GLY 34 -9.318 0.948 3.671
Start of MODEL 4
1 H1 LYS 1 H1 LYS 1 -13.535 0.284 -4.415
2 H2 LYS 1 H2 LYS 1 -13.281 1.281 -3.118
3 H3 LYS 1 H3 LYS 1 -12.420 -0.127 -3.298
4 HA LYS 1 HA LYS 1 -12.308 2.173 -5.136
5 HB2 LYS 1 HB2 LYS 1 -10.278 1.294 -3.046
6 HB3 LYS 1 HB3 LYS 1 -9.983 2.495 -4.317
7 HG2 LYS 1 HG2 LYS 1 -12.010 3.775 -3.439
8 HG3 LYS 1 HG3 LYS 1 -11.959 2.726 -2.014
9 HD2 LYS 1 HD2 LYS 1 -9.679 4.489 -3.015
10 HD3 LYS 1 HD3 LYS 1 -10.781 4.926 -1.707
11 HE2 LYS 1 HE2 LYS 1 -9.932 3.248 -0.244
12 HE3 LYS 1 HE3 LYS 1 -9.180 2.360 -1.578
13 HZ1 LYS 1 HZ1 LYS 1 -7.477 3.448 -0.482
14 HZ2 LYS 1 HZ2 LYS 1 -7.627 4.131 -1.907
15 HZ3 LYS 1 HZ3 LYS 1 -8.193 4.965 -0.583
16 H LEU 2 H LEU 2 -9.283 0.890 -5.340
17 HA LEU 2 HA LEU 2 -9.867 -0.598 -7.676
18 HB2 LEU 2 HB2 LEU 2 -7.234 -0.842 -6.228
19 HB3 LEU 2 HB3 LEU 2 -7.538 -1.065 -7.847
20 HG LEU 2 HG LEU 2 -7.821 1.213 -8.397
21 HD11 LEU 2 HD11 LEU 2 -8.640 2.398 -6.485
22 HD12 LEU 2 HD12 LEU 2 -7.290 1.812 -5.461
23 HD13 LEU 2 HD13 LEU 2 -7.020 2.971 -6.774
24 HD21 LEU 2 HD21 LEU 2 -5.308 0.549 -6.781
25 HD22 LEU 2 HD22 LEU 2 -5.621 0.106 -8.463
26 HD23 LEU 2 HD23 LEU 2 -5.436 1.804 -8.027
27 HA PRO 3 HA PRO 3 -10.896 -4.644 -6.914
28 HB2 PRO 3 HB2 PRO 3 -8.135 -5.507 -7.873
29 HB3 PRO 3 HB3 PRO 3 -9.707 -6.214 -8.361
30 HG2 PRO 3 HG2 PRO 3 -8.553 -4.471 -9.989
31 HG3 PRO 3 HG3 PRO 3 -10.282 -4.171 -9.555
32 HD2 PRO 3 HD2 PRO 3 -7.790 -2.997 -8.258
33 HD3 PRO 3 HD3 PRO 3 -9.229 -2.141 -8.858
34 HA PRO 4 HA PRO 4 -9.229 -7.088 -3.470
35 HB2 PRO 4 HB2 PRO 4 -10.270 -9.561 -4.071
36 HB3 PRO 4 HB3 PRO 4 -11.255 -8.228 -3.388
37 HG2 PRO 4 HG2 PRO 4 -10.985 -9.052 -6.292
38 HG3 PRO 4 HG3 PRO 4 -12.484 -8.690 -5.376
39 HD2 PRO 4 HD2 PRO 4 -11.322 -6.851 -6.979
40 HD3 PRO 4 HD3 PRO 4 -12.062 -6.365 -5.429
41 H GLY 5 H GLY 5 -7.317 -8.308 -3.286
42 HA2 GLY 5 HA2 GLY 5 -5.567 -9.758 -4.320
43 HA3 GLY 5 HA3 GLY 5 -5.908 -8.958 -5.847
44 H TRP 6 H TRP 6 -6.175 -6.099 -4.714
45 HA TRP 6 HA TRP 6 -3.357 -5.483 -4.409
46 HB2 TRP 6 HB2 TRP 6 -5.934 -3.929 -4.009
47 HB3 TRP 6 HB3 TRP 6 -4.324 -3.275 -3.776
48 HD1 TRP 6 HD1 TRP 6 -6.734 -4.049 -6.518
49 HE1 TRP 6 HE1 TRP 6 -5.828 -3.009 -8.686
50 HE3 TRP 6 HE3 TRP 6 -2.037 -2.956 -4.931
51 HZ2 TRP 6 HZ2 TRP 6 -3.299 -1.919 -9.639
52 HZ3 TRP 6 HZ3 TRP 6 -0.419 -1.908 -6.422
53 HH2 TRP 6 HH2 TRP 6 -1.013 -1.380 -8.795
54 H GLU 7 H GLU 7 -2.159 -5.848 -2.614
55 HA GLU 7 HA GLU 7 -3.439 -5.782 0.079
56 HB2 GLU 7 HB2 GLU 7 -3.140 -8.050 -1.143
57 HB3 GLU 7 HB3 GLU 7 -1.418 -7.857 -0.852
58 HG2 GLU 7 HG2 GLU 7 -3.611 -7.902 1.278
59 HG3 GLU 7 HG3 GLU 7 -2.679 -9.308 0.772
60 H LYS 8 H LYS 8 -2.037 -5.265 1.800
61 HA LYS 8 HA LYS 8 -0.208 -3.161 1.404
62 HB2 LYS 8 HB2 LYS 8 -1.434 -3.184 3.362
63 HB3 LYS 8 HB3 LYS 8 -1.173 -4.852 3.708
64 HG2 LYS 8 HG2 LYS 8 1.019 -2.756 3.933
65 HG3 LYS 8 HG3 LYS 8 -0.124 -3.111 5.218
66 HD2 LYS 8 HD2 LYS 8 2.107 -4.895 4.217
67 HD3 LYS 8 HD3 LYS 8 1.835 -4.213 5.791
68 HE2 LYS 8 HE2 LYS 8 1.348 -6.429 6.115
69 HE3 LYS 8 HE3 LYS 8 -0.257 -5.707 5.983
70 HZ1 LYS 8 HZ1 LYS 8 -0.595 -6.781 3.925
71 HZ2 LYS 8 HZ2 LYS 8 0.951 -6.787 3.522
72 HZ3 LYS 8 HZ3 LYS 8 0.371 -7.873 4.632
73 H ARG 9 H ARG 9 1.942 -2.954 1.246
74 HA ARG 9 HA ARG 9 3.769 -5.105 2.090
75 HB2 ARG 9 HB2 ARG 9 3.843 -3.879 -0.698
76 HB3 ARG 9 HB3 ARG 9 5.083 -4.945 -0.035
77 HG2 ARG 9 HG2 ARG 9 2.209 -5.683 -0.671
78 HG3 ARG 9 HG3 ARG 9 3.631 -6.114 -1.613
79 HD2 ARG 9 HD2 ARG 9 4.261 -7.815 -0.219
80 HD3 ARG 9 HD3 ARG 9 3.689 -7.009 1.229
81 HE ARG 9 HE ARG 9 1.476 -7.723 0.886
82 HH11 ARG 9 HH11 ARG 9 3.466 -9.038 -1.696
83 HH12 ARG 9 HH12 ARG 9 2.370 -10.370 -1.977
84 HH21 ARG 9 HH22 ARG 9 0.193 -9.307 0.528
85 HH22 ARG 9 HH21 ARG 9 0.415 -10.498 -0.766
86 H MET 10 H MET 10 6.136 -4.226 1.830
87 HA MET 10 HA MET 10 6.238 -1.349 2.536
88 HB2 MET 10 HB2 MET 10 6.030 -2.684 4.621
89 HB3 MET 10 HB3 MET 10 7.468 -3.611 4.157
90 HG2 MET 10 HG2 MET 10 8.777 -1.482 4.125
91 HG3 MET 10 HG3 MET 10 7.349 -0.609 4.673
92 HE1 MET 10 HE1 MET 10 6.706 -0.298 7.116
93 HE2 MET 10 HE2 MET 10 5.996 -1.924 6.944
94 HE3 MET 10 HE3 MET 10 6.988 -1.529 8.366
95 H PHE 11 H PHE 11 7.866 -0.301 1.591
96 HA PHE 11 HA PHE 11 9.564 -1.624 -0.283
97 HB2 PHE 11 HB2 PHE 11 8.502 0.705 -0.354
98 HB3 PHE 11 HB3 PHE 11 9.827 1.233 0.660
99 HD1 PHE 11 HD1 PHE 11 12.291 0.535 -0.291
100 HD2 PHE 11 HD2 PHE 11 8.693 0.818 -2.664
101 HE1 PHE 11 HE1 PHE 11 13.654 0.783 -2.332
102 HE2 PHE 11 HE2 PHE 11 10.072 1.085 -4.704
103 HZ PHE 11 HZ PHE 11 12.552 1.070 -4.548
104 H ARG 12 H ARG 12 10.769 -3.102 0.812
105 HA ARG 12 HA ARG 12 12.533 -2.933 2.906
106 HB2 ARG 12 HB2 ARG 12 12.042 -4.924 1.543
107 HB3 ARG 12 HB3 ARG 12 12.952 -4.262 0.196
108 HG2 ARG 12 HG2 ARG 12 14.634 -4.339 2.607
109 HG3 ARG 12 HG3 ARG 12 13.861 -5.897 2.356
110 HD2 ARG 12 HD2 ARG 12 16.010 -5.879 1.247
111 HD3 ARG 12 HD3 ARG 12 14.724 -6.000 0.051
112 HE ARG 12 HE ARG 12 16.228 -3.458 0.704
113 HH11 ARG 12 HH11 ARG 12 14.618 -5.334 -1.798
114 HH12 ARG 12 HH12 ARG 12 15.001 -4.143 -3.014
115 HH21 ARG 12 HH21 ARG 12 16.622 -2.076 -0.747
116 HH22 ARG 12 HH22 ARG 12 16.178 -2.281 -2.439
117 H SER 13 H SER 13 14.322 -1.931 3.400
118 HA SER 13 HA SER 13 16.284 -0.819 3.364
119 HB2 SER 13 HB2 SER 13 15.932 -0.196 0.416
120 HB3 SER 13 HB3 SER 13 17.317 0.222 1.415
121 HG SER 13 HG SER 13 17.878 -1.843 1.621
122 H ASN 14 H ASN 14 13.187 0.556 2.703
123 HA ASN 14 HA ASN 14 14.234 2.883 4.199
124 HB2 ASN 14 HB2 ASN 14 13.186 4.561 2.852
125 HB3 ASN 14 HB3 ASN 14 14.312 3.629 1.877
126 HD21 ASN 14 HD21 ASN 14 13.470 3.572 -0.209
127 HD22 ASN 14 HD22 ASN 14 11.790 3.203 -0.532
128 H GLY 15 H GLY 15 11.419 0.865 3.422
129 HA2 GLY 15 HA2 GLY 15 10.013 0.162 5.178
130 HA3 GLY 15 HA3 GLY 15 10.377 1.606 6.108
131 H THR 16 H THR 16 9.708 2.551 2.916
132 HA THR 16 HA THR 16 7.245 3.835 3.493
133 HB THR 16 HB THR 16 8.242 2.960 0.750
134 HG1 THR 16 HG1 THR 16 9.840 4.115 1.658
135 HG21 THR 16 HG21 THR 16 5.921 3.795 0.709
136 HG22 THR 16 HG22 THR 16 6.416 5.241 1.622
137 HG23 THR 16 HG23 THR 16 7.025 4.970 -0.025
138 H VAL 17 H VAL 17 5.323 2.831 3.990
139 HA VAL 17 HA VAL 17 4.738 0.158 2.932
140 HB VAL 17 HB VAL 17 3.215 2.055 4.724
141 HG11 VAL 17 HG11 VAL 17 2.229 -0.641 3.697
142 HG12 VAL 17 HG12 VAL 17 1.534 0.249 5.067
143 HG13 VAL 17 HG13 VAL 17 1.449 0.939 3.447
144 HG21 VAL 17 HG21 VAL 17 3.565 0.223 6.353
145 HG22 VAL 17 HG22 VAL 17 4.315 -0.773 5.085
146 HG23 VAL 17 HG23 VAL 17 5.118 0.713 5.657
147 H TYR 18 H TYR 18 3.207 -0.400 1.503
148 HA TYR 18 HA TYR 18 1.776 1.551 -0.141
149 HB2 TYR 18 HB2 TYR 18 2.983 1.235 -2.141
150 HB3 TYR 18 HB3 TYR 18 4.194 1.572 -0.924
151 HD1 TYR 18 HD2 TYR 18 5.646 -0.246 -0.043
152 HD2 TYR 18 HD1 TYR 18 3.048 -0.740 -3.413
153 HE1 TYR 18 HE2 TYR 18 6.907 -2.338 -0.727
154 HE2 TYR 18 HE1 TYR 18 4.226 -2.830 -4.057
155 HH TYR 18 HH TYR 18 5.973 -4.242 -3.573
156 H TYR 19 H TYR 19 0.947 0.020 -2.270
157 HA TYR 19 HA TYR 19 0.158 -2.607 -1.121
158 HB2 TYR 19 HB2 TYR 19 -1.554 -0.416 -2.136
159 HB3 TYR 19 HB3 TYR 19 -1.943 -2.005 -2.723
160 HD1 TYR 19 HD2 TYR 19 -1.152 -0.385 0.636
161 HD2 TYR 19 HD1 TYR 19 -3.540 -3.176 -1.589
162 HE1 TYR 19 HE2 TYR 19 -2.438 -0.954 2.685
163 HE2 TYR 19 HE1 TYR 19 -4.826 -3.732 0.437
164 HH TYR 19 HH TYR 19 -5.166 -3.346 2.649
165 H PHE 20 H PHE 20 -0.122 -4.222 -2.451
166 HA PHE 20 HA PHE 20 1.073 -4.095 -5.195
167 HB2 PHE 20 HB2 PHE 20 2.747 -4.797 -3.545
168 HB3 PHE 20 HB3 PHE 20 1.619 -5.978 -2.881
169 HD1 PHE 20 HD1 PHE 20 3.531 -5.133 -5.995
170 HD2 PHE 20 HD2 PHE 20 1.493 -8.198 -3.737
171 HE1 PHE 20 HE1 PHE 20 4.477 -6.871 -7.491
172 HE2 PHE 20 HE2 PHE 20 2.489 -9.932 -5.217
173 HZ PHE 20 HZ PHE 20 3.961 -9.276 -7.090
174 H ASN 21 H ASN 21 -0.153 -5.105 -6.686
175 HA ASN 21 HA ASN 21 -2.519 -6.623 -5.868
176 HB2 ASN 21 HB2 ASN 21 -2.430 -5.038 -7.858
177 HB3 ASN 21 HB3 ASN 21 -1.440 -6.249 -8.659
178 HD21 ASN 21 HD22 ASN 21 -4.686 -5.295 -8.068
179 HD22 ASN 21 HD21 ASN 21 -5.400 -6.856 -8.475
180 H HIS 22 H HIS 22 -2.003 -8.505 -4.891
181 HA HIS 22 HA HIS 22 0.281 -10.075 -5.702
182 HB2 HIS 22 HB2 HIS 22 -0.163 -11.388 -3.861
183 HB3 HIS 22 HB3 HIS 22 -0.777 -9.826 -3.361
184 HD1 HIS 22 HD1 HIS 22 -2.217 -13.047 -4.938
185 HD2 HIS 22 HD2 HIS 22 -3.220 -9.898 -2.349
186 HE1 HIS 22 HE1 HIS 22 -4.547 -13.610 -3.945
187 H ILE 23 H ILE 23 -2.525 -9.717 -7.380
188 HA ILE 23 HA ILE 23 -2.629 -12.531 -8.341
189 HB ILE 23 HB ILE 23 -4.671 -10.293 -8.635
190 HG12 ILE 23 HG12 ILE 23 -4.610 -12.712 -6.772
191 HG13 ILE 23 HG13 ILE 23 -4.505 -11.021 -6.290
192 HG21 ILE 23 HG21 ILE 23 -4.722 -11.945 -10.495
193 HG22 ILE 23 HG22 ILE 23 -4.891 -13.254 -9.301
194 HG23 ILE 23 HG23 ILE 23 -6.162 -12.024 -9.493
195 HD11 ILE 23 HD11 ILE 23 -6.943 -12.442 -7.390
196 HD12 ILE 23 HD12 ILE 23 -6.707 -11.718 -5.796
197 HD13 ILE 23 HD13 ILE 23 -6.829 -10.672 -7.226
198 H THR 24 H THR 24 -2.116 -9.133 -9.372
199 HA THR 24 HA THR 24 -1.370 -10.132 -12.097
200 HB THR 24 HB THR 24 -1.614 -7.896 -12.873
201 HG1 THR 24 HG1 THR 24 -2.345 -6.279 -11.444
202 HG21 THR 24 HG21 THR 24 -4.001 -8.465 -11.064
203 HG22 THR 24 HG22 THR 24 -3.983 -7.480 -12.543
204 HG23 THR 24 HG23 THR 24 -3.716 -9.230 -12.642
205 H ASN 25 H ASN 25 0.074 -8.695 -9.289
206 HA ASN 25 HA ASN 25 2.162 -8.319 -8.673
207 HB2 ASN 25 HB2 ASN 25 3.213 -8.577 -11.498
208 HB3 ASN 25 HB3 ASN 25 4.143 -8.501 -10.015
209 HD21 ASN 25 HD22 ASN 25 2.063 -10.527 -11.974
210 HD22 ASN 25 HD21 ASN 25 2.511 -12.037 -11.152
211 H ALA 26 H ALA 26 0.148 -6.353 -10.276
212 HA ALA 26 HA ALA 26 1.797 -4.062 -10.803
213 HB1 ALA 26 HB1 ALA 26 -1.125 -4.208 -9.953
214 HB2 ALA 26 HB2 ALA 26 -0.317 -2.824 -10.719
215 HB3 ALA 26 HB3 ALA 26 -0.520 -4.334 -11.622
216 H SER 27 H SER 27 1.867 -2.018 -9.502
217 HA SER 27 HA SER 27 1.903 -2.405 -6.551
218 HB2 SER 27 HB2 SER 27 4.101 -3.102 -7.456
219 HB3 SER 27 HB3 SER 27 4.241 -1.543 -8.299
220 HG SER 27 HG SER 27 5.297 -1.350 -6.360
221 H GLN 28 H GLN 28 1.328 -0.529 -5.444
222 HA GLN 28 HA GLN 28 1.637 2.093 -6.699
223 HB2 GLN 28 HB2 GLN 28 -0.545 0.905 -7.552
224 HB3 GLN 28 HB3 GLN 28 -1.182 1.226 -5.939
225 HG2 GLN 28 HG2 GLN 28 -0.832 3.657 -6.306
226 HG3 GLN 28 HG3 GLN 28 -0.066 3.330 -7.861
227 HE21 GLN 28 HE22 GLN 28 -2.329 5.094 -7.706
228 HE22 GLN 28 HE21 GLN 28 -3.637 4.209 -8.475
229 H PHE 29 H PHE 29 1.251 3.865 -5.151
230 HA PHE 29 HA PHE 29 1.502 3.070 -2.342
231 HB2 PHE 29 HB2 PHE 29 1.353 5.811 -3.606
232 HB3 PHE 29 HB3 PHE 29 1.785 5.457 -1.937
233 HD1 PHE 29 HD2 PHE 29 3.753 3.502 -1.779
234 HD2 PHE 29 HD1 PHE 29 3.190 6.321 -5.000
235 HE1 PHE 29 HE2 PHE 29 6.129 3.254 -2.413
236 HE2 PHE 29 HE1 PHE 29 5.573 6.061 -5.632
237 HZ PHE 29 HZ PHE 29 7.046 4.529 -4.343
238 H GLU 30 H GLU 30 -1.163 3.892 -4.407
239 HA GLU 30 HA GLU 30 -3.040 4.706 -2.337
240 HB2 GLU 30 HB2 GLU 30 -3.751 5.362 -4.426
241 HB3 GLU 30 HB3 GLU 30 -3.097 3.947 -5.224
242 HG2 GLU 30 HG2 GLU 30 -5.483 4.017 -5.417
243 HG3 GLU 30 HG3 GLU 30 -4.950 2.567 -4.584
244 H ARG 31 H ARG 31 -4.170 3.477 -1.059
245 HA ARG 31 HA ARG 31 -3.768 0.539 -0.834
246 HB2 ARG 31 HB2 ARG 31 -3.181 1.838 1.101
247 HB3 ARG 31 HB3 ARG 31 -4.718 2.703 1.098
248 HG2 ARG 31 HG2 ARG 31 -4.943 -0.257 1.259
249 HG3 ARG 31 HG3 ARG 31 -4.061 0.518 2.596
250 HD2 ARG 31 HD2 ARG 31 -5.998 1.995 2.978
251 HD3 ARG 31 HD3 ARG 31 -6.921 1.023 1.803
252 HE ARG 31 HE ARG 31 -5.784 0.081 4.405
253 HH11 ARG 31 HH21 ARG 31 -8.007 -0.762 1.687
254 HH12 ARG 31 HH22 ARG 31 -8.465 -2.179 2.634
255 HH21 ARG 31 HH11 ARG 31 -6.420 -1.957 5.176
256 HH22 ARG 31 HH12 ARG 31 -7.595 -2.820 4.184
257 HA PRO 32 HA PRO 32 -7.983 0.783 -2.595
258 HB2 PRO 32 HB2 PRO 32 -7.571 -2.056 -3.490
259 HB3 PRO 32 HB3 PRO 32 -8.086 -0.616 -4.353
260 HG2 PRO 32 HG2 PRO 32 -5.661 -1.644 -4.685
261 HG3 PRO 32 HG3 PRO 32 -5.845 0.076 -4.685
262 HD2 PRO 32 HD2 PRO 32 -5.124 -1.647 -2.273
263 HD3 PRO 32 HD3 PRO 32 -4.251 -0.220 -2.876
264 H SER 33 H SER 33 -9.512 -1.561 -2.763
265 HA SER 33 HA SER 33 -10.951 -1.631 -0.380
266 HB2 SER 33 HB2 SER 33 -11.106 -3.711 -2.574
267 HB3 SER 33 HB3 SER 33 -12.416 -2.994 -1.625
268 HG SER 33 HG SER 33 -11.110 -2.118 -3.932
269 H GLY 34 H GLY 34 -8.062 -2.858 -0.155
270 HA2 GLY 34 HA2 GLY 34 -8.779 -5.514 1.050
271 HA3 GLY 34 HA3 GLY 34 -7.216 -5.147 0.304
Start of MODEL 5
1 H1 LYS 1 H1 LYS 1 -12.892 1.356 -3.600
2 H2 LYS 1 H2 LYS 1 -12.692 2.154 -2.160
3 H3 LYS 1 H3 LYS 1 -12.018 0.667 -2.392
4 HA LYS 1 HA LYS 1 -11.274 3.188 -3.724
5 HB2 LYS 1 HB2 LYS 1 -9.607 1.266 -2.049
6 HB3 LYS 1 HB3 LYS 1 -9.051 2.788 -2.765
7 HG2 LYS 1 HG2 LYS 1 -10.717 4.022 -1.338
8 HG3 LYS 1 HG3 LYS 1 -11.167 2.483 -0.594
9 HD2 LYS 1 HD2 LYS 1 -9.685 3.440 0.934
10 HD3 LYS 1 HD3 LYS 1 -8.724 2.213 0.102
11 HE2 LYS 1 HE2 LYS 1 -7.785 4.036 -1.373
12 HE3 LYS 1 HE3 LYS 1 -8.721 5.225 -0.451
13 HZ1 LYS 1 HZ1 LYS 1 -6.595 3.451 0.588
14 HZ2 LYS 1 HZ2 LYS 1 -6.444 5.065 0.358
15 HZ3 LYS 1 HZ3 LYS 1 -7.462 4.509 1.534
16 H LEU 2 H LEU 2 -8.607 1.616 -4.424
17 HA LEU 2 HA LEU 2 -9.485 0.569 -6.932
18 HB2 LEU 2 HB2 LEU 2 -6.832 -0.145 -5.700
19 HB3 LEU 2 HB3 LEU 2 -7.232 -0.156 -7.300
20 HG LEU 2 HG LEU 2 -7.291 2.246 -7.528
21 HD11 LEU 2 HD11 LEU 2 -6.489 2.341 -4.588
22 HD12 LEU 2 HD12 LEU 2 -6.136 3.633 -5.741
23 HD13 LEU 2 HD13 LEU 2 -7.805 3.227 -5.415
24 HD21 LEU 2 HD21 LEU 2 -4.767 1.064 -6.273
25 HD22 LEU 2 HD22 LEU 2 -5.268 0.924 -7.963
26 HD23 LEU 2 HD23 LEU 2 -4.834 2.507 -7.310
27 HA PRO 3 HA PRO 3 -10.961 -3.389 -6.543
28 HB2 PRO 3 HB2 PRO 3 -8.373 -4.471 -7.719
29 HB3 PRO 3 HB3 PRO 3 -10.050 -4.955 -8.171
30 HG2 PRO 3 HG2 PRO 3 -8.784 -3.199 -9.716
31 HG3 PRO 3 HG3 PRO 3 -10.434 -2.743 -9.141
32 HD2 PRO 3 HD2 PRO 3 -7.746 -2.007 -7.920
33 HD3 PRO 3 HD3 PRO 3 -9.089 -0.919 -8.326
34 HA PRO 4 HA PRO 4 -9.473 -6.199 -3.371
35 HB2 PRO 4 HB2 PRO 4 -10.842 -8.506 -4.008
36 HB3 PRO 4 HB3 PRO 4 -11.609 -7.098 -3.207
37 HG2 PRO 4 HG2 PRO 4 -11.602 -7.790 -6.158
38 HG3 PRO 4 HG3 PRO 4 -12.992 -7.293 -5.139
39 HD2 PRO 4 HD2 PRO 4 -11.680 -5.529 -6.723
40 HD3 PRO 4 HD3 PRO 4 -12.278 -5.039 -5.112
41 H GLY 5 H GLY 5 -7.783 -7.643 -3.249
42 HA2 GLY 5 HA2 GLY 5 -6.236 -9.281 -4.416
43 HA3 GLY 5 HA3 GLY 5 -6.511 -8.373 -5.886
44 H TRP 6 H TRP 6 -6.374 -5.566 -4.559
45 HA TRP 6 HA TRP 6 -3.484 -5.338 -4.433
46 HB2 TRP 6 HB2 TRP 6 -5.827 -3.519 -3.819
47 HB3 TRP 6 HB3 TRP 6 -4.143 -3.060 -3.635
48 HD1 TRP 6 HD1 TRP 6 -6.755 -3.356 -6.296
49 HE1 TRP 6 HE1 TRP 6 -5.809 -2.305 -8.439
50 HE3 TRP 6 HE3 TRP 6 -1.902 -2.964 -4.884
51 HZ2 TRP 6 HZ2 TRP 6 -3.209 -1.556 -9.486
52 HZ3 TRP 6 HZ3 TRP 6 -0.249 -2.025 -6.376
53 HH2 TRP 6 HH2 TRP 6 -0.836 -1.333 -8.724
54 H GLU 7 H GLU 7 -2.192 -5.877 -2.731
55 HA GLU 7 HA GLU 7 -3.328 -5.824 0.024
56 HB2 GLU 7 HB2 GLU 7 -3.234 -8.046 -1.403
57 HB3 GLU 7 HB3 GLU 7 -1.525 -8.033 -1.006
58 HG2 GLU 7 HG2 GLU 7 -3.822 -7.945 1.014
59 HG3 GLU 7 HG3 GLU 7 -3.026 -9.423 0.476
60 H LYS 8 H LYS 8 -1.799 -5.599 1.707
61 HA LYS 8 HA LYS 8 0.011 -3.471 1.289
62 HB2 LYS 8 HB2 LYS 8 -1.061 -3.423 3.289
63 HB3 LYS 8 HB3 LYS 8 -1.001 -5.118 3.571
64 HG2 LYS 8 HG2 LYS 8 1.415 -3.281 3.869
65 HG3 LYS 8 HG3 LYS 8 0.244 -3.593 5.142
66 HD2 LYS 8 HD2 LYS 8 2.311 -5.505 4.058
67 HD3 LYS 8 HD3 LYS 8 2.029 -4.947 5.675
68 HE2 LYS 8 HE2 LYS 8 1.360 -7.152 5.746
69 HE3 LYS 8 HE3 LYS 8 -0.169 -6.274 5.678
70 HZ1 LYS 8 HZ1 LYS 8 0.974 -7.168 3.124
71 HZ2 LYS 8 HZ2 LYS 8 0.316 -8.335 4.093
72 HZ3 LYS 8 HZ3 LYS 8 -0.587 -7.120 3.547
73 H ARG 9 H ARG 9 2.142 -3.193 1.253
74 HA ARG 9 HA ARG 9 4.044 -5.355 1.917
75 HB2 ARG 9 HB2 ARG 9 4.133 -3.699 -0.646
76 HB3 ARG 9 HB3 ARG 9 5.412 -4.780 -0.102
77 HG2 ARG 9 HG2 ARG 9 2.614 -5.619 -0.939
78 HG3 ARG 9 HG3 ARG 9 4.078 -5.702 -1.925
79 HD2 ARG 9 HD2 ARG 9 5.074 -7.354 -0.475
80 HD3 ARG 9 HD3 ARG 9 3.736 -7.251 0.664
81 HE ARG 9 HE ARG 9 3.729 -8.538 -2.011
82 HH11 ARG 9 HH11 ARG 9 1.724 -7.569 0.675
83 HH12 ARG 9 HH12 ARG 9 0.550 -8.813 0.534
84 HH21 ARG 9 HH21 ARG 9 2.125 -10.117 -2.383
85 HH22 ARG 9 HH22 ARG 9 0.760 -10.160 -1.286
86 H MET 10 H MET 10 6.322 -4.314 2.072
87 HA MET 10 HA MET 10 6.192 -1.439 2.811
88 HB2 MET 10 HB2 MET 10 6.124 -2.775 4.889
89 HB3 MET 10 HB3 MET 10 7.616 -3.601 4.402
90 HG2 MET 10 HG2 MET 10 8.775 -1.389 4.336
91 HG3 MET 10 HG3 MET 10 7.315 -0.600 4.902
92 HE1 MET 10 HE1 MET 10 7.059 -1.509 8.601
93 HE2 MET 10 HE2 MET 10 6.644 -0.342 7.327
94 HE3 MET 10 HE3 MET 10 6.085 -2.031 7.210
95 H PHE 11 H PHE 11 7.736 -0.232 1.910
96 HA PHE 11 HA PHE 11 9.450 -1.479 -0.019
97 HB2 PHE 11 HB2 PHE 11 8.147 0.773 -0.095
98 HB3 PHE 11 HB3 PHE 11 9.557 1.446 0.690
99 HD1 PHE 11 HD2 PHE 11 11.911 0.650 -0.519
100 HD2 PHE 11 HD1 PHE 11 8.027 0.785 -2.403
101 HE1 PHE 11 HE2 PHE 11 12.988 0.646 -2.745
102 HE2 PHE 11 HE1 PHE 11 9.119 0.809 -4.631
103 HZ PHE 11 HZ PHE 11 11.597 0.727 -4.807
104 H ARG 12 H ARG 12 10.722 -2.838 1.313
105 HA ARG 12 HA ARG 12 12.618 -2.098 3.192
106 HB2 ARG 12 HB2 ARG 12 13.957 -3.940 2.564
107 HB3 ARG 12 HB3 ARG 12 12.275 -4.415 2.461
108 HG2 ARG 12 HG2 ARG 12 14.027 -3.722 0.039
109 HG3 ARG 12 HG3 ARG 12 13.801 -5.324 0.708
110 HD2 ARG 12 HD2 ARG 12 12.310 -5.385 -1.008
111 HD3 ARG 12 HD3 ARG 12 11.265 -4.959 0.353
112 HE ARG 12 HE ARG 12 12.258 -2.607 -1.030
113 HH11 ARG 12 HH11 ARG 12 9.794 -5.095 -1.207
114 HH12 ARG 12 HH12 ARG 12 8.725 -4.152 -2.227
115 HH21 ARG 12 HH21 ARG 12 10.847 -1.443 -2.478
116 HH22 ARG 12 HH22 ARG 12 9.374 -2.212 -2.972
117 H SER 13 H SER 13 14.520 -1.194 3.275
118 HA SER 13 HA SER 13 16.347 0.056 2.815
119 HB2 SER 13 HB2 SER 13 16.479 -0.720 0.441
120 HB3 SER 13 HB3 SER 13 15.383 0.613 -0.004
121 HG SER 13 HG SER 13 16.957 1.944 1.248
122 H ASN 14 H ASN 14 13.046 1.040 2.724
123 HA ASN 14 HA ASN 14 13.974 3.509 4.006
124 HB2 ASN 14 HB2 ASN 14 12.566 5.024 2.741
125 HB3 ASN 14 HB3 ASN 14 13.766 4.266 1.708
126 HD21 ASN 14 HD22 ASN 14 12.970 3.542 -0.264
127 HD22 ASN 14 HD21 ASN 14 11.281 3.151 -0.515
128 H GLY 15 H GLY 15 11.244 1.293 3.379
129 HA2 GLY 15 HA2 GLY 15 10.019 0.403 5.183
130 HA3 GLY 15 HA3 GLY 15 10.291 1.844 6.146
131 H THR 16 H THR 16 9.377 2.834 3.022
132 HA THR 16 HA THR 16 6.848 3.856 3.782
133 HB THR 16 HB THR 16 7.774 3.181 0.957
134 HG1 THR 16 HG1 THR 16 9.309 4.432 1.803
135 HG21 THR 16 HG21 THR 16 5.397 3.820 1.045
136 HG22 THR 16 HG22 THR 16 5.805 5.257 2.017
137 HG23 THR 16 HG23 THR 16 6.361 5.123 0.336
138 H VAL 17 H VAL 17 5.006 2.716 4.248
139 HA VAL 17 HA VAL 17 4.628 0.021 3.156
140 HB VAL 17 HB VAL 17 2.906 1.761 4.907
141 HG11 VAL 17 HG11 VAL 17 1.276 0.544 3.555
142 HG12 VAL 17 HG12 VAL 17 2.170 -0.974 3.788
143 HG13 VAL 17 HG13 VAL 17 1.360 -0.186 5.156
144 HG21 VAL 17 HG21 VAL 17 3.343 -0.069 6.527
145 HG22 VAL 17 HG22 VAL 17 4.199 -0.987 5.266
146 HG23 VAL 17 HG23 VAL 17 4.881 0.539 5.887
147 H TYR 18 H TYR 18 3.435 -0.588 1.591
148 HA TYR 18 HA TYR 18 2.024 1.286 -0.206
149 HB2 TYR 18 HB2 TYR 18 3.390 0.978 -2.055
150 HB3 TYR 18 HB3 TYR 18 4.509 1.337 -0.771
151 HD1 TYR 18 HD1 TYR 18 5.963 -0.544 0.126
152 HD2 TYR 18 HD2 TYR 18 3.468 -1.003 -3.357
153 HE1 TYR 18 HE1 TYR 18 7.411 -2.430 -0.693
154 HE2 TYR 18 HE2 TYR 18 4.880 -2.857 -4.156
155 HH TYR 18 HH TYR 18 6.725 -4.090 -3.766
156 H TYR 19 H TYR 19 1.387 -0.235 -2.319
157 HA TYR 19 HA TYR 19 0.489 -2.853 -1.192
158 HB2 TYR 19 HB2 TYR 19 -1.205 -0.598 -2.151
159 HB3 TYR 19 HB3 TYR 19 -1.656 -2.200 -2.665
160 HD1 TYR 19 HD1 TYR 19 -0.572 -0.632 0.636
161 HD2 TYR 19 HD2 TYR 19 -3.298 -3.209 -1.434
162 HE1 TYR 19 HE1 TYR 19 -1.788 -1.080 2.761
163 HE2 TYR 19 HE2 TYR 19 -4.547 -3.620 0.641
164 HH TYR 19 HH TYR 19 -4.704 -3.106 2.885
165 H PHE 20 H PHE 20 0.014 -4.429 -2.544
166 HA PHE 20 HA PHE 20 1.240 -4.398 -5.268
167 HB2 PHE 20 HB2 PHE 20 2.801 -5.231 -3.677
168 HB3 PHE 20 HB3 PHE 20 1.583 -6.243 -2.883
169 HD1 PHE 20 HD1 PHE 20 0.780 -8.372 -3.946
170 HD2 PHE 20 HD2 PHE 20 3.997 -6.013 -5.597
171 HE1 PHE 20 HE1 PHE 20 1.549 -10.322 -5.293
172 HE2 PHE 20 HE2 PHE 20 4.669 -7.929 -7.015
173 HZ PHE 20 HZ PHE 20 3.415 -10.082 -6.879
174 H ASN 21 H ASN 21 -0.106 -5.254 -6.797
175 HA ASN 21 HA ASN 21 -2.675 -6.395 -5.911
176 HB2 ASN 21 HB2 ASN 21 -2.533 -4.776 -7.821
177 HB3 ASN 21 HB3 ASN 21 -1.618 -5.986 -8.698
178 HD21 ASN 21 HD22 ASN 21 -4.841 -5.063 -7.487
179 HD22 ASN 21 HD21 ASN 21 -5.648 -6.430 -8.238
180 H HIS 22 H HIS 22 -2.475 -8.379 -5.045
181 HA HIS 22 HA HIS 22 -0.461 -10.221 -5.901
182 HB2 HIS 22 HB2 HIS 22 -1.065 -11.466 -4.084
183 HB3 HIS 22 HB3 HIS 22 -1.575 -9.874 -3.573
184 HD1 HIS 22 HD1 HIS 22 -3.227 -12.907 -5.306
185 HD2 HIS 22 HD2 HIS 22 -4.026 -9.814 -2.578
186 HE1 HIS 22 HE1 HIS 22 -5.615 -13.326 -4.374
187 H ILE 23 H ILE 23 -3.140 -9.455 -7.622
188 HA ILE 23 HA ILE 23 -3.649 -12.216 -8.621
189 HB ILE 23 HB ILE 23 -5.268 -9.648 -8.861
190 HG12 ILE 23 HG12 ILE 23 -5.620 -12.112 -7.092
191 HG13 ILE 23 HG13 ILE 23 -5.267 -10.474 -6.553
192 HG21 ILE 23 HG21 ILE 23 -7.054 -11.037 -9.769
193 HG22 ILE 23 HG22 ILE 23 -5.633 -11.178 -10.788
194 HG23 ILE 23 HG23 ILE 23 -6.030 -12.487 -9.646
195 HD11 ILE 23 HD11 ILE 23 -7.515 -9.757 -7.479
196 HD12 ILE 23 HD12 ILE 23 -7.883 -11.487 -7.693
197 HD13 ILE 23 HD13 ILE 23 -7.550 -10.851 -6.079
198 H THR 24 H THR 24 -2.385 -9.066 -9.492
199 HA THR 24 HA THR 24 -1.808 -9.974 -12.295
200 HB THR 24 HB THR 24 -1.695 -7.578 -12.843
201 HG1 THR 24 HG1 THR 24 -2.716 -7.184 -10.253
202 HG21 THR 24 HG21 THR 24 -4.309 -8.233 -11.405
203 HG22 THR 24 HG22 THR 24 -4.056 -6.969 -12.623
204 HG23 THR 24 HG23 THR 24 -3.911 -8.681 -13.080
205 H ASN 25 H ASN 25 -0.248 -9.029 -9.346
206 HA ASN 25 HA ASN 25 1.839 -8.733 -8.716
207 HB2 ASN 25 HB2 ASN 25 2.325 -10.480 -10.600
208 HB3 ASN 25 HB3 ASN 25 2.988 -9.103 -11.476
209 HD21 ASN 25 HD22 ASN 25 4.546 -7.727 -9.894
210 HD22 ASN 25 HD21 ASN 25 5.777 -8.797 -9.173
211 H ALA 26 H ALA 26 0.026 -6.576 -10.277
212 HA ALA 26 HA ALA 26 1.928 -4.494 -10.861
213 HB1 ALA 26 HB1 ALA 26 -0.435 -4.531 -11.647
214 HB2 ALA 26 HB2 ALA 26 -0.977 -4.234 -9.982
215 HB3 ALA 26 HB3 ALA 26 -0.002 -3.021 -10.828
216 H SER 27 H SER 27 1.972 -2.343 -9.529
217 HA SER 27 HA SER 27 1.734 -2.703 -6.620
218 HB2 SER 27 HB2 SER 27 4.370 -2.168 -7.997
219 HB3 SER 27 HB3 SER 27 4.052 -1.797 -6.284
220 HG SER 27 HG SER 27 3.260 -4.303 -7.192
221 H GLN 28 H GLN 28 1.596 -0.759 -5.458
222 HA GLN 28 HA GLN 28 1.583 1.840 -6.827
223 HB2 GLN 28 HB2 GLN 28 -0.601 0.899 -7.412
224 HB3 GLN 28 HB3 GLN 28 -0.895 0.423 -5.740
225 HG2 GLN 28 HG2 GLN 28 -2.206 2.394 -6.470
226 HG3 GLN 28 HG3 GLN 28 -1.220 2.683 -5.048
227 HE21 GLN 28 HE22 GLN 28 -1.199 3.211 -8.673
228 HE22 GLN 28 HE21 GLN 28 -0.244 4.674 -8.493
229 H PHE 29 H PHE 29 1.484 3.600 -5.232
230 HA PHE 29 HA PHE 29 2.552 2.778 -2.618
231 HB2 PHE 29 HB2 PHE 29 2.127 5.505 -3.834
232 HB3 PHE 29 HB3 PHE 29 2.927 5.174 -2.299
233 HD1 PHE 29 HD1 PHE 29 4.668 2.850 -2.865
234 HD2 PHE 29 HD2 PHE 29 3.789 6.300 -5.316
235 HE1 PHE 29 HE1 PHE 29 6.835 2.586 -4.023
236 HE2 PHE 29 HE2 PHE 29 5.965 6.018 -6.472
237 HZ PHE 29 HZ PHE 29 7.490 4.165 -5.829
238 H GLU 30 H GLU 30 -0.420 4.404 -3.853
239 HA GLU 30 HA GLU 30 -1.387 4.575 -1.131
240 HB2 GLU 30 HB2 GLU 30 -2.093 6.287 -2.618
241 HB3 GLU 30 HB3 GLU 30 -2.735 5.117 -3.769
242 HG2 GLU 30 HG2 GLU 30 -4.507 6.286 -2.551
243 HG3 GLU 30 HG3 GLU 30 -4.570 4.552 -2.312
244 H ARG 31 H ARG 31 -3.000 3.536 -0.152
245 HA ARG 31 HA ARG 31 -2.988 0.626 -0.580
246 HB2 ARG 31 HB2 ARG 31 -3.995 2.298 1.767
247 HB3 ARG 31 HB3 ARG 31 -3.726 0.567 1.746
248 HG2 ARG 31 HG2 ARG 31 -1.648 1.050 2.565
249 HG3 ARG 31 HG3 ARG 31 -1.242 1.521 0.915
250 HD2 ARG 31 HD2 ARG 31 -2.312 3.837 1.809
251 HD3 ARG 31 HD3 ARG 31 -1.830 3.137 3.352
252 HE ARG 31 HE ARG 31 0.491 2.869 2.267
253 HH11 ARG 31 HH11 ARG 31 -1.574 5.483 0.955
254 HH12 ARG 31 HH12 ARG 31 -0.167 6.491 0.749
255 HH21 ARG 31 HH22 ARG 31 2.117 4.033 1.641
256 HH22 ARG 31 HH21 ARG 31 1.905 5.664 1.032
257 HA PRO 32 HA PRO 32 -7.332 1.036 -1.884
258 HB2 PRO 32 HB2 PRO 32 -7.107 -1.669 -3.110
259 HB3 PRO 32 HB3 PRO 32 -7.576 -0.116 -3.766
260 HG2 PRO 32 HG2 PRO 32 -5.231 -1.229 -4.389
261 HG3 PRO 32 HG3 PRO 32 -5.326 0.480 -4.225
262 HD2 PRO 32 HD2 PRO 32 -4.499 -1.428 -2.031
263 HD3 PRO 32 HD3 PRO 32 -3.635 0.030 -2.590
264 H SER 33 H SER 33 -9.045 -1.178 -2.066
265 HA SER 33 HA SER 33 -9.324 -1.978 0.791
266 HB2 SER 33 HB2 SER 33 -11.679 -1.338 0.628
267 HB3 SER 33 HB3 SER 33 -10.637 0.060 0.291
268 HG SER 33 HG SER 33 -11.658 -1.695 -1.666
269 H GLY 34 H GLY 34 -8.636 -4.165 0.297
270 HA2 GLY 34 HA2 GLY 34 -10.362 -6.120 0.222
271 HA3 GLY 34 HA3 GLY 34 -10.265 -5.798 -1.512
Start of MODEL 6
1 H1 LYS 1 H1 LYS 1 -8.950 4.301 -3.731
2 H2 LYS 1 H2 LYS 1 -10.433 4.216 -4.503
3 H3 LYS 1 H3 LYS 1 -9.043 3.944 -5.336
4 HA LYS 1 HA LYS 1 -8.601 2.126 -3.670
5 HB2 LYS 1 HB2 LYS 1 -11.559 2.602 -3.260
6 HB3 LYS 1 HB3 LYS 1 -10.900 0.970 -3.188
7 HG2 LYS 1 HG2 LYS 1 -10.758 1.593 -0.976
8 HG3 LYS 1 HG3 LYS 1 -9.129 1.867 -1.570
9 HD2 LYS 1 HD2 LYS 1 -9.905 4.376 -1.844
10 HD3 LYS 1 HD3 LYS 1 -11.278 3.888 -0.866
11 HE2 LYS 1 HE2 LYS 1 -9.598 4.877 0.549
12 HE3 LYS 1 HE3 LYS 1 -9.720 3.156 0.945
13 HZ1 LYS 1 HZ1 LYS 1 -7.652 2.749 -0.150
14 HZ2 LYS 1 HZ2 LYS 1 -7.667 4.161 -0.966
15 HZ3 LYS 1 HZ3 LYS 1 -7.377 4.156 0.643
16 H LEU 2 H LEU 2 -9.261 -0.144 -4.363
17 HA LEU 2 HA LEU 2 -9.632 -0.432 -7.213
18 HB2 LEU 2 HB2 LEU 2 -6.952 -1.249 -6.027
19 HB3 LEU 2 HB3 LEU 2 -7.436 -1.364 -7.622
20 HG LEU 2 HG LEU 2 -7.475 1.093 -7.917
21 HD11 LEU 2 HD11 LEU 2 -7.044 1.624 -5.359
22 HD12 LEU 2 HD12 LEU 2 -5.386 1.146 -5.717
23 HD13 LEU 2 HD13 LEU 2 -6.117 2.476 -6.604
24 HD21 LEU 2 HD21 LEU 2 -4.920 -0.488 -7.338
25 HD22 LEU 2 HD22 LEU 2 -5.815 -0.456 -8.879
26 HD23 LEU 2 HD23 LEU 2 -4.996 1.000 -8.313
27 HA PRO 3 HA PRO 3 -11.114 -4.502 -6.499
28 HB2 PRO 3 HB2 PRO 3 -8.592 -5.533 -7.863
29 HB3 PRO 3 HB3 PRO 3 -10.266 -6.068 -8.205
30 HG2 PRO 3 HG2 PRO 3 -9.184 -4.341 -9.862
31 HG3 PRO 3 HG3 PRO 3 -10.780 -3.855 -9.153
32 HD2 PRO 3 HD2 PRO 3 -7.985 -3.211 -8.123
33 HD3 PRO 3 HD3 PRO 3 -9.288 -2.054 -8.477
34 HA PRO 4 HA PRO 4 -9.248 -7.494 -3.594
35 HB2 PRO 4 HB2 PRO 4 -10.520 -9.808 -4.366
36 HB3 PRO 4 HB3 PRO 4 -11.319 -8.527 -3.403
37 HG2 PRO 4 HG2 PRO 4 -11.447 -8.961 -6.401
38 HG3 PRO 4 HG3 PRO 4 -12.802 -8.653 -5.267
39 HD2 PRO 4 HD2 PRO 4 -11.743 -6.664 -6.736
40 HD3 PRO 4 HD3 PRO 4 -12.210 -6.369 -5.041
41 H GLY 5 H GLY 5 -7.435 -8.808 -3.714
42 HA2 GLY 5 HA2 GLY 5 -5.886 -10.249 -5.057
43 HA3 GLY 5 HA3 GLY 5 -6.303 -9.244 -6.443
44 H TRP 6 H TRP 6 -6.341 -6.624 -4.858
45 HA TRP 6 HA TRP 6 -3.447 -6.136 -4.790
46 HB2 TRP 6 HB2 TRP 6 -5.931 -4.553 -4.091
47 HB3 TRP 6 HB3 TRP 6 -4.289 -3.951 -3.914
48 HD1 TRP 6 HD1 TRP 6 -6.855 -4.507 -6.606
49 HE1 TRP 6 HE1 TRP 6 -6.065 -3.285 -8.688
50 HE3 TRP 6 HE3 TRP 6 -2.093 -3.563 -5.150
51 HZ2 TRP 6 HZ2 TRP 6 -3.545 -2.180 -9.710
52 HZ3 TRP 6 HZ3 TRP 6 -0.537 -2.418 -6.616
53 HH2 TRP 6 HH2 TRP 6 -1.215 -1.707 -8.935
54 H GLU 7 H GLU 7 -2.116 -6.373 -3.023
55 HA GLU 7 HA GLU 7 -3.303 -6.514 -0.301
56 HB2 GLU 7 HB2 GLU 7 -2.674 -8.780 -1.634
57 HB3 GLU 7 HB3 GLU 7 -1.073 -8.395 -1.023
58 HG2 GLU 7 HG2 GLU 7 -3.636 -8.732 0.617
59 HG3 GLU 7 HG3 GLU 7 -2.357 -9.936 0.444
60 H LYS 8 H LYS 8 -1.846 -5.917 1.377
61 HA LYS 8 HA LYS 8 -0.336 -3.561 0.686
62 HB2 LYS 8 HB2 LYS 8 -1.830 -3.865 2.622
63 HB3 LYS 8 HB3 LYS 8 -0.702 -5.026 3.335
64 HG2 LYS 8 HG2 LYS 8 1.029 -3.183 3.394
65 HG3 LYS 8 HG3 LYS 8 -0.186 -2.064 2.777
66 HD2 LYS 8 HD2 LYS 8 -0.458 -3.620 5.402
67 HD3 LYS 8 HD3 LYS 8 0.240 -2.012 5.261
68 HE2 LYS 8 HE2 LYS 8 -1.933 -1.510 5.885
69 HE3 LYS 8 HE3 LYS 8 -1.957 -1.283 4.139
70 HZ1 LYS 8 HZ1 LYS 8 -3.105 -3.531 5.678
71 HZ2 LYS 8 HZ2 LYS 8 -3.846 -2.462 4.637
72 HZ3 LYS 8 HZ3 LYS 8 -2.867 -3.623 4.047
73 H ARG 9 H ARG 9 1.779 -3.110 0.922
74 HA ARG 9 HA ARG 9 3.751 -5.167 1.725
75 HB2 ARG 9 HB2 ARG 9 3.755 -3.789 -1.002
76 HB3 ARG 9 HB3 ARG 9 5.120 -4.697 -0.356
77 HG2 ARG 9 HG2 ARG 9 2.390 -5.825 -1.065
78 HG3 ARG 9 HG3 ARG 9 3.872 -5.973 -1.999
79 HD2 ARG 9 HD2 ARG 9 4.501 -7.798 -0.910
80 HD3 ARG 9 HD3 ARG 9 4.436 -6.972 0.636
81 HE ARG 9 HE ARG 9 2.049 -7.508 0.814
82 HH11 ARG 9 HH12 ARG 9 3.742 -9.468 -1.553
83 HH12 ARG 9 HH11 ARG 9 2.601 -10.782 -1.421
84 HH21 ARG 9 HH22 ARG 9 0.597 -9.204 0.950
85 HH22 ARG 9 HH21 ARG 9 0.871 -10.628 -0.011
86 H MET 10 H MET 10 6.021 -4.153 1.754
87 HA MET 10 HA MET 10 5.936 -1.271 2.445
88 HB2 MET 10 HB2 MET 10 5.611 -2.611 4.516
89 HB3 MET 10 HB3 MET 10 7.131 -3.461 4.187
90 HG2 MET 10 HG2 MET 10 8.322 -1.261 4.248
91 HG3 MET 10 HG3 MET 10 6.805 -0.468 4.659
92 HE1 MET 10 HE1 MET 10 5.327 -1.821 6.817
93 HE2 MET 10 HE2 MET 10 6.172 -1.373 8.317
94 HE3 MET 10 HE3 MET 10 5.948 -0.164 7.034
95 H PHE 11 H PHE 11 7.576 -0.166 1.581
96 HA PHE 11 HA PHE 11 9.535 -1.457 -0.061
97 HB2 PHE 11 HB2 PHE 11 8.379 0.811 -0.360
98 HB3 PHE 11 HB3 PHE 11 9.522 1.439 0.810
99 HD1 PHE 11 HD1 PHE 11 12.062 1.140 0.285
100 HD2 PHE 11 HD2 PHE 11 8.955 0.558 -2.647
101 HE1 PHE 11 HE1 PHE 11 13.730 1.386 -1.526
102 HE2 PHE 11 HE2 PHE 11 10.626 0.822 -4.462
103 HZ PHE 11 HZ PHE 11 13.014 1.237 -3.910
104 H ARG 12 H ARG 12 10.925 -2.739 1.020
105 HA ARG 12 HA ARG 12 12.216 -2.401 3.435
106 HB2 ARG 12 HB2 ARG 12 13.863 -3.998 2.638
107 HB3 ARG 12 HB3 ARG 12 12.263 -4.423 2.058
108 HG2 ARG 12 HG2 ARG 12 13.472 -4.789 0.140
109 HG3 ARG 12 HG3 ARG 12 12.994 -3.114 -0.135
110 HD2 ARG 12 HD2 ARG 12 15.251 -2.499 0.979
111 HD3 ARG 12 HD3 ARG 12 15.680 -4.197 0.804
112 HE ARG 12 HE ARG 12 15.041 -3.728 -1.702
113 HH11 ARG 12 HH11 ARG 12 16.795 -1.433 0.368
114 HH12 ARG 12 HH12 ARG 12 17.571 -0.692 -1.004
115 HH21 ARG 12 HH21 ARG 12 16.066 -2.693 -3.388
116 HH22 ARG 12 HH22 ARG 12 17.166 -1.389 -3.065
117 H SER 13 H SER 13 14.175 -1.613 4.157
118 HA SER 13 HA SER 13 15.863 -0.181 4.469
119 HB2 SER 13 HB2 SER 13 15.893 0.511 1.520
120 HB3 SER 13 HB3 SER 13 17.154 0.820 2.711
121 HG SER 13 HG SER 13 17.454 -1.399 2.932
122 H ASN 14 H ASN 14 12.814 1.008 3.358
123 HA ASN 14 HA ASN 14 13.501 3.413 4.939
124 HB2 ASN 14 HB2 ASN 14 12.531 4.998 3.440
125 HB3 ASN 14 HB3 ASN 14 13.813 4.119 2.623
126 HD21 ASN 14 HD22 ASN 14 13.183 4.169 0.450
127 HD22 ASN 14 HD21 ASN 14 11.593 3.639 -0.065
128 H GLY 15 H GLY 15 10.939 1.175 3.893
129 HA2 GLY 15 HA2 GLY 15 9.375 0.420 5.460
130 HA3 GLY 15 HA3 GLY 15 9.537 1.892 6.408
131 H THR 16 H THR 16 9.202 2.681 3.091
132 HA THR 16 HA THR 16 6.669 3.930 3.415
133 HB THR 16 HB THR 16 7.940 3.053 0.790
134 HG1 THR 16 HG1 THR 16 9.404 4.270 1.858
135 HG21 THR 16 HG21 THR 16 6.735 5.013 -0.120
136 HG22 THR 16 HG22 THR 16 5.607 3.808 0.525
137 HG23 THR 16 HG23 THR 16 5.968 5.279 1.461
138 H VAL 17 H VAL 17 4.745 2.884 3.773
139 HA VAL 17 HA VAL 17 4.321 0.184 2.732
140 HB VAL 17 HB VAL 17 2.608 2.085 4.334
141 HG11 VAL 17 HG11 VAL 17 0.980 0.900 2.940
142 HG12 VAL 17 HG12 VAL 17 1.767 -0.654 3.311
143 HG13 VAL 17 HG13 VAL 17 0.934 0.269 4.584
144 HG21 VAL 17 HG21 VAL 17 2.850 0.300 6.039
145 HG22 VAL 17 HG22 VAL 17 3.727 -0.709 4.866
146 HG23 VAL 17 HG23 VAL 17 4.447 0.807 5.464
147 H TYR 18 H TYR 18 3.011 -0.465 1.193
148 HA TYR 18 HA TYR 18 1.526 1.339 -0.561
149 HB2 TYR 18 HB2 TYR 18 2.813 1.049 -2.506
150 HB3 TYR 18 HB3 TYR 18 3.948 1.527 -1.269
151 HD1 TYR 18 HD1 TYR 18 5.423 -0.294 -0.182
152 HD2 TYR 18 HD2 TYR 18 3.172 -0.862 -3.806
153 HE1 TYR 18 HE1 TYR 18 6.884 -2.245 -0.805
154 HE2 TYR 18 HE2 TYR 18 4.587 -2.812 -4.400
155 HH TYR 18 HH TYR 18 6.420 -4.054 -3.825
156 H TYR 19 H TYR 19 0.985 -0.334 -2.689
157 HA TYR 19 HA TYR 19 0.290 -2.984 -1.520
158 HB2 TYR 19 HB2 TYR 19 -1.483 -0.869 -2.627
159 HB3 TYR 19 HB3 TYR 19 -1.769 -2.465 -3.239
160 HD1 TYR 19 HD1 TYR 19 -1.364 -0.697 0.044
161 HD2 TYR 19 HD2 TYR 19 -3.064 -3.965 -2.104
162 HE1 TYR 19 HE1 TYR 19 -2.897 -1.156 1.971
163 HE2 TYR 19 HE2 TYR 19 -4.580 -4.484 -0.212
164 HH TYR 19 HH TYR 19 -4.792 -2.364 2.717
165 H PHE 20 H PHE 20 -0.004 -4.628 -2.906
166 HA PHE 20 HA PHE 20 1.275 -4.509 -5.596
167 HB2 PHE 20 HB2 PHE 20 2.874 -5.278 -4.016
168 HB3 PHE 20 HB3 PHE 20 1.705 -6.346 -3.227
169 HD1 PHE 20 HD1 PHE 20 3.947 -5.939 -6.119
170 HD2 PHE 20 HD2 PHE 20 1.184 -8.584 -4.116
171 HE1 PHE 20 HE1 PHE 20 4.749 -7.828 -7.507
172 HE2 PHE 20 HE2 PHE 20 2.080 -10.486 -5.431
173 HZ PHE 20 HZ PHE 20 3.824 -10.112 -7.151
174 H ASN 21 H ASN 21 0.097 -5.535 -7.164
175 HA ASN 21 HA ASN 21 -2.443 -6.836 -6.379
176 HB2 ASN 21 HB2 ASN 21 -2.374 -5.212 -8.288
177 HB3 ASN 21 HB3 ASN 21 -1.301 -6.317 -9.124
178 HD21 ASN 21 HD22 ASN 21 -4.667 -5.766 -8.037
179 HD22 ASN 21 HD21 ASN 21 -5.277 -7.177 -8.886
180 H HIS 22 H HIS 22 -2.116 -8.835 -5.528
181 HA HIS 22 HA HIS 22 0.082 -10.487 -6.361
182 HB2 HIS 22 HB2 HIS 22 -0.435 -11.786 -4.556
183 HB3 HIS 22 HB3 HIS 22 -1.071 -10.245 -4.042
184 HD1 HIS 22 HD1 HIS 22 -2.523 -13.336 -5.857
185 HD2 HIS 22 HD2 HIS 22 -3.471 -10.429 -2.979
186 HE1 HIS 22 HE1 HIS 22 -4.866 -13.951 -4.914
187 H ILE 23 H ILE 23 -2.611 -9.904 -8.138
188 HA ILE 23 HA ILE 23 -2.904 -12.694 -9.146
189 HB ILE 23 HB ILE 23 -4.650 -10.228 -9.519
190 HG12 ILE 23 HG12 ILE 23 -5.008 -12.710 -7.772
191 HG13 ILE 23 HG13 ILE 23 -4.748 -11.065 -7.205
192 HG21 ILE 23 HG21 ILE 23 -5.168 -13.113 -10.346
193 HG22 ILE 23 HG22 ILE 23 -6.287 -11.744 -10.539
194 HG23 ILE 23 HG23 ILE 23 -4.794 -11.774 -11.457
195 HD11 ILE 23 HD11 ILE 23 -7.056 -11.527 -6.891
196 HD12 ILE 23 HD12 ILE 23 -6.958 -10.414 -8.266
197 HD13 ILE 23 HD13 ILE 23 -7.252 -12.151 -8.531
198 H THR 24 H THR 24 -1.764 -9.490 -9.970
199 HA THR 24 HA THR 24 -1.008 -10.377 -12.738
200 HB THR 24 HB THR 24 -1.011 -7.978 -13.314
201 HG1 THR 24 HG1 THR 24 -2.168 -7.626 -10.765
202 HG21 THR 24 HG21 THR 24 -3.405 -7.507 -13.194
203 HG22 THR 24 HG22 THR 24 -3.142 -9.211 -13.629
204 HG23 THR 24 HG23 THR 24 -3.640 -8.774 -11.979
205 H ASN 25 H ASN 25 0.286 -9.089 -9.747
206 HA ASN 25 HA ASN 25 2.313 -8.793 -8.957
207 HB2 ASN 25 HB2 ASN 25 3.587 -9.021 -11.692
208 HB3 ASN 25 HB3 ASN 25 4.396 -8.983 -10.138
209 HD21 ASN 25 HD22 ASN 25 2.451 -10.941 -12.287
210 HD22 ASN 25 HD21 ASN 25 2.812 -12.475 -11.463
211 H ALA 26 H ALA 26 0.472 -6.730 -10.659
212 HA ALA 26 HA ALA 26 2.214 -4.497 -11.058
213 HB1 ALA 26 HB1 ALA 26 -0.074 -4.739 -12.013
214 HB2 ALA 26 HB2 ALA 26 -0.760 -4.499 -10.392
215 HB3 ALA 26 HB3 ALA 26 0.157 -3.199 -11.170
216 H SER 27 H SER 27 1.925 -2.332 -9.738
217 HA SER 27 HA SER 27 1.526 -2.734 -6.853
218 HB2 SER 27 HB2 SER 27 4.166 -1.875 -8.048
219 HB3 SER 27 HB3 SER 27 3.691 -1.557 -6.361
220 HG SER 27 HG SER 27 3.275 -4.132 -7.328
221 H GLN 28 H GLN 28 1.105 -0.770 -5.701
222 HA GLN 28 HA GLN 28 1.261 1.798 -7.033
223 HB2 GLN 28 HB2 GLN 28 -0.907 0.641 -7.884
224 HB3 GLN 28 HB3 GLN 28 -1.536 0.857 -6.250
225 HG2 GLN 28 HG2 GLN 28 -1.322 3.297 -6.468
226 HG3 GLN 28 HG3 GLN 28 -0.446 3.120 -7.996
227 HE21 GLN 28 HE22 GLN 28 -1.734 2.059 -9.879
228 HE22 GLN 28 HE21 GLN 28 -3.449 2.446 -9.850
229 H PHE 29 H PHE 29 0.702 3.589 -5.500
230 HA PHE 29 HA PHE 29 1.286 2.837 -2.730
231 HB2 PHE 29 HB2 PHE 29 0.883 5.570 -3.952
232 HB3 PHE 29 HB3 PHE 29 1.612 5.202 -2.392
233 HD1 PHE 29 HD2 PHE 29 3.627 3.316 -2.625
234 HD2 PHE 29 HD1 PHE 29 2.408 6.129 -5.660
235 HE1 PHE 29 HE2 PHE 29 5.844 3.108 -3.709
236 HE2 PHE 29 HE1 PHE 29 4.626 5.908 -6.745
237 HZ PHE 29 HZ PHE 29 6.346 4.399 -5.775
238 H GLU 30 H GLU 30 -1.614 3.836 -4.513
239 HA GLU 30 HA GLU 30 -3.191 4.459 -2.166
240 HB2 GLU 30 HB2 GLU 30 -4.051 5.330 -4.159
241 HB3 GLU 30 HB3 GLU 30 -3.772 3.837 -5.046
242 HG2 GLU 30 HG2 GLU 30 -6.130 4.162 -4.769
243 HG3 GLU 30 HG3 GLU 30 -5.613 2.729 -3.893
244 H ARG 31 H ARG 31 -4.316 3.190 -0.941
245 HA ARG 31 HA ARG 31 -3.640 0.292 -0.808
246 HB2 ARG 31 HB2 ARG 31 -4.597 2.343 1.231
247 HB3 ARG 31 HB3 ARG 31 -4.413 0.629 1.597
248 HG2 ARG 31 HG2 ARG 31 -2.077 0.735 1.594
249 HG3 ARG 31 HG3 ARG 31 -2.016 1.961 0.368
250 HD2 ARG 31 HD2 ARG 31 -1.155 2.809 2.379
251 HD3 ARG 31 HD3 ARG 31 -2.693 3.648 2.066
252 HE ARG 31 HE ARG 31 -3.429 1.560 3.756
253 HH11 ARG 31 HH11 ARG 31 -1.025 4.086 4.185
254 HH12 ARG 31 HH12 ARG 31 -1.151 3.981 5.927
255 HH21 ARG 31 HH21 ARG 31 -3.572 1.469 5.707
256 HH22 ARG 31 HH22 ARG 31 -2.651 2.468 6.861
257 HA PRO 32 HA PRO 32 -7.820 0.325 -2.422
258 HB2 PRO 32 HB2 PRO 32 -7.541 -2.611 -3.055
259 HB3 PRO 32 HB3 PRO 32 -7.990 -1.267 -4.017
260 HG2 PRO 32 HG2 PRO 32 -5.630 -2.268 -4.357
261 HG3 PRO 32 HG3 PRO 32 -5.809 -0.542 -4.409
262 HD2 PRO 32 HD2 PRO 32 -5.035 -2.119 -1.951
263 HD3 PRO 32 HD3 PRO 32 -4.178 -0.715 -2.645
264 H SER 33 H SER 33 -6.785 -1.737 -0.188
265 HA SER 33 HA SER 33 -9.433 -2.036 1.210
266 HB2 SER 33 HB2 SER 33 -8.457 -4.207 2.162
267 HB3 SER 33 HB3 SER 33 -8.905 -4.174 0.456
268 HG SER 33 HG SER 33 -6.228 -3.823 1.422
269 H GLY 34 H GLY 34 -7.019 -0.052 1.561
270 HA2 GLY 34 HA2 GLY 34 -6.484 1.264 3.429
271 HA3 GLY 34 HA3 GLY 34 -7.232 0.073 4.492
Start of MODEL 7
1 H1 LYS 1 H1 LYS 1 -13.619 -2.727 1.777
2 H2 LYS 1 H2 LYS 1 -14.634 -3.943 2.273
3 H3 LYS 1 H3 LYS 1 -14.284 -3.714 0.667
4 HA LYS 1 HA LYS 1 -12.313 -4.483 2.709
5 HB2 LYS 1 HB2 LYS 1 -12.280 -6.698 1.669
6 HB3 LYS 1 HB3 LYS 1 -13.871 -6.335 2.318
7 HG2 LYS 1 HG2 LYS 1 -14.825 -5.992 0.157
8 HG3 LYS 1 HG3 LYS 1 -13.232 -5.819 -0.586
9 HD2 LYS 1 HD2 LYS 1 -12.756 -8.216 -0.182
10 HD3 LYS 1 HD3 LYS 1 -14.391 -8.406 0.473
11 HE2 LYS 1 HE2 LYS 1 -14.273 -9.119 -1.877
12 HE3 LYS 1 HE3 LYS 1 -15.371 -7.745 -1.684
13 HZ1 LYS 1 HZ1 LYS 1 -12.547 -7.344 -2.497
14 HZ2 LYS 1 HZ2 LYS 1 -13.765 -7.589 -3.610
15 HZ3 LYS 1 HZ3 LYS 1 -13.751 -6.283 -2.619
16 H LEU 2 H LEU 2 -10.970 -5.990 0.356
17 HA LEU 2 HA LEU 2 -9.929 -3.669 -1.172
18 HB2 LEU 2 HB2 LEU 2 -8.487 -6.247 -0.447
19 HB3 LEU 2 HB3 LEU 2 -7.827 -4.893 -1.354
20 HG LEU 2 HG LEU 2 -8.610 -4.816 1.592
21 HD11 LEU 2 HD11 LEU 2 -6.212 -4.763 2.006
22 HD12 LEU 2 HD12 LEU 2 -6.631 -6.226 1.103
23 HD13 LEU 2 HD13 LEU 2 -5.876 -4.865 0.255
24 HD21 LEU 2 HD21 LEU 2 -7.200 -2.742 -0.150
25 HD22 LEU 2 HD22 LEU 2 -8.814 -2.578 0.580
26 HD23 LEU 2 HD23 LEU 2 -7.385 -2.653 1.612
27 HA PRO 3 HA PRO 3 -11.262 -6.149 -4.701
28 HB2 PRO 3 HB2 PRO 3 -8.932 -5.236 -6.285
29 HB3 PRO 3 HB3 PRO 3 -10.665 -4.969 -6.571
30 HG2 PRO 3 HG2 PRO 3 -8.980 -2.955 -5.717
31 HG3 PRO 3 HG3 PRO 3 -10.717 -3.040 -5.286
32 HD2 PRO 3 HD2 PRO 3 -8.337 -3.847 -3.617
33 HD3 PRO 3 HD3 PRO 3 -9.823 -2.975 -3.156
34 HA PRO 4 HA PRO 4 -9.158 -9.899 -4.409
35 HB2 PRO 4 HB2 PRO 4 -9.108 -11.057 -6.927
36 HB3 PRO 4 HB3 PRO 4 -10.558 -10.907 -5.891
37 HG2 PRO 4 HG2 PRO 4 -9.675 -9.081 -8.139
38 HG3 PRO 4 HG3 PRO 4 -11.309 -9.755 -7.833
39 HD2 PRO 4 HD2 PRO 4 -10.663 -7.244 -7.080
40 HD3 PRO 4 HD3 PRO 4 -11.673 -8.269 -6.017
41 H GLY 5 H GLY 5 -7.133 -10.354 -3.950
42 HA2 GLY 5 HA2 GLY 5 -4.950 -11.034 -4.533
43 HA3 GLY 5 HA3 GLY 5 -4.973 -9.972 -5.932
44 H TRP 6 H TRP 6 -6.098 -7.772 -3.769
45 HA TRP 6 HA TRP 6 -3.439 -6.622 -3.592
46 HB2 TRP 6 HB2 TRP 6 -6.149 -5.700 -2.655
47 HB3 TRP 6 HB3 TRP 6 -4.673 -4.781 -2.397
48 HD1 TRP 6 HD1 TRP 6 -7.247 -5.421 -4.945
49 HE1 TRP 6 HE1 TRP 6 -6.797 -3.981 -7.044
50 HE3 TRP 6 HE3 TRP 6 -2.475 -4.047 -3.904
51 HZ2 TRP 6 HZ2 TRP 6 -4.594 -2.443 -8.119
52 HZ3 TRP 6 HZ3 TRP 6 -1.213 -2.579 -5.454
53 HH2 TRP 6 HH2 TRP 6 -2.269 -1.754 -7.544
54 H GLU 7 H GLU 7 -1.953 -6.689 -2.067
55 HA GLU 7 HA GLU 7 -2.739 -7.096 0.769
56 HB2 GLU 7 HB2 GLU 7 -1.781 -9.140 -0.741
57 HB3 GLU 7 HB3 GLU 7 -0.247 -8.420 -0.282
58 HG2 GLU 7 HG2 GLU 7 -2.447 -9.281 1.663
59 HG3 GLU 7 HG3 GLU 7 -1.100 -10.303 1.170
60 H LYS 8 H LYS 8 -1.195 -6.249 2.265
61 HA LYS 8 HA LYS 8 0.146 -3.770 1.561
62 HB2 LYS 8 HB2 LYS 8 -0.766 -3.757 3.660
63 HB3 LYS 8 HB3 LYS 8 -0.438 -5.413 4.010
64 HG2 LYS 8 HG2 LYS 8 2.010 -3.697 3.894
65 HG3 LYS 8 HG3 LYS 8 0.824 -3.226 5.078
66 HD2 LYS 8 HD2 LYS 8 2.476 -4.687 6.059
67 HD3 LYS 8 HD3 LYS 8 0.869 -5.384 6.181
68 HE2 LYS 8 HE2 LYS 8 2.708 -6.187 3.912
69 HE3 LYS 8 HE3 LYS 8 2.989 -6.838 5.519
70 HZ1 LYS 8 HZ1 LYS 8 0.893 -7.922 5.500
71 HZ2 LYS 8 HZ2 LYS 8 0.337 -7.139 4.170
72 HZ3 LYS 8 HZ3 LYS 8 1.453 -8.187 3.958
73 H ARG 9 H ARG 9 2.302 -3.354 1.408
74 HA ARG 9 HA ARG 9 4.327 -5.489 1.785
75 HB2 ARG 9 HB2 ARG 9 3.970 -3.877 -0.779
76 HB3 ARG 9 HB3 ARG 9 5.440 -4.769 -0.393
77 HG2 ARG 9 HG2 ARG 9 2.695 -5.995 -0.811
78 HG3 ARG 9 HG3 ARG 9 4.030 -5.970 -1.962
79 HD2 ARG 9 HD2 ARG 9 4.886 -7.833 -1.152
80 HD3 ARG 9 HD3 ARG 9 5.067 -7.120 0.441
81 HE ARG 9 HE ARG 9 2.694 -7.768 0.912
82 HH11 ARG 9 HH11 ARG 9 4.265 -9.580 -1.661
83 HH12 ARG 9 HH12 ARG 9 3.305 -11.006 -1.373
84 HH21 ARG 9 HH22 ARG 9 1.575 -9.650 1.320
85 HH22 ARG 9 HH21 ARG 9 1.802 -11.035 0.279
86 H MET 10 H MET 10 6.601 -4.464 1.548
87 HA MET 10 HA MET 10 6.633 -1.667 2.526
88 HB2 MET 10 HB2 MET 10 6.619 -3.236 4.463
89 HB3 MET 10 HB3 MET 10 8.104 -3.982 3.842
90 HG2 MET 10 HG2 MET 10 9.238 -1.788 3.978
91 HG3 MET 10 HG3 MET 10 7.759 -1.052 4.592
92 HE1 MET 10 HE1 MET 10 7.514 -2.119 8.226
93 HE2 MET 10 HE2 MET 10 7.164 -0.859 7.023
94 HE3 MET 10 HE3 MET 10 6.522 -2.506 6.801
95 H PHE 11 H PHE 11 8.231 -0.452 1.742
96 HA PHE 11 HA PHE 11 9.669 -1.449 -0.532
97 HB2 PHE 11 HB2 PHE 11 8.327 0.753 -0.163
98 HB3 PHE 11 HB3 PHE 11 9.819 1.369 0.524
99 HD1 PHE 11 HD1 PHE 11 11.969 1.071 -1.007
100 HD2 PHE 11 HD2 PHE 11 7.924 0.796 -2.461
101 HE1 PHE 11 HE1 PHE 11 12.771 1.532 -3.308
102 HE2 PHE 11 HE2 PHE 11 8.727 1.252 -4.765
103 HZ PHE 11 HZ PHE 11 11.147 1.626 -5.192
104 H ARG 12 H ARG 12 11.483 -2.533 -0.273
105 HA ARG 12 HA ARG 12 13.344 -2.459 1.840
106 HB2 ARG 12 HB2 ARG 12 13.711 -3.197 -1.106
107 HB3 ARG 12 HB3 ARG 12 14.902 -3.487 0.148
108 HG2 ARG 12 HG2 ARG 12 13.808 -5.544 -0.219
109 HG3 ARG 12 HG3 ARG 12 13.311 -4.959 1.362
110 HD2 ARG 12 HD2 ARG 12 11.468 -6.019 0.141
111 HD3 ARG 12 HD3 ARG 12 11.116 -4.337 0.490
112 HE ARG 12 HE ARG 12 12.308 -4.930 -2.151
113 HH11 ARG 12 HH21 ARG 12 9.235 -4.226 -0.505
114 HH12 ARG 12 HH22 ARG 12 8.379 -4.175 -2.039
115 HH21 ARG 12 HH11 ARG 12 11.115 -4.691 -4.038
116 HH22 ARG 12 HH12 ARG 12 9.419 -4.328 -3.923
117 H SER 13 H SER 13 15.289 -1.462 2.115
118 HA SER 13 HA SER 13 16.989 0.050 1.999
119 HB2 SER 13 HB2 SER 13 17.219 1.865 0.460
120 HB3 SER 13 HB3 SER 13 16.804 0.409 -0.460
121 HG SER 13 HG SER 13 14.670 1.080 -0.481
122 H ASN 14 H ASN 14 13.580 0.941 2.362
123 HA ASN 14 HA ASN 14 14.458 3.039 4.297
124 HB2 ASN 14 HB2 ASN 14 12.948 4.675 3.239
125 HB3 ASN 14 HB3 ASN 14 14.258 4.178 2.174
126 HD21 ASN 14 HD22 ASN 14 13.734 3.193 0.152
127 HD22 ASN 14 HD21 ASN 14 12.043 3.037 -0.309
128 H GLY 15 H GLY 15 11.754 0.904 3.253
129 HA2 GLY 15 HA2 GLY 15 10.502 -0.222 4.907
130 HA3 GLY 15 HA3 GLY 15 10.828 1.046 6.080
131 H THR 16 H THR 16 9.896 2.465 3.097
132 HA THR 16 HA THR 16 7.413 3.462 4.018
133 HB THR 16 HB THR 16 8.261 3.069 1.117
134 HG1 THR 16 HG1 THR 16 9.843 4.210 2.049
135 HG21 THR 16 HG21 THR 16 5.912 3.726 1.298
136 HG22 THR 16 HG22 THR 16 6.329 5.009 2.461
137 HG23 THR 16 HG23 THR 16 6.873 5.118 0.777
138 H VAL 17 H VAL 17 5.492 2.445 4.274
139 HA VAL 17 HA VAL 17 5.075 -0.229 3.134
140 HB VAL 17 HB VAL 17 3.376 1.555 4.889
141 HG11 VAL 17 HG11 VAL 17 1.736 0.345 3.535
142 HG12 VAL 17 HG12 VAL 17 2.594 -1.188 3.811
143 HG13 VAL 17 HG13 VAL 17 1.795 -0.347 5.155
144 HG21 VAL 17 HG21 VAL 17 5.315 0.333 5.905
145 HG22 VAL 17 HG22 VAL 17 3.766 -0.263 6.525
146 HG23 VAL 17 HG23 VAL 17 4.641 -1.197 5.290
147 H TYR 18 H TYR 18 3.645 -0.816 1.620
148 HA TYR 18 HA TYR 18 2.067 1.119 0.101
149 HB2 TYR 18 HB2 TYR 18 3.077 0.731 -2.011
150 HB3 TYR 18 HB3 TYR 18 4.336 1.244 -0.926
151 HD1 TYR 18 HD2 TYR 18 6.038 -0.467 -0.126
152 HD2 TYR 18 HD1 TYR 18 3.150 -1.283 -3.216
153 HE1 TYR 18 HE2 TYR 18 7.470 -2.313 -1.006
154 HE2 TYR 18 HE1 TYR 18 4.539 -3.138 -4.065
155 HH TYR 18 HH TYR 18 6.442 -4.299 -3.792
156 H TYR 19 H TYR 19 1.063 -0.374 -1.914
157 HA TYR 19 HA TYR 19 0.428 -3.064 -0.814
158 HB2 TYR 19 HB2 TYR 19 -1.439 -0.877 -1.650
159 HB3 TYR 19 HB3 TYR 19 -1.858 -2.516 -2.074
160 HD1 TYR 19 HD1 TYR 19 -0.772 -0.540 0.980
161 HD2 TYR 19 HD2 TYR 19 -2.993 -3.899 -0.587
162 HE1 TYR 19 HE1 TYR 19 -1.748 -0.932 3.209
163 HE2 TYR 19 HE2 TYR 19 -3.978 -4.279 1.658
164 HH TYR 19 HH TYR 19 -3.201 -2.205 4.452
165 H PHE 20 H PHE 20 -0.041 -4.630 -2.212
166 HA PHE 20 HA PHE 20 0.839 -4.366 -5.056
167 HB2 PHE 20 HB2 PHE 20 2.722 -4.971 -3.639
168 HB3 PHE 20 HB3 PHE 20 1.781 -6.263 -2.881
169 HD1 PHE 20 HD1 PHE 20 3.376 -5.171 -6.038
170 HD2 PHE 20 HD2 PHE 20 1.697 -8.503 -3.867
171 HE1 PHE 20 HE1 PHE 20 4.310 -6.737 -7.722
172 HE2 PHE 20 HE2 PHE 20 2.716 -10.057 -5.503
173 HZ PHE 20 HZ PHE 20 3.971 -9.188 -7.453
174 H ASN 21 H ASN 21 -0.526 -5.403 -6.409
175 HA ASN 21 HA ASN 21 -2.508 -7.294 -5.364
176 HB2 ASN 21 HB2 ASN 21 -3.034 -5.567 -7.130
177 HB3 ASN 21 HB3 ASN 21 -2.015 -6.484 -8.234
178 HD21 ASN 21 HD22 ASN 21 -5.179 -6.248 -6.829
179 HD22 ASN 21 HD21 ASN 21 -5.741 -7.849 -7.277
180 H HIS 22 H HIS 22 -1.716 -9.231 -4.824
181 HA HIS 22 HA HIS 22 0.621 -10.359 -6.061
182 HB2 HIS 22 HB2 HIS 22 0.557 -11.905 -4.356
183 HB3 HIS 22 HB3 HIS 22 -0.180 -10.507 -3.618
184 HD1 HIS 22 HD1 HIS 22 -1.484 -13.631 -5.484
185 HD2 HIS 22 HD2 HIS 22 -2.383 -11.056 -2.284
186 HE1 HIS 22 HE1 HIS 22 -3.600 -14.590 -4.323
187 H ILE 23 H ILE 23 -2.335 -10.161 -7.470
188 HA ILE 23 HA ILE 23 -2.063 -12.786 -8.860
189 HB ILE 23 HB ILE 23 -4.443 -10.896 -8.719
190 HG12 ILE 23 HG12 ILE 23 -4.016 -13.644 -7.452
191 HG13 ILE 23 HG13 ILE 23 -4.002 -12.114 -6.582
192 HG21 ILE 23 HG21 ILE 23 -5.672 -12.659 -9.913
193 HG22 ILE 23 HG22 ILE 23 -4.330 -12.088 -10.884
194 HG23 ILE 23 HG23 ILE 23 -4.189 -13.636 -10.023
195 HD11 ILE 23 HD11 ILE 23 -6.386 -11.724 -7.315
196 HD12 ILE 23 HD12 ILE 23 -6.401 -13.404 -7.909
197 HD13 ILE 23 HD13 ILE 23 -6.126 -13.076 -6.193
198 H THR 24 H THR 24 -2.153 -9.220 -9.328
199 HA THR 24 HA THR 24 -1.475 -9.666 -12.214
200 HB THR 24 HB THR 24 -2.244 -7.443 -12.617
201 HG1 THR 24 HG1 THR 24 -3.277 -6.348 -10.835
202 HG21 THR 24 HG21 THR 24 -4.300 -8.800 -10.818
203 HG22 THR 24 HG22 THR 24 -4.613 -7.647 -12.134
204 HG23 THR 24 HG23 THR 24 -3.975 -9.258 -12.505
205 H ASN 25 H ASN 25 -0.055 -8.398 -9.336
206 HA ASN 25 HA ASN 25 1.938 -7.596 -8.813
207 HB2 ASN 25 HB2 ASN 25 2.739 -7.246 -11.708
208 HB3 ASN 25 HB3 ASN 25 3.772 -7.186 -10.295
209 HD21 ASN 25 HD22 ASN 25 1.937 -9.304 -12.409
210 HD22 ASN 25 HD21 ASN 25 2.765 -10.787 -11.888
211 H ALA 26 H ALA 26 -0.568 -5.968 -10.192
212 HA ALA 26 HA ALA 26 0.348 -3.333 -10.569
213 HB1 ALA 26 HB1 ALA 26 -1.959 -4.080 -11.010
214 HB2 ALA 26 HB2 ALA 26 -2.238 -4.281 -9.263
215 HB3 ALA 26 HB3 ALA 26 -1.937 -2.668 -9.939
216 H SER 27 H SER 27 0.977 -1.657 -9.204
217 HA SER 27 HA SER 27 1.304 -2.293 -6.299
218 HB2 SER 27 HB2 SER 27 3.404 -1.346 -8.289
219 HB3 SER 27 HB3 SER 27 3.623 -1.464 -6.534
220 HG SER 27 HG SER 27 2.991 -3.677 -8.260
221 H GLN 28 H GLN 28 0.829 -0.559 -4.977
222 HA GLN 28 HA GLN 28 1.086 2.196 -5.999
223 HB2 GLN 28 HB2 GLN 28 -1.246 2.762 -5.310
224 HB3 GLN 28 HB3 GLN 28 -1.139 1.739 -6.740
225 HG2 GLN 28 HG2 GLN 28 -1.747 -0.244 -5.428
226 HG3 GLN 28 HG3 GLN 28 -1.775 0.699 -3.942
227 HE21 GLN 28 HE22 GLN 28 -3.496 2.271 -3.638
228 HE22 GLN 28 HE21 GLN 28 -4.951 2.175 -4.655
229 H PHE 29 H PHE 29 1.281 3.781 -4.326
230 HA PHE 29 HA PHE 29 2.245 2.660 -1.814
231 HB2 PHE 29 HB2 PHE 29 2.201 5.393 -3.059
232 HB3 PHE 29 HB3 PHE 29 2.468 5.212 -1.333
233 HD1 PHE 29 HD2 PHE 29 3.807 2.661 -3.768
234 HD2 PHE 29 HD1 PHE 29 4.670 6.125 -1.329
235 HE1 PHE 29 HE2 PHE 29 6.212 2.266 -4.054
236 HE2 PHE 29 HE1 PHE 29 7.094 5.719 -1.643
237 HZ PHE 29 HZ PHE 29 7.872 3.786 -2.994
238 H GLU 30 H GLU 30 -0.556 4.852 -2.582
239 HA GLU 30 HA GLU 30 -1.570 4.475 0.147
240 HB2 GLU 30 HB2 GLU 30 -2.098 6.292 -1.902
241 HB3 GLU 30 HB3 GLU 30 -3.544 5.306 -1.895
242 HG2 GLU 30 HG2 GLU 30 -2.334 6.755 0.509
243 HG3 GLU 30 HG3 GLU 30 -3.683 7.342 -0.463
244 H ARG 31 H ARG 31 -3.430 3.286 0.614
245 HA ARG 31 HA ARG 31 -3.302 0.662 -0.707
246 HB2 ARG 31 HB2 ARG 31 -5.506 0.657 1.164
247 HB3 ARG 31 HB3 ARG 31 -4.091 -0.311 1.079
248 HG2 ARG 31 HG2 ARG 31 -3.539 0.543 3.052
249 HG3 ARG 31 HG3 ARG 31 -3.025 1.987 2.230
250 HD2 ARG 31 HD2 ARG 31 -5.684 1.372 3.593
251 HD3 ARG 31 HD3 ARG 31 -4.496 2.586 4.051
252 HE ARG 31 HE ARG 31 -5.078 3.916 2.104
253 HH11 ARG 31 HH21 ARG 31 -7.381 1.312 2.597
254 HH12 ARG 31 HH22 ARG 31 -8.602 2.034 1.575
255 HH21 ARG 31 HH12 ARG 31 -6.626 4.847 0.930
256 HH22 ARG 31 HH11 ARG 31 -8.186 4.062 0.665
257 HA PRO 32 HA PRO 32 -6.987 1.274 -3.245
258 HB2 PRO 32 HB2 PRO 32 -7.492 -1.320 -3.983
259 HB3 PRO 32 HB3 PRO 32 -6.161 -0.347 -4.667
260 HG2 PRO 32 HG2 PRO 32 -6.013 -2.465 -2.527
261 HG3 PRO 32 HG3 PRO 32 -4.884 -2.095 -3.864
262 HD2 PRO 32 HD2 PRO 32 -4.523 -1.276 -1.246
263 HD3 PRO 32 HD3 PRO 32 -3.784 -0.500 -2.681
264 H SER 33 H SER 33 -9.387 0.113 -3.225
265 HA SER 33 HA SER 33 -10.130 -1.189 -0.815
266 HB2 SER 33 HB2 SER 33 -10.945 1.727 -1.203
267 HB3 SER 33 HB3 SER 33 -11.720 0.602 -0.065
268 HG SER 33 HG SER 33 -8.973 0.618 0.067
269 H GLY 34 H GLY 34 -12.129 -2.052 -1.067
270 HA2 GLY 34 HA2 GLY 34 -14.231 -1.613 -2.823
271 HA3 GLY 34 HA3 GLY 34 -13.039 -2.497 -3.794
Start of MODEL 8
1 H1 LYS 1 H1 LYS 1 -12.546 0.920 -3.423
2 H2 LYS 1 H2 LYS 1 -13.103 1.660 -4.762
3 H3 LYS 1 H3 LYS 1 -13.225 2.413 -3.295
4 HA LYS 1 HA LYS 1 -11.458 3.378 -4.602
5 HB2 LYS 1 HB2 LYS 1 -11.395 3.047 -2.009
6 HB3 LYS 1 HB3 LYS 1 -10.104 1.892 -2.358
7 HG2 LYS 1 HG2 LYS 1 -8.866 3.699 -3.574
8 HG3 LYS 1 HG3 LYS 1 -10.194 4.812 -3.259
9 HD2 LYS 1 HD2 LYS 1 -8.318 5.171 -1.704
10 HD3 LYS 1 HD3 LYS 1 -9.794 4.696 -0.846
11 HE2 LYS 1 HE2 LYS 1 -8.967 2.369 -0.676
12 HE3 LYS 1 HE3 LYS 1 -7.519 2.807 -1.600
13 HZ1 LYS 1 HZ1 LYS 1 -6.850 4.262 0.167
14 HZ2 LYS 1 HZ2 LYS 1 -8.222 3.931 1.053
15 HZ3 LYS 1 HZ3 LYS 1 -7.081 2.756 0.735
16 H LEU 2 H LEU 2 -10.213 0.056 -3.678
17 HA LEU 2 HA LEU 2 -9.844 -0.437 -6.449
18 HB2 LEU 2 HB2 LEU 2 -7.196 -0.902 -5.149
19 HB3 LEU 2 HB3 LEU 2 -7.597 -0.883 -6.753
20 HG LEU 2 HG LEU 2 -7.856 1.589 -6.774
21 HD11 LEU 2 HD11 LEU 2 -6.062 1.830 -4.374
22 HD12 LEU 2 HD12 LEU 2 -7.161 2.990 -5.104
23 HD13 LEU 2 HD13 LEU 2 -7.790 1.700 -4.056
24 HD21 LEU 2 HD21 LEU 2 -5.912 0.428 -7.665
25 HD22 LEU 2 HD22 LEU 2 -5.384 1.898 -6.836
26 HD23 LEU 2 HD23 LEU 2 -5.183 0.309 -6.051
27 HA PRO 3 HA PRO 3 -11.039 -4.431 -5.759
28 HB2 PRO 3 HB2 PRO 3 -8.462 -5.357 -7.086
29 HB3 PRO 3 HB3 PRO 3 -10.127 -5.924 -7.447
30 HG2 PRO 3 HG2 PRO 3 -8.996 -4.136 -9.059
31 HG3 PRO 3 HG3 PRO 3 -10.661 -3.784 -8.455
32 HD2 PRO 3 HD2 PRO 3 -8.014 -2.798 -7.312
33 HD3 PRO 3 HD3 PRO 3 -9.453 -1.863 -7.738
34 HA PRO 4 HA PRO 4 -9.092 -7.205 -2.732
35 HB2 PRO 4 HB2 PRO 4 -10.314 -9.581 -3.386
36 HB3 PRO 4 HB3 PRO 4 -11.140 -8.273 -2.483
37 HG2 PRO 4 HG2 PRO 4 -11.273 -8.863 -5.453
38 HG3 PRO 4 HG3 PRO 4 -12.627 -8.520 -4.328
39 HD2 PRO 4 HD2 PRO 4 -11.586 -6.601 -5.921
40 HD3 PRO 4 HD3 PRO 4 -12.097 -6.217 -4.254
41 H GLY 5 H GLY 5 -7.228 -8.494 -2.858
42 HA2 GLY 5 HA2 GLY 5 -5.679 -9.937 -4.187
43 HA3 GLY 5 HA3 GLY 5 -6.156 -9.010 -5.603
44 H TRP 6 H TRP 6 -6.174 -6.258 -4.194
45 HA TRP 6 HA TRP 6 -3.315 -5.764 -4.200
46 HB2 TRP 6 HB2 TRP 6 -5.770 -4.185 -3.381
47 HB3 TRP 6 HB3 TRP 6 -4.126 -3.579 -3.284
48 HD1 TRP 6 HD1 TRP 6 -6.861 -4.041 -5.788
49 HE1 TRP 6 HE1 TRP 6 -6.151 -2.903 -7.978
50 HE3 TRP 6 HE3 TRP 6 -1.977 -3.236 -4.688
51 HZ2 TRP 6 HZ2 TRP 6 -3.707 -1.895 -9.167
52 HZ3 TRP 6 HZ3 TRP 6 -0.495 -2.181 -6.295
53 HH2 TRP 6 HH2 TRP 6 -1.309 -1.508 -8.575
54 H GLU 7 H GLU 7 -1.895 -6.134 -2.574
55 HA GLU 7 HA GLU 7 -2.860 -6.275 0.242
56 HB2 GLU 7 HB2 GLU 7 -2.568 -8.474 -1.178
57 HB3 GLU 7 HB3 GLU 7 -0.848 -8.214 -0.941
58 HG2 GLU 7 HG2 GLU 7 -2.959 -8.486 1.256
59 HG3 GLU 7 HG3 GLU 7 -1.941 -9.798 0.666
60 H LYS 8 H LYS 8 -1.269 -5.819 1.827
61 HA LYS 8 HA LYS 8 0.382 -3.572 1.286
62 HB2 LYS 8 HB2 LYS 8 -0.610 -3.615 3.346
63 HB3 LYS 8 HB3 LYS 8 -0.363 -5.295 3.631
64 HG2 LYS 8 HG2 LYS 8 1.873 -3.240 3.750
65 HG3 LYS 8 HG3 LYS 8 0.838 -3.647 5.107
66 HD2 LYS 8 HD2 LYS 8 2.972 -5.383 3.849
67 HD3 LYS 8 HD3 LYS 8 2.821 -4.788 5.473
68 HE2 LYS 8 HE2 LYS 8 2.355 -7.030 5.691
69 HE3 LYS 8 HE3 LYS 8 0.753 -6.290 5.751
70 HZ1 LYS 8 HZ1 LYS 8 1.725 -7.215 3.125
71 HZ2 LYS 8 HZ2 LYS 8 1.243 -8.366 4.203
72 HZ3 LYS 8 HZ3 LYS 8 0.218 -7.237 3.672
73 H ARG 9 H ARG 9 2.490 -3.251 1.024
74 HA ARG 9 HA ARG 9 4.489 -5.345 1.580
75 HB2 ARG 9 HB2 ARG 9 4.301 -3.844 -1.069
76 HB3 ARG 9 HB3 ARG 9 5.654 -4.869 -0.590
77 HG2 ARG 9 HG2 ARG 9 2.805 -5.771 -1.126
78 HG3 ARG 9 HG3 ARG 9 4.186 -5.974 -2.197
79 HD2 ARG 9 HD2 ARG 9 4.924 -7.827 -1.161
80 HD3 ARG 9 HD3 ARG 9 4.715 -7.143 0.440
81 HE ARG 9 HE ARG 9 2.408 -7.749 0.472
82 HH11 ARG 9 HH11 ARG 9 3.999 -9.188 -2.313
83 HH12 ARG 9 HH12 ARG 9 2.870 -10.517 -2.390
84 HH21 ARG 9 HH22 ARG 9 1.033 -9.434 0.359
85 HH22 ARG 9 HH21 ARG 9 1.152 -10.621 -0.930
86 H MET 10 H MET 10 6.757 -4.296 1.403
87 HA MET 10 HA MET 10 6.688 -1.453 2.244
88 HB2 MET 10 HB2 MET 10 6.524 -2.642 4.287
89 HB3 MET 10 HB3 MET 10 7.785 -3.789 3.836
90 HG2 MET 10 HG2 MET 10 8.442 -0.850 3.956
91 HG3 MET 10 HG3 MET 10 8.259 -1.716 5.459
92 HE1 MET 10 HE1 MET 10 9.487 -4.522 5.254
93 HE2 MET 10 HE2 MET 10 11.190 -4.184 5.632
94 HE3 MET 10 HE3 MET 10 9.903 -3.329 6.507
95 H PHE 11 H PHE 11 8.362 -0.245 1.704
96 HA PHE 11 HA PHE 11 10.238 -1.157 -0.307
97 HB2 PHE 11 HB2 PHE 11 8.941 0.988 -0.270
98 HB3 PHE 11 HB3 PHE 11 9.919 1.506 1.085
99 HD1 PHE 11 HD2 PHE 11 12.316 -0.130 -0.962
100 HD2 PHE 11 HD1 PHE 11 9.779 3.378 -0.872
101 HE1 PHE 11 HE2 PHE 11 13.851 1.026 -2.470
102 HE2 PHE 11 HE1 PHE 11 11.346 4.525 -2.404
103 HZ PHE 11 HZ PHE 11 13.390 3.355 -3.206
104 H ARG 12 H ARG 12 11.822 -2.441 0.455
105 HA ARG 12 HA ARG 12 13.144 -2.425 2.927
106 HB2 ARG 12 HB2 ARG 12 13.634 -3.510 0.179
107 HB3 ARG 12 HB3 ARG 12 15.073 -3.308 1.149
108 HG2 ARG 12 HG2 ARG 12 14.113 -5.573 1.291
109 HG3 ARG 12 HG3 ARG 12 14.340 -4.785 2.839
110 HD2 ARG 12 HD2 ARG 12 12.236 -6.132 2.671
111 HD3 ARG 12 HD3 ARG 12 12.019 -4.465 3.179
112 HE ARG 12 HE ARG 12 10.566 -4.194 1.453
113 HH11 ARG 12 HH12 ARG 12 12.674 -6.756 0.321
114 HH12 ARG 12 HH11 ARG 12 11.815 -6.897 -1.194
115 HH21 ARG 12 HH21 ARG 12 9.567 -4.368 -0.332
116 HH22 ARG 12 HH22 ARG 12 10.028 -5.504 -1.596
117 H SER 13 H SER 13 15.136 -1.726 3.612
118 HA SER 13 HA SER 13 16.679 -0.235 4.146
119 HB2 SER 13 HB2 SER 13 17.620 -0.745 1.907
120 HB3 SER 13 HB3 SER 13 16.763 0.673 1.258
121 HG SER 13 HG SER 13 17.809 1.806 3.095
122 H ASN 14 H ASN 14 13.590 0.888 3.383
123 HA ASN 14 HA ASN 14 14.295 3.261 5.001
124 HB2 ASN 14 HB2 ASN 14 13.008 4.811 3.609
125 HB3 ASN 14 HB3 ASN 14 14.402 4.160 2.760
126 HD21 ASN 14 HD21 ASN 14 14.062 3.113 0.784
127 HD22 ASN 14 HD22 ASN 14 12.463 2.829 0.148
128 H GLY 15 H GLY 15 11.665 1.102 3.824
129 HA2 GLY 15 HA2 GLY 15 10.250 0.123 5.461
130 HA3 GLY 15 HA3 GLY 15 10.361 1.555 6.468
131 H THR 16 H THR 16 9.882 2.621 3.273
132 HA THR 16 HA THR 16 7.313 3.667 3.798
133 HB THR 16 HB THR 16 8.458 3.120 1.034
134 HG1 THR 16 HG1 THR 16 9.981 4.265 2.106
135 HG21 THR 16 HG21 THR 16 6.110 3.828 0.987
136 HG22 THR 16 HG22 THR 16 6.486 5.196 2.062
137 HG23 THR 16 HG23 THR 16 7.165 5.134 0.422
138 H VAL 17 H VAL 17 5.427 2.579 4.053
139 HA VAL 17 HA VAL 17 5.035 -0.053 2.840
140 HB VAL 17 HB VAL 17 3.287 1.704 4.573
141 HG11 VAL 17 HG11 VAL 17 2.587 -1.026 3.420
142 HG12 VAL 17 HG12 VAL 17 1.735 -0.249 4.771
143 HG13 VAL 17 HG13 VAL 17 1.699 0.495 3.174
144 HG21 VAL 17 HG21 VAL 17 4.566 -1.037 5.006
145 HG22 VAL 17 HG22 VAL 17 5.210 0.493 5.646
146 HG23 VAL 17 HG23 VAL 17 3.647 -0.112 6.213
147 H TYR 18 H TYR 18 3.688 -0.626 1.285
148 HA TYR 18 HA TYR 18 2.081 1.277 -0.245
149 HB2 TYR 18 HB2 TYR 18 3.194 0.993 -2.326
150 HB3 TYR 18 HB3 TYR 18 4.392 1.511 -1.164
151 HD1 TYR 18 HD1 TYR 18 6.150 -0.049 -0.361
152 HD2 TYR 18 HD2 TYR 18 3.365 -1.110 -3.466
153 HE1 TYR 18 HE1 TYR 18 7.643 -1.940 -1.082
154 HE2 TYR 18 HE2 TYR 18 4.809 -3.002 -4.147
155 HH TYR 18 HH TYR 18 6.815 -4.046 -3.815
156 H TYR 19 H TYR 19 1.247 -0.269 -2.350
157 HA TYR 19 HA TYR 19 0.610 -2.938 -1.190
158 HB2 TYR 19 HB2 TYR 19 -1.274 -0.779 -2.009
159 HB3 TYR 19 HB3 TYR 19 -1.657 -2.389 -2.541
160 HD1 TYR 19 HD1 TYR 19 -0.510 -0.809 0.720
161 HD2 TYR 19 HD2 TYR 19 -3.116 -3.595 -1.249
162 HE1 TYR 19 HE1 TYR 19 -1.627 -1.343 2.893
163 HE2 TYR 19 HE2 TYR 19 -4.285 -4.052 0.864
164 HH TYR 19 HH TYR 19 -4.471 -3.447 3.093
165 H PHE 20 H PHE 20 0.121 -4.528 -2.573
166 HA PHE 20 HA PHE 20 1.110 -4.328 -5.387
167 HB2 PHE 20 HB2 PHE 20 2.874 -5.091 -3.900
168 HB3 PHE 20 HB3 PHE 20 1.792 -6.268 -3.150
169 HD1 PHE 20 HD1 PHE 20 3.555 -5.398 -6.310
170 HD2 PHE 20 HD2 PHE 20 1.452 -8.468 -4.111
171 HE1 PHE 20 HE1 PHE 20 4.343 -7.103 -7.922
172 HE2 PHE 20 HE2 PHE 20 2.289 -10.171 -5.712
173 HZ PHE 20 HZ PHE 20 3.724 -9.500 -7.611
174 H ASN 21 H ASN 21 -0.253 -5.263 -6.817
175 HA ASN 21 HA ASN 21 -2.607 -6.719 -5.829
176 HB2 ASN 21 HB2 ASN 21 -2.735 -5.001 -7.670
177 HB3 ASN 21 HB3 ASN 21 -1.792 -6.091 -8.662
178 HD21 ASN 21 HD22 ASN 21 -4.973 -5.468 -7.226
179 HD22 ASN 21 HD21 ASN 21 -5.724 -6.882 -7.954
180 H HIS 22 H HIS 22 -2.046 -8.679 -5.055
181 HA HIS 22 HA HIS 22 0.055 -10.255 -6.214
182 HB2 HIS 22 HB2 HIS 22 -0.229 -11.650 -4.410
183 HB3 HIS 22 HB3 HIS 22 -0.767 -10.116 -3.770
184 HD1 HIS 22 HD1 HIS 22 -2.437 -13.200 -5.393
185 HD2 HIS 22 HD2 HIS 22 -3.081 -10.223 -2.503
186 HE1 HIS 22 HE1 HIS 22 -4.674 -13.778 -4.209
187 H ILE 23 H ILE 23 -2.855 -9.713 -7.618
188 HA ILE 23 HA ILE 23 -3.198 -12.477 -8.678
189 HB ILE 23 HB ILE 23 -5.095 -10.095 -8.659
190 HG12 ILE 23 HG12 ILE 23 -5.027 -12.640 -6.970
191 HG13 ILE 23 HG13 ILE 23 -4.782 -10.992 -6.397
192 HG21 ILE 23 HG21 ILE 23 -5.603 -12.975 -9.508
193 HG22 ILE 23 HG22 ILE 23 -6.800 -11.660 -9.464
194 HG23 ILE 23 HG23 ILE 23 -5.475 -11.584 -10.609
195 HD11 ILE 23 HD11 ILE 23 -7.167 -10.471 -7.087
196 HD12 ILE 23 HD12 ILE 23 -7.388 -12.221 -7.334
197 HD13 ILE 23 HD13 ILE 23 -6.965 -11.601 -5.733
198 H THR 24 H THR 24 -2.370 -9.177 -9.527
199 HA THR 24 HA THR 24 -2.017 -9.925 -12.416
200 HB THR 24 HB THR 24 -2.222 -7.520 -12.877
201 HG1 THR 24 HG1 THR 24 -2.956 -7.315 -10.171
202 HG21 THR 24 HG21 THR 24 -4.325 -8.839 -12.912
203 HG22 THR 24 HG22 THR 24 -4.575 -8.493 -11.187
204 HG23 THR 24 HG23 THR 24 -4.593 -7.169 -12.366
205 H ASN 25 H ASN 25 -0.270 -8.901 -9.613
206 HA ASN 25 HA ASN 25 1.838 -8.418 -9.185
207 HB2 ASN 25 HB2 ASN 25 2.287 -10.037 -11.192
208 HB3 ASN 25 HB3 ASN 25 2.720 -8.568 -12.063
209 HD21 ASN 25 HD22 ASN 25 4.302 -7.112 -10.594
210 HD22 ASN 25 HD21 ASN 25 5.693 -8.078 -10.041
211 H ALA 26 H ALA 26 -0.329 -6.397 -10.463
212 HA ALA 26 HA ALA 26 1.316 -4.106 -11.093
213 HB1 ALA 26 HB1 ALA 26 -1.080 -4.333 -11.712
214 HB2 ALA 26 HB2 ALA 26 -1.525 -4.223 -9.996
215 HB3 ALA 26 HB3 ALA 26 -0.753 -2.846 -10.804
216 H SER 27 H SER 27 1.445 -2.092 -9.690
217 HA SER 27 HA SER 27 1.602 -2.607 -6.772
218 HB2 SER 27 HB2 SER 27 3.796 -3.155 -7.863
219 HB3 SER 27 HB3 SER 27 3.907 -1.461 -8.383
220 HG SER 27 HG SER 27 4.053 -0.847 -6.269
221 H GLN 28 H GLN 28 1.277 -0.742 -5.505
222 HA GLN 28 HA GLN 28 0.929 1.895 -6.777
223 HB2 GLN 28 HB2 GLN 28 -1.113 0.646 -7.345
224 HB3 GLN 28 HB3 GLN 28 -1.349 0.200 -5.655
225 HG2 GLN 28 HG2 GLN 28 -2.884 1.953 -6.506
226 HG3 GLN 28 HG3 GLN 28 -1.997 2.400 -5.069
227 HE21 GLN 28 HE22 GLN 28 -2.219 2.986 -8.644
228 HE22 GLN 28 HE21 GLN 28 -1.327 4.490 -8.514
229 H PHE 29 H PHE 29 0.669 3.596 -5.206
230 HA PHE 29 HA PHE 29 1.694 2.912 -2.510
231 HB2 PHE 29 HB2 PHE 29 1.385 5.585 -3.888
232 HB3 PHE 29 HB3 PHE 29 2.171 5.293 -2.336
233 HD1 PHE 29 HD1 PHE 29 4.039 3.298 -2.444
234 HD2 PHE 29 HD2 PHE 29 2.812 5.763 -5.766
235 HE1 PHE 29 HE1 PHE 29 6.164 2.786 -3.609
236 HE2 PHE 29 HE2 PHE 29 4.942 5.245 -6.929
237 HZ PHE 29 HZ PHE 29 6.619 3.757 -5.854
238 H GLU 30 H GLU 30 -1.297 3.836 -4.063
239 HA GLU 30 HA GLU 30 -2.538 4.526 -1.519
240 HB2 GLU 30 HB2 GLU 30 -3.291 5.588 -3.556
241 HB3 GLU 30 HB3 GLU 30 -3.867 4.037 -4.183
242 HG2 GLU 30 HG2 GLU 30 -5.669 5.493 -3.193
243 HG3 GLU 30 HG3 GLU 30 -5.544 3.907 -2.434
244 H ARG 31 H ARG 31 -3.586 3.291 -0.192
245 HA ARG 31 HA ARG 31 -3.127 0.366 -0.358
246 HB2 ARG 31 HB2 ARG 31 -3.949 2.211 1.928
247 HB3 ARG 31 HB3 ARG 31 -3.668 0.492 2.080
248 HG2 ARG 31 HG2 ARG 31 -1.501 0.808 2.403
249 HG3 ARG 31 HG3 ARG 31 -1.298 1.588 0.849
250 HD2 ARG 31 HD2 ARG 31 -2.271 3.123 3.302
251 HD3 ARG 31 HD3 ARG 31 -0.571 2.737 3.077
252 HE ARG 31 HE ARG 31 -0.409 4.124 1.190
253 HH11 ARG 31 HH11 ARG 31 -3.724 4.262 2.334
254 HH12 ARG 31 HH12 ARG 31 -4.181 5.327 1.009
255 HH21 ARG 31 HH22 ARG 31 -0.978 5.695 -0.151
256 HH22 ARG 31 HH21 ARG 31 -2.630 6.328 -0.134
257 HA PRO 32 HA PRO 32 -7.632 0.370 -1.193
258 HB2 PRO 32 HB2 PRO 32 -7.408 -2.235 -2.541
259 HB3 PRO 32 HB3 PRO 32 -7.853 -0.664 -3.192
260 HG2 PRO 32 HG2 PRO 32 -5.535 -1.888 -3.828
261 HG3 PRO 32 HG3 PRO 32 -5.600 -0.168 -3.758
262 HD2 PRO 32 HD2 PRO 32 -4.726 -1.978 -1.514
263 HD3 PRO 32 HD3 PRO 32 -3.869 -0.553 -2.162
264 H SER 33 H SER 33 -9.436 -1.138 -0.825
265 HA SER 33 HA SER 33 -9.271 -3.671 0.405
266 HB2 SER 33 HB2 SER 33 -9.875 -1.362 2.308
267 HB3 SER 33 HB3 SER 33 -10.353 -3.043 2.627
268 HG SER 33 HG SER 33 -7.687 -2.465 1.913
269 H GLY 34 H GLY 34 -10.424 -2.663 -1.870
270 HA2 GLY 34 HA2 GLY 34 -12.620 -3.132 -2.777
271 HA3 GLY 34 HA3 GLY 34 -13.342 -2.386 -1.337
Start of MODEL 9
1 H1 LYS 1 H1 LYS 1 -9.876 4.942 -4.537
2 H2 LYS 1 H2 LYS 1 -9.945 4.424 -6.108
3 H3 LYS 1 H3 LYS 1 -8.570 4.236 -5.191
4 HA LYS 1 HA LYS 1 -9.476 2.626 -3.842
5 HB2 LYS 1 HB2 LYS 1 -11.652 3.843 -3.628
6 HB3 LYS 1 HB3 LYS 1 -12.200 3.101 -5.127
7 HG2 LYS 1 HG2 LYS 1 -11.177 1.458 -2.773
8 HG3 LYS 1 HG3 LYS 1 -12.839 2.050 -2.820
9 HD2 LYS 1 HD2 LYS 1 -13.326 0.784 -4.846
10 HD3 LYS 1 HD3 LYS 1 -11.643 0.282 -4.981
11 HE2 LYS 1 HE2 LYS 1 -12.028 -0.630 -2.516
12 HE3 LYS 1 HE3 LYS 1 -13.727 -0.631 -3.010
13 HZ1 LYS 1 HZ1 LYS 1 -12.956 -2.004 -4.960
14 HZ2 LYS 1 HZ2 LYS 1 -11.439 -2.049 -4.255
15 HZ3 LYS 1 HZ3 LYS 1 -12.673 -2.745 -3.500
16 H LEU 2 H LEU 2 -8.128 1.230 -4.857
17 HA LEU 2 HA LEU 2 -8.975 0.055 -7.438
18 HB2 LEU 2 HB2 LEU 2 -6.458 -0.708 -5.942
19 HB3 LEU 2 HB3 LEU 2 -6.859 -1.029 -7.546
20 HG LEU 2 HG LEU 2 -6.743 1.253 -8.289
21 HD11 LEU 2 HD11 LEU 2 -6.851 2.642 -6.340
22 HD12 LEU 2 HD12 LEU 2 -5.527 1.753 -5.549
23 HD13 LEU 2 HD13 LEU 2 -5.225 2.777 -6.969
24 HD21 LEU 2 HD21 LEU 2 -4.991 -0.371 -8.675
25 HD22 LEU 2 HD22 LEU 2 -4.231 1.165 -8.276
26 HD23 LEU 2 HD23 LEU 2 -4.329 -0.128 -7.045
27 HA PRO 3 HA PRO 3 -10.797 -3.788 -6.302
28 HB2 PRO 3 HB2 PRO 3 -8.381 -5.148 -7.550
29 HB3 PRO 3 HB3 PRO 3 -10.103 -5.518 -7.875
30 HG2 PRO 3 HG2 PRO 3 -8.764 -4.071 -9.627
31 HG3 PRO 3 HG3 PRO 3 -10.344 -3.394 -9.052
32 HD2 PRO 3 HD2 PRO 3 -7.553 -2.840 -7.961
33 HD3 PRO 3 HD3 PRO 3 -8.772 -1.667 -8.511
34 HA PRO 4 HA PRO 4 -9.247 -6.789 -3.227
35 HB2 PRO 4 HB2 PRO 4 -10.765 -8.800 -4.890
36 HB3 PRO 4 HB3 PRO 4 -10.819 -8.539 -3.119
37 HG2 PRO 4 HG2 PRO 4 -12.832 -7.651 -4.709
38 HG3 PRO 4 HG3 PRO 4 -12.223 -6.638 -3.363
39 HD2 PRO 4 HD2 PRO 4 -11.575 -6.439 -6.311
40 HD3 PRO 4 HD3 PRO 4 -11.945 -5.140 -5.132
41 H GLY 5 H GLY 5 -7.439 -8.186 -3.208
42 HA2 GLY 5 HA2 GLY 5 -5.897 -9.744 -4.411
43 HA3 GLY 5 HA3 GLY 5 -6.209 -8.805 -5.866
44 H TRP 6 H TRP 6 -6.150 -6.093 -4.403
45 HA TRP 6 HA TRP 6 -3.269 -5.752 -4.297
46 HB2 TRP 6 HB2 TRP 6 -5.695 -4.067 -3.689
47 HB3 TRP 6 HB3 TRP 6 -4.036 -3.503 -3.504
48 HD1 TRP 6 HD1 TRP 6 -6.600 -4.018 -6.239
49 HE1 TRP 6 HE1 TRP 6 -5.722 -3.006 -8.361
50 HE3 TRP 6 HE3 TRP 6 -1.815 -3.261 -4.752
51 HZ2 TRP 6 HZ2 TRP 6 -3.144 -2.107 -9.417
52 HZ3 TRP 6 HZ3 TRP 6 -0.189 -2.309 -6.271
53 HH2 TRP 6 HH2 TRP 6 -0.812 -1.701 -8.639
54 H GLU 7 H GLU 7 -1.933 -5.994 -2.586
55 HA GLU 7 HA GLU 7 -3.022 -6.056 0.181
56 HB2 GLU 7 HB2 GLU 7 -2.544 -8.330 -1.219
57 HB3 GLU 7 HB3 GLU 7 -0.913 -8.045 -0.642
58 HG2 GLU 7 HG2 GLU 7 -3.417 -8.228 1.109
59 HG3 GLU 7 HG3 GLU 7 -2.337 -9.576 0.759
60 H LYS 8 H LYS 8 -1.484 -5.565 1.800
61 HA LYS 8 HA LYS 8 0.261 -3.380 1.211
62 HB2 LYS 8 HB2 LYS 8 -0.704 -3.167 3.234
63 HB3 LYS 8 HB3 LYS 8 -0.747 -4.850 3.595
64 HG2 LYS 8 HG2 LYS 8 1.994 -3.617 3.705
65 HG3 LYS 8 HG3 LYS 8 0.811 -2.955 4.793
66 HD2 LYS 8 HD2 LYS 8 2.086 -4.708 5.875
67 HD3 LYS 8 HD3 LYS 8 0.364 -5.031 5.892
68 HE2 LYS 8 HE2 LYS 8 2.180 -6.309 3.823
69 HE3 LYS 8 HE3 LYS 8 2.090 -6.951 5.451
70 HZ1 LYS 8 HZ1 LYS 8 -0.205 -7.464 5.181
71 HZ2 LYS 8 HZ2 LYS 8 -0.364 -6.680 3.758
72 HZ3 LYS 8 HZ3 LYS 8 0.478 -7.991 3.773
73 H ARG 9 H ARG 9 2.439 -3.158 1.104
74 HA ARG 9 HA ARG 9 4.280 -5.362 1.763
75 HB2 ARG 9 HB2 ARG 9 4.189 -3.997 -0.963
76 HB3 ARG 9 HB3 ARG 9 5.537 -4.985 -0.404
77 HG2 ARG 9 HG2 ARG 9 2.700 -5.976 -0.885
78 HG3 ARG 9 HG3 ARG 9 4.079 -6.174 -1.969
79 HD2 ARG 9 HD2 ARG 9 5.239 -7.580 -0.376
80 HD3 ARG 9 HD3 ARG 9 3.984 -7.345 0.835
81 HE ARG 9 HE ARG 9 3.825 -8.997 -1.621
82 HH11 ARG 9 HH21 ARG 9 1.975 -7.696 1.040
83 HH12 ARG 9 HH22 ARG 9 0.841 -8.972 1.167
84 HH21 ARG 9 HH12 ARG 9 2.269 -10.670 -1.625
85 HH22 ARG 9 HH11 ARG 9 0.985 -10.587 -0.442
86 H MET 10 H MET 10 6.634 -4.419 1.580
87 HA MET 10 HA MET 10 6.624 -1.569 2.437
88 HB2 MET 10 HB2 MET 10 6.560 -3.085 4.413
89 HB3 MET 10 HB3 MET 10 8.061 -3.840 3.852
90 HG2 MET 10 HG2 MET 10 9.170 -1.591 3.953
91 HG3 MET 10 HG3 MET 10 7.683 -0.909 4.603
92 HE1 MET 10 HE1 MET 10 7.524 -2.179 8.215
93 HE2 MET 10 HE2 MET 10 7.061 -0.894 7.080
94 HE3 MET 10 HE3 MET 10 6.539 -2.573 6.788
95 H PHE 11 H PHE 11 8.108 -0.363 1.491
96 HA PHE 11 HA PHE 11 9.924 -1.407 -0.449
97 HB2 PHE 11 HB2 PHE 11 8.670 0.768 -0.464
98 HB3 PHE 11 HB3 PHE 11 9.742 1.339 0.799
99 HD1 PHE 11 HD1 PHE 11 11.812 -0.561 -1.437
100 HD2 PHE 11 HD2 PHE 11 9.646 3.167 -1.122
101 HE1 PHE 11 HE1 PHE 11 13.275 0.440 -3.141
102 HE2 PHE 11 HE2 PHE 11 11.135 4.160 -2.833
103 HZ PHE 11 HZ PHE 11 12.956 2.802 -3.842
104 H ARG 12 H ARG 12 11.285 -2.846 0.601
105 HA ARG 12 HA ARG 12 12.831 -2.618 2.815
106 HB2 ARG 12 HB2 ARG 12 14.184 -4.306 2.007
107 HB3 ARG 12 HB3 ARG 12 12.691 -4.538 1.116
108 HG2 ARG 12 HG2 ARG 12 15.284 -3.299 0.089
109 HG3 ARG 12 HG3 ARG 12 14.657 -4.892 -0.300
110 HD2 ARG 12 HD2 ARG 12 12.817 -3.975 -1.563
111 HD3 ARG 12 HD3 ARG 12 13.180 -2.332 -1.043
112 HE ARG 12 HE ARG 12 14.532 -3.858 -3.121
113 HH11 ARG 12 HH11 ARG 12 14.880 -1.016 -1.011
114 HH12 ARG 12 HH12 ARG 12 16.036 -0.282 -2.091
115 HH21 ARG 12 HH21 ARG 12 16.017 -2.830 -4.426
116 HH22 ARG 12 HH22 ARG 12 16.658 -1.285 -3.965
117 H SER 13 H SER 13 14.774 -1.853 3.483
118 HA SER 13 HA SER 13 16.523 -0.520 3.767
119 HB2 SER 13 HB2 SER 13 17.339 -1.247 1.540
120 HB3 SER 13 HB3 SER 13 16.545 0.175 0.820
121 HG SER 13 HG SER 13 17.732 1.365 2.535
122 H ASN 14 H ASN 14 13.502 0.702 3.038
123 HA ASN 14 HA ASN 14 14.334 3.157 4.443
124 HB2 ASN 14 HB2 ASN 14 13.058 4.662 3.017
125 HB3 ASN 14 HB3 ASN 14 14.368 3.895 2.130
126 HD21 ASN 14 HD22 ASN 14 13.854 2.839 0.217
127 HD22 ASN 14 HD21 ASN 14 12.203 2.562 -0.294
128 H GLY 15 H GLY 15 11.633 1.000 3.460
129 HA2 GLY 15 HA2 GLY 15 10.276 0.071 5.146
130 HA3 GLY 15 HA3 GLY 15 10.498 1.480 6.169
131 H THR 16 H THR 16 9.827 2.502 2.965
132 HA THR 16 HA THR 16 7.300 3.625 3.608
133 HB THR 16 HB THR 16 8.284 2.924 0.814
134 HG1 THR 16 HG1 THR 16 9.860 4.125 1.743
135 HG21 THR 16 HG21 THR 16 6.956 4.895 0.152
136 HG22 THR 16 HG22 THR 16 5.936 3.625 0.841
137 HG23 THR 16 HG23 THR 16 6.360 5.053 1.818
138 H VAL 17 H VAL 17 5.513 2.411 4.201
139 HA VAL 17 HA VAL 17 5.010 -0.170 2.929
140 HB VAL 17 HB VAL 17 3.394 1.450 4.900
141 HG11 VAL 17 HG11 VAL 17 2.737 -1.296 3.756
142 HG12 VAL 17 HG12 VAL 17 1.953 -0.565 5.170
143 HG13 VAL 17 HG13 VAL 17 1.755 0.171 3.580
144 HG21 VAL 17 HG21 VAL 17 4.846 -1.234 5.084
145 HG22 VAL 17 HG22 VAL 17 5.466 0.304 5.739
146 HG23 VAL 17 HG23 VAL 17 4.001 -0.420 6.421
147 H TYR 18 H TYR 18 3.629 -0.651 1.421
148 HA TYR 18 HA TYR 18 2.002 1.334 -0.025
149 HB2 TYR 18 HB2 TYR 18 3.160 1.236 -2.057
150 HB3 TYR 18 HB3 TYR 18 4.394 1.565 -0.865
151 HD1 TYR 18 HD1 TYR 18 5.870 -0.415 -0.065
152 HD2 TYR 18 HD2 TYR 18 3.330 -0.582 -3.543
153 HE1 TYR 18 HE1 TYR 18 7.144 -2.406 -0.924
154 HE2 TYR 18 HE2 TYR 18 4.541 -2.576 -4.351
155 HH TYR 18 HH TYR 18 6.306 -4.009 -3.977
156 H TYR 19 H TYR 19 1.250 -0.141 -2.269
157 HA TYR 19 HA TYR 19 0.550 -2.818 -1.171
158 HB2 TYR 19 HB2 TYR 19 -1.257 -0.677 -2.206
159 HB3 TYR 19 HB3 TYR 19 -1.604 -2.323 -2.660
160 HD1 TYR 19 HD1 TYR 19 -0.644 -0.553 0.563
161 HD2 TYR 19 HD2 TYR 19 -3.179 -3.420 -1.396
162 HE1 TYR 19 HE1 TYR 19 -1.836 -0.976 2.698
163 HE2 TYR 19 HE2 TYR 19 -4.402 -3.811 0.702
164 HH TYR 19 HH TYR 19 -4.597 -3.207 2.924
165 H PHE 20 H PHE 20 0.201 -4.417 -2.563
166 HA PHE 20 HA PHE 20 1.344 -4.227 -5.311
167 HB2 PHE 20 HB2 PHE 20 3.013 -5.067 -3.782
168 HB3 PHE 20 HB3 PHE 20 1.845 -6.146 -3.010
169 HD1 PHE 20 HD2 PHE 20 3.756 -5.557 -6.149
170 HD2 PHE 20 HD1 PHE 20 1.421 -8.397 -3.856
171 HE1 PHE 20 HE2 PHE 20 4.562 -7.398 -7.583
172 HE2 PHE 20 HE1 PHE 20 2.276 -10.225 -5.285
173 HZ PHE 20 HZ PHE 20 3.832 -9.743 -7.147
174 H ASN 21 H ASN 21 0.105 -5.345 -6.834
175 HA ASN 21 HA ASN 21 -2.354 -6.660 -5.853
176 HB2 ASN 21 HB2 ASN 21 -2.347 -5.115 -7.843
177 HB3 ASN 21 HB3 ASN 21 -1.451 -6.357 -8.705
178 HD21 ASN 21 HD22 ASN 21 -4.644 -5.328 -7.716
179 HD22 ASN 21 HD21 ASN 21 -5.421 -6.846 -8.150
180 H HIS 22 H HIS 22 -2.088 -8.620 -5.010
181 HA HIS 22 HA HIS 22 0.098 -10.324 -5.825
182 HB2 HIS 22 HB2 HIS 22 -0.390 -11.544 -3.967
183 HB3 HIS 22 HB3 HIS 22 -1.007 -9.987 -3.491
184 HD1 HIS 22 HD1 HIS 22 -2.515 -13.141 -5.149
185 HD2 HIS 22 HD2 HIS 22 -3.433 -10.043 -2.466
186 HE1 HIS 22 HE1 HIS 22 -4.873 -13.651 -4.197
187 H ILE 23 H ILE 23 -2.696 -9.725 -7.493
188 HA ILE 23 HA ILE 23 -2.955 -12.487 -8.556
189 HB ILE 23 HB ILE 23 -4.862 -10.144 -8.910
190 HG12 ILE 23 HG12 ILE 23 -5.015 -12.436 -6.897
191 HG13 ILE 23 HG13 ILE 23 -4.770 -10.734 -6.509
192 HG21 ILE 23 HG21 ILE 23 -6.436 -11.840 -9.681
193 HG22 ILE 23 HG22 ILE 23 -4.976 -11.929 -10.648
194 HG23 ILE 23 HG23 ILE 23 -5.252 -13.128 -9.364
195 HD11 ILE 23 HD11 ILE 23 -7.311 -11.979 -7.599
196 HD12 ILE 23 HD12 ILE 23 -7.044 -11.218 -6.028
197 HD13 ILE 23 HD13 ILE 23 -7.036 -10.222 -7.493
198 H THR 24 H THR 24 -2.201 -9.102 -9.451
199 HA THR 24 HA THR 24 -1.539 -10.003 -12.229
200 HB THR 24 HB THR 24 -1.786 -7.743 -12.895
201 HG1 THR 24 HG1 THR 24 -2.419 -6.154 -11.422
202 HG21 THR 24 HG21 THR 24 -4.142 -7.306 -12.503
203 HG22 THR 24 HG22 THR 24 -3.905 -9.056 -12.664
204 HG23 THR 24 HG23 THR 24 -4.141 -8.338 -11.057
205 H ASN 25 H ASN 25 0.030 -8.885 -9.406
206 HA ASN 25 HA ASN 25 2.148 -8.463 -8.870
207 HB2 ASN 25 HB2 ASN 25 2.647 -10.115 -10.823
208 HB3 ASN 25 HB3 ASN 25 3.136 -8.675 -11.711
209 HD21 ASN 25 HD22 ASN 25 4.739 -7.230 -10.290
210 HD22 ASN 25 HD21 ASN 25 6.076 -8.219 -9.651
211 H ALA 26 H ALA 26 0.116 -6.407 -10.282
212 HA ALA 26 HA ALA 26 1.831 -4.174 -10.908
213 HB1 ALA 26 HB1 ALA 26 -1.063 -4.245 -9.963
214 HB2 ALA 26 HB2 ALA 26 -0.248 -2.876 -10.751
215 HB3 ALA 26 HB3 ALA 26 -0.511 -4.379 -11.648
216 H SER 27 H SER 27 1.749 -2.048 -9.604
217 HA SER 27 HA SER 27 2.038 -2.440 -6.661
218 HB2 SER 27 HB2 SER 27 4.252 -2.626 -7.748
219 HB3 SER 27 HB3 SER 27 3.998 -1.043 -8.517
220 HG SER 27 HG SER 27 5.143 -0.756 -6.610
221 H GLN 28 H GLN 28 1.509 -0.595 -5.418
222 HA GLN 28 HA GLN 28 0.648 1.910 -6.713
223 HB2 GLN 28 HB2 GLN 28 -1.227 0.388 -7.077
224 HB3 GLN 28 HB3 GLN 28 -1.219 -0.097 -5.375
225 HG2 GLN 28 HG2 GLN 28 -3.076 1.418 -5.975
226 HG3 GLN 28 HG3 GLN 28 -2.063 2.000 -4.683
227 HE21 GLN 28 HE22 GLN 28 -2.296 2.309 -8.340
228 HE22 GLN 28 HE21 GLN 28 -1.881 4.015 -8.256
229 H PHE 29 H PHE 29 0.295 3.636 -5.212
230 HA PHE 29 HA PHE 29 1.381 3.187 -2.497
231 HB2 PHE 29 HB2 PHE 29 0.873 5.770 -3.964
232 HB3 PHE 29 HB3 PHE 29 1.630 5.597 -2.382
233 HD1 PHE 29 HD2 PHE 29 3.627 3.504 -2.572
234 HD2 PHE 29 HD1 PHE 29 2.448 6.371 -5.594
235 HE1 PHE 29 HE2 PHE 29 5.818 3.262 -3.666
236 HE2 PHE 29 HE1 PHE 29 4.661 6.113 -6.677
237 HZ PHE 29 HZ PHE 29 6.349 4.560 -5.719
238 H GLU 30 H GLU 30 -1.711 3.980 -4.096
239 HA GLU 30 HA GLU 30 -3.113 4.660 -1.652
240 HB2 GLU 30 HB2 GLU 30 -4.064 5.028 -3.911
241 HB3 GLU 30 HB3 GLU 30 -4.127 3.279 -4.161
242 HG2 GLU 30 HG2 GLU 30 -5.665 3.245 -2.041
243 HG3 GLU 30 HG3 GLU 30 -5.761 4.983 -2.247
244 H ARG 31 H ARG 31 -4.220 3.291 -0.239
245 HA ARG 31 HA ARG 31 -3.548 0.370 -0.254
246 HB2 ARG 31 HB2 ARG 31 -4.806 2.081 1.955
247 HB3 ARG 31 HB3 ARG 31 -4.449 0.360 2.021
248 HG2 ARG 31 HG2 ARG 31 -2.588 1.127 3.084
249 HG3 ARG 31 HG3 ARG 31 -1.982 1.143 1.435
250 HD2 ARG 31 HD2 ARG 31 -3.180 3.698 1.953
251 HD3 ARG 31 HD3 ARG 31 -2.167 3.268 3.334
252 HE ARG 31 HE ARG 31 -1.277 3.800 0.550
253 HH11 ARG 31 HH21 ARG 31 -0.105 2.459 3.634
254 HH12 ARG 31 HH22 ARG 31 1.551 2.617 3.018
255 HH21 ARG 31 HH11 ARG 31 0.732 3.942 0.037
256 HH22 ARG 31 HH12 ARG 31 2.026 3.387 1.154
257 HA PRO 32 HA PRO 32 -7.661 0.753 -2.158
258 HB2 PRO 32 HB2 PRO 32 -7.450 -2.066 -3.092
259 HB3 PRO 32 HB3 PRO 32 -7.702 -0.569 -3.985
260 HG2 PRO 32 HG2 PRO 32 -5.387 -1.833 -4.146
261 HG3 PRO 32 HG3 PRO 32 -5.431 -0.107 -4.190
262 HD2 PRO 32 HD2 PRO 32 -4.937 -1.841 -1.737
263 HD3 PRO 32 HD3 PRO 32 -3.988 -0.435 -2.281
264 H SER 33 H SER 33 -9.431 0.669 -0.935
265 HA SER 33 HA SER 33 -9.650 -1.078 1.340
266 HB2 SER 33 HB2 SER 33 -11.631 0.216 1.843
267 HB3 SER 33 HB3 SER 33 -10.347 1.319 1.306
268 HG SER 33 HG SER 33 -12.364 0.190 -0.306
269 H GLY 34 H GLY 34 -9.528 -3.060 -0.045
270 HA2 GLY 34 HA2 GLY 34 -10.523 -5.068 -0.661
271 HA3 GLY 34 HA3 GLY 34 -12.107 -4.418 -0.188
Start of MODEL 10
1 H1 LYS 1 H1 LYS 1 -13.227 0.801 -5.004
2 H2 LYS 1 H2 LYS 1 -12.905 1.780 -6.272
3 H3 LYS 1 H3 LYS 1 -13.008 2.417 -4.745
4 HA LYS 1 HA LYS 1 -10.704 2.253 -5.434
5 HB2 LYS 1 HB2 LYS 1 -11.777 0.597 -3.163
6 HB3 LYS 1 HB3 LYS 1 -10.076 0.451 -3.549
7 HG2 LYS 1 HG2 LYS 1 -11.429 3.095 -2.906
8 HG3 LYS 1 HG3 LYS 1 -10.538 2.079 -1.769
9 HD2 LYS 1 HD2 LYS 1 -8.501 2.280 -3.294
10 HD3 LYS 1 HD3 LYS 1 -9.407 3.470 -4.234
11 HE2 LYS 1 HE2 LYS 1 -7.947 4.623 -2.720
12 HE3 LYS 1 HE3 LYS 1 -9.613 4.895 -2.188
13 HZ1 LYS 1 HZ1 LYS 1 -7.907 4.279 -0.413
14 HZ2 LYS 1 HZ2 LYS 1 -9.292 3.369 -0.384
15 HZ3 LYS 1 HZ3 LYS 1 -7.913 2.761 -1.002
16 H LEU 2 H LEU 2 -8.844 0.461 -5.474
17 HA LEU 2 HA LEU 2 -9.299 -0.962 -7.872
18 HB2 LEU 2 HB2 LEU 2 -6.831 -1.337 -6.182
19 HB3 LEU 2 HB3 LEU 2 -6.982 -1.477 -7.841
20 HG LEU 2 HG LEU 2 -7.180 0.907 -8.220
21 HD11 LEU 2 HD11 LEU 2 -6.789 1.183 -5.209
22 HD12 LEU 2 HD12 LEU 2 -6.288 2.426 -6.356
23 HD13 LEU 2 HD13 LEU 2 -7.978 2.005 -6.266
24 HD21 LEU 2 HD21 LEU 2 -5.044 -0.291 -8.332
25 HD22 LEU 2 HD22 LEU 2 -4.785 1.336 -7.702
26 HD23 LEU 2 HD23 LEU 2 -4.787 -0.059 -6.593
27 HA PRO 3 HA PRO 3 -10.466 -5.014 -7.136
28 HB2 PRO 3 HB2 PRO 3 -7.731 -5.926 -8.108
29 HB3 PRO 3 HB3 PRO 3 -9.324 -6.544 -8.645
30 HG2 PRO 3 HG2 PRO 3 -8.057 -4.796 -10.176
31 HG3 PRO 3 HG3 PRO 3 -9.781 -4.434 -9.770
32 HD2 PRO 3 HD2 PRO 3 -7.267 -3.428 -8.380
33 HD3 PRO 3 HD3 PRO 3 -8.650 -2.495 -8.981
34 HA PRO 4 HA PRO 4 -8.899 -7.778 -3.863
35 HB2 PRO 4 HB2 PRO 4 -9.939 -9.974 -5.647
36 HB3 PRO 4 HB3 PRO 4 -10.258 -9.697 -3.906
37 HG2 PRO 4 HG2 PRO 4 -12.143 -9.109 -5.772
38 HG3 PRO 4 HG3 PRO 4 -11.854 -8.001 -4.390
39 HD2 PRO 4 HD2 PRO 4 -10.823 -7.770 -7.226
40 HD3 PRO 4 HD3 PRO 4 -11.557 -6.519 -6.174
41 H GLY 5 H GLY 5 -6.922 -8.949 -3.660
42 HA2 GLY 5 HA2 GLY 5 -5.083 -10.261 -4.692
43 HA3 GLY 5 HA3 GLY 5 -5.365 -9.370 -6.184
44 H TRP 6 H TRP 6 -5.769 -6.633 -4.841
45 HA TRP 6 HA TRP 6 -2.999 -5.948 -4.397
46 HB2 TRP 6 HB2 TRP 6 -5.657 -4.596 -3.984
47 HB3 TRP 6 HB3 TRP 6 -4.105 -3.858 -3.604
48 HD1 TRP 6 HD1 TRP 6 -6.311 -4.564 -6.573
49 HE1 TRP 6 HE1 TRP 6 -5.361 -3.389 -8.608
50 HE3 TRP 6 HE3 TRP 6 -1.774 -3.330 -4.656
51 HZ2 TRP 6 HZ2 TRP 6 -2.866 -2.065 -9.352
52 HZ3 TRP 6 HZ3 TRP 6 -0.150 -2.108 -5.998
53 HH2 TRP 6 HH2 TRP 6 -0.659 -1.442 -8.362
54 H GLU 7 H GLU 7 -1.805 -6.031 -2.619
55 HA GLU 7 HA GLU 7 -2.977 -6.654 0.046
56 HB2 GLU 7 HB2 GLU 7 -2.148 -8.600 -1.350
57 HB3 GLU 7 HB3 GLU 7 -0.581 -7.811 -1.440
58 HG2 GLU 7 HG2 GLU 7 -0.851 -7.940 1.270
59 HG3 GLU 7 HG3 GLU 7 -1.854 -9.312 0.815
60 H LYS 8 H LYS 8 -1.950 -5.656 1.774
61 HA LYS 8 HA LYS 8 -0.161 -3.470 1.550
62 HB2 LYS 8 HB2 LYS 8 -1.553 -3.719 3.432
63 HB3 LYS 8 HB3 LYS 8 -0.968 -5.317 3.834
64 HG2 LYS 8 HG2 LYS 8 0.776 -2.819 3.956
65 HG3 LYS 8 HG3 LYS 8 -0.307 -3.262 5.260
66 HD2 LYS 8 HD2 LYS 8 2.200 -4.741 4.407
67 HD3 LYS 8 HD3 LYS 8 1.830 -3.946 5.916
68 HE2 LYS 8 HE2 LYS 8 1.294 -5.969 6.720
69 HE3 LYS 8 HE3 LYS 8 -0.220 -5.766 5.840
70 HZ1 LYS 8 HZ1 LYS 8 2.184 -7.263 4.981
71 HZ2 LYS 8 HZ2 LYS 8 0.656 -7.846 5.171
72 HZ3 LYS 8 HZ3 LYS 8 1.037 -6.851 3.906
73 H ARG 9 H ARG 9 1.948 -3.301 1.357
74 HA ARG 9 HA ARG 9 3.753 -5.396 2.383
75 HB2 ARG 9 HB2 ARG 9 3.877 -4.650 -0.575
76 HB3 ARG 9 HB3 ARG 9 5.142 -5.515 0.310
77 HG2 ARG 9 HG2 ARG 9 3.261 -7.189 0.978
78 HG3 ARG 9 HG3 ARG 9 2.339 -6.472 -0.331
79 HD2 ARG 9 HD2 ARG 9 4.099 -7.213 -1.915
80 HD3 ARG 9 HD3 ARG 9 5.057 -7.834 -0.552
81 HE ARG 9 HE ARG 9 2.487 -8.961 -0.288
82 HH11 ARG 9 HH11 ARG 9 5.237 -9.431 -2.380
83 HH12 ARG 9 HH12 ARG 9 4.785 -11.076 -2.766
84 HH21 ARG 9 HH21 ARG 9 1.745 -10.834 -1.059
85 HH22 ARG 9 HH22 ARG 9 2.812 -11.906 -1.956
86 H MET 10 H MET 10 6.135 -4.670 2.116
87 HA MET 10 HA MET 10 6.295 -1.766 2.789
88 HB2 MET 10 HB2 MET 10 6.542 -3.270 4.755
89 HB3 MET 10 HB3 MET 10 7.903 -4.063 3.947
90 HG2 MET 10 HG2 MET 10 9.048 -1.798 3.850
91 HG3 MET 10 HG3 MET 10 7.722 -1.136 4.789
92 HE1 MET 10 HE1 MET 10 9.883 -4.528 5.074
93 HE2 MET 10 HE2 MET 10 10.991 -3.176 4.731
94 HE3 MET 10 HE3 MET 10 11.028 -3.980 6.316
95 H PHE 11 H PHE 11 7.693 -0.559 1.649
96 HA PHE 11 HA PHE 11 9.067 -1.745 -0.560
97 HB2 PHE 11 HB2 PHE 11 7.872 0.548 -0.352
98 HB3 PHE 11 HB3 PHE 11 9.386 1.129 0.304
99 HD1 PHE 11 HD2 PHE 11 11.558 0.351 -1.227
100 HD2 PHE 11 HD1 PHE 11 7.485 0.721 -2.623
101 HE1 PHE 11 HE2 PHE 11 12.364 0.444 -3.560
102 HE2 PHE 11 HE1 PHE 11 8.310 0.844 -4.959
103 HZ PHE 11 HZ PHE 11 10.746 0.692 -5.434
104 H ARG 12 H ARG 12 10.459 -3.218 0.503
105 HA ARG 12 HA ARG 12 12.635 -2.655 2.127
106 HB2 ARG 12 HB2 ARG 12 13.790 -4.502 1.200
107 HB3 ARG 12 HB3 ARG 12 12.094 -4.913 1.334
108 HG2 ARG 12 HG2 ARG 12 13.494 -4.148 -1.288
109 HG3 ARG 12 HG3 ARG 12 13.281 -5.774 -0.677
110 HD2 ARG 12 HD2 ARG 12 11.555 -5.669 -2.149
111 HD3 ARG 12 HD3 ARG 12 10.742 -5.273 -0.629
112 HE ARG 12 HE ARG 12 11.645 -2.894 -2.032
113 HH11 ARG 12 HH11 ARG 12 9.037 -5.261 -1.962
114 HH12 ARG 12 HH12 ARG 12 7.905 -4.179 -2.760
115 HH21 ARG 12 HH21 ARG 12 10.082 -1.586 -3.197
116 HH22 ARG 12 HH22 ARG 12 8.510 -2.275 -3.473
117 H SER 13 H SER 13 14.590 -1.830 1.962
118 HA SER 13 HA SER 13 16.406 -0.638 1.259
119 HB2 SER 13 HB2 SER 13 15.081 0.475 -1.200
120 HB3 SER 13 HB3 SER 13 16.800 0.296 -0.826
121 HG SER 13 HG SER 13 14.891 -1.661 -1.485
122 H ASN 14 H ASN 14 13.134 0.498 1.703
123 HA ASN 14 HA ASN 14 14.375 2.804 3.048
124 HB2 ASN 14 HB2 ASN 14 12.886 4.475 2.108
125 HB3 ASN 14 HB3 ASN 14 13.893 3.746 0.867
126 HD21 ASN 14 HD22 ASN 14 12.783 3.262 -1.032
127 HD22 ASN 14 HD21 ASN 14 11.061 2.935 -1.058
128 H GLY 15 H GLY 15 11.480 0.753 2.693
129 HA2 GLY 15 HA2 GLY 15 10.469 -0.190 4.599
130 HA3 GLY 15 HA3 GLY 15 10.951 1.171 5.593
131 H THR 16 H THR 16 9.668 2.418 2.700
132 HA THR 16 HA THR 16 7.310 3.472 3.884
133 HB THR 16 HB THR 16 7.814 3.020 0.912
134 HG1 THR 16 HG1 THR 16 9.535 4.093 1.616
135 HG21 THR 16 HG21 THR 16 5.525 3.784 1.405
136 HG22 THR 16 HG22 THR 16 6.166 5.100 2.417
137 HG23 THR 16 HG23 THR 16 6.467 5.088 0.666
138 H VAL 17 H VAL 17 5.456 2.372 4.434
139 HA VAL 17 HA VAL 17 4.869 -0.215 3.148
140 HB VAL 17 HB VAL 17 3.458 1.364 5.290
141 HG11 VAL 17 HG11 VAL 17 1.867 -0.546 5.515
142 HG12 VAL 17 HG12 VAL 17 1.622 0.362 4.025
143 HG13 VAL 17 HG13 VAL 17 2.471 -1.200 3.977
144 HG21 VAL 17 HG21 VAL 17 5.483 -0.039 5.852
145 HG22 VAL 17 HG22 VAL 17 4.008 -0.652 6.618
146 HG23 VAL 17 HG23 VAL 17 4.643 -1.453 5.165
147 H TYR 18 H TYR 18 3.344 -0.658 1.758
148 HA TYR 18 HA TYR 18 1.739 1.372 0.387
149 HB2 TYR 18 HB2 TYR 18 2.888 1.372 -1.638
150 HB3 TYR 18 HB3 TYR 18 4.146 1.598 -0.455
151 HD1 TYR 18 HD1 TYR 18 5.494 -0.619 0.238
152 HD2 TYR 18 HD2 TYR 18 3.097 -0.194 -3.312
153 HE1 TYR 18 HE1 TYR 18 6.774 -2.477 -0.873
154 HE2 TYR 18 HE2 TYR 18 4.306 -2.061 -4.368
155 HH TYR 18 HH TYR 18 5.952 -3.514 -4.194
156 H TYR 19 H TYR 19 1.024 -0.018 -1.925
157 HA TYR 19 HA TYR 19 0.294 -2.725 -0.962
158 HB2 TYR 19 HB2 TYR 19 -1.433 -0.547 -1.977
159 HB3 TYR 19 HB3 TYR 19 -1.724 -2.120 -2.663
160 HD1 TYR 19 HD2 TYR 19 -1.150 -0.641 0.814
161 HD2 TYR 19 HD1 TYR 19 -3.218 -3.529 -1.631
162 HE1 TYR 19 HE2 TYR 19 -2.360 -1.480 2.789
163 HE2 TYR 19 HE1 TYR 19 -4.558 -4.244 0.310
164 HH TYR 19 HH TYR 19 -4.992 -3.870 2.555
165 H PHE 20 H PHE 20 0.163 -4.292 -2.322
166 HA PHE 20 HA PHE 20 1.565 -4.092 -4.963
167 HB2 PHE 20 HB2 PHE 20 3.159 -4.729 -3.279
168 HB3 PHE 20 HB3 PHE 20 2.030 -5.867 -2.543
169 HD1 PHE 20 HD2 PHE 20 4.075 -5.235 -5.584
170 HD2 PHE 20 HD1 PHE 20 1.894 -8.172 -3.282
171 HE1 PHE 20 HE2 PHE 20 5.048 -7.041 -6.967
172 HE2 PHE 20 HE1 PHE 20 2.889 -9.968 -4.672
173 HZ PHE 20 HZ PHE 20 4.451 -9.416 -6.520
174 H ASN 21 H ASN 21 0.522 -5.230 -6.579
175 HA ASN 21 HA ASN 21 -1.863 -6.794 -5.802
176 HB2 ASN 21 HB2 ASN 21 -1.869 -5.211 -7.760
177 HB3 ASN 21 HB3 ASN 21 -0.794 -6.346 -8.577
178 HD21 ASN 21 HD22 ASN 21 -4.121 -5.625 -7.900
179 HD22 ASN 21 HD21 ASN 21 -4.718 -7.212 -8.372
180 H HIS 22 H HIS 22 -1.463 -8.720 -4.940
181 HA HIS 22 HA HIS 22 0.920 -10.197 -5.589
182 HB2 HIS 22 HB2 HIS 22 0.418 -11.456 -3.763
183 HB3 HIS 22 HB3 HIS 22 -0.426 -9.993 -3.356
184 HD1 HIS 22 HD1 HIS 22 -1.409 -13.262 -5.181
185 HD2 HIS 22 HD2 HIS 22 -2.863 -10.396 -2.482
186 HE1 HIS 22 HE1 HIS 22 -3.756 -14.072 -4.425
187 H ILE 23 H ILE 23 -1.788 -9.871 -7.465
188 HA ILE 23 HA ILE 23 -1.655 -12.638 -8.557
189 HB ILE 23 HB ILE 23 -3.787 -10.503 -8.958
190 HG12 ILE 23 HG12 ILE 23 -3.789 -12.968 -7.155
191 HG13 ILE 23 HG13 ILE 23 -3.776 -11.291 -6.616
192 HG21 ILE 23 HG21 ILE 23 -3.777 -13.454 -9.702
193 HG22 ILE 23 HG22 ILE 23 -5.098 -12.296 -9.981
194 HG23 ILE 23 HG23 ILE 23 -3.583 -12.108 -10.847
195 HD11 ILE 23 HD11 ILE 23 -6.070 -12.736 -7.970
196 HD12 ILE 23 HD12 ILE 23 -5.995 -12.060 -6.338
197 HD13 ILE 23 HD13 ILE 23 -6.023 -10.971 -7.737
198 H THR 24 H THR 24 -1.326 -9.167 -9.427
199 HA THR 24 HA THR 24 -0.350 -9.968 -12.139
200 HB THR 24 HB THR 24 -0.771 -7.730 -12.808
201 HG1 THR 24 HG1 THR 24 -1.679 -6.244 -11.368
202 HG21 THR 24 HG21 THR 24 -3.176 -8.591 -11.144
203 HG22 THR 24 HG22 THR 24 -3.184 -7.540 -12.577
204 HG23 THR 24 HG23 THR 24 -2.758 -9.254 -12.739
205 H ASN 25 H ASN 25 0.898 -8.762 -9.210
206 HA ASN 25 HA ASN 25 2.896 -8.117 -8.498
207 HB2 ASN 25 HB2 ASN 25 3.724 -9.710 -10.382
208 HB3 ASN 25 HB3 ASN 25 4.149 -8.230 -11.237
209 HD21 ASN 25 HD22 ASN 25 5.462 -6.631 -9.690
210 HD22 ASN 25 HD21 ASN 25 6.832 -7.481 -8.933
211 H ALA 26 H ALA 26 0.802 -6.269 -10.092
212 HA ALA 26 HA ALA 26 2.290 -3.863 -10.577
213 HB1 ALA 26 HB1 ALA 26 -0.604 -4.213 -9.698
214 HB2 ALA 26 HB2 ALA 26 0.105 -2.764 -10.438
215 HB3 ALA 26 HB3 ALA 26 -0.012 -4.261 -11.376
216 H SER 27 H SER 27 2.109 -1.814 -9.214
217 HA SER 27 HA SER 27 2.158 -2.234 -6.275
218 HB2 SER 27 HB2 SER 27 4.472 -1.318 -8.018
219 HB3 SER 27 HB3 SER 27 4.360 -0.935 -6.292
220 HG SER 27 HG SER 27 4.130 -3.569 -7.318
221 H GLN 28 H GLN 28 1.332 -0.473 -5.184
222 HA GLN 28 HA GLN 28 1.210 2.204 -6.346
223 HB2 GLN 28 HB2 GLN 28 -0.549 0.939 -7.537
224 HB3 GLN 28 HB3 GLN 28 -1.274 0.456 -6.023
225 HG2 GLN 28 HG2 GLN 28 -1.002 3.383 -6.861
226 HG3 GLN 28 HG3 GLN 28 -2.322 2.361 -7.437
227 HE21 GLN 28 HE22 GLN 28 -3.232 0.918 -5.364
228 HE22 GLN 28 HE21 GLN 28 -3.507 1.875 -3.929
229 H PHE 29 H PHE 29 0.166 3.753 -4.623
230 HA PHE 29 HA PHE 29 1.338 2.875 -2.103
231 HB2 PHE 29 HB2 PHE 29 0.174 5.541 -2.902
232 HB3 PHE 29 HB3 PHE 29 1.129 5.209 -1.459
233 HD1 PHE 29 HD1 PHE 29 3.447 3.758 -2.146
234 HD2 PHE 29 HD2 PHE 29 1.387 6.689 -4.559
235 HE1 PHE 29 HE1 PHE 29 5.531 4.188 -3.410
236 HE2 PHE 29 HE2 PHE 29 3.480 7.110 -5.818
237 HZ PHE 29 HZ PHE 29 5.553 5.862 -5.249
238 H GLU 30 H GLU 30 -2.016 3.966 -2.993
239 HA GLU 30 HA GLU 30 -2.778 3.732 -0.161
240 HB2 GLU 30 HB2 GLU 30 -3.679 5.247 -2.353
241 HB3 GLU 30 HB3 GLU 30 -4.996 4.134 -2.055
242 HG2 GLU 30 HG2 GLU 30 -3.704 5.950 0.036
243 HG3 GLU 30 HG3 GLU 30 -5.172 6.329 -0.865
244 H ARG 31 H ARG 31 -4.475 2.490 0.574
245 HA ARG 31 HA ARG 31 -4.310 -0.320 -0.243
246 HB2 ARG 31 HB2 ARG 31 -6.423 0.632 1.652
247 HB3 ARG 31 HB3 ARG 31 -5.539 -0.845 1.674
248 HG2 ARG 31 HG2 ARG 31 -3.940 -0.046 3.063
249 HG3 ARG 31 HG3 ARG 31 -3.743 1.462 2.228
250 HD2 ARG 31 HD2 ARG 31 -5.834 0.735 4.313
251 HD3 ARG 31 HD3 ARG 31 -4.519 1.900 4.469
252 HE ARG 31 HE ARG 31 -5.638 3.261 2.680
253 HH11 ARG 31 HH12 ARG 31 -7.789 0.980 4.366
254 HH12 ARG 31 HH11 ARG 31 -9.167 1.578 3.427
255 HH21 ARG 31 HH21 ARG 31 -7.450 4.014 1.754
256 HH22 ARG 31 HH22 ARG 31 -8.990 3.154 2.007
257 HA PRO 32 HA PRO 32 -8.040 0.121 -2.772
258 HB2 PRO 32 HB2 PRO 32 -7.647 -2.777 -3.452
259 HB3 PRO 32 HB3 PRO 32 -7.998 -1.347 -4.423
260 HG2 PRO 32 HG2 PRO 32 -5.555 -2.322 -4.426
261 HG3 PRO 32 HG3 PRO 32 -5.756 -0.608 -4.400
262 HD2 PRO 32 HD2 PRO 32 -5.347 -2.393 -1.952
263 HD3 PRO 32 HD3 PRO 32 -4.439 -0.911 -2.391
264 H SER 33 H SER 33 -9.935 -1.895 -3.115
265 HA SER 33 HA SER 33 -11.885 -2.497 -2.275
266 HB2 SER 33 HB2 SER 33 -12.114 -3.698 -0.229
267 HB3 SER 33 HB3 SER 33 -10.632 -4.193 -1.058
268 HG SER 33 HG SER 33 -9.627 -2.482 0.380
269 H GLY 34 H GLY 34 -10.359 -0.435 0.291
270 HA2 GLY 34 HA2 GLY 34 -12.323 1.668 -0.079
271 HA3 GLY 34 HA3 GLY 34 -12.635 0.724 1.383
Start of MODEL 11
1 H1 LYS 1 H1 LYS 1 -14.419 -6.468 0.411
2 H2 LYS 1 H2 LYS 1 -14.424 -5.051 1.215
3 H3 LYS 1 H3 LYS 1 -14.650 -6.444 2.061
4 HA LYS 1 HA LYS 1 -12.441 -5.459 2.315
5 HB2 LYS 1 HB2 LYS 1 -11.166 -7.474 2.118
6 HB3 LYS 1 HB3 LYS 1 -12.779 -7.929 2.653
7 HG2 LYS 1 HG2 LYS 1 -13.362 -8.813 0.485
8 HG3 LYS 1 HG3 LYS 1 -11.996 -8.029 -0.290
9 HD2 LYS 1 HD2 LYS 1 -10.504 -9.518 1.288
10 HD3 LYS 1 HD3 LYS 1 -11.986 -10.461 1.491
11 HE2 LYS 1 HE2 LYS 1 -10.834 -11.495 -0.306
12 HE3 LYS 1 HE3 LYS 1 -12.125 -10.555 -1.068
13 HZ1 LYS 1 HZ1 LYS 1 -9.274 -9.750 -0.844
14 HZ2 LYS 1 HZ2 LYS 1 -10.045 -10.201 -2.222
15 HZ3 LYS 1 HZ3 LYS 1 -10.426 -8.783 -1.483
16 H LEU 2 H LEU 2 -10.163 -5.590 1.216
17 HA LEU 2 HA LEU 2 -10.006 -3.964 -1.017
18 HB2 LEU 2 HB2 LEU 2 -7.977 -6.131 -0.394
19 HB3 LEU 2 HB3 LEU 2 -7.694 -4.565 -1.138
20 HG LEU 2 HG LEU 2 -8.370 -5.122 1.780
21 HD11 LEU 2 HD11 LEU 2 -6.114 -4.258 2.185
22 HD12 LEU 2 HD12 LEU 2 -6.053 -5.637 1.070
23 HD13 LEU 2 HD13 LEU 2 -5.884 -3.981 0.443
24 HD21 LEU 2 HD21 LEU 2 -7.826 -2.433 0.472
25 HD22 LEU 2 HD22 LEU 2 -9.406 -2.963 1.099
26 HD23 LEU 2 HD23 LEU 2 -8.045 -2.727 2.201
27 HA PRO 3 HA PRO 3 -11.136 -6.463 -4.483
28 HB2 PRO 3 HB2 PRO 3 -8.897 -5.226 -6.063
29 HB3 PRO 3 HB3 PRO 3 -10.634 -5.332 -6.457
30 HG2 PRO 3 HG2 PRO 3 -9.532 -3.007 -5.564
31 HG3 PRO 3 HG3 PRO 3 -11.164 -3.525 -5.031
32 HD2 PRO 3 HD2 PRO 3 -8.541 -3.781 -3.552
33 HD3 PRO 3 HD3 PRO 3 -10.138 -3.257 -2.963
34 HA PRO 4 HA PRO 4 -8.883 -10.188 -4.737
35 HB2 PRO 4 HB2 PRO 4 -8.878 -10.037 -7.739
36 HB3 PRO 4 HB3 PRO 4 -9.327 -11.408 -6.682
37 HG2 PRO 4 HG2 PRO 4 -11.258 -9.872 -7.813
38 HG3 PRO 4 HG3 PRO 4 -11.405 -10.397 -6.105
39 HD2 PRO 4 HD2 PRO 4 -10.521 -7.719 -7.182
40 HD3 PRO 4 HD3 PRO 4 -11.590 -8.092 -5.796
41 H GLY 5 H GLY 5 -6.844 -10.542 -4.278
42 HA2 GLY 5 HA2 GLY 5 -4.611 -10.946 -4.731
43 HA3 GLY 5 HA3 GLY 5 -4.675 -9.874 -6.127
44 H TRP 6 H TRP 6 -5.917 -7.750 -3.933
45 HA TRP 6 HA TRP 6 -3.333 -6.494 -3.715
46 HB2 TRP 6 HB2 TRP 6 -6.032 -5.709 -2.602
47 HB3 TRP 6 HB3 TRP 6 -4.551 -4.810 -2.326
48 HD1 TRP 6 HD1 TRP 6 -7.251 -5.201 -4.731
49 HE1 TRP 6 HE1 TRP 6 -6.876 -3.682 -6.795
50 HE3 TRP 6 HE3 TRP 6 -2.371 -4.060 -3.941
51 HZ2 TRP 6 HZ2 TRP 6 -4.616 -2.319 -8.032
52 HZ3 TRP 6 HZ3 TRP 6 -1.114 -2.652 -5.554
53 HH2 TRP 6 HH2 TRP 6 -2.222 -1.810 -7.616
54 H GLU 7 H GLU 7 -1.787 -6.654 -2.296
55 HA GLU 7 HA GLU 7 -2.415 -7.139 0.555
56 HB2 GLU 7 HB2 GLU 7 -1.566 -9.181 -0.999
57 HB3 GLU 7 HB3 GLU 7 0.001 -8.472 -0.642
58 HG2 GLU 7 HG2 GLU 7 -2.088 -9.304 1.439
59 HG3 GLU 7 HG3 GLU 7 -0.768 -10.334 0.883
60 H LYS 8 H LYS 8 -0.830 -6.302 1.975
61 HA LYS 8 HA LYS 8 0.339 -3.750 1.227
62 HB2 LYS 8 HB2 LYS 8 -0.610 -3.780 3.305
63 HB3 LYS 8 HB3 LYS 8 -0.146 -5.401 3.696
64 HG2 LYS 8 HG2 LYS 8 1.787 -3.067 3.659
65 HG3 LYS 8 HG3 LYS 8 0.851 -3.551 5.061
66 HD2 LYS 8 HD2 LYS 8 3.178 -5.033 3.808
67 HD3 LYS 8 HD3 LYS 8 3.007 -4.359 5.400
68 HE2 LYS 8 HE2 LYS 8 2.863 -6.620 5.777
69 HE3 LYS 8 HE3 LYS 8 1.175 -6.108 5.853
70 HZ1 LYS 8 HZ1 LYS 8 2.198 -7.070 3.255
71 HZ2 LYS 8 HZ2 LYS 8 1.903 -8.195 4.415
72 HZ3 LYS 8 HZ3 LYS 8 0.723 -7.255 3.846
73 H ARG 9 H ARG 9 2.459 -3.192 0.999
74 HA ARG 9 HA ARG 9 4.591 -5.225 1.407
75 HB2 ARG 9 HB2 ARG 9 4.149 -3.654 -1.173
76 HB3 ARG 9 HB3 ARG 9 5.653 -4.491 -0.787
77 HG2 ARG 9 HG2 ARG 9 2.935 -5.791 -1.155
78 HG3 ARG 9 HG3 ARG 9 4.267 -5.775 -2.310
79 HD2 ARG 9 HD2 ARG 9 5.249 -7.546 -1.406
80 HD3 ARG 9 HD3 ARG 9 5.250 -6.842 0.195
81 HE ARG 9 HE ARG 9 2.978 -7.669 0.569
82 HH11 ARG 9 HH11 ARG 9 4.520 -9.144 -2.227
83 HH12 ARG 9 HH12 ARG 9 3.647 -10.644 -2.042
84 HH21 ARG 9 HH21 ARG 9 1.924 -9.599 0.790
85 HH22 ARG 9 HH22 ARG 9 2.142 -10.875 -0.394
86 H MET 10 H MET 10 6.824 -4.186 1.282
87 HA MET 10 HA MET 10 6.748 -1.429 2.375
88 HB2 MET 10 HB2 MET 10 6.603 -3.066 4.240
89 HB3 MET 10 HB3 MET 10 8.128 -3.792 3.699
90 HG2 MET 10 HG2 MET 10 9.253 -1.597 4.012
91 HG3 MET 10 HG3 MET 10 7.739 -0.896 4.571
92 HE1 MET 10 HE1 MET 10 6.367 -2.528 6.600
93 HE2 MET 10 HE2 MET 10 7.254 -2.218 8.111
94 HE3 MET 10 HE3 MET 10 6.955 -0.887 6.973
95 H PHE 11 H PHE 11 8.256 -0.151 1.597
96 HA PHE 11 HA PHE 11 10.130 -1.019 -0.367
97 HB2 PHE 11 HB2 PHE 11 8.847 1.135 -0.260
98 HB3 PHE 11 HB3 PHE 11 9.859 1.626 1.080
99 HD1 PHE 11 HD2 PHE 11 11.989 -0.096 -1.288
100 HD2 PHE 11 HD1 PHE 11 9.849 3.608 -0.640
101 HE1 PHE 11 HE2 PHE 11 13.470 1.050 -2.881
102 HE2 PHE 11 HE1 PHE 11 11.368 4.746 -2.230
103 HZ PHE 11 HZ PHE 11 13.184 3.472 -3.349
104 H ARG 12 H ARG 12 11.466 -2.520 0.617
105 HA ARG 12 HA ARG 12 12.952 -2.377 2.896
106 HB2 ARG 12 HB2 ARG 12 14.704 -3.799 1.655
107 HB3 ARG 12 HB3 ARG 12 13.065 -4.360 1.856
108 HG2 ARG 12 HG2 ARG 12 13.525 -5.066 -0.243
109 HG3 ARG 12 HG3 ARG 12 12.607 -3.619 -0.576
110 HD2 ARG 12 HD2 ARG 12 15.636 -3.945 -0.727
111 HD3 ARG 12 HD3 ARG 12 14.508 -3.895 -2.095
112 HE ARG 12 HE ARG 12 14.288 -1.538 -0.433
113 HH11 ARG 12 HH11 ARG 12 16.305 -2.744 -3.024
114 HH12 ARG 12 HH12 ARG 12 16.996 -1.168 -3.318
115 HH21 ARG 12 HH21 ARG 12 15.187 0.263 -0.688
116 HH22 ARG 12 HH22 ARG 12 16.326 0.602 -1.992
117 H SER 13 H SER 13 15.041 -1.866 3.539
118 HA SER 13 HA SER 13 16.676 -0.460 4.026
119 HB2 SER 13 HB2 SER 13 17.559 -0.968 1.771
120 HB3 SER 13 HB3 SER 13 16.724 0.474 1.148
121 HG SER 13 HG SER 13 17.845 1.564 2.983
122 H ASN 14 H ASN 14 13.622 0.774 3.353
123 HA ASN 14 HA ASN 14 14.405 3.090 4.996
124 HB2 ASN 14 HB2 ASN 14 13.160 4.719 3.687
125 HB3 ASN 14 HB3 ASN 14 14.494 4.041 2.767
126 HD21 ASN 14 HD22 ASN 14 14.026 3.252 0.728
127 HD22 ASN 14 HD21 ASN 14 12.391 2.984 0.162
128 H GLY 15 H GLY 15 11.727 1.030 3.774
129 HA2 GLY 15 HA2 GLY 15 10.322 -0.029 5.347
130 HA3 GLY 15 HA3 GLY 15 10.507 1.304 6.475
131 H THR 16 H THR 16 9.941 2.563 3.332
132 HA THR 16 HA THR 16 7.405 3.630 4.060
133 HB THR 16 HB THR 16 8.447 3.334 1.217
134 HG1 THR 16 HG1 THR 16 10.041 4.333 2.346
135 HG21 THR 16 HG21 THR 16 6.115 4.070 1.366
136 HG22 THR 16 HG22 THR 16 6.561 5.310 2.563
137 HG23 THR 16 HG23 THR 16 7.156 5.434 0.897
138 H VAL 17 H VAL 17 5.510 2.524 4.250
139 HA VAL 17 HA VAL 17 5.169 -0.020 2.878
140 HB VAL 17 HB VAL 17 3.375 1.605 4.693
141 HG11 VAL 17 HG11 VAL 17 1.798 0.440 3.240
142 HG12 VAL 17 HG12 VAL 17 2.715 -1.066 3.411
143 HG13 VAL 17 HG13 VAL 17 1.855 -0.377 4.802
144 HG21 VAL 17 HG21 VAL 17 4.714 -1.126 4.976
145 HG22 VAL 17 HG22 VAL 17 5.317 0.385 5.700
146 HG23 VAL 17 HG23 VAL 17 3.772 -0.295 6.234
147 H TYR 18 H TYR 18 3.842 -0.562 1.300
148 HA TYR 18 HA TYR 18 2.150 1.319 -0.177
149 HB2 TYR 18 HB2 TYR 18 3.216 1.000 -2.286
150 HB3 TYR 18 HB3 TYR 18 4.402 1.608 -1.167
151 HD1 TYR 18 HD1 TYR 18 6.211 0.070 -0.288
152 HD2 TYR 18 HD2 TYR 18 3.508 -1.078 -3.453
153 HE1 TYR 18 HE1 TYR 18 7.806 -1.719 -1.049
154 HE2 TYR 18 HE2 TYR 18 5.083 -2.850 -4.163
155 HH TYR 18 HH TYR 18 7.154 -3.778 -3.849
156 H TYR 19 H TYR 19 1.403 -0.322 -2.327
157 HA TYR 19 HA TYR 19 0.767 -2.973 -1.116
158 HB2 TYR 19 HB2 TYR 19 -1.128 -0.860 -2.087
159 HB3 TYR 19 HB3 TYR 19 -1.491 -2.519 -2.479
160 HD1 TYR 19 HD1 TYR 19 -0.638 -0.376 0.478
161 HD2 TYR 19 HD2 TYR 19 -2.528 -3.972 -0.938
162 HE1 TYR 19 HE1 TYR 19 -1.789 -0.647 2.684
163 HE2 TYR 19 HE2 TYR 19 -3.603 -4.287 1.266
164 HH TYR 19 HH TYR 19 -3.922 -3.411 3.366
165 H PHE 20 H PHE 20 0.224 -4.614 -2.523
166 HA PHE 20 HA PHE 20 1.096 -4.367 -5.361
167 HB2 PHE 20 HB2 PHE 20 2.963 -5.077 -4.047
168 HB3 PHE 20 HB3 PHE 20 1.999 -6.325 -3.228
169 HD1 PHE 20 HD1 PHE 20 3.505 -5.296 -6.455
170 HD2 PHE 20 HD2 PHE 20 1.752 -8.558 -4.221
171 HE1 PHE 20 HE1 PHE 20 4.277 -6.901 -8.175
172 HE2 PHE 20 HE2 PHE 20 2.606 -10.152 -5.905
173 HZ PHE 20 HZ PHE 20 3.838 -9.341 -7.895
174 H ASN 21 H ASN 21 -0.035 -5.663 -6.768
175 HA ASN 21 HA ASN 21 -2.326 -7.182 -5.651
176 HB2 ASN 21 HB2 ASN 21 -2.797 -5.330 -7.292
177 HB3 ASN 21 HB3 ASN 21 -1.860 -6.216 -8.475
178 HD21 ASN 21 HD22 ASN 21 -4.899 -6.086 -6.662
179 HD22 ASN 21 HD21 ASN 21 -5.587 -7.554 -7.331
180 H HIS 22 H HIS 22 -1.623 -9.193 -5.202
181 HA HIS 22 HA HIS 22 0.513 -10.429 -6.664
182 HB2 HIS 22 HB2 HIS 22 0.569 -11.923 -4.923
183 HB3 HIS 22 HB3 HIS 22 -0.091 -10.514 -4.149
184 HD1 HIS 22 HD1 HIS 22 -1.592 -13.632 -5.864
185 HD2 HIS 22 HD2 HIS 22 -2.180 -11.009 -2.629
186 HE1 HIS 22 HE1 HIS 22 -3.628 -14.536 -4.526
187 H ILE 23 H ILE 23 -2.521 -10.099 -7.825
188 HA ILE 23 HA ILE 23 -2.533 -12.784 -9.158
189 HB ILE 23 HB ILE 23 -4.751 -10.756 -8.701
190 HG12 ILE 23 HG12 ILE 23 -4.335 -13.645 -7.784
191 HG13 ILE 23 HG13 ILE 23 -4.185 -12.210 -6.777
192 HG21 ILE 23 HG21 ILE 23 -5.010 -11.682 -10.979
193 HG22 ILE 23 HG22 ILE 23 -4.856 -13.332 -10.337
194 HG23 ILE 23 HG23 ILE 23 -6.252 -12.311 -9.919
195 HD11 ILE 23 HD11 ILE 23 -6.288 -13.138 -6.250
196 HD12 ILE 23 HD12 ILE 23 -6.640 -11.725 -7.269
197 HD13 ILE 23 HD13 ILE 23 -6.728 -13.365 -7.949
198 H THR 24 H THR 24 -2.368 -9.292 -9.669
199 HA THR 24 HA THR 24 -2.080 -9.692 -12.629
200 HB THR 24 HB THR 24 -2.454 -7.262 -12.758
201 HG1 THR 24 HG1 THR 24 -3.011 -7.428 -10.003
202 HG21 THR 24 HG21 THR 24 -4.605 -8.599 -11.049
203 HG22 THR 24 HG22 THR 24 -4.796 -7.149 -12.050
204 HG23 THR 24 HG23 THR 24 -4.468 -8.717 -12.819
205 H ASN 25 H ASN 25 -0.206 -8.942 -9.846
206 HA ASN 25 HA ASN 25 1.860 -8.330 -9.442
207 HB2 ASN 25 HB2 ASN 25 2.320 -9.833 -11.533
208 HB3 ASN 25 HB3 ASN 25 2.665 -8.307 -12.346
209 HD21 ASN 25 HD22 ASN 25 4.213 -6.844 -10.855
210 HD22 ASN 25 HD21 ASN 25 5.650 -7.762 -10.340
211 H ALA 26 H ALA 26 -0.439 -6.365 -10.406
212 HA ALA 26 HA ALA 26 1.056 -3.960 -11.055
213 HB1 ALA 26 HB1 ALA 26 -1.702 -4.305 -9.793
214 HB2 ALA 26 HB2 ALA 26 -1.060 -2.837 -10.547
215 HB3 ALA 26 HB3 ALA 26 -1.374 -4.273 -11.541
216 H SER 27 H SER 27 1.169 -2.056 -9.491
217 HA SER 27 HA SER 27 0.957 -2.699 -6.654
218 HB2 SER 27 HB2 SER 27 3.515 -2.799 -7.841
219 HB3 SER 27 HB3 SER 27 3.429 -1.199 -7.089
220 HG SER 27 HG SER 27 2.513 -2.485 -5.186
221 H GLN 28 H GLN 28 0.823 -0.757 -5.335
222 HA GLN 28 HA GLN 28 0.699 1.865 -6.673
223 HB2 GLN 28 HB2 GLN 28 -1.668 0.454 -5.358
224 HB3 GLN 28 HB3 GLN 28 -1.545 2.210 -5.404
225 HG2 GLN 28 HG2 GLN 28 -1.422 2.179 -7.870
226 HG3 GLN 28 HG3 GLN 28 -1.576 0.421 -7.863
227 HE21 GLN 28 HE22 GLN 28 -3.314 3.496 -7.300
228 HE22 GLN 28 HE21 GLN 28 -4.904 2.701 -7.300
229 H PHE 29 H PHE 29 0.771 3.603 -5.101
230 HA PHE 29 HA PHE 29 1.794 2.757 -2.411
231 HB2 PHE 29 HB2 PHE 29 2.265 5.190 -4.104
232 HB3 PHE 29 HB3 PHE 29 2.256 5.346 -2.353
233 HD1 PHE 29 HD2 PHE 29 3.655 2.787 -4.798
234 HD2 PHE 29 HD1 PHE 29 4.371 5.306 -1.364
235 HE1 PHE 29 HE2 PHE 29 5.948 1.885 -4.610
236 HE2 PHE 29 HE1 PHE 29 6.674 4.403 -1.201
237 HZ PHE 29 HZ PHE 29 7.462 2.685 -2.811
238 H GLU 30 H GLU 30 -0.829 4.107 -4.153
239 HA GLU 30 HA GLU 30 -2.431 5.065 -1.959
240 HB2 GLU 30 HB2 GLU 30 -3.545 3.899 -4.517
241 HB3 GLU 30 HB3 GLU 30 -4.136 5.230 -3.541
242 HG2 GLU 30 HG2 GLU 30 -3.338 6.364 -5.379
243 HG3 GLU 30 HG3 GLU 30 -1.925 6.461 -4.336
244 H ARG 31 H ARG 31 -3.701 3.793 -0.522
245 HA ARG 31 HA ARG 31 -3.426 0.860 -0.745
246 HB2 ARG 31 HB2 ARG 31 -4.822 2.487 1.429
247 HB3 ARG 31 HB3 ARG 31 -4.519 0.749 1.411
248 HG2 ARG 31 HG2 ARG 31 -2.796 1.405 2.734
249 HG3 ARG 31 HG3 ARG 31 -2.005 1.389 1.163
250 HD2 ARG 31 HD2 ARG 31 -3.075 4.024 1.555
251 HD3 ARG 31 HD3 ARG 31 -2.324 3.538 3.072
252 HE ARG 31 HE ARG 31 -0.980 3.919 0.437
253 HH11 ARG 31 HH11 ARG 31 -0.412 2.831 3.749
254 HH12 ARG 31 HH12 ARG 31 1.321 2.938 3.500
255 HH21 ARG 31 HH21 ARG 31 1.031 3.982 0.240
256 HH22 ARG 31 HH22 ARG 31 2.171 3.435 1.477
257 HA PRO 32 HA PRO 32 -7.536 0.670 -2.681
258 HB2 PRO 32 HB2 PRO 32 -7.761 -2.129 -1.805
259 HB3 PRO 32 HB3 PRO 32 -7.698 -1.468 -3.457
260 HG2 PRO 32 HG2 PRO 32 -5.648 -2.903 -2.221
261 HG3 PRO 32 HG3 PRO 32 -5.430 -1.813 -3.600
262 HD2 PRO 32 HD2 PRO 32 -4.809 -1.350 -0.708
263 HD3 PRO 32 HD3 PRO 32 -4.042 -0.653 -2.169
264 H SER 33 H SER 33 -9.879 -0.071 -1.857
265 HA SER 33 HA SER 33 -10.209 -0.767 0.856
266 HB2 SER 33 HB2 SER 33 -10.766 2.109 0.028
267 HB3 SER 33 HB3 SER 33 -11.597 1.319 1.388
268 HG SER 33 HG SER 33 -8.798 1.112 1.230
269 H GLY 34 H GLY 34 -12.304 -1.360 1.210
270 HA2 GLY 34 HA2 GLY 34 -14.730 -1.079 0.050
271 HA3 GLY 34 HA3 GLY 34 -13.883 -2.146 -1.086
Start of MODEL 12
1 H1 LYS 1 H1 LYS 1 -12.493 2.997 -3.573
2 H2 LYS 1 H2 LYS 1 -12.439 1.452 -4.105
3 H3 LYS 1 H3 LYS 1 -12.360 2.677 -5.200
4 HA LYS 1 HA LYS 1 -10.235 3.390 -4.324
5 HB2 LYS 1 HB2 LYS 1 -10.555 0.962 -2.517
6 HB3 LYS 1 HB3 LYS 1 -9.048 1.849 -2.778
7 HG2 LYS 1 HG2 LYS 1 -9.882 3.824 -1.751
8 HG3 LYS 1 HG3 LYS 1 -11.528 3.189 -1.656
9 HD2 LYS 1 HD2 LYS 1 -11.090 1.783 0.090
10 HD3 LYS 1 HD3 LYS 1 -9.409 1.506 -0.344
11 HE2 LYS 1 HE2 LYS 1 -10.346 4.168 0.768
12 HE3 LYS 1 HE3 LYS 1 -9.882 2.804 1.802
13 HZ1 LYS 1 HZ1 LYS 1 -8.107 4.088 -0.220
14 HZ2 LYS 1 HZ2 LYS 1 -7.959 4.228 1.401
15 HZ3 LYS 1 HZ3 LYS 1 -7.707 2.776 0.657
16 H LEU 2 H LEU 2 -9.697 -0.078 -4.073
17 HA LEU 2 HA LEU 2 -9.535 -0.492 -6.872
18 HB2 LEU 2 HB2 LEU 2 -6.910 -1.017 -5.461
19 HB3 LEU 2 HB3 LEU 2 -7.257 -1.117 -7.091
20 HG LEU 2 HG LEU 2 -7.483 1.339 -7.315
21 HD11 LEU 2 HD11 LEU 2 -6.573 2.842 -5.801
22 HD12 LEU 2 HD12 LEU 2 -7.436 1.792 -4.674
23 HD13 LEU 2 HD13 LEU 2 -5.697 1.618 -4.890
24 HD21 LEU 2 HD21 LEU 2 -4.867 0.000 -6.470
25 HD22 LEU 2 HD22 LEU 2 -5.569 0.041 -8.102
26 HD23 LEU 2 HD23 LEU 2 -4.976 1.539 -7.375
27 HA PRO 3 HA PRO 3 -10.793 -4.532 -6.144
28 HB2 PRO 3 HB2 PRO 3 -8.156 -5.461 -7.357
29 HB3 PRO 3 HB3 PRO 3 -9.790 -6.069 -7.778
30 HG2 PRO 3 HG2 PRO 3 -8.669 -4.304 -9.388
31 HG3 PRO 3 HG3 PRO 3 -10.335 -3.918 -8.803
32 HD2 PRO 3 HD2 PRO 3 -7.680 -3.006 -7.622
33 HD3 PRO 3 HD3 PRO 3 -9.067 -2.013 -8.090
34 HA PRO 4 HA PRO 4 -8.963 -7.382 -3.096
35 HB2 PRO 4 HB2 PRO 4 -10.088 -9.767 -3.892
36 HB3 PRO 4 HB3 PRO 4 -10.991 -8.507 -2.992
37 HG2 PRO 4 HG2 PRO 4 -10.949 -8.994 -5.983
38 HG3 PRO 4 HG3 PRO 4 -12.371 -8.726 -4.923
39 HD2 PRO 4 HD2 PRO 4 -11.320 -6.720 -6.379
40 HD3 PRO 4 HD3 PRO 4 -11.892 -6.416 -4.718
41 H GLY 5 H GLY 5 -7.072 -8.632 -3.130
42 HA2 GLY 5 HA2 GLY 5 -5.408 -10.004 -4.391
43 HA3 GLY 5 HA3 GLY 5 -5.815 -9.052 -5.812
44 H TRP 6 H TRP 6 -6.010 -6.367 -4.294
45 HA TRP 6 HA TRP 6 -3.164 -5.795 -4.121
46 HB2 TRP 6 HB2 TRP 6 -5.710 -4.281 -3.482
47 HB3 TRP 6 HB3 TRP 6 -4.092 -3.627 -3.271
48 HD1 TRP 6 HD1 TRP 6 -6.620 -4.185 -5.976
49 HE1 TRP 6 HE1 TRP 6 -5.787 -3.037 -8.104
50 HE3 TRP 6 HE3 TRP 6 -1.859 -3.242 -4.509
51 HZ2 TRP 6 HZ2 TRP 6 -3.293 -1.920 -9.098
52 HZ3 TRP 6 HZ3 TRP 6 -0.297 -2.132 -5.994
53 HH2 TRP 6 HH2 TRP 6 -0.963 -1.455 -8.323
54 H GLU 7 H GLU 7 -1.856 -6.033 -2.367
55 HA GLU 7 HA GLU 7 -3.046 -6.176 0.362
56 HB2 GLU 7 HB2 GLU 7 -2.441 -8.426 -0.975
57 HB3 GLU 7 HB3 GLU 7 -0.812 -8.048 -0.440
58 HG2 GLU 7 HG2 GLU 7 -3.268 -8.369 1.356
59 HG3 GLU 7 HG3 GLU 7 -2.099 -9.640 1.009
60 H LYS 8 H LYS 8 -1.575 -5.628 2.044
61 HA LYS 8 HA LYS 8 0.178 -3.419 1.519
62 HB2 LYS 8 HB2 LYS 8 -0.914 -3.264 3.514
63 HB3 LYS 8 HB3 LYS 8 -0.859 -4.944 3.880
64 HG2 LYS 8 HG2 LYS 8 1.812 -3.598 4.014
65 HG3 LYS 8 HG3 LYS 8 0.592 -2.938 5.069
66 HD2 LYS 8 HD2 LYS 8 1.895 -4.612 6.226
67 HD3 LYS 8 HD3 LYS 8 0.195 -5.048 6.183
68 HE2 LYS 8 HE2 LYS 8 2.141 -6.183 4.154
69 HE3 LYS 8 HE3 LYS 8 2.087 -6.843 5.779
70 HZ1 LYS 8 HZ1 LYS 8 -0.117 -7.593 5.468
71 HZ2 LYS 8 HZ2 LYS 8 -0.391 -6.716 4.112
72 HZ3 LYS 8 HZ3 LYS 8 0.566 -7.926 3.992
73 H ARG 9 H ARG 9 2.346 -3.251 1.477
74 HA ARG 9 HA ARG 9 4.141 -5.476 2.162
75 HB2 ARG 9 HB2 ARG 9 4.137 -4.112 -0.572
76 HB3 ARG 9 HB3 ARG 9 5.459 -5.112 0.024
77 HG2 ARG 9 HG2 ARG 9 2.632 -6.055 -0.556
78 HG3 ARG 9 HG3 ARG 9 4.051 -6.306 -1.566
79 HD2 ARG 9 HD2 ARG 9 4.666 -8.138 -0.467
80 HD3 ARG 9 HD3 ARG 9 4.617 -7.324 1.086
81 HE ARG 9 HE ARG 9 2.197 -7.737 1.203
82 HH11 ARG 9 HH11 ARG 9 3.860 -9.789 -1.112
83 HH12 ARG 9 HH12 ARG 9 2.674 -11.061 -0.991
84 HH21 ARG 9 HH22 ARG 9 0.749 -9.405 1.397
85 HH22 ARG 9 HH21 ARG 9 0.926 -10.834 0.404
86 H MET 10 H MET 10 6.509 -4.569 1.972
87 HA MET 10 HA MET 10 6.563 -1.707 2.800
88 HB2 MET 10 HB2 MET 10 6.670 -3.248 4.764
89 HB3 MET 10 HB3 MET 10 8.113 -3.996 4.059
90 HG2 MET 10 HG2 MET 10 9.224 -1.745 4.095
91 HG3 MET 10 HG3 MET 10 7.786 -1.072 4.851
92 HE1 MET 10 HE1 MET 10 10.871 -3.871 6.860
93 HE2 MET 10 HE2 MET 10 9.876 -4.452 5.509
94 HE3 MET 10 HE3 MET 10 11.036 -3.125 5.254
95 H PHE 11 H PHE 11 7.992 -0.499 1.703
96 HA PHE 11 HA PHE 11 9.353 -1.664 -0.504
97 HB2 PHE 11 HB2 PHE 11 8.202 0.605 -0.283
98 HB3 PHE 11 HB3 PHE 11 9.676 1.174 0.473
99 HD1 PHE 11 HD1 PHE 11 11.923 0.732 -0.932
100 HD2 PHE 11 HD2 PHE 11 7.943 0.608 -2.601
101 HE1 PHE 11 HE1 PHE 11 12.861 1.047 -3.198
102 HE2 PHE 11 HE2 PHE 11 8.892 0.937 -4.867
103 HZ PHE 11 HZ PHE 11 11.350 1.159 -5.172
104 H ARG 12 H ARG 12 10.906 -3.049 0.061
105 HA ARG 12 HA ARG 12 12.999 -2.966 1.837
106 HB2 ARG 12 HB2 ARG 12 12.371 -4.791 0.290
107 HB3 ARG 12 HB3 ARG 12 13.026 -3.899 -1.070
108 HG2 ARG 12 HG2 ARG 12 14.666 -4.959 1.282
109 HG3 ARG 12 HG3 ARG 12 14.432 -5.779 -0.267
110 HD2 ARG 12 HD2 ARG 12 15.410 -3.660 -1.368
111 HD3 ARG 12 HD3 ARG 12 15.943 -3.225 0.275
112 HE ARG 12 HE ARG 12 16.804 -5.862 -0.362
113 HH11 ARG 12 HH21 ARG 12 17.571 -2.467 -1.067
114 HH12 ARG 12 HH22 ARG 12 19.236 -2.838 -1.424
115 HH21 ARG 12 HH11 ARG 12 18.972 -6.239 -0.829
116 HH22 ARG 12 HH12 ARG 12 20.003 -4.918 -1.282
117 H SER 13 H SER 13 14.708 -1.774 2.174
118 HA SER 13 HA SER 13 16.593 -0.539 1.910
119 HB2 SER 13 HB2 SER 13 15.873 0.839 -0.634
120 HB3 SER 13 HB3 SER 13 17.453 0.385 0.011
121 HG SER 13 HG SER 13 15.458 -1.181 -1.194
122 H ASN 14 H ASN 14 13.346 0.616 1.967
123 HA ASN 14 HA ASN 14 14.463 2.890 3.485
124 HB2 ASN 14 HB2 ASN 14 13.038 4.573 2.482
125 HB3 ASN 14 HB3 ASN 14 14.127 3.871 1.296
126 HD21 ASN 14 HD22 ASN 14 13.097 3.673 -0.687
127 HD22 ASN 14 HD21 ASN 14 11.414 3.216 -0.838
128 H GLY 15 H GLY 15 11.671 0.743 2.945
129 HA2 GLY 15 HA2 GLY 15 10.565 -0.189 4.805
130 HA3 GLY 15 HA3 GLY 15 10.987 1.186 5.808
131 H THR 16 H THR 16 9.819 2.350 2.827
132 HA THR 16 HA THR 16 7.420 3.439 3.891
133 HB THR 16 HB THR 16 8.031 2.883 0.957
134 HG1 THR 16 HG1 THR 16 9.699 4.026 1.718
135 HG21 THR 16 HG21 THR 16 6.274 4.974 2.315
136 HG22 THR 16 HG22 THR 16 6.641 4.897 0.580
137 HG23 THR 16 HG23 THR 16 5.701 3.601 1.335
138 H VAL 17 H VAL 17 5.639 2.266 4.560
139 HA VAL 17 HA VAL 17 5.018 -0.298 3.290
140 HB VAL 17 HB VAL 17 3.580 1.286 5.403
141 HG11 VAL 17 HG11 VAL 17 2.754 -1.391 4.212
142 HG12 VAL 17 HG12 VAL 17 2.107 -0.703 5.715
143 HG13 VAL 17 HG13 VAL 17 1.807 0.110 4.180
144 HG21 VAL 17 HG21 VAL 17 5.686 0.040 6.032
145 HG22 VAL 17 HG22 VAL 17 4.253 -0.650 6.813
146 HG23 VAL 17 HG23 VAL 17 4.950 -1.449 5.387
147 H TYR 18 H TYR 18 3.638 -0.715 1.824
148 HA TYR 18 HA TYR 18 1.971 1.294 0.444
149 HB2 TYR 18 HB2 TYR 18 3.134 1.302 -1.568
150 HB3 TYR 18 HB3 TYR 18 4.394 1.510 -0.378
151 HD1 TYR 18 HD1 TYR 18 5.730 -0.654 0.327
152 HD2 TYR 18 HD2 TYR 18 3.280 -0.376 -3.211
153 HE1 TYR 18 HE1 TYR 18 6.923 -2.623 -0.682
154 HE2 TYR 18 HE2 TYR 18 4.434 -2.340 -4.173
155 HH TYR 18 HH TYR 18 6.138 -3.836 -3.922
156 H TYR 19 H TYR 19 1.214 -0.092 -1.839
157 HA TYR 19 HA TYR 19 0.533 -2.818 -0.849
158 HB2 TYR 19 HB2 TYR 19 -1.269 -0.677 -1.883
159 HB3 TYR 19 HB3 TYR 19 -1.580 -2.315 -2.390
160 HD1 TYR 19 HD2 TYR 19 -0.727 -0.625 0.901
161 HD2 TYR 19 HD1 TYR 19 -3.159 -3.483 -1.199
162 HE1 TYR 19 HE2 TYR 19 -2.023 -1.066 2.975
163 HE2 TYR 19 HE1 TYR 19 -4.483 -3.890 0.839
164 HH TYR 19 HH TYR 19 -4.819 -3.264 3.033
165 H PHE 20 H PHE 20 0.266 -4.388 -2.272
166 HA PHE 20 HA PHE 20 1.469 -4.111 -4.993
167 HB2 PHE 20 HB2 PHE 20 3.113 -4.927 -3.433
168 HB3 PHE 20 HB3 PHE 20 1.961 -6.070 -2.733
169 HD1 PHE 20 HD1 PHE 20 4.095 -5.368 -5.672
170 HD2 PHE 20 HD2 PHE 20 1.579 -8.284 -3.707
171 HE1 PHE 20 HE1 PHE 20 4.993 -7.140 -7.138
172 HE2 PHE 20 HE2 PHE 20 2.550 -10.056 -5.138
173 HZ PHE 20 HZ PHE 20 4.221 -9.494 -6.874
174 H ASN 21 H ASN 21 0.337 -5.254 -6.579
175 HA ASN 21 HA ASN 21 -2.149 -6.616 -5.691
176 HB2 ASN 21 HB2 ASN 21 -2.228 -4.949 -7.558
177 HB3 ASN 21 HB3 ASN 21 -1.190 -6.016 -8.480
178 HD21 ASN 21 HD22 ASN 21 -4.491 -5.542 -7.190
179 HD22 ASN 21 HD21 ASN 21 -5.127 -6.965 -8.000
180 H HIS 22 H HIS 22 -1.739 -8.610 -4.921
181 HA HIS 22 HA HIS 22 0.487 -10.164 -5.867
182 HB2 HIS 22 HB2 HIS 22 0.062 -11.543 -4.086
183 HB3 HIS 22 HB3 HIS 22 -0.556 -10.019 -3.506
184 HD1 HIS 22 HD1 HIS 22 -2.047 -13.112 -5.285
185 HD2 HIS 22 HD2 HIS 22 -2.948 -10.182 -2.413
186 HE1 HIS 22 HE1 HIS 22 -4.363 -13.730 -4.288
187 H ILE 23 H ILE 23 -2.274 -9.649 -7.534
188 HA ILE 23 HA ILE 23 -2.467 -12.414 -8.634
189 HB ILE 23 HB ILE 23 -4.398 -10.066 -8.812
190 HG12 ILE 23 HG12 ILE 23 -4.474 -12.610 -7.123
191 HG13 ILE 23 HG13 ILE 23 -4.301 -10.961 -6.525
192 HG21 ILE 23 HG21 ILE 23 -4.540 -11.565 -10.787
193 HG22 ILE 23 HG22 ILE 23 -4.759 -12.957 -9.698
194 HG23 ILE 23 HG23 ILE 23 -5.977 -11.662 -9.788
195 HD11 ILE 23 HD11 ILE 23 -6.604 -10.451 -7.456
196 HD12 ILE 23 HD12 ILE 23 -6.789 -12.202 -7.731
197 HD13 ILE 23 HD13 ILE 23 -6.538 -11.586 -6.094
198 H THR 24 H THR 24 -1.625 -9.088 -9.396
199 HA THR 24 HA THR 24 -0.985 -9.813 -12.238
200 HB THR 24 HB THR 24 -1.220 -7.410 -12.704
201 HG1 THR 24 HG1 THR 24 -2.204 -7.244 -10.075
202 HG21 THR 24 HG21 THR 24 -3.684 -8.459 -11.232
203 HG22 THR 24 HG22 THR 24 -3.634 -7.132 -12.407
204 HG23 THR 24 HG23 THR 24 -3.272 -8.792 -12.930
205 H ASN 25 H ASN 25 0.480 -8.763 -9.287
206 HA ASN 25 HA ASN 25 2.523 -8.208 -8.672
207 HB2 ASN 25 HB2 ASN 25 3.209 -9.799 -10.623
208 HB3 ASN 25 HB3 ASN 25 3.650 -8.316 -11.465
209 HD21 ASN 25 HD22 ASN 25 5.067 -6.794 -9.925
210 HD22 ASN 25 HD21 ASN 25 6.441 -7.699 -9.242
211 H ALA 26 H ALA 26 0.406 -6.251 -10.097
212 HA ALA 26 HA ALA 26 1.994 -3.907 -10.617
213 HB1 ALA 26 HB1 ALA 26 -0.362 -4.230 -11.348
214 HB2 ALA 26 HB2 ALA 26 -0.890 -4.089 -9.659
215 HB3 ALA 26 HB3 ALA 26 -0.117 -2.714 -10.465
216 H SER 27 H SER 27 1.732 -1.823 -9.168
217 HA SER 27 HA SER 27 1.818 -2.354 -6.265
218 HB2 SER 27 HB2 SER 27 4.162 -1.326 -7.877
219 HB3 SER 27 HB3 SER 27 3.982 -1.060 -6.126
220 HG SER 27 HG SER 27 3.549 -3.636 -7.119
221 H GLN 28 H GLN 28 1.418 -0.507 -4.992
222 HA GLN 28 HA GLN 28 0.702 2.050 -6.281
223 HB2 GLN 28 HB2 GLN 28 -1.175 0.559 -6.739
224 HB3 GLN 28 HB3 GLN 28 -1.237 0.041 -5.051
225 HG2 GLN 28 HG2 GLN 28 -3.068 1.556 -5.713
226 HG3 GLN 28 HG3 GLN 28 -2.121 2.120 -4.354
227 HE21 GLN 28 HE22 GLN 28 -2.454 2.579 -7.968
228 HE22 GLN 28 HE21 GLN 28 -1.926 4.249 -7.845
229 H PHE 29 H PHE 29 0.285 3.736 -4.735
230 HA PHE 29 HA PHE 29 1.409 3.247 -2.040
231 HB2 PHE 29 HB2 PHE 29 0.763 5.850 -3.423
232 HB3 PHE 29 HB3 PHE 29 1.619 5.652 -1.896
233 HD1 PHE 29 HD2 PHE 29 3.644 3.631 -2.284
234 HD2 PHE 29 HD1 PHE 29 2.217 6.560 -5.124
235 HE1 PHE 29 HE2 PHE 29 5.781 3.486 -3.514
236 HE2 PHE 29 HE1 PHE 29 4.363 6.399 -6.351
237 HZ PHE 29 HZ PHE 29 6.148 4.866 -5.550
238 H GLU 30 H GLU 30 -1.671 4.053 -3.624
239 HA GLU 30 HA GLU 30 -3.130 4.605 -1.173
240 HB2 GLU 30 HB2 GLU 30 -4.114 5.348 -3.177
241 HB3 GLU 30 HB3 GLU 30 -3.822 3.826 -4.001
242 HG2 GLU 30 HG2 GLU 30 -6.151 4.078 -3.665
243 HG3 GLU 30 HG3 GLU 30 -5.584 2.714 -2.716
244 H ARG 31 H ARG 31 -4.404 3.207 0.011
245 HA ARG 31 HA ARG 31 -3.688 0.297 0.051
246 HB2 ARG 31 HB2 ARG 31 -4.964 2.026 2.228
247 HB3 ARG 31 HB3 ARG 31 -4.632 0.300 2.312
248 HG2 ARG 31 HG2 ARG 31 -2.758 1.016 3.373
249 HG3 ARG 31 HG3 ARG 31 -2.147 1.070 1.723
250 HD2 ARG 31 HD2 ARG 31 -3.301 3.618 2.240
251 HD3 ARG 31 HD3 ARG 31 -2.394 3.162 3.688
252 HE ARG 31 HE ARG 31 -1.327 3.720 0.982
253 HH11 ARG 31 HH21 ARG 31 -0.308 2.310 4.096
254 HH12 ARG 31 HH22 ARG 31 1.374 2.470 3.563
255 HH21 ARG 31 HH11 ARG 31 0.692 3.858 0.572
256 HH22 ARG 31 HH12 ARG 31 1.936 3.272 1.729
257 HA PRO 32 HA PRO 32 -7.890 0.385 -1.690
258 HB2 PRO 32 HB2 PRO 32 -7.467 -2.356 -2.739
259 HB3 PRO 32 HB3 PRO 32 -7.863 -0.855 -3.562
260 HG2 PRO 32 HG2 PRO 32 -5.489 -1.983 -3.845
261 HG3 PRO 32 HG3 PRO 32 -5.629 -0.268 -3.860
262 HD2 PRO 32 HD2 PRO 32 -4.931 -1.949 -1.439
263 HD3 PRO 32 HD3 PRO 32 -4.103 -0.474 -2.018
264 H SER 33 H SER 33 -9.854 -0.715 -1.366
265 HA SER 33 HA SER 33 -10.102 -3.211 0.029
266 HB2 SER 33 HB2 SER 33 -11.199 -2.450 2.022
267 HB3 SER 33 HB3 SER 33 -9.675 -1.554 1.932
268 HG SER 33 HG SER 33 -12.230 -0.691 1.075
269 H GLY 34 H GLY 34 -10.852 -2.304 -2.589
270 HA2 GLY 34 HA2 GLY 34 -12.835 -2.602 -3.852
271 HA3 GLY 34 HA3 GLY 34 -13.822 -2.084 -2.466
Start of MODEL 13
1 H1 LYS 1 H1 LYS 1 -13.166 1.513 -2.350
2 H2 LYS 1 H2 LYS 1 -12.335 0.092 -2.565
3 H3 LYS 1 H3 LYS 1 -13.467 0.537 -3.653
4 HA LYS 1 HA LYS 1 -12.214 2.419 -4.368
5 HB2 LYS 1 HB2 LYS 1 -10.141 1.429 -2.372
6 HB3 LYS 1 HB3 LYS 1 -9.868 2.668 -3.614
7 HG2 LYS 1 HG2 LYS 1 -11.848 3.946 -2.602
8 HG3 LYS 1 HG3 LYS 1 -11.720 2.857 -1.212
9 HD2 LYS 1 HD2 LYS 1 -9.510 4.656 -2.304
10 HD3 LYS 1 HD3 LYS 1 -10.500 5.013 -0.884
11 HE2 LYS 1 HE2 LYS 1 -9.545 3.208 0.382
12 HE3 LYS 1 HE3 LYS 1 -8.844 2.475 -1.067
13 HZ1 LYS 1 HZ1 LYS 1 -7.399 4.396 -1.311
14 HZ2 LYS 1 HZ2 LYS 1 -7.893 4.994 0.153
15 HZ3 LYS 1 HZ3 LYS 1 -7.105 3.527 -0.010
16 H LEU 2 H LEU 2 -9.226 1.051 -4.687
17 HA LEU 2 HA LEU 2 -9.960 -0.364 -7.021
18 HB2 LEU 2 HB2 LEU 2 -7.265 -0.792 -5.768
19 HB3 LEU 2 HB3 LEU 2 -7.693 -0.888 -7.366
20 HG LEU 2 HG LEU 2 -7.912 1.491 -7.682
21 HD11 LEU 2 HD11 LEU 2 -7.096 1.756 -4.755
22 HD12 LEU 2 HD12 LEU 2 -6.780 3.007 -5.957
23 HD13 LEU 2 HD13 LEU 2 -8.432 2.564 -5.626
24 HD21 LEU 2 HD21 LEU 2 -5.814 0.277 -8.100
25 HD22 LEU 2 HD22 LEU 2 -5.478 1.917 -7.537
26 HD23 LEU 2 HD23 LEU 2 -5.291 0.540 -6.430
27 HA PRO 3 HA PRO 3 -11.145 -4.370 -6.257
28 HB2 PRO 3 HB2 PRO 3 -8.521 -5.324 -7.474
29 HB3 PRO 3 HB3 PRO 3 -10.167 -5.944 -7.849
30 HG2 PRO 3 HG2 PRO 3 -9.070 -4.202 -9.519
31 HG3 PRO 3 HG3 PRO 3 -10.734 -3.827 -8.923
32 HD2 PRO 3 HD2 PRO 3 -8.077 -2.832 -7.824
33 HD3 PRO 3 HD3 PRO 3 -9.502 -1.881 -8.260
34 HA PRO 4 HA PRO 4 -9.302 -7.024 -3.062
35 HB2 PRO 4 HB2 PRO 4 -10.501 -9.425 -3.656
36 HB3 PRO 4 HB3 PRO 4 -11.363 -8.082 -2.845
37 HG2 PRO 4 HG2 PRO 4 -11.379 -8.800 -5.788
38 HG3 PRO 4 HG3 PRO 4 -12.776 -8.416 -4.734
39 HD2 PRO 4 HD2 PRO 4 -11.679 -6.561 -6.364
40 HD3 PRO 4 HD3 PRO 4 -12.257 -6.110 -4.736
41 H GLY 5 H GLY 5 -7.435 -8.312 -3.077
42 HA2 GLY 5 HA2 GLY 5 -5.847 -9.804 -4.292
43 HA3 GLY 5 HA3 GLY 5 -6.281 -8.946 -5.765
44 H TRP 6 H TRP 6 -6.342 -6.122 -4.516
45 HA TRP 6 HA TRP 6 -3.494 -5.631 -4.446
46 HB2 TRP 6 HB2 TRP 6 -5.959 -3.998 -3.766
47 HB3 TRP 6 HB3 TRP 6 -4.315 -3.408 -3.642
48 HD1 TRP 6 HD1 TRP 6 -6.964 -4.004 -6.214
49 HE1 TRP 6 HE1 TRP 6 -6.182 -2.943 -8.425
50 HE3 TRP 6 HE3 TRP 6 -2.123 -3.148 -4.985
51 HZ2 TRP 6 HZ2 TRP 6 -3.683 -2.018 -9.582
52 HZ3 TRP 6 HZ3 TRP 6 -0.591 -2.140 -6.573
53 HH2 TRP 6 HH2 TRP 6 -1.311 -1.591 -8.916
54 H GLU 7 H GLU 7 -2.104 -5.925 -2.802
55 HA GLU 7 HA GLU 7 -3.085 -5.998 0.005
56 HB2 GLU 7 HB2 GLU 7 -2.746 -8.228 -1.376
57 HB3 GLU 7 HB3 GLU 7 -1.036 -7.940 -1.103
58 HG2 GLU 7 HG2 GLU 7 -3.195 -8.189 1.049
59 HG3 GLU 7 HG3 GLU 7 -2.146 -9.500 0.514
60 H LYS 8 H LYS 8 -1.551 -5.433 1.549
61 HA LYS 8 HA LYS 8 0.157 -3.245 0.969
62 HB2 LYS 8 HB2 LYS 8 -0.873 -3.208 3.008
63 HB3 LYS 8 HB3 LYS 8 -0.655 -4.884 3.355
64 HG2 LYS 8 HG2 LYS 8 1.590 -2.841 3.468
65 HG3 LYS 8 HG3 LYS 8 0.528 -3.218 4.811
66 HD2 LYS 8 HD2 LYS 8 2.681 -4.985 3.629
67 HD3 LYS 8 HD3 LYS 8 2.520 -4.335 5.230
68 HE2 LYS 8 HE2 LYS 8 2.050 -6.570 5.513
69 HE3 LYS 8 HE3 LYS 8 0.451 -5.823 5.548
70 HZ1 LYS 8 HZ1 LYS 8 -0.080 -6.817 3.485
71 HZ2 LYS 8 HZ2 LYS 8 1.432 -6.843 2.958
72 HZ3 LYS 8 HZ3 LYS 8 0.913 -7.945 4.069
73 H ARG 9 H ARG 9 2.275 -2.962 0.752
74 HA ARG 9 HA ARG 9 4.217 -5.095 1.395
75 HB2 ARG 9 HB2 ARG 9 4.127 -3.607 -1.272
76 HB3 ARG 9 HB3 ARG 9 5.481 -4.603 -0.732
77 HG2 ARG 9 HG2 ARG 9 2.662 -5.561 -1.319
78 HG3 ARG 9 HG3 ARG 9 4.075 -5.759 -2.353
79 HD2 ARG 9 HD2 ARG 9 4.767 -7.604 -1.303
80 HD3 ARG 9 HD3 ARG 9 4.614 -6.877 0.284
81 HE ARG 9 HE ARG 9 2.259 -7.430 0.348
82 HH11 ARG 9 HH21 ARG 9 3.905 -9.088 -2.280
83 HH12 ARG 9 HH22 ARG 9 2.788 -10.428 -2.262
84 HH21 ARG 9 HH11 ARG 9 0.882 -9.141 0.349
85 HH22 ARG 9 HH12 ARG 9 1.056 -10.433 -0.823
86 H MET 10 H MET 10 6.508 -4.115 1.384
87 HA MET 10 HA MET 10 6.428 -1.295 2.309
88 HB2 MET 10 HB2 MET 10 6.091 -2.824 4.240
89 HB3 MET 10 HB3 MET 10 7.630 -3.616 3.861
90 HG2 MET 10 HG2 MET 10 8.794 -1.439 4.170
91 HG3 MET 10 HG3 MET 10 7.263 -0.672 4.572
92 HE1 MET 10 HE1 MET 10 6.298 -0.524 6.897
93 HE2 MET 10 HE2 MET 10 5.673 -2.156 6.544
94 HE3 MET 10 HE3 MET 10 6.447 -1.815 8.109
95 H PHE 11 H PHE 11 8.071 -0.093 1.656
96 HA PHE 11 HA PHE 11 10.157 -1.118 -0.029
97 HB2 PHE 11 HB2 PHE 11 8.963 1.144 -0.091
98 HB3 PHE 11 HB3 PHE 11 9.965 1.623 1.257
99 HD1 PHE 11 HD2 PHE 11 12.626 1.367 0.859
100 HD2 PHE 11 HD1 PHE 11 9.661 1.524 -2.277
101 HE1 PHE 11 HE2 PHE 11 14.367 2.041 -0.752
102 HE2 PHE 11 HE1 PHE 11 11.415 2.225 -3.884
103 HZ PHE 11 HZ PHE 11 13.770 2.481 -3.129
104 H ARG 12 H ARG 12 11.079 -2.739 1.373
105 HA ARG 12 HA ARG 12 12.504 -2.275 3.721
106 HB2 ARG 12 HB2 ARG 12 13.794 -4.159 3.300
107 HB3 ARG 12 HB3 ARG 12 12.235 -4.484 2.573
108 HG2 ARG 12 HG2 ARG 12 14.804 -3.744 1.082
109 HG3 ARG 12 HG3 ARG 12 14.129 -5.349 1.285
110 HD2 ARG 12 HD2 ARG 12 13.521 -4.800 -0.874
111 HD3 ARG 12 HD3 ARG 12 12.038 -4.512 0.053
112 HE ARG 12 HE ARG 12 13.510 -2.083 -0.037
113 HH11 ARG 12 HH21 ARG 12 11.752 -4.086 -2.321
114 HH12 ARG 12 HH22 ARG 12 11.399 -2.749 -3.383
115 HH21 ARG 12 HH12 ARG 12 13.039 -0.416 -1.396
116 HH22 ARG 12 HH11 ARG 12 12.135 -0.677 -2.845
117 H SER 13 H SER 13 14.476 -1.590 4.291
118 HA SER 13 HA SER 13 16.374 -0.384 4.357
119 HB2 SER 13 HB2 SER 13 16.024 0.488 1.478
120 HB3 SER 13 HB3 SER 13 17.408 0.790 2.536
121 HG SER 13 HG SER 13 17.765 -1.037 1.229
122 H ASN 14 H ASN 14 13.218 0.900 3.631
123 HA ASN 14 HA ASN 14 13.980 3.057 5.477
124 HB2 ASN 14 HB2 ASN 14 13.050 4.872 4.240
125 HB3 ASN 14 HB3 ASN 14 14.312 4.099 3.296
126 HD21 ASN 14 HD22 ASN 14 13.657 4.624 1.186
127 HD22 ASN 14 HD21 ASN 14 12.082 4.159 0.576
128 H GLY 15 H GLY 15 11.387 1.052 4.142
129 HA2 GLY 15 HA2 GLY 15 9.797 0.114 5.584
130 HA3 GLY 15 HA3 GLY 15 9.932 1.463 6.699
131 H THR 16 H THR 16 9.685 2.691 3.528
132 HA THR 16 HA THR 16 7.118 3.834 3.928
133 HB THR 16 HB THR 16 8.470 3.372 1.239
134 HG1 THR 16 HG1 THR 16 9.910 4.408 2.517
135 HG21 THR 16 HG21 THR 16 6.144 4.152 1.056
136 HG22 THR 16 HG22 THR 16 6.468 5.448 2.231
137 HG23 THR 16 HG23 THR 16 7.270 5.465 0.647
138 H VAL 17 H VAL 17 5.174 2.826 3.946
139 HA VAL 17 HA VAL 17 4.851 0.215 2.685
140 HB VAL 17 HB VAL 17 2.983 2.012 4.253
141 HG11 VAL 17 HG11 VAL 17 2.328 -0.709 3.059
142 HG12 VAL 17 HG12 VAL 17 1.385 0.088 4.335
143 HG13 VAL 17 HG13 VAL 17 1.492 0.827 2.738
144 HG21 VAL 17 HG21 VAL 17 3.165 0.191 5.922
145 HG22 VAL 17 HG22 VAL 17 4.194 -0.738 4.808
146 HG23 VAL 17 HG23 VAL 17 4.774 0.796 5.502
147 H TYR 18 H TYR 18 3.581 -0.351 1.035
148 HA TYR 18 HA TYR 18 2.063 1.547 -0.573
149 HB2 TYR 18 HB2 TYR 18 3.213 1.148 -2.638
150 HB3 TYR 18 HB3 TYR 18 4.348 1.794 -1.479
151 HD1 TYR 18 HD1 TYR 18 6.106 0.294 -0.457
152 HD2 TYR 18 HD2 TYR 18 3.535 -0.988 -3.674
153 HE1 TYR 18 HE1 TYR 18 7.697 -1.569 -1.020
154 HE2 TYR 18 HE2 TYR 18 5.095 -2.831 -4.204
155 HH TYR 18 HH TYR 18 7.092 -3.815 -3.701
156 H TYR 19 H TYR 19 1.351 -0.081 -2.730
157 HA TYR 19 HA TYR 19 0.556 -2.664 -1.508
158 HB2 TYR 19 HB2 TYR 19 -1.138 -0.432 -2.508
159 HB3 TYR 19 HB3 TYR 19 -1.581 -2.022 -3.059
160 HD1 TYR 19 HD2 TYR 19 -0.748 -0.252 0.208
161 HD2 TYR 19 HD1 TYR 19 -3.002 -3.323 -1.787
162 HE1 TYR 19 HE2 TYR 19 -1.869 -0.825 2.326
163 HE2 TYR 19 HE1 TYR 19 -4.217 -3.815 0.309
164 HH TYR 19 HH TYR 19 -4.549 -3.257 2.502
165 H PHE 20 H PHE 20 -0.001 -4.288 -2.862
166 HA PHE 20 HA PHE 20 1.099 -4.274 -5.628
167 HB2 PHE 20 HB2 PHE 20 2.828 -5.005 -4.131
168 HB3 PHE 20 HB3 PHE 20 1.722 -6.110 -3.300
169 HD1 PHE 20 HD1 PHE 20 3.533 -5.501 -6.487
170 HD2 PHE 20 HD2 PHE 20 1.338 -8.358 -4.106
171 HE1 PHE 20 HE1 PHE 20 4.261 -7.331 -8.003
172 HE2 PHE 20 HE2 PHE 20 2.134 -10.186 -5.592
173 HZ PHE 20 HZ PHE 20 3.563 -9.679 -7.542
174 H ASN 21 H ASN 21 -0.304 -5.309 -7.024
175 HA ASN 21 HA ASN 21 -2.667 -6.685 -5.945
176 HB2 ASN 21 HB2 ASN 21 -2.761 -5.145 -7.939
177 HB3 ASN 21 HB3 ASN 21 -1.844 -6.354 -8.831
178 HD21 ASN 21 HD22 ASN 21 -5.026 -5.383 -7.909
179 HD22 ASN 21 HD21 ASN 21 -5.783 -6.929 -8.278
180 H HIS 22 H HIS 22 -2.264 -8.613 -5.067
181 HA HIS 22 HA HIS 22 -0.067 -10.261 -5.955
182 HB2 HIS 22 HB2 HIS 22 -0.446 -11.497 -4.070
183 HB3 HIS 22 HB3 HIS 22 -1.064 -9.941 -3.576
184 HD1 HIS 22 HD1 HIS 22 -2.544 -13.170 -5.099
185 HD2 HIS 22 HD2 HIS 22 -3.463 -10.031 -2.467
186 HE1 HIS 22 HE1 HIS 22 -4.841 -13.737 -4.030
187 H ILE 23 H ILE 23 -2.944 -9.808 -7.506
188 HA ILE 23 HA ILE 23 -3.181 -12.621 -8.448
189 HB ILE 23 HB ILE 23 -5.158 -10.320 -8.691
190 HG12 ILE 23 HG12 ILE 23 -5.122 -12.700 -6.779
191 HG13 ILE 23 HG13 ILE 23 -4.911 -11.009 -6.333
192 HG21 ILE 23 HG21 ILE 23 -5.337 -12.016 -10.505
193 HG22 ILE 23 HG22 ILE 23 -5.499 -13.288 -9.272
194 HG23 ILE 23 HG23 ILE 23 -6.738 -12.023 -9.447
195 HD11 ILE 23 HD11 ILE 23 -7.252 -10.551 -7.177
196 HD12 ILE 23 HD12 ILE 23 -7.466 -12.315 -7.311
197 HD13 ILE 23 HD13 ILE 23 -7.127 -11.583 -5.738
198 H THR 24 H THR 24 -2.657 -9.233 -9.531
199 HA THR 24 HA THR 24 -2.083 -10.249 -12.284
200 HB THR 24 HB THR 24 -2.223 -7.991 -13.028
201 HG1 THR 24 HG1 THR 24 -2.808 -6.360 -11.530
202 HG21 THR 24 HG21 THR 24 -4.386 -9.199 -12.705
203 HG22 THR 24 HG22 THR 24 -4.546 -8.439 -11.107
204 HG23 THR 24 HG23 THR 24 -4.541 -7.438 -12.576
205 H ASN 25 H ASN 25 -0.405 -8.907 -9.541
206 HA ASN 25 HA ASN 25 1.723 -8.643 -9.037
207 HB2 ASN 25 HB2 ASN 25 2.627 -9.052 -11.893
208 HB3 ASN 25 HB3 ASN 25 3.620 -9.017 -10.450
209 HD21 ASN 25 HD22 ASN 25 1.294 -10.907 -12.267
210 HD22 ASN 25 HD21 ASN 25 1.655 -12.435 -11.434
211 H ALA 26 H ALA 26 -0.216 -6.590 -10.617
212 HA ALA 26 HA ALA 26 1.572 -4.412 -11.241
213 HB1 ALA 26 HB1 ALA 26 -0.783 -4.551 -12.005
214 HB2 ALA 26 HB2 ALA 26 -1.338 -4.382 -10.321
215 HB3 ALA 26 HB3 ALA 26 -0.475 -3.049 -11.116
216 H SER 27 H SER 27 1.706 -2.315 -9.928
217 HA SER 27 HA SER 27 1.324 -2.653 -7.032
218 HB2 SER 27 HB2 SER 27 3.647 -3.334 -7.492
219 HB3 SER 27 HB3 SER 27 3.967 -1.709 -8.132
220 HG SER 27 HG SER 27 2.780 -2.039 -5.549
221 H GLN 28 H GLN 28 1.226 -0.632 -5.865
222 HA GLN 28 HA GLN 28 0.949 1.909 -7.250
223 HB2 GLN 28 HB2 GLN 28 -1.126 0.758 -7.893
224 HB3 GLN 28 HB3 GLN 28 -1.423 0.273 -6.225
225 HG2 GLN 28 HG2 GLN 28 -2.879 2.107 -7.091
226 HG3 GLN 28 HG3 GLN 28 -2.056 2.436 -5.579
227 HE21 GLN 28 HE22 GLN 28 -1.797 3.110 -9.172
228 HE22 GLN 28 HE21 GLN 28 -0.982 4.633 -8.864
229 H PHE 29 H PHE 29 0.678 3.633 -5.591
230 HA PHE 29 HA PHE 29 1.484 2.738 -2.861
231 HB2 PHE 29 HB2 PHE 29 1.846 5.285 -4.404
232 HB3 PHE 29 HB3 PHE 29 1.742 5.331 -2.651
233 HD1 PHE 29 HD1 PHE 29 3.475 2.945 -5.088
234 HD2 PHE 29 HD2 PHE 29 3.812 5.503 -1.619
235 HE1 PHE 29 HE1 PHE 29 5.832 2.297 -4.835
236 HE2 PHE 29 HE2 PHE 29 6.186 4.854 -1.394
237 HZ PHE 29 HZ PHE 29 7.204 3.246 -2.992
238 H GLU 30 H GLU 30 -1.244 4.160 -4.633
239 HA GLU 30 HA GLU 30 -2.769 4.845 -2.295
240 HB2 GLU 30 HB2 GLU 30 -3.175 5.177 -4.900
241 HB3 GLU 30 HB3 GLU 30 -4.163 3.736 -4.721
242 HG2 GLU 30 HG2 GLU 30 -4.432 6.429 -3.313
243 HG3 GLU 30 HG3 GLU 30 -5.488 5.787 -4.566
244 H ARG 31 H ARG 31 -4.008 3.678 -1.104
245 HA ARG 31 HA ARG 31 -3.441 0.740 -0.802
246 HB2 ARG 31 HB2 ARG 31 -2.670 2.101 1.004
247 HB3 ARG 31 HB3 ARG 31 -4.235 2.900 1.198
248 HG2 ARG 31 HG2 ARG 31 -4.289 -0.061 1.413
249 HG3 ARG 31 HG3 ARG 31 -3.264 0.761 2.607
250 HD2 ARG 31 HD2 ARG 31 -5.183 2.141 3.292
251 HD3 ARG 31 HD3 ARG 31 -6.228 1.197 2.207
252 HE ARG 31 HE ARG 31 -4.773 0.182 4.617
253 HH11 ARG 31 HH11 ARG 31 -7.305 -0.617 2.141
254 HH12 ARG 31 HH12 ARG 31 -7.620 -2.059 3.102
255 HH21 ARG 31 HH21 ARG 31 -5.311 -1.892 5.404
256 HH22 ARG 31 HH22 ARG 31 -6.594 -2.733 4.528
257 HA PRO 32 HA PRO 32 -7.776 0.845 -2.141
258 HB2 PRO 32 HB2 PRO 32 -7.500 -2.011 -3.001
259 HB3 PRO 32 HB3 PRO 32 -7.999 -0.564 -3.853
260 HG2 PRO 32 HG2 PRO 32 -5.646 -1.708 -4.299
261 HG3 PRO 32 HG3 PRO 32 -5.749 0.018 -4.336
262 HD2 PRO 32 HD2 PRO 32 -4.946 -1.638 -1.914
263 HD3 PRO 32 HD3 PRO 32 -4.075 -0.253 -2.615
264 H SER 33 H SER 33 -9.387 -1.397 -2.171
265 HA SER 33 HA SER 33 -10.663 -1.419 0.302
266 HB2 SER 33 HB2 SER 33 -11.052 -3.495 -1.864
267 HB3 SER 33 HB3 SER 33 -12.264 -2.708 -0.845
268 HG SER 33 HG SER 33 -11.053 -1.909 -3.236
269 H GLY 34 H GLY 34 -7.818 -2.736 0.337
270 HA2 GLY 34 HA2 GLY 34 -8.530 -5.303 1.707
271 HA3 GLY 34 HA3 GLY 34 -7.129 -5.163 0.628
Start of MODEL 14
1 H1 LYS 1 H1 LYS 1 -10.083 1.741 -2.302
2 H2 LYS 1 H2 LYS 1 -11.460 1.767 -1.456
3 H3 LYS 1 H3 LYS 1 -11.406 2.495 -2.947
4 HA LYS 1 HA LYS 1 -11.146 -0.390 -2.427
5 HB2 LYS 1 HB2 LYS 1 -13.470 1.186 -3.588
6 HB3 LYS 1 HB3 LYS 1 -13.306 -0.560 -3.733
7 HG2 LYS 1 HG2 LYS 1 -13.572 0.967 -1.123
8 HG3 LYS 1 HG3 LYS 1 -14.840 0.075 -1.936
9 HD2 LYS 1 HD2 LYS 1 -13.761 -2.043 -1.607
10 HD3 LYS 1 HD3 LYS 1 -12.282 -1.304 -0.980
11 HE2 LYS 1 HE2 LYS 1 -14.956 -0.810 0.352
12 HE3 LYS 1 HE3 LYS 1 -14.032 -2.281 0.702
13 HZ1 LYS 1 HZ1 LYS 1 -12.271 -1.045 1.582
14 HZ2 LYS 1 HZ2 LYS 1 -12.729 0.363 0.898
15 HZ3 LYS 1 HZ3 LYS 1 -13.592 -0.264 2.177
16 H LEU 2 H LEU 2 -10.034 -1.438 -3.830
17 HA LEU 2 HA LEU 2 -10.257 -1.079 -6.672
18 HB2 LEU 2 HB2 LEU 2 -7.436 -1.451 -5.658
19 HB3 LEU 2 HB3 LEU 2 -7.933 -1.377 -7.204
20 HG LEU 2 HG LEU 2 -8.424 0.987 -7.190
21 HD11 LEU 2 HD11 LEU 2 -8.852 1.710 -4.955
22 HD12 LEU 2 HD12 LEU 2 -7.362 0.975 -4.334
23 HD13 LEU 2 HD13 LEU 2 -7.307 2.386 -5.392
24 HD21 LEU 2 HD21 LEU 2 -6.290 0.081 -7.942
25 HD22 LEU 2 HD22 LEU 2 -5.991 1.595 -7.088
26 HD23 LEU 2 HD23 LEU 2 -5.653 0.043 -6.296
27 HA PRO 3 HA PRO 3 -10.918 -5.298 -6.773
28 HB2 PRO 3 HB2 PRO 3 -8.183 -5.795 -7.992
29 HB3 PRO 3 HB3 PRO 3 -9.754 -6.535 -8.507
30 HG2 PRO 3 HG2 PRO 3 -8.837 -4.444 -9.878
31 HG3 PRO 3 HG3 PRO 3 -10.533 -4.326 -9.262
32 HD2 PRO 3 HD2 PRO 3 -7.977 -3.287 -7.989
33 HD3 PRO 3 HD3 PRO 3 -9.485 -2.387 -8.231
34 HA PRO 4 HA PRO 4 -9.087 -8.183 -3.791
35 HB2 PRO 4 HB2 PRO 4 -10.077 -10.291 -5.712
36 HB3 PRO 4 HB3 PRO 4 -10.319 -10.183 -3.940
37 HG2 PRO 4 HG2 PRO 4 -12.328 -9.549 -5.654
38 HG3 PRO 4 HG3 PRO 4 -12.027 -8.546 -4.197
39 HD2 PRO 4 HD2 PRO 4 -11.167 -8.013 -7.051
40 HD3 PRO 4 HD3 PRO 4 -11.897 -6.901 -5.851
41 H GLY 5 H GLY 5 -7.061 -9.244 -3.726
42 HA2 GLY 5 HA2 GLY 5 -5.192 -10.386 -4.893
43 HA3 GLY 5 HA3 GLY 5 -5.564 -9.424 -6.315
44 H TRP 6 H TRP 6 -6.007 -6.746 -4.924
45 HA TRP 6 HA TRP 6 -3.264 -6.018 -4.462
46 HB2 TRP 6 HB2 TRP 6 -5.920 -4.654 -3.951
47 HB3 TRP 6 HB3 TRP 6 -4.344 -3.928 -3.688
48 HD1 TRP 6 HD1 TRP 6 -6.793 -4.523 -6.430
49 HE1 TRP 6 HE1 TRP 6 -5.940 -3.300 -8.531
50 HE3 TRP 6 HE3 TRP 6 -2.068 -3.463 -4.885
51 HZ2 TRP 6 HZ2 TRP 6 -3.457 -2.194 -9.495
52 HZ3 TRP 6 HZ3 TRP 6 -0.502 -2.292 -6.366
53 HH2 TRP 6 HH2 TRP 6 -1.168 -1.660 -8.688
54 H GLU 7 H GLU 7 -2.038 -6.394 -2.718
55 HA GLU 7 HA GLU 7 -3.266 -6.370 -0.004
56 HB2 GLU 7 HB2 GLU 7 -2.821 -8.690 -1.156
57 HB3 GLU 7 HB3 GLU 7 -1.131 -8.367 -0.813
58 HG2 GLU 7 HG2 GLU 7 -3.394 -8.431 1.246
59 HG3 GLU 7 HG3 GLU 7 -2.369 -9.807 0.851
60 H LYS 8 H LYS 8 -1.716 -5.856 1.701
61 HA LYS 8 HA LYS 8 -0.140 -3.558 1.062
62 HB2 LYS 8 HB2 LYS 8 -1.186 -3.453 3.093
63 HB3 LYS 8 HB3 LYS 8 -1.000 -5.120 3.456
64 HG2 LYS 8 HG2 LYS 8 1.631 -3.766 3.605
65 HG3 LYS 8 HG3 LYS 8 0.399 -2.913 4.488
66 HD2 LYS 8 HD2 LYS 8 1.313 -4.395 6.041
67 HD3 LYS 8 HD3 LYS 8 -0.284 -5.004 5.673
68 HE2 LYS 8 HE2 LYS 8 2.381 -6.141 4.717
69 HE3 LYS 8 HE3 LYS 8 1.350 -6.784 5.993
70 HZ1 LYS 8 HZ1 LYS 8 0.868 -8.106 4.121
71 HZ2 LYS 8 HZ2 LYS 8 -0.390 -7.069 4.038
72 HZ3 LYS 8 HZ3 LYS 8 0.878 -6.878 3.083
73 H ARG 9 H ARG 9 2.002 -3.206 0.971
74 HA ARG 9 HA ARG 9 3.945 -5.329 1.683
75 HB2 ARG 9 HB2 ARG 9 3.907 -3.916 -1.017
76 HB3 ARG 9 HB3 ARG 9 5.272 -4.868 -0.426
77 HG2 ARG 9 HG2 ARG 9 2.493 -5.906 -1.043
78 HG3 ARG 9 HG3 ARG 9 3.933 -6.106 -2.039
79 HD2 ARG 9 HD2 ARG 9 4.633 -7.905 -0.911
80 HD3 ARG 9 HD3 ARG 9 4.437 -7.124 0.646
81 HE ARG 9 HE ARG 9 2.097 -7.713 0.690
82 HH11 ARG 9 HH11 ARG 9 3.792 -9.395 -1.881
83 HH12 ARG 9 HH12 ARG 9 2.636 -10.701 -1.928
84 HH21 ARG 9 HH21 ARG 9 0.687 -9.389 0.651
85 HH22 ARG 9 HH22 ARG 9 0.858 -10.675 -0.531
86 H MET 10 H MET 10 6.269 -4.344 1.508
87 HA MET 10 HA MET 10 6.250 -1.520 2.405
88 HB2 MET 10 HB2 MET 10 6.093 -3.019 4.389
89 HB3 MET 10 HB3 MET 10 7.599 -3.809 3.886
90 HG2 MET 10 HG2 MET 10 8.754 -1.599 4.013
91 HG3 MET 10 HG3 MET 10 7.254 -0.861 4.573
92 HE1 MET 10 HE1 MET 10 6.895 -1.969 8.205
93 HE2 MET 10 HE2 MET 10 6.574 -0.693 7.013
94 HE3 MET 10 HE3 MET 10 5.951 -2.342 6.745
95 H PHE 11 H PHE 11 7.776 -0.348 1.507
96 HA PHE 11 HA PHE 11 9.682 -1.396 -0.346
97 HB2 PHE 11 HB2 PHE 11 8.445 0.779 -0.450
98 HB3 PHE 11 HB3 PHE 11 9.401 1.344 0.903
99 HD1 PHE 11 HD2 PHE 11 11.667 -0.525 -1.182
100 HD2 PHE 11 HD1 PHE 11 9.486 3.206 -0.962
101 HE1 PHE 11 HE2 PHE 11 13.302 0.526 -2.674
102 HE2 PHE 11 HE1 PHE 11 11.138 4.242 -2.485
103 HZ PHE 11 HZ PHE 11 13.056 2.908 -3.338
104 H ARG 12 H ARG 12 10.967 -2.860 0.833
105 HA ARG 12 HA ARG 12 12.623 -2.400 3.022
106 HB2 ARG 12 HB2 ARG 12 14.162 -4.040 2.066
107 HB3 ARG 12 HB3 ARG 12 12.483 -4.546 1.878
108 HG2 ARG 12 HG2 ARG 12 12.537 -3.797 -0.512
109 HG3 ARG 12 HG3 ARG 12 14.239 -3.337 -0.313
110 HD2 ARG 12 HD2 ARG 12 14.803 -5.692 0.263
111 HD3 ARG 12 HD3 ARG 12 13.104 -6.135 0.093
112 HE ARG 12 HE ARG 12 13.271 -6.082 -2.206
113 HH11 ARG 12 HH11 ARG 12 16.245 -4.727 -0.959
114 HH12 ARG 12 HH12 ARG 12 17.048 -4.768 -2.505
115 HH21 ARG 12 HH21 ARG 12 14.327 -6.134 -4.170
116 HH22 ARG 12 HH22 ARG 12 15.963 -5.569 -4.287
117 H SER 13 H SER 13 14.650 -1.597 3.359
118 HA SER 13 HA SER 13 16.516 -0.279 3.195
119 HB2 SER 13 HB2 SER 13 17.071 1.223 1.417
120 HB3 SER 13 HB3 SER 13 16.620 -0.333 0.701
121 HG SER 13 HG SER 13 14.572 0.482 0.311
122 H ASN 14 H ASN 14 13.193 0.861 3.000
123 HA ASN 14 HA ASN 14 13.968 3.158 4.739
124 HB2 ASN 14 HB2 ASN 14 12.595 4.674 3.336
125 HB3 ASN 14 HB3 ASN 14 14.012 4.046 2.496
126 HD21 ASN 14 HD22 ASN 14 13.729 2.628 0.660
127 HD22 ASN 14 HD21 ASN 14 12.126 2.448 -0.022
128 H GLY 15 H GLY 15 11.290 1.038 3.593
129 HA2 GLY 15 HA2 GLY 15 9.870 0.056 5.207
130 HA3 GLY 15 HA3 GLY 15 10.049 1.445 6.271
131 H THR 16 H THR 16 9.498 2.495 3.029
132 HA THR 16 HA THR 16 6.975 3.648 3.637
133 HB THR 16 HB THR 16 8.018 3.013 0.850
134 HG1 THR 16 HG1 THR 16 9.605 4.157 1.843
135 HG21 THR 16 HG21 THR 16 5.677 3.768 0.891
136 HG22 THR 16 HG22 THR 16 6.137 5.164 1.894
137 HG23 THR 16 HG23 THR 16 6.736 5.024 0.227
138 H VAL 17 H VAL 17 5.090 2.549 4.026
139 HA VAL 17 HA VAL 17 4.664 -0.089 2.834
140 HB VAL 17 HB VAL 17 3.019 1.638 4.690
141 HG11 VAL 17 HG11 VAL 17 1.330 0.483 3.339
142 HG12 VAL 17 HG12 VAL 17 2.184 -1.065 3.548
143 HG13 VAL 17 HG13 VAL 17 1.429 -0.255 4.936
144 HG21 VAL 17 HG21 VAL 17 4.978 0.363 5.589
145 HG22 VAL 17 HG22 VAL 17 3.446 -0.243 6.240
146 HG23 VAL 17 HG23 VAL 17 4.268 -1.138 4.941
147 H TYR 18 H TYR 18 3.135 -0.687 1.391
148 HA TYR 18 HA TYR 18 1.671 1.275 -0.208
149 HB2 TYR 18 HB2 TYR 18 2.878 1.070 -2.204
150 HB3 TYR 18 HB3 TYR 18 4.085 1.386 -0.985
151 HD1 TYR 18 HD1 TYR 18 5.562 -0.511 -0.172
152 HD2 TYR 18 HD2 TYR 18 3.018 -0.774 -3.625
153 HE1 TYR 18 HE1 TYR 18 6.914 -2.460 -1.036
154 HE2 TYR 18 HE2 TYR 18 4.315 -2.717 -4.468
155 HH TYR 18 HH TYR 18 6.138 -4.056 -4.118
156 H TYR 19 H TYR 19 0.891 -0.245 -2.378
157 HA TYR 19 HA TYR 19 0.222 -2.934 -1.283
158 HB2 TYR 19 HB2 TYR 19 -1.624 -0.803 -2.208
159 HB3 TYR 19 HB3 TYR 19 -1.951 -2.403 -2.800
160 HD1 TYR 19 HD1 TYR 19 -1.265 -0.677 0.527
161 HD2 TYR 19 HD2 TYR 19 -3.286 -3.826 -1.587
162 HE1 TYR 19 HE1 TYR 19 -2.441 -1.324 2.595
163 HE2 TYR 19 HE2 TYR 19 -4.601 -4.360 0.435
164 HH TYR 19 HH TYR 19 -5.238 -3.478 2.518
165 H PHE 20 H PHE 20 -0.113 -4.539 -2.659
166 HA PHE 20 HA PHE 20 1.061 -4.359 -5.405
167 HB2 PHE 20 HB2 PHE 20 2.756 -4.995 -3.777
168 HB3 PHE 20 HB3 PHE 20 1.679 -6.218 -3.093
169 HD1 PHE 20 HD2 PHE 20 3.655 -5.330 -6.112
170 HD2 PHE 20 HD1 PHE 20 1.586 -8.458 -3.983
171 HE1 PHE 20 HE2 PHE 20 4.713 -7.026 -7.582
172 HE2 PHE 20 HE1 PHE 20 2.699 -10.153 -5.420
173 HZ PHE 20 HZ PHE 20 4.246 -9.445 -7.219
174 H ASN 21 H ASN 21 -0.207 -5.328 -6.879
175 HA ASN 21 HA ASN 21 -2.461 -7.011 -6.079
176 HB2 ASN 21 HB2 ASN 21 -2.570 -5.338 -7.971
177 HB3 ASN 21 HB3 ASN 21 -1.431 -6.339 -8.835
178 HD21 ASN 21 HD22 ASN 21 -4.783 -6.068 -7.675
179 HD22 ASN 21 HD21 ASN 21 -5.323 -7.542 -8.464
180 H HIS 22 H HIS 22 -1.771 -8.918 -5.222
181 HA HIS 22 HA HIS 22 0.556 -10.296 -6.174
182 HB2 HIS 22 HB2 HIS 22 0.205 -11.756 -4.412
183 HB3 HIS 22 HB3 HIS 22 -0.450 -10.247 -3.817
184 HD1 HIS 22 HD1 HIS 22 -1.844 -13.399 -5.565
185 HD2 HIS 22 HD2 HIS 22 -2.834 -10.478 -2.713
186 HE1 HIS 22 HE1 HIS 22 -4.140 -14.081 -4.561
187 H ILE 23 H ILE 23 -2.198 -10.026 -7.898
188 HA ILE 23 HA ILE 23 -2.173 -12.823 -8.936
189 HB ILE 23 HB ILE 23 -4.252 -10.615 -9.198
190 HG12 ILE 23 HG12 ILE 23 -4.224 -13.153 -7.496
191 HG13 ILE 23 HG13 ILE 23 -4.134 -11.499 -6.896
192 HG21 ILE 23 HG21 ILE 23 -4.386 -13.530 -10.074
193 HG22 ILE 23 HG22 ILE 23 -5.698 -12.334 -10.195
194 HG23 ILE 23 HG23 ILE 23 -4.251 -12.129 -11.162
195 HD11 ILE 23 HD11 ILE 23 -6.345 -12.225 -6.506
196 HD12 ILE 23 HD12 ILE 23 -6.430 -11.078 -7.860
197 HD13 ILE 23 HD13 ILE 23 -6.544 -12.832 -8.154
198 H THR 24 H THR 24 -1.516 -9.468 -9.704
199 HA THR 24 HA THR 24 -0.771 -10.192 -12.525
200 HB THR 24 HB THR 24 -1.166 -7.823 -13.067
201 HG1 THR 24 HG1 THR 24 -2.258 -7.667 -10.473
202 HG21 THR 24 HG21 THR 24 -3.581 -9.018 -11.627
203 HG22 THR 24 HG22 THR 24 -3.596 -7.725 -12.838
204 HG23 THR 24 HG23 THR 24 -3.097 -9.368 -13.303
205 H ASN 25 H ASN 25 0.460 -8.784 -9.566
206 HA ASN 25 HA ASN 25 2.460 -8.192 -8.870
207 HB2 ASN 25 HB2 ASN 25 3.618 -8.187 -11.664
208 HB3 ASN 25 HB3 ASN 25 4.486 -8.064 -10.149
209 HD21 ASN 25 HD22 ASN 25 2.734 -10.236 -12.264
210 HD22 ASN 25 HD21 ASN 25 3.360 -11.719 -11.509
211 H ALA 26 H ALA 26 0.280 -6.419 -10.578
212 HA ALA 26 HA ALA 26 1.627 -3.960 -11.023
213 HB1 ALA 26 HB1 ALA 26 -0.608 -2.970 -10.917
214 HB2 ALA 26 HB2 ALA 26 -0.661 -4.496 -11.819
215 HB3 ALA 26 HB3 ALA 26 -1.253 -4.429 -10.145
216 H SER 27 H SER 27 1.791 -2.034 -9.706
217 HA SER 27 HA SER 27 1.802 -2.478 -6.755
218 HB2 SER 27 HB2 SER 27 4.111 -1.543 -8.504
219 HB3 SER 27 HB3 SER 27 4.076 -1.476 -6.733
220 HG SER 27 HG SER 27 3.797 -3.856 -8.284
221 H GLN 28 H GLN 28 0.987 -0.734 -5.668
222 HA GLN 28 HA GLN 28 1.085 1.979 -6.833
223 HB2 GLN 28 HB2 GLN 28 -1.437 0.370 -6.281
224 HB3 GLN 28 HB3 GLN 28 -1.437 2.113 -6.048
225 HG2 GLN 28 HG2 GLN 28 -0.771 2.511 -8.361
226 HG3 GLN 28 HG3 GLN 28 -0.625 0.777 -8.660
227 HE21 GLN 28 HE22 GLN 28 -3.092 3.381 -7.875
228 HE22 GLN 28 HE21 GLN 28 -4.364 2.411 -8.626
229 H PHE 29 H PHE 29 0.445 3.631 -5.124
230 HA PHE 29 HA PHE 29 1.391 2.695 -2.447
231 HB2 PHE 29 HB2 PHE 29 0.975 5.478 -3.551
232 HB3 PHE 29 HB3 PHE 29 1.582 5.082 -1.945
233 HD1 PHE 29 HD2 PHE 29 3.649 3.317 -1.976
234 HD2 PHE 29 HD1 PHE 29 2.599 5.985 -5.195
235 HE1 PHE 29 HE2 PHE 29 5.961 3.159 -2.857
236 HE2 PHE 29 HE1 PHE 29 4.916 5.826 -6.075
237 HZ PHE 29 HZ PHE 29 6.599 4.414 -4.909
238 H GLU 30 H GLU 30 -1.362 3.793 -4.231
239 HA GLU 30 HA GLU 30 -3.139 4.348 -2.082
240 HB2 GLU 30 HB2 GLU 30 -3.931 3.234 -4.790
241 HB3 GLU 30 HB3 GLU 30 -4.841 4.299 -3.728
242 HG2 GLU 30 HG2 GLU 30 -4.147 5.808 -5.314
243 HG3 GLU 30 HG3 GLU 30 -2.847 5.998 -4.147
244 H ARG 31 H ARG 31 -4.187 3.084 -0.786
245 HA ARG 31 HA ARG 31 -3.696 0.219 -0.644
246 HB2 ARG 31 HB2 ARG 31 -3.041 1.542 1.147
247 HB3 ARG 31 HB3 ARG 31 -4.497 2.494 1.182
248 HG2 ARG 31 HG2 ARG 31 -4.911 -0.388 1.726
249 HG3 ARG 31 HG3 ARG 31 -3.810 0.384 2.834
250 HD2 ARG 31 HD2 ARG 31 -6.267 0.388 3.572
251 HD3 ARG 31 HD3 ARG 31 -5.270 1.823 3.783
252 HE ARG 31 HE ARG 31 -6.987 1.653 1.356
253 HH11 ARG 31 HH11 ARG 31 -6.198 3.501 4.214
254 HH12 ARG 31 HH12 ARG 31 -7.157 4.860 3.685
255 HH21 ARG 31 HH21 ARG 31 -8.460 3.218 0.906
256 HH22 ARG 31 HH22 ARG 31 -8.330 4.723 1.781
257 HA PRO 32 HA PRO 32 -7.844 0.014 -2.282
258 HB2 PRO 32 HB2 PRO 32 -7.372 -2.921 -2.902
259 HB3 PRO 32 HB3 PRO 32 -8.096 -1.656 -3.770
260 HG2 PRO 32 HG2 PRO 32 -5.631 -2.299 -4.372
261 HG3 PRO 32 HG3 PRO 32 -5.915 -0.606 -4.249
262 HD2 PRO 32 HD2 PRO 32 -4.978 -2.324 -1.952
263 HD3 PRO 32 HD3 PRO 32 -4.195 -0.842 -2.564
264 H SER 33 H SER 33 -6.895 -1.919 0.097
265 HA SER 33 HA SER 33 -9.242 -3.300 1.001
266 HB2 SER 33 HB2 SER 33 -7.177 -1.982 2.811
267 HB3 SER 33 HB3 SER 33 -8.305 -3.271 3.268
268 HG SER 33 HG SER 33 -7.266 -4.623 1.755
269 H GLY 34 H GLY 34 -8.350 0.082 1.363
270 HA2 GLY 34 HA2 GLY 34 -10.997 0.803 2.559
271 HA3 GLY 34 HA3 GLY 34 -9.559 1.809 2.608
Start of MODEL 15
1 H1 LYS 1 H1 LYS 1 -9.192 -4.726 4.585
2 H2 LYS 1 H2 LYS 1 -10.396 -4.079 3.641
3 H3 LYS 1 H3 LYS 1 -8.870 -3.468 3.587
4 HA LYS 1 HA LYS 1 -7.980 -5.301 2.539
5 HB2 LYS 1 HB2 LYS 1 -9.315 -6.943 3.893
6 HB3 LYS 1 HB3 LYS 1 -10.693 -6.650 2.838
7 HG2 LYS 1 HG2 LYS 1 -9.536 -8.737 2.300
8 HG3 LYS 1 HG3 LYS 1 -9.493 -7.631 0.937
9 HD2 LYS 1 HD2 LYS 1 -7.135 -7.056 1.472
10 HD3 LYS 1 HD3 LYS 1 -7.181 -8.118 2.885
11 HE2 LYS 1 HE2 LYS 1 -7.480 -10.067 1.516
12 HE3 LYS 1 HE3 LYS 1 -7.771 -9.100 0.062
13 HZ1 LYS 1 HZ1 LYS 1 -5.451 -10.078 0.351
14 HZ2 LYS 1 HZ2 LYS 1 -5.508 -8.494 -0.045
15 HZ3 LYS 1 HZ3 LYS 1 -5.167 -8.920 1.493
16 H LEU 2 H LEU 2 -8.316 -5.887 0.211
17 HA LEU 2 HA LEU 2 -9.901 -3.871 -1.244
18 HB2 LEU 2 HB2 LEU 2 -7.483 -4.288 -2.614
19 HB3 LEU 2 HB3 LEU 2 -8.069 -2.852 -1.884
20 HG LEU 2 HG LEU 2 -5.708 -3.474 -1.474
21 HD11 LEU 2 HD11 LEU 2 -6.777 -1.751 -0.232
22 HD12 LEU 2 HD12 LEU 2 -7.455 -2.933 0.918
23 HD13 LEU 2 HD13 LEU 2 -5.707 -2.662 0.833
24 HD21 LEU 2 HD21 LEU 2 -4.994 -5.250 -0.432
25 HD22 LEU 2 HD22 LEU 2 -6.209 -5.148 0.847
26 HD23 LEU 2 HD23 LEU 2 -6.566 -5.956 -0.719
27 HA PRO 3 HA PRO 3 -11.126 -6.748 -4.237
28 HB2 PRO 3 HB2 PRO 3 -9.379 -5.615 -6.424
29 HB3 PRO 3 HB3 PRO 3 -11.136 -5.949 -6.446
30 HG2 PRO 3 HG2 PRO 3 -10.244 -3.420 -6.131
31 HG3 PRO 3 HG3 PRO 3 -11.618 -4.026 -5.148
32 HD2 PRO 3 HD2 PRO 3 -8.721 -3.727 -4.362
33 HD3 PRO 3 HD3 PRO 3 -10.187 -3.320 -3.449
34 HA PRO 4 HA PRO 4 -8.924 -10.426 -4.649
35 HB2 PRO 4 HB2 PRO 4 -9.289 -10.431 -7.639
36 HB3 PRO 4 HB3 PRO 4 -9.508 -11.778 -6.480
37 HG2 PRO 4 HG2 PRO 4 -11.670 -10.395 -7.339
38 HG3 PRO 4 HG3 PRO 4 -11.510 -10.810 -5.601
39 HD2 PRO 4 HD2 PRO 4 -10.952 -8.185 -6.973
40 HD3 PRO 4 HD3 PRO 4 -11.745 -8.496 -5.398
41 H GLY 5 H GLY 5 -6.911 -10.813 -4.388
42 HA2 GLY 5 HA2 GLY 5 -4.683 -11.207 -4.922
43 HA3 GLY 5 HA3 GLY 5 -4.844 -10.224 -6.380
44 H TRP 6 H TRP 6 -6.033 -7.905 -4.412
45 HA TRP 6 HA TRP 6 -3.387 -6.716 -4.145
46 HB2 TRP 6 HB2 TRP 6 -6.052 -5.750 -3.119
47 HB3 TRP 6 HB3 TRP 6 -4.542 -4.884 -3.015
48 HD1 TRP 6 HD1 TRP 6 -7.383 -5.489 -5.316
49 HE1 TRP 6 HE1 TRP 6 -7.098 -4.037 -7.403
50 HE3 TRP 6 HE3 TRP 6 -2.576 -4.029 -4.563
51 HZ2 TRP 6 HZ2 TRP 6 -4.909 -2.619 -8.734
52 HZ3 TRP 6 HZ3 TRP 6 -1.448 -2.554 -6.168
53 HH2 TRP 6 HH2 TRP 6 -2.564 -1.904 -8.310
54 H GLU 7 H GLU 7 -1.950 -6.897 -2.537
55 HA GLU 7 HA GLU 7 -2.944 -6.780 0.181
56 HB2 GLU 7 HB2 GLU 7 -2.814 -9.238 -0.262
57 HB3 GLU 7 HB3 GLU 7 -1.085 -9.074 -0.546
58 HG2 GLU 7 HG2 GLU 7 -1.782 -9.899 1.755
59 HG3 GLU 7 HG3 GLU 7 -0.665 -8.547 1.742
60 H LYS 8 H LYS 8 -1.214 -6.386 1.724
61 HA LYS 8 HA LYS 8 0.108 -4.022 0.976
62 HB2 LYS 8 HB2 LYS 8 -1.151 -4.720 2.945
63 HB3 LYS 8 HB3 LYS 8 0.183 -5.788 3.443
64 HG2 LYS 8 HG2 LYS 8 1.549 -3.640 3.704
65 HG3 LYS 8 HG3 LYS 8 0.044 -2.757 3.383
66 HD2 LYS 8 HD2 LYS 8 0.558 -4.724 5.671
67 HD3 LYS 8 HD3 LYS 8 0.307 -2.990 5.785
68 HE2 LYS 8 HE2 LYS 8 -1.742 -3.783 6.470
69 HE3 LYS 8 HE3 LYS 8 -2.049 -3.424 4.775
70 HZ1 LYS 8 HZ1 LYS 8 -1.907 -5.851 4.296
71 HZ2 LYS 8 HZ2 LYS 8 -1.475 -6.142 5.850
72 HZ3 LYS 8 HZ3 LYS 8 -2.969 -5.568 5.476
73 H ARG 9 H ARG 9 2.156 -3.455 0.965
74 HA ARG 9 HA ARG 9 4.387 -5.411 1.328
75 HB2 ARG 9 HB2 ARG 9 3.934 -3.695 -1.153
76 HB3 ARG 9 HB3 ARG 9 5.458 -4.512 -0.799
77 HG2 ARG 9 HG2 ARG 9 2.793 -5.898 -1.285
78 HG3 ARG 9 HG3 ARG 9 4.098 -5.687 -2.454
79 HD2 ARG 9 HD2 ARG 9 5.617 -7.063 -1.110
80 HD3 ARG 9 HD3 ARG 9 4.400 -7.208 0.162
81 HE ARG 9 HE ARG 9 3.343 -8.845 -0.972
82 HH11 ARG 9 HH21 ARG 9 5.352 -7.253 -3.366
83 HH12 ARG 9 HH22 ARG 9 4.918 -8.368 -4.634
84 HH21 ARG 9 HH11 ARG 9 2.966 -10.362 -2.575
85 HH22 ARG 9 HH12 ARG 9 3.675 -10.135 -4.151
86 H MET 10 H MET 10 6.570 -4.255 1.316
87 HA MET 10 HA MET 10 6.358 -1.521 2.445
88 HB2 MET 10 HB2 MET 10 6.280 -3.206 4.283
89 HB3 MET 10 HB3 MET 10 7.849 -3.830 3.747
90 HG2 MET 10 HG2 MET 10 8.843 -1.585 4.119
91 HG3 MET 10 HG3 MET 10 7.279 -0.980 4.658
92 HE1 MET 10 HE1 MET 10 6.813 -2.374 8.171
93 HE2 MET 10 HE2 MET 10 6.462 -1.043 7.049
94 HE3 MET 10 HE3 MET 10 5.969 -2.706 6.642
95 H PHE 11 H PHE 11 7.920 -0.155 1.819
96 HA PHE 11 HA PHE 11 9.830 -0.998 -0.164
97 HB2 PHE 11 HB2 PHE 11 8.494 1.159 -0.103
98 HB3 PHE 11 HB3 PHE 11 9.582 1.713 1.157
99 HD1 PHE 11 HD2 PHE 11 12.028 2.050 0.632
100 HD2 PHE 11 HD1 PHE 11 9.184 0.984 -2.425
101 HE1 PHE 11 HE2 PHE 11 13.629 2.784 -1.110
102 HE2 PHE 11 HE1 PHE 11 10.797 1.695 -4.170
103 HZ PHE 11 HZ PHE 11 13.019 2.603 -3.520
104 H ARG 12 H ARG 12 11.400 -2.274 0.601
105 HA ARG 12 HA ARG 12 12.918 -2.206 2.878
106 HB2 ARG 12 HB2 ARG 12 14.511 -3.474 1.764
107 HB3 ARG 12 HB3 ARG 12 13.032 -3.812 0.885
108 HG2 ARG 12 HG2 ARG 12 15.341 -2.022 0.033
109 HG3 ARG 12 HG3 ARG 12 14.920 -3.586 -0.635
110 HD2 ARG 12 HD2 ARG 12 12.905 -2.726 -1.660
111 HD3 ARG 12 HD3 ARG 12 13.080 -1.159 -0.876
112 HE ARG 12 HE ARG 12 14.422 -2.057 -3.259
113 HH11 ARG 12 HH11 ARG 12 14.786 0.211 -0.557
114 HH12 ARG 12 HH12 ARG 12 16.009 1.125 -1.396
115 HH21 ARG 12 HH21 ARG 12 15.895 -0.747 -4.307
116 HH22 ARG 12 HH22 ARG 12 16.528 0.656 -3.502
117 H SER 13 H SER 13 14.650 -1.167 3.707
118 HA SER 13 HA SER 13 16.284 0.319 4.092
119 HB2 SER 13 HB2 SER 13 15.951 1.595 1.370
120 HB3 SER 13 HB3 SER 13 17.328 1.702 2.465
121 HG SER 13 HG SER 13 17.796 -0.439 2.075
122 H ASN 14 H ASN 14 13.048 1.334 3.430
123 HA ASN 14 HA ASN 14 13.592 3.454 5.408
124 HB2 ASN 14 HB2 ASN 14 12.383 5.193 4.289
125 HB3 ASN 14 HB3 ASN 14 13.716 4.642 3.287
126 HD21 ASN 14 HD22 ASN 14 12.919 5.224 1.234
127 HD22 ASN 14 HD21 ASN 14 11.413 4.571 0.623
128 H GLY 15 H GLY 15 11.237 1.165 4.065
129 HA2 GLY 15 HA2 GLY 15 9.810 0.008 5.510
130 HA3 GLY 15 HA3 GLY 15 9.864 1.313 6.688
131 H THR 16 H THR 16 9.331 2.595 3.550
132 HA THR 16 HA THR 16 6.718 3.522 4.171
133 HB THR 16 HB THR 16 7.901 3.254 1.377
134 HG1 THR 16 HG1 THR 16 9.334 4.377 2.607
135 HG21 THR 16 HG21 THR 16 5.796 5.104 2.581
136 HG22 THR 16 HG22 THR 16 6.484 5.262 0.954
137 HG23 THR 16 HG23 THR 16 5.515 3.832 1.368
138 H VAL 17 H VAL 17 4.889 2.313 4.332
139 HA VAL 17 HA VAL 17 4.686 -0.246 2.957
140 HB VAL 17 HB VAL 17 2.810 1.316 4.745
141 HG11 VAL 17 HG11 VAL 17 1.334 -0.684 4.824
142 HG12 VAL 17 HG12 VAL 17 1.293 0.108 3.250
143 HG13 VAL 17 HG13 VAL 17 2.237 -1.380 3.464
144 HG21 VAL 17 HG21 VAL 17 4.225 -1.377 5.032
145 HG22 VAL 17 HG22 VAL 17 4.769 0.147 5.774
146 HG23 VAL 17 HG23 VAL 17 3.238 -0.582 6.280
147 H TYR 18 H TYR 18 3.322 -0.840 1.364
148 HA TYR 18 HA TYR 18 1.682 1.040 -0.160
149 HB2 TYR 18 HB2 TYR 18 2.832 0.819 -2.234
150 HB3 TYR 18 HB3 TYR 18 3.961 1.429 -1.055
151 HD1 TYR 18 HD1 TYR 18 5.835 -0.015 -0.238
152 HD2 TYR 18 HD2 TYR 18 3.163 -1.280 -3.386
153 HE1 TYR 18 HE1 TYR 18 7.496 -1.719 -0.989
154 HE2 TYR 18 HE2 TYR 18 4.818 -2.972 -4.116
155 HH TYR 18 HH TYR 18 7.963 -3.380 -2.477
156 H TYR 19 H TYR 19 1.029 -0.538 -2.377
157 HA TYR 19 HA TYR 19 0.454 -3.248 -1.271
158 HB2 TYR 19 HB2 TYR 19 -1.501 -1.156 -2.180
159 HB3 TYR 19 HB3 TYR 19 -1.830 -2.827 -2.558
160 HD1 TYR 19 HD1 TYR 19 -0.996 -0.644 0.395
161 HD2 TYR 19 HD2 TYR 19 -2.797 -4.282 -1.009
162 HE1 TYR 19 HE1 TYR 19 -2.169 -0.916 2.589
163 HE2 TYR 19 HE2 TYR 19 -3.798 -4.644 1.271
164 HH TYR 19 HH TYR 19 -4.500 -2.305 3.309
165 H PHE 20 H PHE 20 -0.041 -4.854 -2.723
166 HA PHE 20 HA PHE 20 0.803 -4.473 -5.550
167 HB2 PHE 20 HB2 PHE 20 2.718 -5.067 -4.222
168 HB3 PHE 20 HB3 PHE 20 1.860 -6.421 -3.479
169 HD1 PHE 20 HD2 PHE 20 1.448 -8.533 -4.773
170 HD2 PHE 20 HD1 PHE 20 3.697 -5.226 -6.404
171 HE1 PHE 20 HE2 PHE 20 2.513 -10.050 -6.444
172 HE2 PHE 20 HE1 PHE 20 4.654 -6.738 -8.134
173 HZ PHE 20 HZ PHE 20 4.057 -9.167 -8.123
174 H ASN 21 H ASN 21 -0.448 -5.640 -6.958
175 HA ASN 21 HA ASN 21 -2.557 -7.406 -5.921
176 HB2 ASN 21 HB2 ASN 21 -3.050 -5.643 -7.672
177 HB3 ASN 21 HB3 ASN 21 -2.000 -6.518 -8.756
178 HD21 ASN 21 HD22 ASN 21 -5.115 -6.535 -7.059
179 HD22 ASN 21 HD21 ASN 21 -5.709 -8.042 -7.706
180 H HIS 22 H HIS 22 -1.656 -9.324 -5.320
181 HA HIS 22 HA HIS 22 0.515 -10.546 -6.763
182 HB2 HIS 22 HB2 HIS 22 0.597 -12.042 -4.977
183 HB3 HIS 22 HB3 HIS 22 0.078 -10.543 -4.249
184 HD1 HIS 22 HD1 HIS 22 -1.712 -13.653 -5.671
185 HD2 HIS 22 HD2 HIS 22 -1.898 -10.852 -2.539
186 HE1 HIS 22 HE1 HIS 22 -3.693 -14.363 -4.145
187 H ILE 23 H ILE 23 -2.436 -10.335 -8.003
188 HA ILE 23 HA ILE 23 -2.359 -13.090 -9.180
189 HB ILE 23 HB ILE 23 -4.604 -11.056 -8.967
190 HG12 ILE 23 HG12 ILE 23 -4.293 -13.925 -7.944
191 HG13 ILE 23 HG13 ILE 23 -4.151 -12.473 -6.962
192 HG21 ILE 23 HG21 ILE 23 -4.594 -13.684 -10.521
193 HG22 ILE 23 HG22 ILE 23 -6.022 -12.664 -10.225
194 HG23 ILE 23 HG23 ILE 23 -4.718 -12.055 -11.219
195 HD11 ILE 23 HD11 ILE 23 -6.562 -11.921 -7.590
196 HD12 ILE 23 HD12 ILE 23 -6.667 -13.572 -8.246
197 HD13 ILE 23 HD13 ILE 23 -6.310 -13.325 -6.531
198 H THR 24 H THR 24 -2.082 -9.641 -9.816
199 HA THR 24 HA THR 24 -1.632 -10.177 -12.739
200 HB THR 24 HB THR 24 -2.160 -7.786 -13.045
201 HG1 THR 24 HG1 THR 24 -2.921 -7.837 -10.332
202 HG21 THR 24 HG21 THR 24 -4.321 -9.182 -11.398
203 HG22 THR 24 HG22 THR 24 -4.541 -7.804 -12.488
204 HG23 THR 24 HG23 THR 24 -4.058 -9.382 -13.145
205 H ASN 25 H ASN 25 -0.083 -8.917 -9.880
206 HA ASN 25 HA ASN 25 1.937 -8.246 -9.373
207 HB2 ASN 25 HB2 ASN 25 2.840 -8.233 -12.258
208 HB3 ASN 25 HB3 ASN 25 3.839 -8.146 -10.820
209 HD21 ASN 25 HD22 ASN 25 1.886 -10.252 -12.821
210 HD22 ASN 25 HD21 ASN 25 2.523 -11.758 -12.129
211 H ALA 26 H ALA 26 -0.446 -6.488 -10.641
212 HA ALA 26 HA ALA 26 0.870 -3.973 -11.167
213 HB1 ALA 26 HB1 ALA 26 -1.366 -3.031 -10.782
214 HB2 ALA 26 HB2 ALA 26 -1.482 -4.481 -11.796
215 HB3 ALA 26 HB3 ALA 26 -1.921 -4.560 -10.075
216 H SER 27 H SER 27 0.872 -2.053 -9.629
217 HA SER 27 HA SER 27 0.661 -2.716 -6.781
218 HB2 SER 27 HB2 SER 27 3.002 -3.248 -7.400
219 HB3 SER 27 HB3 SER 27 3.223 -1.574 -7.935
220 HG SER 27 HG SER 27 2.235 -2.115 -5.309
221 H GLN 28 H GLN 28 0.509 -0.837 -5.423
222 HA GLN 28 HA GLN 28 0.311 1.828 -6.656
223 HB2 GLN 28 HB2 GLN 28 -1.981 0.374 -5.248
224 HB3 GLN 28 HB3 GLN 28 -1.882 2.129 -5.369
225 HG2 GLN 28 HG2 GLN 28 -1.888 1.999 -7.832
226 HG3 GLN 28 HG3 GLN 28 -2.044 0.241 -7.738
227 HE21 GLN 28 HE22 GLN 28 -3.706 3.353 -7.113
228 HE22 GLN 28 HE21 GLN 28 -5.306 2.585 -6.995
229 H PHE 29 H PHE 29 0.478 3.489 -5.055
230 HA PHE 29 HA PHE 29 1.476 2.568 -2.376
231 HB2 PHE 29 HB2 PHE 29 2.008 5.025 -4.017
232 HB3 PHE 29 HB3 PHE 29 2.004 5.140 -2.262
233 HD1 PHE 29 HD1 PHE 29 3.334 2.592 -4.760
234 HD2 PHE 29 HD2 PHE 29 4.121 5.034 -1.284
235 HE1 PHE 29 HE1 PHE 29 5.596 1.623 -4.588
236 HE2 PHE 29 HE2 PHE 29 6.401 4.065 -1.142
237 HZ PHE 29 HZ PHE 29 7.136 2.356 -2.780
238 H GLU 30 H GLU 30 -1.096 4.046 -4.111
239 HA GLU 30 HA GLU 30 -2.686 4.937 -1.855
240 HB2 GLU 30 HB2 GLU 30 -3.933 3.997 -4.431
241 HB3 GLU 30 HB3 GLU 30 -4.324 5.371 -3.418
242 HG2 GLU 30 HG2 GLU 30 -3.508 6.384 -5.334
243 HG3 GLU 30 HG3 GLU 30 -2.076 6.400 -4.312
244 H ARG 31 H ARG 31 -4.002 3.543 -0.534
245 HA ARG 31 HA ARG 31 -3.756 0.642 -1.010
246 HB2 ARG 31 HB2 ARG 31 -5.309 2.042 1.213
247 HB3 ARG 31 HB3 ARG 31 -4.881 0.330 1.078
248 HG2 ARG 31 HG2 ARG 31 -3.315 1.047 2.573
249 HG3 ARG 31 HG3 ARG 31 -2.431 1.090 1.055
250 HD2 ARG 31 HD2 ARG 31 -3.601 3.687 1.427
251 HD3 ARG 31 HD3 ARG 31 -2.933 3.205 2.977
252 HE ARG 31 HE ARG 31 -1.432 3.649 0.434
253 HH11 ARG 31 HH11 ARG 31 -1.057 2.507 3.747
254 HH12 ARG 31 HH12 ARG 31 0.685 2.676 3.630
255 HH21 ARG 31 HH21 ARG 31 0.583 3.772 0.368
256 HH22 ARG 31 HH22 ARG 31 1.656 3.195 1.639
257 HA PRO 32 HA PRO 32 -7.399 1.306 -3.537
258 HB2 PRO 32 HB2 PRO 32 -7.672 -1.046 -4.769
259 HB3 PRO 32 HB3 PRO 32 -6.344 0.115 -5.000
260 HG2 PRO 32 HG2 PRO 32 -6.316 -2.377 -3.284
261 HG3 PRO 32 HG3 PRO 32 -5.117 -1.965 -4.480
262 HD2 PRO 32 HD2 PRO 32 -4.791 -1.330 -1.835
263 HD3 PRO 32 HD3 PRO 32 -4.196 -0.265 -3.136
264 H SER 33 H SER 33 -8.033 1.219 -1.388
265 HA SER 33 HA SER 33 -10.529 1.040 -0.420
266 HB2 SER 33 HB2 SER 33 -11.000 -1.187 -1.128
267 HB3 SER 33 HB3 SER 33 -9.521 -1.805 -0.372
268 HG SER 33 HG SER 33 -10.913 -2.342 1.074
269 H GLY 34 H GLY 34 -8.022 -1.066 1.074
270 HA2 GLY 34 HA2 GLY 34 -6.720 0.663 2.822
271 HA3 GLY 34 HA3 GLY 34 -8.205 0.162 3.646
Start of MODEL 16
1 H1 LYS 1 H1 LYS 1 -11.371 -10.592 1.559
2 H2 LYS 1 H2 LYS 1 -11.073 -10.457 -0.062
3 H3 LYS 1 H3 LYS 1 -12.263 -9.562 0.613
4 HA LYS 1 HA LYS 1 -10.674 -8.368 1.962
5 HB2 LYS 1 HB2 LYS 1 -8.301 -8.528 1.461
6 HB3 LYS 1 HB3 LYS 1 -8.918 -10.059 2.044
7 HG2 LYS 1 HG2 LYS 1 -8.819 -11.064 -0.153
8 HG3 LYS 1 HG3 LYS 1 -8.516 -9.502 -0.926
9 HD2 LYS 1 HD2 LYS 1 -6.365 -9.301 0.264
10 HD3 LYS 1 HD3 LYS 1 -6.614 -10.892 1.005
11 HE2 LYS 1 HE2 LYS 1 -6.499 -12.005 -1.135
12 HE3 LYS 1 HE3 LYS 1 -6.610 -10.465 -2.009
13 HZ1 LYS 1 HZ1 LYS 1 -4.496 -9.833 -1.220
14 HZ2 LYS 1 HZ2 LYS 1 -4.339 -11.159 -0.251
15 HZ3 LYS 1 HZ3 LYS 1 -4.296 -11.349 -1.880
16 H LEU 2 H LEU 2 -8.676 -7.080 0.175
17 HA LEU 2 HA LEU 2 -10.276 -5.351 -1.443
18 HB2 LEU 2 HB2 LEU 2 -7.289 -5.994 -1.320
19 HB3 LEU 2 HB3 LEU 2 -7.989 -4.651 -2.197
20 HG LEU 2 HG LEU 2 -8.987 -3.955 0.159
21 HD11 LEU 2 HD11 LEU 2 -7.269 -4.395 1.962
22 HD12 LEU 2 HD12 LEU 2 -8.242 -5.794 1.572
23 HD13 LEU 2 HD13 LEU 2 -6.577 -5.668 0.940
24 HD21 LEU 2 HD21 LEU 2 -6.873 -2.637 0.522
25 HD22 LEU 2 HD22 LEU 2 -6.104 -3.637 -0.742
26 HD23 LEU 2 HD23 LEU 2 -7.478 -2.604 -1.133
27 HA PRO 3 HA PRO 3 -10.805 -7.394 -5.209
28 HB2 PRO 3 HB2 PRO 3 -8.888 -5.768 -6.868
29 HB3 PRO 3 HB3 PRO 3 -10.616 -6.113 -7.148
30 HG2 PRO 3 HG2 PRO 3 -9.830 -3.701 -6.177
31 HG3 PRO 3 HG3 PRO 3 -11.298 -4.512 -5.542
32 HD2 PRO 3 HD2 PRO 3 -8.533 -4.414 -4.338
33 HD3 PRO 3 HD3 PRO 3 -10.108 -4.192 -3.559
34 HA PRO 4 HA PRO 4 -8.431 -10.856 -5.750
35 HB2 PRO 4 HB2 PRO 4 -8.292 -10.563 -8.723
36 HB3 PRO 4 HB3 PRO 4 -8.704 -12.011 -7.759
37 HG2 PRO 4 HG2 PRO 4 -10.688 -10.513 -8.865
38 HG3 PRO 4 HG3 PRO 4 -10.850 -11.150 -7.199
39 HD2 PRO 4 HD2 PRO 4 -10.152 -8.362 -8.087
40 HD3 PRO 4 HD3 PRO 4 -11.164 -8.902 -6.715
41 H GLY 5 H GLY 5 -6.545 -10.924 -5.027
42 HA2 GLY 5 HA2 GLY 5 -4.200 -11.254 -5.194
43 HA3 GLY 5 HA3 GLY 5 -4.133 -10.144 -6.557
44 H TRP 6 H TRP 6 -5.802 -8.088 -4.618
45 HA TRP 6 HA TRP 6 -3.327 -6.750 -3.984
46 HB2 TRP 6 HB2 TRP 6 -6.184 -6.112 -3.274
47 HB3 TRP 6 HB3 TRP 6 -4.818 -5.099 -2.831
48 HD1 TRP 6 HD1 TRP 6 -7.195 -5.694 -5.513
49 HE1 TRP 6 HE1 TRP 6 -6.784 -4.083 -7.435
50 HE3 TRP 6 HE3 TRP 6 -2.530 -4.170 -4.197
51 HZ2 TRP 6 HZ2 TRP 6 -4.535 -2.478 -8.435
52 HZ3 TRP 6 HZ3 TRP 6 -1.307 -2.528 -5.579
53 HH2 TRP 6 HH2 TRP 6 -2.269 -1.705 -7.716
54 H GLU 7 H GLU 7 -2.060 -6.614 -2.236
55 HA GLU 7 HA GLU 7 -3.220 -7.025 0.444
56 HB2 GLU 7 HB2 GLU 7 -1.847 -9.098 -0.750
57 HB3 GLU 7 HB3 GLU 7 -0.519 -8.258 0.030
58 HG2 GLU 7 HG2 GLU 7 -3.079 -9.203 1.411
59 HG3 GLU 7 HG3 GLU 7 -1.588 -10.132 1.332
60 H LYS 8 H LYS 8 -1.994 -6.013 2.085
61 HA LYS 8 HA LYS 8 -0.524 -3.582 1.425
62 HB2 LYS 8 HB2 LYS 8 -1.812 -3.364 3.309
63 HB3 LYS 8 HB3 LYS 8 -1.615 -4.983 3.850
64 HG2 LYS 8 HG2 LYS 8 0.892 -3.379 4.053
65 HG3 LYS 8 HG3 LYS 8 -0.466 -2.697 4.905
66 HD2 LYS 8 HD2 LYS 8 0.870 -4.113 6.354
67 HD3 LYS 8 HD3 LYS 8 -0.788 -4.682 6.252
68 HE2 LYS 8 HE2 LYS 8 1.336 -5.891 4.461
69 HE3 LYS 8 HE3 LYS 8 1.293 -6.339 6.161
70 HZ1 LYS 8 HZ1 LYS 8 -0.048 -7.808 4.585
71 HZ2 LYS 8 HZ2 LYS 8 -0.896 -7.236 5.899
72 HZ3 LYS 8 HZ3 LYS 8 -1.074 -6.676 4.360
73 H ARG 9 H ARG 9 1.654 -3.240 1.637
74 HA ARG 9 HA ARG 9 3.511 -5.451 2.372
75 HB2 ARG 9 HB2 ARG 9 3.446 -3.991 -0.303
76 HB3 ARG 9 HB3 ARG 9 4.861 -4.866 0.269
77 HG2 ARG 9 HG2 ARG 9 2.163 -6.136 -0.354
78 HG3 ARG 9 HG3 ARG 9 3.601 -6.097 -1.369
79 HD2 ARG 9 HD2 ARG 9 3.966 -8.121 -0.558
80 HD3 ARG 9 HD3 ARG 9 4.756 -7.236 0.752
81 HE ARG 9 HE ARG 9 2.091 -7.494 1.567
82 HH11 ARG 9 HH11 ARG 9 4.631 -9.756 0.744
83 HH12 ARG 9 HH12 ARG 9 3.931 -11.059 1.670
84 HH21 ARG 9 HH21 ARG 9 1.125 -9.262 2.661
85 HH22 ARG 9 HH22 ARG 9 2.023 -10.747 2.757
86 H MET 10 H MET 10 5.825 -4.580 2.358
87 HA MET 10 HA MET 10 5.943 -1.699 3.110
88 HB2 MET 10 HB2 MET 10 6.208 -3.224 5.076
89 HB3 MET 10 HB3 MET 10 7.596 -3.968 4.263
90 HG2 MET 10 HG2 MET 10 8.628 -1.640 4.151
91 HG3 MET 10 HG3 MET 10 7.296 -1.060 5.133
92 HE1 MET 10 HE1 MET 10 9.572 -4.389 5.367
93 HE2 MET 10 HE2 MET 10 10.632 -3.014 4.967
94 HE3 MET 10 HE3 MET 10 10.745 -3.798 6.560
95 H PHE 11 H PHE 11 7.306 -0.511 1.916
96 HA PHE 11 HA PHE 11 8.517 -1.676 -0.390
97 HB2 PHE 11 HB2 PHE 11 7.311 0.555 -0.136
98 HB3 PHE 11 HB3 PHE 11 8.773 1.180 0.596
99 HD1 PHE 11 HD1 PHE 11 10.917 1.219 -0.840
100 HD2 PHE 11 HD2 PHE 11 7.025 0.300 -2.462
101 HE1 PHE 11 HE1 PHE 11 11.767 1.657 -3.131
102 HE2 PHE 11 HE2 PHE 11 7.888 0.723 -4.755
103 HZ PHE 11 HZ PHE 11 10.258 1.392 -5.091
104 H ARG 12 H ARG 12 9.970 -3.147 0.581
105 HA ARG 12 HA ARG 12 12.214 -2.654 2.093
106 HB2 ARG 12 HB2 ARG 12 13.356 -4.373 0.373
107 HB3 ARG 12 HB3 ARG 12 12.244 -4.813 1.647
108 HG2 ARG 12 HG2 ARG 12 11.720 -6.047 -0.316
109 HG3 ARG 12 HG3 ARG 12 10.379 -4.998 0.078
110 HD2 ARG 12 HD2 ARG 12 12.222 -3.719 -1.837
111 HD3 ARG 12 HD3 ARG 12 11.739 -5.306 -2.390
112 HE ARG 12 HE ARG 12 9.402 -4.667 -2.283
113 HH11 ARG 12 HH11 ARG 12 11.561 -1.863 -2.076
114 HH12 ARG 12 HH12 ARG 12 10.416 -0.841 -2.896
115 HH21 ARG 12 HH21 ARG 12 7.893 -3.200 -3.111
116 HH22 ARG 12 HH22 ARG 12 8.445 -1.574 -3.428
117 H SER 13 H SER 13 14.104 -1.771 1.964
118 HA SER 13 HA SER 13 15.920 -0.561 1.299
119 HB2 SER 13 HB2 SER 13 14.607 0.550 -1.170
120 HB3 SER 13 HB3 SER 13 16.325 0.422 -0.765
121 HG SER 13 HG SER 13 14.493 -1.593 -1.466
122 H ASN 14 H ASN 14 12.603 0.623 1.654
123 HA ASN 14 HA ASN 14 13.889 2.859 3.068
124 HB2 ASN 14 HB2 ASN 14 12.585 4.615 2.149
125 HB3 ASN 14 HB3 ASN 14 13.450 3.803 0.857
126 HD21 ASN 14 HD22 ASN 14 12.100 4.292 -0.902
127 HD22 ASN 14 HD21 ASN 14 10.405 3.838 -0.911
128 H GLY 15 H GLY 15 11.033 0.797 2.762
129 HA2 GLY 15 HA2 GLY 15 10.025 -0.076 4.704
130 HA3 GLY 15 HA3 GLY 15 10.530 1.308 5.650
131 H THR 16 H THR 16 9.211 2.532 2.782
132 HA THR 16 HA THR 16 6.866 3.608 3.959
133 HB THR 16 HB THR 16 7.330 3.070 0.993
134 HG1 THR 16 HG1 THR 16 9.082 4.142 1.655
135 HG21 THR 16 HG21 THR 16 6.002 5.137 0.700
136 HG22 THR 16 HG22 THR 16 5.061 3.873 1.507
137 HG23 THR 16 HG23 THR 16 5.737 5.219 2.455
138 H VAL 17 H VAL 17 4.916 2.632 4.391
139 HA VAL 17 HA VAL 17 4.442 -0.089 3.367
140 HB VAL 17 HB VAL 17 2.833 1.714 5.167
141 HG11 VAL 17 HG11 VAL 17 1.221 -0.150 5.495
142 HG12 VAL 17 HG12 VAL 17 1.110 0.543 3.879
143 HG13 VAL 17 HG13 VAL 17 1.947 -1.008 4.121
144 HG21 VAL 17 HG21 VAL 17 4.801 0.423 6.071
145 HG22 VAL 17 HG22 VAL 17 3.268 -0.119 6.776
146 HG23 VAL 17 HG23 VAL 17 4.036 -1.077 5.490
147 H TYR 18 H TYR 18 3.016 -0.728 1.914
148 HA TYR 18 HA TYR 18 1.610 1.175 0.169
149 HB2 TYR 18 HB2 TYR 18 2.953 0.987 -1.685
150 HB3 TYR 18 HB3 TYR 18 4.144 1.058 -0.408
151 HD1 TYR 18 HD1 TYR 18 5.282 -1.038 0.344
152 HD2 TYR 18 HD2 TYR 18 2.985 -0.724 -3.256
153 HE1 TYR 18 HE1 TYR 18 6.542 -3.007 -0.640
154 HE2 TYR 18 HE2 TYR 18 4.184 -2.675 -4.235
155 HH TYR 18 HH TYR 18 5.709 -4.365 -3.800
156 H TYR 19 H TYR 19 0.920 -0.320 -1.926
157 HA TYR 19 HA TYR 19 0.077 -2.991 -0.887
158 HB2 TYR 19 HB2 TYR 19 -1.645 -0.830 -2.041
159 HB3 TYR 19 HB3 TYR 19 -2.011 -2.487 -2.441
160 HD1 TYR 19 HD1 TYR 19 -1.285 -0.422 0.657
161 HD2 TYR 19 HD2 TYR 19 -3.366 -3.783 -1.069
162 HE1 TYR 19 HE1 TYR 19 -2.647 -0.652 2.721
163 HE2 TYR 19 HE2 TYR 19 -4.708 -4.000 1.032
164 HH TYR 19 HH TYR 19 -5.310 -1.593 3.037
165 H PHE 20 H PHE 20 -0.152 -4.591 -2.258
166 HA PHE 20 HA PHE 20 1.018 -4.361 -5.002
167 HB2 PHE 20 HB2 PHE 20 2.743 -4.902 -3.366
168 HB3 PHE 20 HB3 PHE 20 1.764 -6.239 -2.738
169 HD1 PHE 20 HD2 PHE 20 3.663 -5.022 -5.671
170 HD2 PHE 20 HD1 PHE 20 1.884 -8.465 -3.775
171 HE1 PHE 20 HE2 PHE 20 4.879 -6.513 -7.243
172 HE2 PHE 20 HE1 PHE 20 3.153 -9.941 -5.300
173 HZ PHE 20 HZ PHE 20 4.629 -8.983 -7.044
174 H ASN 21 H ASN 21 -0.141 -5.436 -6.471
175 HA ASN 21 HA ASN 21 -2.220 -7.345 -5.669
176 HB2 ASN 21 HB2 ASN 21 -2.609 -5.582 -7.437
177 HB3 ASN 21 HB3 ASN 21 -1.387 -6.378 -8.410
178 HD21 ASN 21 HD22 ASN 21 -4.699 -6.543 -7.153
179 HD22 ASN 21 HD21 ASN 21 -5.099 -8.067 -7.930
180 H HIS 22 H HIS 22 -1.295 -9.221 -4.975
181 HA HIS 22 HA HIS 22 1.089 -10.323 -6.125
182 HB2 HIS 22 HB2 HIS 22 0.965 -11.912 -4.405
183 HB3 HIS 22 HB3 HIS 22 0.381 -10.421 -3.721
184 HD1 HIS 22 HD1 HIS 22 -1.362 -13.451 -5.399
185 HD2 HIS 22 HD2 HIS 22 -1.657 -10.768 -2.192
186 HE1 HIS 22 HE1 HIS 22 -3.516 -14.088 -4.098
187 H ILE 23 H ILE 23 -1.640 -10.204 -7.786
188 HA ILE 23 HA ILE 23 -1.250 -12.909 -9.011
189 HB ILE 23 HB ILE 23 -3.628 -11.024 -9.070
190 HG12 ILE 23 HG12 ILE 23 -3.241 -13.895 -8.078
191 HG13 ILE 23 HG13 ILE 23 -3.406 -12.469 -7.065
192 HG21 ILE 23 HG21 ILE 23 -3.337 -11.943 -11.345
193 HG22 ILE 23 HG22 ILE 23 -3.219 -13.586 -10.681
194 HG23 ILE 23 HG23 ILE 23 -4.735 -12.660 -10.577
195 HD11 ILE 23 HD11 ILE 23 -5.551 -13.778 -8.755
196 HD12 ILE 23 HD12 ILE 23 -5.510 -13.533 -7.004
197 HD13 ILE 23 HD13 ILE 23 -5.729 -12.141 -8.087
198 H THR 24 H THR 24 -1.098 -9.424 -9.491
199 HA THR 24 HA THR 24 -0.264 -9.830 -12.352
200 HB THR 24 HB THR 24 -1.085 -7.548 -12.728
201 HG1 THR 24 HG1 THR 24 -2.115 -7.700 -10.113
202 HG21 THR 24 HG21 THR 24 -3.214 -9.185 -11.271
203 HG22 THR 24 HG22 THR 24 -3.485 -7.861 -12.411
204 HG23 THR 24 HG23 THR 24 -2.754 -9.381 -12.979
205 H ASN 25 H ASN 25 0.815 -8.493 -9.329
206 HA ASN 25 HA ASN 25 2.703 -7.599 -8.617
207 HB2 ASN 25 HB2 ASN 25 3.766 -7.193 -11.419
208 HB3 ASN 25 HB3 ASN 25 4.646 -7.068 -9.910
209 HD21 ASN 25 HD22 ASN 25 3.191 -9.294 -12.193
210 HD22 ASN 25 HD21 ASN 25 4.065 -10.718 -11.589
211 H ALA 26 H ALA 26 0.230 -6.096 -10.221
212 HA ALA 26 HA ALA 26 1.121 -3.449 -10.587
213 HB1 ALA 26 HB1 ALA 26 -1.581 -4.376 -9.518
214 HB2 ALA 26 HB2 ALA 26 -1.219 -2.814 -10.267
215 HB3 ALA 26 HB3 ALA 26 -1.123 -4.299 -11.234
216 H SER 27 H SER 27 1.576 -1.743 -9.211
217 HA SER 27 HA SER 27 1.627 -2.311 -6.270
218 HB2 SER 27 HB2 SER 27 3.862 -1.332 -8.095
219 HB3 SER 27 HB3 SER 27 3.931 -1.390 -6.328
220 HG SER 27 HG SER 27 3.539 -3.671 -8.039
221 H GLN 28 H GLN 28 0.975 -0.562 -5.041
222 HA GLN 28 HA GLN 28 1.323 2.164 -6.088
223 HB2 GLN 28 HB2 GLN 28 -0.847 1.371 -7.026
224 HB3 GLN 28 HB3 GLN 28 -1.423 1.004 -5.404
225 HG2 GLN 28 HG2 GLN 28 -2.300 3.139 -6.402
226 HG3 GLN 28 HG3 GLN 28 -1.540 3.327 -4.833
227 HE21 GLN 28 HE22 GLN 28 -0.872 3.768 -8.390
228 HE22 GLN 28 HE21 GLN 28 0.301 5.033 -8.057
229 H PHE 29 H PHE 29 1.083 3.808 -4.391
230 HA PHE 29 HA PHE 29 1.623 2.744 -1.683
231 HB2 PHE 29 HB2 PHE 29 1.705 5.529 -2.861
232 HB3 PHE 29 HB3 PHE 29 2.014 5.156 -1.167
233 HD1 PHE 29 HD2 PHE 29 3.734 3.103 -0.813
234 HD2 PHE 29 HD1 PHE 29 3.640 5.702 -4.244
235 HE1 PHE 29 HE2 PHE 29 6.126 2.597 -1.256
236 HE2 PHE 29 HE1 PHE 29 6.025 5.180 -4.703
237 HZ PHE 29 HZ PHE 29 7.273 3.630 -3.209
238 H GLU 30 H GLU 30 -0.870 4.759 -3.335
239 HA GLU 30 HA GLU 30 -2.542 4.845 -0.980
240 HB2 GLU 30 HB2 GLU 30 -2.822 6.511 -2.708
241 HB3 GLU 30 HB3 GLU 30 -3.121 5.271 -3.920
242 HG2 GLU 30 HG2 GLU 30 -5.180 6.407 -3.320
243 HG3 GLU 30 HG3 GLU 30 -5.270 4.705 -2.902
244 H ARG 31 H ARG 31 -4.376 3.601 -0.524
245 HA ARG 31 HA ARG 31 -3.940 0.764 -1.248
246 HB2 ARG 31 HB2 ARG 31 -6.064 1.621 0.698
247 HB3 ARG 31 HB3 ARG 31 -5.173 0.124 0.586
248 HG2 ARG 31 HG2 ARG 31 -4.133 0.980 2.412
249 HG3 ARG 31 HG3 ARG 31 -3.056 1.630 1.186
250 HD2 ARG 31 HD2 ARG 31 -3.655 3.253 2.974
251 HD3 ARG 31 HD3 ARG 31 -4.143 3.822 1.388
252 HE ARG 31 HE ARG 31 -6.109 2.334 3.096
253 HH11 ARG 31 HH12 ARG 31 -5.646 5.258 1.101
254 HH12 ARG 31 HH11 ARG 31 -7.240 5.785 1.480
255 HH21 ARG 31 HH21 ARG 31 -7.963 2.843 3.210
256 HH22 ARG 31 HH22 ARG 31 -8.650 4.398 2.673
257 HA PRO 32 HA PRO 32 -7.134 1.089 -4.228
258 HB2 PRO 32 HB2 PRO 32 -7.640 -1.594 -4.828
259 HB3 PRO 32 HB3 PRO 32 -6.221 -0.656 -5.348
260 HG2 PRO 32 HG2 PRO 32 -6.392 -2.618 -3.094
261 HG3 PRO 32 HG3 PRO 32 -5.074 -2.333 -4.228
262 HD2 PRO 32 HD2 PRO 32 -5.074 -1.307 -1.687
263 HD3 PRO 32 HD3 PRO 32 -4.238 -0.540 -3.070
264 H SER 33 H SER 33 -7.746 -0.581 -1.573
265 HA SER 33 HA SER 33 -10.670 -0.023 -1.391
266 HB2 SER 33 HB2 SER 33 -10.652 -1.896 -2.951
267 HB3 SER 33 HB3 SER 33 -9.679 -2.858 -1.832
268 HG SER 33 HG SER 33 -11.508 -2.399 -0.329
269 H GLY 34 H GLY 34 -8.132 0.159 0.488
270 HA2 GLY 34 HA2 GLY 34 -9.433 -0.261 2.966
271 HA3 GLY 34 HA3 GLY 34 -8.471 -1.702 2.624
Start of MODEL 17
1 H1 LYS 1 H1 LYS 1 -11.361 -1.114 -3.004
2 H2 LYS 1 H2 LYS 1 -12.733 -1.467 -3.855
3 H3 LYS 1 H3 LYS 1 -12.738 -0.284 -2.699
4 HA LYS 1 HA LYS 1 -12.718 0.789 -4.792
5 HB2 LYS 1 HB2 LYS 1 -9.861 0.874 -3.800
6 HB3 LYS 1 HB3 LYS 1 -10.728 2.134 -4.666
7 HG2 LYS 1 HG2 LYS 1 -12.054 2.636 -2.672
8 HG3 LYS 1 HG3 LYS 1 -11.419 1.201 -1.842
9 HD2 LYS 1 HD2 LYS 1 -9.070 2.198 -2.243
10 HD3 LYS 1 HD3 LYS 1 -9.892 3.721 -2.595
11 HE2 LYS 1 HE2 LYS 1 -10.729 3.880 -0.363
12 HE3 LYS 1 HE3 LYS 1 -10.473 2.147 -0.059
13 HZ1 LYS 1 HZ1 LYS 1 -8.721 3.475 0.990
14 HZ2 LYS 1 HZ2 LYS 1 -8.105 2.495 -0.172
15 HZ3 LYS 1 HZ3 LYS 1 -8.245 4.089 -0.479
16 H LEU 2 H LEU 2 -9.321 -0.096 -5.223
17 HA LEU 2 HA LEU 2 -9.800 -1.262 -7.779
18 HB2 LEU 2 HB2 LEU 2 -7.198 -1.541 -6.275
19 HB3 LEU 2 HB3 LEU 2 -7.439 -1.617 -7.915
20 HG LEU 2 HG LEU 2 -7.854 0.734 -8.196
21 HD11 LEU 2 HD11 LEU 2 -7.070 2.308 -6.378
22 HD12 LEU 2 HD12 LEU 2 -8.668 1.643 -6.140
23 HD13 LEU 2 HD13 LEU 2 -7.282 0.997 -5.214
24 HD21 LEU 2 HD21 LEU 2 -5.287 -0.048 -6.732
25 HD22 LEU 2 HD22 LEU 2 -5.630 -0.264 -8.454
26 HD23 LEU 2 HD23 LEU 2 -5.486 1.366 -7.790
27 HA PRO 3 HA PRO 3 -10.649 -5.428 -7.346
28 HB2 PRO 3 HB2 PRO 3 -7.831 -6.065 -8.302
29 HB3 PRO 3 HB3 PRO 3 -9.358 -6.819 -8.887
30 HG2 PRO 3 HG2 PRO 3 -8.276 -4.890 -10.351
31 HG3 PRO 3 HG3 PRO 3 -10.018 -4.691 -9.909
32 HD2 PRO 3 HD2 PRO 3 -7.580 -3.564 -8.475
33 HD3 PRO 3 HD3 PRO 3 -9.022 -2.686 -8.997
34 HA PRO 4 HA PRO 4 -8.942 -8.069 -4.073
35 HB2 PRO 4 HB2 PRO 4 -9.799 -10.543 -4.928
36 HB3 PRO 4 HB3 PRO 4 -10.880 -9.342 -4.153
37 HG2 PRO 4 HG2 PRO 4 -10.498 -9.873 -7.111
38 HG3 PRO 4 HG3 PRO 4 -12.035 -9.689 -6.207
39 HD2 PRO 4 HD2 PRO 4 -10.963 -7.640 -7.603
40 HD3 PRO 4 HD3 PRO 4 -11.752 -7.347 -6.029
41 H GLY 5 H GLY 5 -6.966 -9.179 -3.904
42 HA2 GLY 5 HA2 GLY 5 -5.093 -10.442 -4.990
43 HA3 GLY 5 HA3 GLY 5 -5.431 -9.530 -6.447
44 H TRP 6 H TRP 6 -5.908 -6.811 -5.105
45 HA TRP 6 HA TRP 6 -3.148 -6.059 -4.649
46 HB2 TRP 6 HB2 TRP 6 -5.825 -4.690 -4.246
47 HB3 TRP 6 HB3 TRP 6 -4.269 -3.953 -3.907
48 HD1 TRP 6 HD1 TRP 6 -6.549 -4.657 -6.782
49 HE1 TRP 6 HE1 TRP 6 -5.607 -3.490 -8.875
50 HE3 TRP 6 HE3 TRP 6 -1.945 -3.475 -5.002
51 HZ2 TRP 6 HZ2 TRP 6 -3.123 -2.238 -9.684
52 HZ3 TRP 6 HZ3 TRP 6 -0.338 -2.294 -6.386
53 HH2 TRP 6 HH2 TRP 6 -0.877 -1.654 -8.752
54 H GLU 7 H GLU 7 -1.969 -6.407 -2.847
55 HA GLU 7 HA GLU 7 -3.332 -6.470 -0.195
56 HB2 GLU 7 HB2 GLU 7 -2.799 -8.722 -1.462
57 HB3 GLU 7 HB3 GLU 7 -1.140 -8.415 -0.972
58 HG2 GLU 7 HG2 GLU 7 -3.559 -8.616 0.891
59 HG3 GLU 7 HG3 GLU 7 -2.473 -9.951 0.511
60 H LYS 8 H LYS 8 -1.967 -5.967 1.593
61 HA LYS 8 HA LYS 8 -0.293 -3.690 1.199
62 HB2 LYS 8 HB2 LYS 8 -1.564 -3.665 3.098
63 HB3 LYS 8 HB3 LYS 8 -1.350 -5.333 3.484
64 HG2 LYS 8 HG2 LYS 8 0.826 -3.239 3.842
65 HG3 LYS 8 HG3 LYS 8 -0.384 -3.625 5.054
66 HD2 LYS 8 HD2 LYS 8 1.924 -5.366 4.161
67 HD3 LYS 8 HD3 LYS 8 1.551 -4.713 5.725
68 HE2 LYS 8 HE2 LYS 8 1.087 -6.950 5.970
69 HE3 LYS 8 HE3 LYS 8 -0.517 -6.238 5.788
70 HZ1 LYS 8 HZ1 LYS 8 -0.761 -7.274 3.697
71 HZ2 LYS 8 HZ2 LYS 8 0.804 -7.247 3.352
72 HZ3 LYS 8 HZ3 LYS 8 0.199 -8.364 4.405
73 H ARG 9 H ARG 9 1.853 -3.365 1.248
74 HA ARG 9 HA ARG 9 3.736 -5.462 2.105
75 HB2 ARG 9 HB2 ARG 9 3.872 -4.124 -0.641
76 HB3 ARG 9 HB3 ARG 9 5.146 -5.129 0.047
77 HG2 ARG 9 HG2 ARG 9 2.363 -6.053 -0.731
78 HG3 ARG 9 HG3 ARG 9 3.845 -6.328 -1.636
79 HD2 ARG 9 HD2 ARG 9 4.496 -8.084 -0.370
80 HD3 ARG 9 HD3 ARG 9 4.027 -7.320 1.137
81 HE ARG 9 HE ARG 9 1.760 -7.983 0.860
82 HH11 ARG 9 HH11 ARG 9 3.771 -9.504 -1.585
83 HH12 ARG 9 HH12 ARG 9 2.663 -10.835 -1.806
84 HH21 ARG 9 HH21 ARG 9 0.447 -9.674 0.617
85 HH22 ARG 9 HH22 ARG 9 0.747 -10.921 -0.591
86 H MET 10 H MET 10 6.022 -4.523 2.102
87 HA MET 10 HA MET 10 6.006 -1.615 2.755
88 HB2 MET 10 HB2 MET 10 6.024 -3.060 4.795
89 HB3 MET 10 HB3 MET 10 7.521 -3.807 4.214
90 HG2 MET 10 HG2 MET 10 8.570 -1.511 4.194
91 HG3 MET 10 HG3 MET 10 7.076 -0.864 4.866
92 HE1 MET 10 HE1 MET 10 10.183 -3.478 7.082
93 HE2 MET 10 HE2 MET 10 9.274 -4.138 5.708
94 HE3 MET 10 HE3 MET 10 10.383 -2.765 5.466
95 H PHE 11 H PHE 11 7.462 -0.451 1.712
96 HA PHE 11 HA PHE 11 9.077 -1.542 -0.358
97 HB2 PHE 11 HB2 PHE 11 7.841 0.612 -0.377
98 HB3 PHE 11 HB3 PHE 11 8.958 1.234 0.822
99 HD1 PHE 11 HD2 PHE 11 10.954 -0.701 -1.478
100 HD2 PHE 11 HD1 PHE 11 8.791 3.029 -1.108
101 HE1 PHE 11 HE2 PHE 11 12.373 0.301 -3.201
102 HE2 PHE 11 HE1 PHE 11 10.224 4.014 -2.864
103 HZ PHE 11 HZ PHE 11 12.026 2.656 -3.911
104 H ARG 12 H ARG 12 10.625 -2.881 0.398
105 HA ARG 12 HA ARG 12 12.451 -2.565 2.475
106 HB2 ARG 12 HB2 ARG 12 13.120 -3.790 -0.234
107 HB3 ARG 12 HB3 ARG 12 13.792 -4.196 1.334
108 HG2 ARG 12 HG2 ARG 12 12.272 -5.823 1.537
109 HG3 ARG 12 HG3 ARG 12 11.014 -4.627 1.695
110 HD2 ARG 12 HD2 ARG 12 11.903 -6.167 -0.749
111 HD3 ARG 12 HD3 ARG 12 10.317 -6.153 0.001
112 HE ARG 12 HE ARG 12 11.498 -4.135 -1.831
113 HH11 ARG 12 HH11 ARG 12 8.526 -4.642 -0.007
114 HH12 ARG 12 HH12 ARG 12 7.550 -4.411 -1.459
115 HH21 ARG 12 HH21 ARG 12 10.080 -3.413 -3.458
116 HH22 ARG 12 HH22 ARG 12 8.366 -3.485 -3.116
117 H SER 13 H SER 13 14.454 -1.671 2.662
118 HA SER 13 HA SER 13 16.269 -0.312 2.367
119 HB2 SER 13 HB2 SER 13 16.656 1.206 0.556
120 HB3 SER 13 HB3 SER 13 16.175 -0.356 -0.127
121 HG SER 13 HG SER 13 14.094 0.421 -0.353
122 H ASN 14 H ASN 14 12.917 0.792 2.477
123 HA ASN 14 HA ASN 14 13.848 3.136 4.075
124 HB2 ASN 14 HB2 ASN 14 12.367 4.619 2.761
125 HB3 ASN 14 HB3 ASN 14 13.692 3.953 1.811
126 HD21 ASN 14 HD22 ASN 14 13.224 2.518 0.040
127 HD22 ASN 14 HD21 ASN 14 11.561 2.320 -0.478
128 H GLY 15 H GLY 15 11.064 0.997 3.279
129 HA2 GLY 15 HA2 GLY 15 9.785 0.106 5.060
130 HA3 GLY 15 HA3 GLY 15 10.090 1.523 6.049
131 H THR 16 H THR 16 9.246 2.518 2.868
132 HA THR 16 HA THR 16 6.764 3.665 3.655
133 HB THR 16 HB THR 16 7.592 2.969 0.811
134 HG1 THR 16 HG1 THR 16 9.265 4.112 1.611
135 HG21 THR 16 HG21 THR 16 5.826 5.171 1.946
136 HG22 THR 16 HG22 THR 16 6.286 4.977 0.241
137 HG23 THR 16 HG23 THR 16 5.271 3.753 1.023
138 H VAL 17 H VAL 17 4.891 2.559 4.144
139 HA VAL 17 HA VAL 17 4.446 -0.111 3.011
140 HB VAL 17 HB VAL 17 2.846 1.598 4.908
141 HG11 VAL 17 HG11 VAL 17 1.134 0.417 3.618
142 HG12 VAL 17 HG12 VAL 17 2.025 -1.115 3.787
143 HG13 VAL 17 HG13 VAL 17 1.300 -0.331 5.205
144 HG21 VAL 17 HG21 VAL 17 3.359 -0.274 6.451
145 HG22 VAL 17 HG22 VAL 17 4.141 -1.164 5.127
146 HG23 VAL 17 HG23 VAL 17 4.863 0.342 5.747
147 H TYR 18 H TYR 18 3.001 -0.731 1.578
148 HA TYR 18 HA TYR 18 1.421 1.141 -0.026
149 HB2 TYR 18 HB2 TYR 18 2.679 1.033 -1.997
150 HB3 TYR 18 HB3 TYR 18 3.857 1.379 -0.751
151 HD1 TYR 18 HD1 TYR 18 5.304 -0.527 0.135
152 HD2 TYR 18 HD2 TYR 18 2.998 -0.733 -3.472
153 HE1 TYR 18 HE1 TYR 18 6.724 -2.429 -0.663
154 HE2 TYR 18 HE2 TYR 18 4.357 -2.663 -4.265
155 HH TYR 18 HH TYR 18 6.019 -4.082 -3.742
156 H TYR 19 H TYR 19 0.818 -0.374 -2.222
157 HA TYR 19 HA TYR 19 0.160 -3.090 -1.200
158 HB2 TYR 19 HB2 TYR 19 -1.659 -1.024 -2.377
159 HB3 TYR 19 HB3 TYR 19 -1.900 -2.686 -2.840
160 HD1 TYR 19 HD1 TYR 19 -1.263 -0.856 0.420
161 HD2 TYR 19 HD2 TYR 19 -3.501 -3.862 -1.688
162 HE1 TYR 19 HE1 TYR 19 -2.588 -1.295 2.448
163 HE2 TYR 19 HE2 TYR 19 -4.858 -4.298 0.334
164 HH TYR 19 HH TYR 19 -4.144 -2.716 3.434
165 H PHE 20 H PHE 20 0.037 -4.692 -2.600
166 HA PHE 20 HA PHE 20 1.330 -4.418 -5.281
167 HB2 PHE 20 HB2 PHE 20 2.961 -5.094 -3.622
168 HB3 PHE 20 HB3 PHE 20 1.860 -6.314 -2.976
169 HD1 PHE 20 HD2 PHE 20 3.904 -5.419 -5.961
170 HD2 PHE 20 HD1 PHE 20 1.782 -8.548 -3.876
171 HE1 PHE 20 HE2 PHE 20 5.004 -7.119 -7.392
172 HE2 PHE 20 HE1 PHE 20 2.924 -10.243 -5.281
173 HZ PHE 20 HZ PHE 20 4.529 -9.540 -7.032
174 H ASN 21 H ASN 21 0.182 -5.411 -6.852
175 HA ASN 21 HA ASN 21 -2.171 -7.025 -6.130
176 HB2 ASN 21 HB2 ASN 21 -2.236 -5.342 -7.991
177 HB3 ASN 21 HB3 ASN 21 -1.070 -6.323 -8.847
178 HD21 ASN 21 HD22 ASN 21 -4.459 -6.065 -7.791
179 HD22 ASN 21 HD21 ASN 21 -4.969 -7.527 -8.620
180 H HIS 22 H HIS 22 -1.592 -8.959 -5.295
181 HA HIS 22 HA HIS 22 0.778 -10.344 -6.134
182 HB2 HIS 22 HB2 HIS 22 0.337 -11.808 -4.401
183 HB3 HIS 22 HB3 HIS 22 -0.358 -10.307 -3.833
184 HD1 HIS 22 HD1 HIS 22 -1.637 -13.457 -5.673
185 HD2 HIS 22 HD2 HIS 22 -2.803 -10.551 -2.871
186 HE1 HIS 22 HE1 HIS 22 -3.975 -14.161 -4.793
187 H ILE 23 H ILE 23 -1.900 -10.035 -7.966
188 HA ILE 23 HA ILE 23 -1.867 -12.812 -9.047
189 HB ILE 23 HB ILE 23 -3.921 -10.581 -9.332
190 HG12 ILE 23 HG12 ILE 23 -3.929 -13.123 -7.639
191 HG13 ILE 23 HG13 ILE 23 -3.885 -11.466 -7.040
192 HG21 ILE 23 HG21 ILE 23 -4.083 -13.487 -10.216
193 HG22 ILE 23 HG22 ILE 23 -5.354 -12.253 -10.379
194 HG23 ILE 23 HG23 ILE 23 -3.871 -12.095 -11.304
195 HD11 ILE 23 HD11 ILE 23 -6.161 -11.095 -8.084
196 HD12 ILE 23 HD12 ILE 23 -6.228 -12.853 -8.365
197 HD13 ILE 23 HD13 ILE 23 -6.095 -12.229 -6.718
198 H THR 24 H THR 24 -1.229 -9.438 -9.782
199 HA THR 24 HA THR 24 -0.327 -10.112 -12.573
200 HB THR 24 HB THR 24 -0.704 -7.733 -13.055
201 HG1 THR 24 HG1 THR 24 -1.859 -7.624 -10.497
202 HG21 THR 24 HG21 THR 24 -2.647 -9.240 -13.410
203 HG22 THR 24 HG22 THR 24 -3.189 -8.932 -11.745
204 HG23 THR 24 HG23 THR 24 -3.144 -7.605 -12.920
205 H ASN 25 H ASN 25 0.821 -9.106 -9.550
206 HA ASN 25 HA ASN 25 2.594 -8.286 -8.669
207 HB2 ASN 25 HB2 ASN 25 4.766 -8.632 -9.447
208 HB3 ASN 25 HB3 ASN 25 3.806 -10.011 -9.964
209 HD21 ASN 25 HD22 ASN 25 4.757 -6.764 -11.247
210 HD22 ASN 25 HD21 ASN 25 5.216 -7.430 -12.833
211 H ALA 26 H ALA 26 0.720 -6.498 -10.392
212 HA ALA 26 HA ALA 26 2.287 -4.118 -10.825
213 HB1 ALA 26 HB1 ALA 26 -0.669 -4.414 -10.136
214 HB2 ALA 26 HB2 ALA 26 0.113 -2.996 -10.862
215 HB3 ALA 26 HB3 ALA 26 0.023 -4.516 -11.770
216 H SER 27 H SER 27 2.097 -2.077 -9.468
217 HA SER 27 HA SER 27 1.875 -2.543 -6.538
218 HB2 SER 27 HB2 SER 27 4.248 -1.309 -7.979
219 HB3 SER 27 HB3 SER 27 3.949 -1.199 -6.233
220 HG SER 27 HG SER 27 4.185 -3.616 -7.699
221 H GLN 28 H GLN 28 1.177 -0.734 -5.365
222 HA GLN 28 HA GLN 28 0.870 1.906 -6.606
223 HB2 GLN 28 HB2 GLN 28 -1.065 0.690 -7.480
224 HB3 GLN 28 HB3 GLN 28 -1.449 0.060 -5.880
225 HG2 GLN 28 HG2 GLN 28 -2.977 1.849 -6.662
226 HG3 GLN 28 HG3 GLN 28 -2.218 2.164 -5.112
227 HE21 GLN 28 HE22 GLN 28 -1.814 2.996 -8.665
228 HE22 GLN 28 HE21 GLN 28 -1.186 4.581 -8.252
229 H PHE 29 H PHE 29 0.322 3.531 -4.943
230 HA PHE 29 HA PHE 29 1.083 2.670 -2.206
231 HB2 PHE 29 HB2 PHE 29 0.815 5.412 -3.449
232 HB3 PHE 29 HB3 PHE 29 1.341 5.076 -1.802
233 HD1 PHE 29 HD1 PHE 29 3.356 3.325 -1.594
234 HD2 PHE 29 HD2 PHE 29 2.505 5.679 -5.103
235 HE1 PHE 29 HE1 PHE 29 5.697 3.028 -2.355
236 HE2 PHE 29 HE2 PHE 29 4.849 5.378 -5.865
237 HZ PHE 29 HZ PHE 29 6.446 4.053 -4.495
238 H GLU 30 H GLU 30 -1.706 4.053 -4.010
239 HA GLU 30 HA GLU 30 -3.240 4.367 -1.583
240 HB2 GLU 30 HB2 GLU 30 -3.794 5.651 -3.522
241 HB3 GLU 30 HB3 GLU 30 -4.112 4.197 -4.473
242 HG2 GLU 30 HG2 GLU 30 -6.190 5.315 -3.775
243 HG3 GLU 30 HG3 GLU 30 -6.077 3.691 -3.110
244 H ARG 31 H ARG 31 -4.385 3.005 -0.488
245 HA ARG 31 HA ARG 31 -3.987 0.130 -0.880
246 HB2 ARG 31 HB2 ARG 31 -5.564 1.528 1.301
247 HB3 ARG 31 HB3 ARG 31 -4.877 -0.062 1.379
248 HG2 ARG 31 HG2 ARG 31 -2.767 0.698 1.951
249 HG3 ARG 31 HG3 ARG 31 -2.816 2.051 0.933
250 HD2 ARG 31 HD2 ARG 31 -3.889 1.736 3.735
251 HD3 ARG 31 HD3 ARG 31 -2.706 2.909 3.146
252 HE ARG 31 HE ARG 31 -5.601 3.077 3.203
253 HH11 ARG 31 HH11 ARG 31 -2.938 4.359 1.182
254 HH12 ARG 31 HH12 ARG 31 -4.139 5.316 0.264
255 HH21 ARG 31 HH21 ARG 31 -6.863 4.393 2.045
256 HH22 ARG 31 HH22 ARG 31 -6.212 5.210 0.604
257 HA PRO 32 HA PRO 32 -7.956 0.245 -2.971
258 HB2 PRO 32 HB2 PRO 32 -7.681 -2.749 -3.418
259 HB3 PRO 32 HB3 PRO 32 -8.151 -1.456 -4.436
260 HG2 PRO 32 HG2 PRO 32 -5.691 -2.385 -4.628
261 HG3 PRO 32 HG3 PRO 32 -5.888 -0.667 -4.699
262 HD2 PRO 32 HD2 PRO 32 -5.222 -2.224 -2.183
263 HD3 PRO 32 HD3 PRO 32 -4.389 -0.783 -2.839
264 H SER 33 H SER 33 -7.315 -1.476 -0.429
265 HA SER 33 HA SER 33 -9.903 -2.401 0.599
266 HB2 SER 33 HB2 SER 33 -8.567 -2.658 2.745
267 HB3 SER 33 HB3 SER 33 -7.913 -3.531 1.345
268 HG SER 33 HG SER 33 -6.166 -2.455 2.217
269 H GLY 34 H GLY 34 -7.826 -0.158 2.395
270 HA2 GLY 34 HA2 GLY 34 -10.002 1.890 2.645
271 HA3 GLY 34 HA3 GLY 34 -9.341 1.091 4.077
Start of MODEL 18
1 H1 LYS 1 H1 LYS 1 -12.248 0.414 -2.114
2 H2 LYS 1 H2 LYS 1 -10.987 -0.541 -2.535
3 H3 LYS 1 H3 LYS 1 -12.459 -0.767 -3.249
4 HA LYS 1 HA LYS 1 -12.338 1.469 -4.209
5 HB2 LYS 1 HB2 LYS 1 -9.396 1.344 -3.540
6 HB3 LYS 1 HB3 LYS 1 -10.279 2.670 -4.275
7 HG2 LYS 1 HG2 LYS 1 -11.326 3.192 -2.108
8 HG3 LYS 1 HG3 LYS 1 -10.621 1.731 -1.386
9 HD2 LYS 1 HD2 LYS 1 -8.328 2.660 -2.105
10 HD3 LYS 1 HD3 LYS 1 -9.139 4.200 -2.362
11 HE2 LYS 1 HE2 LYS 1 -9.657 4.424 -0.044
12 HE3 LYS 1 HE3 LYS 1 -9.363 2.698 0.279
13 HZ1 LYS 1 HZ1 LYS 1 -7.201 4.500 -0.655
14 HZ2 LYS 1 HZ2 LYS 1 -7.475 4.174 0.960
15 HZ3 LYS 1 HZ3 LYS 1 -7.065 2.988 -0.114
16 H LEU 2 H LEU 2 -9.090 0.261 -4.964
17 HA LEU 2 HA LEU 2 -9.938 -0.883 -7.441
18 HB2 LEU 2 HB2 LEU 2 -7.239 -1.340 -6.180
19 HB3 LEU 2 HB3 LEU 2 -7.619 -1.429 -7.790
20 HG LEU 2 HG LEU 2 -7.866 0.929 -8.114
21 HD11 LEU 2 HD11 LEU 2 -7.079 1.243 -5.186
22 HD12 LEU 2 HD12 LEU 2 -6.838 2.493 -6.410
23 HD13 LEU 2 HD13 LEU 2 -8.465 1.966 -6.054
24 HD21 LEU 2 HD21 LEU 2 -5.261 0.007 -6.808
25 HD22 LEU 2 HD22 LEU 2 -5.745 -0.246 -8.489
26 HD23 LEU 2 HD23 LEU 2 -5.437 1.392 -7.907
27 HA PRO 3 HA PRO 3 -10.988 -4.996 -6.831
28 HB2 PRO 3 HB2 PRO 3 -8.332 -5.833 -8.066
29 HB3 PRO 3 HB3 PRO 3 -9.953 -6.485 -8.482
30 HG2 PRO 3 HG2 PRO 3 -8.912 -4.654 -10.076
31 HG3 PRO 3 HG3 PRO 3 -10.578 -4.319 -9.453
32 HD2 PRO 3 HD2 PRO 3 -7.917 -3.399 -8.305
33 HD3 PRO 3 HD3 PRO 3 -9.321 -2.393 -8.685
34 HA PRO 4 HA PRO 4 -9.144 -7.763 -3.735
35 HB2 PRO 4 HB2 PRO 4 -10.201 -10.181 -4.531
36 HB3 PRO 4 HB3 PRO 4 -11.139 -8.937 -3.647
37 HG2 PRO 4 HG2 PRO 4 -11.061 -9.441 -6.634
38 HG3 PRO 4 HG3 PRO 4 -12.497 -9.190 -5.589
39 HD2 PRO 4 HD2 PRO 4 -11.465 -7.178 -7.050
40 HD3 PRO 4 HD3 PRO 4 -12.063 -6.871 -5.398
41 H GLY 5 H GLY 5 -7.226 -8.983 -3.733
42 HA2 GLY 5 HA2 GLY 5 -5.520 -10.336 -4.973
43 HA3 GLY 5 HA3 GLY 5 -5.919 -9.386 -6.391
44 H TRP 6 H TRP 6 -6.142 -6.663 -5.039
45 HA TRP 6 HA TRP 6 -3.312 -6.059 -4.736
46 HB2 TRP 6 HB2 TRP 6 -5.882 -4.543 -4.193
47 HB3 TRP 6 HB3 TRP 6 -4.268 -3.898 -3.967
48 HD1 TRP 6 HD1 TRP 6 -6.762 -4.578 -6.696
49 HE1 TRP 6 HE1 TRP 6 -5.932 -3.471 -8.852
50 HE3 TRP 6 HE3 TRP 6 -2.020 -3.489 -5.218
51 HZ2 TRP 6 HZ2 TRP 6 -3.467 -2.270 -9.829
52 HZ3 TRP 6 HZ3 TRP 6 -0.456 -2.408 -6.737
53 HH2 TRP 6 HH2 TRP 6 -1.144 -1.752 -9.055
54 H GLU 7 H GLU 7 -2.093 -6.496 -2.946
55 HA GLU 7 HA GLU 7 -3.385 -6.462 -0.257
56 HB2 GLU 7 HB2 GLU 7 -2.922 -8.764 -1.565
57 HB3 GLU 7 HB3 GLU 7 -1.298 -8.532 -0.942
58 HG2 GLU 7 HG2 GLU 7 -3.865 -8.607 0.719
59 HG3 GLU 7 HG3 GLU 7 -2.808 -9.989 0.438
60 H LYS 8 H LYS 8 -1.955 -6.009 1.483
61 HA LYS 8 HA LYS 8 -0.248 -3.796 0.980
62 HB2 LYS 8 HB2 LYS 8 -1.336 -3.577 2.922
63 HB3 LYS 8 HB3 LYS 8 -1.375 -5.254 3.305
64 HG2 LYS 8 HG2 LYS 8 1.326 -3.964 3.596
65 HG3 LYS 8 HG3 LYS 8 0.054 -3.319 4.589
66 HD2 LYS 8 HD2 LYS 8 1.273 -5.028 5.787
67 HD3 LYS 8 HD3 LYS 8 -0.435 -5.400 5.666
68 HE2 LYS 8 HE2 LYS 8 1.585 -6.643 3.772
69 HE3 LYS 8 HE3 LYS 8 1.370 -7.274 5.393
70 HZ1 LYS 8 HZ1 LYS 8 -0.055 -8.378 3.602
71 HZ2 LYS 8 HZ2 LYS 8 -0.880 -7.845 4.930
72 HZ3 LYS 8 HZ3 LYS 8 -0.935 -7.088 3.491
73 H ARG 9 H ARG 9 1.894 -3.497 0.941
74 HA ARG 9 HA ARG 9 3.823 -5.575 1.750
75 HB2 ARG 9 HB2 ARG 9 3.829 -4.212 -0.975
76 HB3 ARG 9 HB3 ARG 9 5.154 -5.191 -0.347
77 HG2 ARG 9 HG2 ARG 9 2.358 -6.197 -1.017
78 HG3 ARG 9 HG3 ARG 9 3.805 -6.379 -2.007
79 HD2 ARG 9 HD2 ARG 9 4.862 -7.803 -0.367
80 HD3 ARG 9 HD3 ARG 9 3.543 -7.575 0.774
81 HE ARG 9 HE ARG 9 3.506 -9.182 -1.724
82 HH11 ARG 9 HH11 ARG 9 1.565 -8.010 0.936
83 HH12 ARG 9 HH12 ARG 9 0.433 -9.296 0.960
84 HH21 ARG 9 HH22 ARG 9 1.968 -10.866 -1.839
85 HH22 ARG 9 HH21 ARG 9 0.657 -10.847 -0.684
86 H MET 10 H MET 10 6.145 -4.448 1.621
87 HA MET 10 HA MET 10 5.868 -1.663 2.646
88 HB2 MET 10 HB2 MET 10 5.704 -3.426 4.434
89 HB3 MET 10 HB3 MET 10 7.340 -3.941 4.014
90 HG2 MET 10 HG2 MET 10 8.180 -1.691 4.613
91 HG3 MET 10 HG3 MET 10 6.542 -1.164 5.000
92 HE1 MET 10 HE1 MET 10 7.847 -1.400 8.647
93 HE2 MET 10 HE2 MET 10 8.772 -0.801 7.258
94 HE3 MET 10 HE3 MET 10 7.038 -0.410 7.412
95 H PHE 11 H PHE 11 7.376 -0.293 1.922
96 HA PHE 11 HA PHE 11 9.164 -1.190 -0.105
97 HB2 PHE 11 HB2 PHE 11 7.796 0.915 -0.041
98 HB3 PHE 11 HB3 PHE 11 8.939 1.566 1.122
99 HD1 PHE 11 HD2 PHE 11 11.375 1.899 0.384
100 HD2 PHE 11 HD1 PHE 11 8.232 0.866 -2.380
101 HE1 PHE 11 HE2 PHE 11 12.765 2.715 -1.497
102 HE2 PHE 11 HE1 PHE 11 9.632 1.667 -4.265
103 HZ PHE 11 HZ PHE 11 11.892 2.603 -3.831
104 H ARG 12 H ARG 12 10.882 -2.347 0.466
105 HA ARG 12 HA ARG 12 12.649 -2.229 2.571
106 HB2 ARG 12 HB2 ARG 12 12.721 -3.932 0.897
107 HB3 ARG 12 HB3 ARG 12 13.057 -2.792 -0.386
108 HG2 ARG 12 HG2 ARG 12 15.174 -2.692 1.668
109 HG3 ARG 12 HG3 ARG 12 14.899 -4.339 1.124
110 HD2 ARG 12 HD2 ARG 12 16.650 -3.215 -0.208
111 HD3 ARG 12 HD3 ARG 12 15.274 -3.734 -1.193
112 HE ARG 12 HE ARG 12 15.589 -0.914 -0.188
113 HH11 ARG 12 HH11 ARG 12 15.433 -2.837 -3.089
114 HH12 ARG 12 HH12 ARG 12 14.582 -1.605 -3.990
115 HH21 ARG 12 HH21 ARG 12 14.090 0.328 -1.173
116 HH22 ARG 12 HH22 ARG 12 13.942 0.310 -2.923
117 H SER 13 H SER 13 14.086 -0.906 3.353
118 HA SER 13 HA SER 13 15.760 0.571 3.582
119 HB2 SER 13 HB2 SER 13 15.275 1.716 0.820
120 HB3 SER 13 HB3 SER 13 16.662 1.989 1.873
121 HG SER 13 HG SER 13 17.385 -0.001 1.509
122 H ASN 14 H ASN 14 12.482 1.439 3.112
123 HA ASN 14 HA ASN 14 13.039 3.630 5.001
124 HB2 ASN 14 HB2 ASN 14 11.690 5.297 3.880
125 HB3 ASN 14 HB3 ASN 14 13.053 4.811 2.885
126 HD21 ASN 14 HD22 ASN 14 12.297 5.155 0.779
127 HD22 ASN 14 HD21 ASN 14 10.801 4.441 0.208
128 H GLY 15 H GLY 15 10.736 1.253 3.767
129 HA2 GLY 15 HA2 GLY 15 9.343 0.068 5.170
130 HA3 GLY 15 HA3 GLY 15 9.407 1.322 6.404
131 H THR 16 H THR 16 8.770 2.703 3.329
132 HA THR 16 HA THR 16 6.147 3.555 3.957
133 HB THR 16 HB THR 16 7.265 3.176 1.147
134 HG1 THR 16 HG1 THR 16 8.692 4.398 2.261
135 HG21 THR 16 HG21 THR 16 4.872 3.694 1.139
136 HG22 THR 16 HG22 THR 16 5.124 5.013 2.310
137 HG23 THR 16 HG23 THR 16 5.788 5.136 0.671
138 H VAL 17 H VAL 17 4.365 2.292 4.246
139 HA VAL 17 HA VAL 17 4.191 -0.311 2.936
140 HB VAL 17 HB VAL 17 2.316 1.185 4.766
141 HG11 VAL 17 HG11 VAL 17 0.935 -0.877 4.891
142 HG12 VAL 17 HG12 VAL 17 0.830 -0.112 3.307
143 HG13 VAL 17 HG13 VAL 17 1.844 -1.554 3.526
144 HG21 VAL 17 HG21 VAL 17 3.872 -1.426 5.047
145 HG22 VAL 17 HG22 VAL 17 4.357 0.132 5.754
146 HG23 VAL 17 HG23 VAL 17 2.878 -0.665 6.308
147 H TYR 18 H TYR 18 2.892 -0.933 1.351
148 HA TYR 18 HA TYR 18 1.383 0.970 -0.319
149 HB2 TYR 18 HB2 TYR 18 2.727 0.716 -2.250
150 HB3 TYR 18 HB3 TYR 18 3.810 1.202 -0.976
151 HD1 TYR 18 HD1 TYR 18 5.442 -0.494 -0.041
152 HD2 TYR 18 HD2 TYR 18 2.945 -1.314 -3.454
153 HE1 TYR 18 HE1 TYR 18 6.957 -2.364 -0.715
154 HE2 TYR 18 HE2 TYR 18 4.437 -3.206 -4.096
155 HH TYR 18 HH TYR 18 7.378 -4.002 -2.246
156 H TYR 19 H TYR 19 0.695 -0.561 -2.471
157 HA TYR 19 HA TYR 19 0.097 -3.277 -1.399
158 HB2 TYR 19 HB2 TYR 19 -1.805 -1.265 -2.550
159 HB3 TYR 19 HB3 TYR 19 -2.046 -2.960 -2.893
160 HD1 TYR 19 HD2 TYR 19 -1.186 -1.016 0.254
161 HD2 TYR 19 HD1 TYR 19 -3.711 -3.937 -1.634
162 HE1 TYR 19 HE2 TYR 19 -2.471 -1.265 2.352
163 HE2 TYR 19 HE1 TYR 19 -4.987 -4.205 0.473
164 HH TYR 19 HH TYR 19 -4.416 -1.996 3.271
165 H PHE 20 H PHE 20 -0.064 -4.897 -2.770
166 HA PHE 20 HA PHE 20 1.108 -4.635 -5.502
167 HB2 PHE 20 HB2 PHE 20 2.769 -5.385 -3.889
168 HB3 PHE 20 HB3 PHE 20 1.651 -6.582 -3.238
169 HD1 PHE 20 HD1 PHE 20 3.636 -5.678 -6.276
170 HD2 PHE 20 HD2 PHE 20 1.471 -8.787 -4.192
171 HE1 PHE 20 HE1 PHE 20 4.633 -7.383 -7.769
172 HE2 PHE 20 HE2 PHE 20 2.511 -10.486 -5.676
173 HZ PHE 20 HZ PHE 20 4.087 -9.792 -7.455
174 H ASN 21 H ASN 21 -0.169 -5.519 -7.024
175 HA ASN 21 HA ASN 21 -2.533 -7.091 -6.296
176 HB2 ASN 21 HB2 ASN 21 -2.544 -5.385 -8.146
177 HB3 ASN 21 HB3 ASN 21 -1.428 -6.410 -9.021
178 HD21 ASN 21 HD22 ASN 21 -4.786 -6.005 -7.930
179 HD22 ASN 21 HD21 ASN 21 -5.367 -7.436 -8.768
180 H HIS 22 H HIS 22 -1.954 -9.033 -5.446
181 HA HIS 22 HA HIS 22 0.303 -10.532 -6.392
182 HB2 HIS 22 HB2 HIS 22 -0.139 -11.977 -4.644
183 HB3 HIS 22 HB3 HIS 22 -0.733 -10.445 -4.043
184 HD1 HIS 22 HD1 HIS 22 -2.241 -13.520 -5.832
185 HD2 HIS 22 HD2 HIS 22 -3.146 -10.572 -2.981
186 HE1 HIS 22 HE1 HIS 22 -4.574 -14.113 -4.858
187 H ILE 23 H ILE 23 -2.426 -10.080 -8.119
188 HA ILE 23 HA ILE 23 -2.614 -12.864 -9.166
189 HB ILE 23 HB ILE 23 -4.521 -10.502 -9.401
190 HG12 ILE 23 HG12 ILE 23 -4.631 -13.011 -7.660
191 HG13 ILE 23 HG13 ILE 23 -4.454 -11.351 -7.096
192 HG21 ILE 23 HG21 ILE 23 -4.670 -12.044 -11.344
193 HG22 ILE 23 HG22 ILE 23 -4.920 -13.405 -10.224
194 HG23 ILE 23 HG23 ILE 23 -6.115 -12.093 -10.352
195 HD11 ILE 23 HD11 ILE 23 -6.745 -10.847 -8.048
196 HD12 ILE 23 HD12 ILE 23 -6.937 -12.600 -8.298
197 HD13 ILE 23 HD13 ILE 23 -6.696 -11.965 -6.669
198 H THR 24 H THR 24 -1.701 -9.576 -9.927
199 HA THR 24 HA THR 24 -1.001 -10.341 -12.751
200 HB THR 24 HB THR 24 -1.159 -7.930 -13.260
201 HG1 THR 24 HG1 THR 24 -2.269 -7.723 -10.676
202 HG21 THR 24 HG21 THR 24 -3.578 -7.616 -13.065
203 HG22 THR 24 HG22 THR 24 -3.214 -9.282 -13.564
204 HG23 THR 24 HG23 THR 24 -3.697 -8.936 -11.889
205 H ASN 25 H ASN 25 0.296 -9.032 -9.769
206 HA ASN 25 HA ASN 25 2.317 -8.636 -9.029
207 HB2 ASN 25 HB2 ASN 25 3.537 -8.739 -11.796
208 HB3 ASN 25 HB3 ASN 25 4.381 -8.683 -10.261
209 HD21 ASN 25 HD22 ASN 25 2.498 -10.712 -12.405
210 HD22 ASN 25 HD21 ASN 25 2.974 -12.236 -11.623
211 H ALA 26 H ALA 26 0.316 -6.646 -10.628
212 HA ALA 26 HA ALA 26 1.942 -4.320 -11.030
213 HB1 ALA 26 HB1 ALA 26 -0.342 -4.646 -11.953
214 HB2 ALA 26 HB2 ALA 26 -1.014 -4.512 -10.314
215 HB3 ALA 26 HB3 ALA 26 -0.190 -3.126 -11.054
216 H SER 27 H SER 27 1.973 -2.324 -9.720
217 HA SER 27 HA SER 27 1.895 -2.748 -6.766
218 HB2 SER 27 HB2 SER 27 4.139 -1.771 -6.657
219 HB3 SER 27 HB3 SER 27 4.160 -3.240 -7.654
220 HG SER 27 HG SER 27 3.723 -0.698 -8.809
221 H GLN 28 H GLN 28 1.062 -1.000 -5.645
222 HA GLN 28 HA GLN 28 1.157 1.711 -6.824
223 HB2 GLN 28 HB2 GLN 28 -0.893 0.689 -7.690
224 HB3 GLN 28 HB3 GLN 28 -1.366 0.169 -6.075
225 HG2 GLN 28 HG2 GLN 28 -2.634 2.136 -6.922
226 HG3 GLN 28 HG3 GLN 28 -1.829 2.410 -5.388
227 HE21 GLN 28 HE22 GLN 28 -1.483 3.104 -8.944
228 HE22 GLN 28 HE21 GLN 28 -0.543 4.550 -8.611
229 H PHE 29 H PHE 29 0.967 3.384 -5.221
230 HA PHE 29 HA PHE 29 1.679 2.521 -2.476
231 HB2 PHE 29 HB2 PHE 29 1.862 5.083 -4.037
232 HB3 PHE 29 HB3 PHE 29 1.781 5.131 -2.284
233 HD1 PHE 29 HD2 PHE 29 3.604 2.397 -4.158
234 HD2 PHE 29 HD1 PHE 29 3.929 6.058 -1.883
235 HE1 PHE 29 HE2 PHE 29 6.017 2.025 -3.902
236 HE2 PHE 29 HE1 PHE 29 6.367 5.681 -1.659
237 HZ PHE 29 HZ PHE 29 7.415 3.660 -2.652
238 H GLU 30 H GLU 30 -1.044 4.089 -4.198
239 HA GLU 30 HA GLU 30 -2.510 4.419 -1.700
240 HB2 GLU 30 HB2 GLU 30 -2.900 5.376 -4.234
241 HB3 GLU 30 HB3 GLU 30 -4.174 4.171 -4.134
242 HG2 GLU 30 HG2 GLU 30 -3.654 6.464 -2.175
243 HG3 GLU 30 HG3 GLU 30 -4.880 6.458 -3.438
244 H ARG 31 H ARG 31 -3.977 3.191 -0.887
245 HA ARG 31 HA ARG 31 -3.525 0.246 -1.202
246 HB2 ARG 31 HB2 ARG 31 -4.705 1.847 1.113
247 HB3 ARG 31 HB3 ARG 31 -4.362 0.124 1.090
248 HG2 ARG 31 HG2 ARG 31 -2.369 0.760 2.017
249 HG3 ARG 31 HG3 ARG 31 -1.888 1.113 0.353
250 HD2 ARG 31 HD2 ARG 31 -2.556 3.467 0.722
251 HD3 ARG 31 HD3 ARG 31 -3.105 3.026 2.353
252 HE ARG 31 HE ARG 31 -0.323 3.253 1.384
253 HH11 ARG 31 HH21 ARG 31 -2.391 2.105 4.083
254 HH12 ARG 31 HH22 ARG 31 -1.093 2.281 5.223
255 HH21 ARG 31 HH11 ARG 31 1.319 3.006 2.866
256 HH22 ARG 31 HH12 ARG 31 0.950 2.894 4.577
257 HA PRO 32 HA PRO 32 -7.651 0.427 -2.881
258 HB2 PRO 32 HB2 PRO 32 -7.473 -2.584 -3.239
259 HB3 PRO 32 HB3 PRO 32 -8.059 -1.316 -4.233
260 HG2 PRO 32 HG2 PRO 32 -5.635 -2.247 -4.692
261 HG3 PRO 32 HG3 PRO 32 -5.832 -0.526 -4.757
262 HD2 PRO 32 HD2 PRO 32 -4.859 -2.028 -2.339
263 HD3 PRO 32 HD3 PRO 32 -4.134 -0.594 -3.137
264 H SER 33 H SER 33 -6.765 -1.146 -0.342
265 HA SER 33 HA SER 33 -9.450 -1.140 1.037
266 HB2 SER 33 HB2 SER 33 -8.530 -3.399 1.022
267 HB3 SER 33 HB3 SER 33 -7.031 -2.825 1.775
268 HG SER 33 HG SER 33 -8.456 -3.625 3.350
269 H GLY 34 H GLY 34 -6.284 -1.172 2.742
270 HA2 GLY 34 HA2 GLY 34 -6.148 1.713 3.129
271 HA3 GLY 34 HA3 GLY 34 -6.657 0.791 4.550
Start of MODEL 19
1 H1 LYS 1 H1 LYS 1 -8.416 4.511 -4.417
2 H2 LYS 1 H2 LYS 1 -9.808 5.040 -3.756
3 H3 LYS 1 H3 LYS 1 -9.739 4.708 -5.383
4 HA LYS 1 HA LYS 1 -9.229 2.688 -3.345
5 HB2 LYS 1 HB2 LYS 1 -11.523 1.783 -3.780
6 HB3 LYS 1 HB3 LYS 1 -11.381 3.186 -2.755
7 HG2 LYS 1 HG2 LYS 1 -13.349 3.355 -4.090
8 HG3 LYS 1 HG3 LYS 1 -12.248 4.658 -4.470
9 HD2 LYS 1 HD2 LYS 1 -13.499 3.759 -6.414
10 HD3 LYS 1 HD3 LYS 1 -11.766 3.760 -6.632
11 HE2 LYS 1 HE2 LYS 1 -12.789 1.740 -7.562
12 HE3 LYS 1 HE3 LYS 1 -11.658 1.336 -6.274
13 HZ1 LYS 1 HZ1 LYS 1 -13.464 0.920 -4.784
14 HZ2 LYS 1 HZ2 LYS 1 -14.611 1.409 -5.913
15 HZ3 LYS 1 HZ3 LYS 1 -13.644 0.044 -6.037
16 H LEU 2 H LEU 2 -8.884 0.644 -4.083
17 HA LEU 2 HA LEU 2 -9.186 0.061 -6.925
18 HB2 LEU 2 HB2 LEU 2 -6.574 -0.660 -5.560
19 HB3 LEU 2 HB3 LEU 2 -7.005 -0.892 -7.166
20 HG LEU 2 HG LEU 2 -6.943 1.490 -7.703
21 HD11 LEU 2 HD11 LEU 2 -5.443 2.932 -6.368
22 HD12 LEU 2 HD12 LEU 2 -6.923 2.630 -5.501
23 HD13 LEU 2 HD13 LEU 2 -5.454 1.762 -5.043
24 HD21 LEU 2 HD21 LEU 2 -5.187 -0.135 -8.255
25 HD22 LEU 2 HD22 LEU 2 -4.448 1.401 -7.818
26 HD23 LEU 2 HD23 LEU 2 -4.461 0.057 -6.644
27 HA PRO 3 HA PRO 3 -10.825 -3.837 -5.934
28 HB2 PRO 3 HB2 PRO 3 -8.349 -5.102 -7.182
29 HB3 PRO 3 HB3 PRO 3 -10.052 -5.553 -7.506
30 HG2 PRO 3 HG2 PRO 3 -8.815 -4.019 -9.257
31 HG3 PRO 3 HG3 PRO 3 -10.415 -3.432 -8.651
32 HD2 PRO 3 HD2 PRO 3 -7.641 -2.720 -7.627
33 HD3 PRO 3 HD3 PRO 3 -8.948 -1.620 -8.120
34 HA PRO 4 HA PRO 4 -9.149 -6.706 -2.804
35 HB2 PRO 4 HB2 PRO 4 -10.506 -9.013 -3.435
36 HB3 PRO 4 HB3 PRO 4 -11.268 -7.630 -2.587
37 HG2 PRO 4 HG2 PRO 4 -11.347 -8.266 -5.552
38 HG3 PRO 4 HG3 PRO 4 -12.715 -7.838 -4.473
39 HD2 PRO 4 HD2 PRO 4 -11.568 -5.976 -6.029
40 HD3 PRO 4 HD3 PRO 4 -12.030 -5.579 -4.354
41 H GLY 5 H GLY 5 -7.386 -8.109 -2.808
42 HA2 GLY 5 HA2 GLY 5 -5.884 -9.706 -4.050
43 HA3 GLY 5 HA3 GLY 5 -6.245 -8.768 -5.490
44 H TRP 6 H TRP 6 -6.145 -6.023 -4.091
45 HA TRP 6 HA TRP 6 -3.254 -5.686 -4.060
46 HB2 TRP 6 HB2 TRP 6 -5.653 -3.996 -3.382
47 HB3 TRP 6 HB3 TRP 6 -3.985 -3.445 -3.242
48 HD1 TRP 6 HD1 TRP 6 -6.626 -3.998 -5.900
49 HE1 TRP 6 HE1 TRP 6 -5.822 -2.866 -8.027
50 HE3 TRP 6 HE3 TRP 6 -1.819 -3.151 -4.544
51 HZ2 TRP 6 HZ2 TRP 6 -3.306 -1.910 -9.135
52 HZ3 TRP 6 HZ3 TRP 6 -0.247 -2.174 -6.099
53 HH2 TRP 6 HH2 TRP 6 -0.945 -1.499 -8.422
54 H GLU 7 H GLU 7 -1.877 -6.018 -2.393
55 HA GLU 7 HA GLU 7 -2.873 -6.118 0.411
56 HB2 GLU 7 HB2 GLU 7 -2.517 -8.331 -1.082
57 HB3 GLU 7 HB3 GLU 7 -0.845 -8.106 -0.605
58 HG2 GLU 7 HG2 GLU 7 -3.230 -8.313 1.299
59 HG3 GLU 7 HG3 GLU 7 -2.210 -9.668 0.821
60 H LYS 8 H LYS 8 -1.252 -5.714 2.006
61 HA LYS 8 HA LYS 8 0.442 -3.498 1.459
62 HB2 LYS 8 HB2 LYS 8 -0.342 -3.434 3.568
63 HB3 LYS 8 HB3 LYS 8 -0.363 -5.137 3.804
64 HG2 LYS 8 HG2 LYS 8 2.381 -3.897 3.796
65 HG3 LYS 8 HG3 LYS 8 1.284 -3.314 5.008
66 HD2 LYS 8 HD2 LYS 8 2.631 -5.133 5.876
67 HD3 LYS 8 HD3 LYS 8 0.914 -5.457 6.000
68 HE2 LYS 8 HE2 LYS 8 2.571 -6.598 3.728
69 HE3 LYS 8 HE3 LYS 8 2.587 -7.346 5.311
70 HZ1 LYS 8 HZ1 LYS 8 0.858 -8.268 3.680
71 HZ2 LYS 8 HZ2 LYS 8 0.278 -7.837 5.165
72 HZ3 LYS 8 HZ3 LYS 8 0.023 -6.959 3.815
73 H ARG 9 H ARG 9 2.582 -3.211 1.202
74 HA ARG 9 HA ARG 9 4.509 -5.410 1.632
75 HB2 ARG 9 HB2 ARG 9 4.252 -3.997 -1.060
76 HB3 ARG 9 HB3 ARG 9 5.647 -4.960 -0.587
77 HG2 ARG 9 HG2 ARG 9 2.819 -6.020 -0.911
78 HG3 ARG 9 HG3 ARG 9 4.140 -6.176 -2.076
79 HD2 ARG 9 HD2 ARG 9 5.418 -7.564 -0.552
80 HD3 ARG 9 HD3 ARG 9 4.198 -7.395 0.706
81 HE ARG 9 HE ARG 9 4.027 -9.026 -1.755
82 HH11 ARG 9 HH11 ARG 9 2.163 -7.751 0.909
83 HH12 ARG 9 HH12 ARG 9 1.053 -9.052 1.037
84 HH21 ARG 9 HH21 ARG 9 2.501 -10.729 -1.746
85 HH22 ARG 9 HH22 ARG 9 1.214 -10.656 -0.566
86 H MET 10 H MET 10 6.850 -4.417 1.259
87 HA MET 10 HA MET 10 6.814 -1.730 2.552
88 HB2 MET 10 HB2 MET 10 7.178 -3.433 4.187
89 HB3 MET 10 HB3 MET 10 8.473 -4.158 3.227
90 HG2 MET 10 HG2 MET 10 8.786 -1.245 3.799
91 HG3 MET 10 HG3 MET 10 8.797 -2.244 5.206
92 HE1 MET 10 HE1 MET 10 10.267 -4.909 4.552
93 HE2 MET 10 HE2 MET 10 11.965 -4.460 4.810
94 HE3 MET 10 HE3 MET 10 10.712 -3.847 5.909
95 H PHE 11 H PHE 11 8.078 -0.155 1.791
96 HA PHE 11 HA PHE 11 9.698 -0.578 -0.577
97 HB2 PHE 11 HB2 PHE 11 8.526 1.520 -0.057
98 HB3 PHE 11 HB3 PHE 11 9.673 1.821 1.243
99 HD1 PHE 11 HD1 PHE 11 11.752 0.499 -1.325
100 HD2 PHE 11 HD2 PHE 11 9.309 3.951 -0.396
101 HE1 PHE 11 HE1 PHE 11 13.094 1.862 -2.840
102 HE2 PHE 11 HE2 PHE 11 10.675 5.310 -1.950
103 HZ PHE 11 HZ PHE 11 12.576 4.272 -3.173
104 H ARG 12 H ARG 12 10.997 -2.196 -0.041
105 HA ARG 12 HA ARG 12 12.969 -2.607 1.815
106 HB2 ARG 12 HB2 ARG 12 13.058 -3.013 -1.205
107 HB3 ARG 12 HB3 ARG 12 14.157 -3.803 -0.073
108 HG2 ARG 12 HG2 ARG 12 12.478 -5.151 0.870
109 HG3 ARG 12 HG3 ARG 12 11.164 -4.142 0.325
110 HD2 ARG 12 HD2 ARG 12 12.849 -5.952 -1.408
111 HD3 ARG 12 HD3 ARG 12 11.180 -6.218 -0.912
112 HE ARG 12 HE ARG 12 12.104 -4.715 -3.155
113 HH11 ARG 12 HH21 ARG 12 9.405 -4.155 -0.845
114 HH12 ARG 12 HH22 ARG 12 8.333 -3.900 -2.199
115 HH21 ARG 12 HH11 ARG 12 10.593 -4.033 -4.678
116 HH22 ARG 12 HH12 ARG 12 9.002 -3.596 -4.111
117 H SER 13 H SER 13 14.800 -1.704 2.398
118 HA SER 13 HA SER 13 16.749 -0.532 2.450
119 HB2 SER 13 HB2 SER 13 16.109 1.313 0.175
120 HB3 SER 13 HB3 SER 13 17.674 0.805 0.819
121 HG SER 13 HG SER 13 15.816 -0.622 -0.735
122 H ASN 14 H ASN 14 13.538 0.775 2.613
123 HA ASN 14 HA ASN 14 14.685 2.659 4.594
124 HB2 ASN 14 HB2 ASN 14 13.304 4.539 3.872
125 HB3 ASN 14 HB3 ASN 14 14.465 4.063 2.639
126 HD21 ASN 14 HD22 ASN 14 13.682 3.678 0.577
127 HD22 ASN 14 HD21 ASN 14 11.982 3.505 0.216
128 H GLY 15 H GLY 15 11.756 0.907 3.498
129 HA2 GLY 15 HA2 GLY 15 10.641 -0.359 5.260
130 HA3 GLY 15 HA3 GLY 15 10.878 0.975 6.366
131 H THR 16 H THR 16 9.986 2.537 3.565
132 HA THR 16 HA THR 16 7.445 3.279 4.621
133 HB THR 16 HB THR 16 8.388 3.652 1.747
134 HG1 THR 16 HG1 THR 16 9.990 4.454 2.935
135 HG21 THR 16 HG21 THR 16 6.979 5.663 1.871
136 HG22 THR 16 HG22 THR 16 6.020 4.201 2.201
137 HG23 THR 16 HG23 THR 16 6.522 5.259 3.541
138 H VAL 17 H VAL 17 5.650 1.651 4.690
139 HA VAL 17 HA VAL 17 5.605 -0.227 2.679
140 HB VAL 17 HB VAL 17 3.683 -0.949 3.882
141 HG11 VAL 17 HG11 VAL 17 5.894 -1.456 4.854
142 HG12 VAL 17 HG12 VAL 17 5.718 -0.045 5.920
143 HG13 VAL 17 HG13 VAL 17 4.590 -1.407 6.051
144 HG21 VAL 17 HG21 VAL 17 3.790 1.642 5.367
145 HG22 VAL 17 HG22 VAL 17 2.523 1.074 4.246
146 HG23 VAL 17 HG23 VAL 17 2.756 0.244 5.793
147 H TYR 18 H TYR 18 3.725 -0.821 1.469
148 HA TYR 18 HA TYR 18 2.102 1.274 0.244
149 HB2 TYR 18 HB2 TYR 18 3.083 1.181 -1.923
150 HB3 TYR 18 HB3 TYR 18 4.345 1.589 -0.798
151 HD1 TYR 18 HD1 TYR 18 6.154 -0.069 -0.265
152 HD2 TYR 18 HD2 TYR 18 3.184 -0.773 -3.294
153 HE1 TYR 18 HE1 TYR 18 7.605 -1.823 -1.305
154 HE2 TYR 18 HE2 TYR 18 4.572 -2.563 -4.282
155 HH TYR 18 HH TYR 18 6.486 -3.677 -4.142
156 H TYR 19 H TYR 19 1.200 -0.130 -2.024
157 HA TYR 19 HA TYR 19 0.529 -2.835 -0.977
158 HB2 TYR 19 HB2 TYR 19 -1.322 -0.646 -1.784
159 HB3 TYR 19 HB3 TYR 19 -1.720 -2.261 -2.306
160 HD1 TYR 19 HD1 TYR 19 -0.595 -0.598 0.949
161 HD2 TYR 19 HD2 TYR 19 -3.191 -3.446 -0.963
162 HE1 TYR 19 HE1 TYR 19 -1.449 -1.287 3.127
163 HE2 TYR 19 HE2 TYR 19 -4.084 -4.125 1.212
164 HH TYR 19 HH TYR 19 -3.822 -3.941 3.507
165 H PHE 20 H PHE 20 0.102 -4.394 -2.365
166 HA PHE 20 HA PHE 20 1.169 -4.206 -5.150
167 HB2 PHE 20 HB2 PHE 20 2.896 -4.978 -3.635
168 HB3 PHE 20 HB3 PHE 20 1.769 -6.096 -2.861
169 HD1 PHE 20 HD1 PHE 20 3.640 -5.458 -6.020
170 HD2 PHE 20 HD2 PHE 20 1.399 -8.337 -3.694
171 HE1 PHE 20 HE1 PHE 20 4.455 -7.286 -7.483
172 HE2 PHE 20 HE2 PHE 20 2.268 -10.153 -5.135
173 HZ PHE 20 HZ PHE 20 3.781 -9.641 -7.023
174 H ASN 21 H ASN 21 -0.177 -5.151 -6.610
175 HA ASN 21 HA ASN 21 -2.544 -6.607 -5.688
176 HB2 ASN 21 HB2 ASN 21 -2.490 -5.022 -7.659
177 HB3 ASN 21 HB3 ASN 21 -1.562 -6.243 -8.517
178 HD21 ASN 21 HD22 ASN 21 -4.758 -5.206 -7.728
179 HD22 ASN 21 HD21 ASN 21 -5.536 -6.724 -8.169
180 H HIS 22 H HIS 22 -2.120 -8.546 -4.773
181 HA HIS 22 HA HIS 22 0.059 -10.204 -5.660
182 HB2 HIS 22 HB2 HIS 22 -0.390 -11.483 -3.827
183 HB3 HIS 22 HB3 HIS 22 -1.024 -9.943 -3.308
184 HD1 HIS 22 HD1 HIS 22 -2.486 -13.092 -5.012
185 HD2 HIS 22 HD2 HIS 22 -3.432 -10.076 -2.247
186 HE1 HIS 22 HE1 HIS 22 -4.815 -13.682 -4.028
187 H ILE 23 H ILE 23 -2.759 -9.640 -7.286
188 HA ILE 23 HA ILE 23 -3.014 -12.391 -8.369
189 HB ILE 23 HB ILE 23 -4.952 -10.072 -8.698
190 HG12 ILE 23 HG12 ILE 23 -5.022 -12.293 -6.603
191 HG13 ILE 23 HG13 ILE 23 -4.788 -10.577 -6.279
192 HG21 ILE 23 HG21 ILE 23 -6.530 -11.788 -9.361
193 HG22 ILE 23 HG22 ILE 23 -5.090 -11.938 -10.359
194 HG23 ILE 23 HG23 ILE 23 -5.348 -13.069 -9.008
195 HD11 ILE 23 HD11 ILE 23 -7.345 -11.883 -7.264
196 HD12 ILE 23 HD12 ILE 23 -7.043 -11.091 -5.717
197 HD13 ILE 23 HD13 ILE 23 -7.086 -10.120 -7.196
198 H THR 24 H THR 24 -2.232 -9.016 -9.242
199 HA THR 24 HA THR 24 -1.566 -9.915 -12.025
200 HB THR 24 HB THR 24 -1.852 -7.676 -12.725
201 HG1 THR 24 HG1 THR 24 -2.557 -6.087 -11.250
202 HG21 THR 24 HG21 THR 24 -4.210 -8.273 -10.888
203 HG22 THR 24 HG22 THR 24 -4.215 -7.260 -12.348
204 HG23 THR 24 HG23 THR 24 -3.955 -9.009 -12.485
205 H ASN 25 H ASN 25 -0.067 -8.770 -9.205
206 HA ASN 25 HA ASN 25 1.920 -8.235 -8.555
207 HB2 ASN 25 HB2 ASN 25 3.730 -9.116 -9.428
208 HB3 ASN 25 HB3 ASN 25 2.655 -9.838 -10.612
209 HD21 ASN 25 HD22 ASN 25 2.224 -8.077 -12.556
210 HD22 ASN 25 HD21 ASN 25 3.769 -7.435 -13.160
211 H ALA 26 H ALA 26 0.035 -6.240 -10.249
212 HA ALA 26 HA ALA 26 1.722 -3.988 -10.723
213 HB1 ALA 26 HB1 ALA 26 -1.193 -4.090 -9.839
214 HB2 ALA 26 HB2 ALA 26 -0.374 -2.705 -10.593
215 HB3 ALA 26 HB3 ALA 26 -0.607 -4.199 -11.516
216 H SER 27 H SER 27 1.879 -1.947 -9.417
217 HA SER 27 HA SER 27 1.838 -2.354 -6.463
218 HB2 SER 27 HB2 SER 27 4.135 -1.309 -8.135
219 HB3 SER 27 HB3 SER 27 3.991 -1.091 -6.379
220 HG SER 27 HG SER 27 3.925 -3.601 -7.703
221 H GLN 28 H GLN 28 1.314 -0.553 -5.237
222 HA GLN 28 HA GLN 28 0.847 2.094 -6.441
223 HB2 GLN 28 HB2 GLN 28 -1.149 0.828 -7.061
224 HB3 GLN 28 HB3 GLN 28 -1.298 0.172 -5.430
225 HG2 GLN 28 HG2 GLN 28 -2.978 1.899 -5.955
226 HG3 GLN 28 HG3 GLN 28 -2.015 2.242 -4.538
227 HE21 GLN 28 HE22 GLN 28 -2.233 3.074 -8.098
228 HE22 GLN 28 HE21 GLN 28 -1.577 4.675 -7.805
229 H PHE 29 H PHE 29 0.515 3.724 -4.697
230 HA PHE 29 HA PHE 29 1.431 2.754 -2.031
231 HB2 PHE 29 HB2 PHE 29 1.714 5.365 -3.446
232 HB3 PHE 29 HB3 PHE 29 1.571 5.352 -1.693
233 HD1 PHE 29 HD1 PHE 29 3.411 3.244 -4.272
234 HD2 PHE 29 HD2 PHE 29 3.570 5.318 -0.491
235 HE1 PHE 29 HE1 PHE 29 5.777 2.584 -4.006
236 HE2 PHE 29 HE2 PHE 29 5.937 4.646 -0.234
237 HZ PHE 29 HZ PHE 29 7.050 3.280 -1.989
238 H GLU 30 H GLU 30 -1.451 4.107 -3.621
239 HA GLU 30 HA GLU 30 -2.865 4.575 -1.148
240 HB2 GLU 30 HB2 GLU 30 -3.652 5.270 -3.440
241 HB3 GLU 30 HB3 GLU 30 -4.073 3.578 -3.745
242 HG2 GLU 30 HG2 GLU 30 -5.405 3.970 -1.387
243 HG3 GLU 30 HG3 GLU 30 -5.343 5.627 -1.935
244 H ARG 31 H ARG 31 -3.999 3.222 0.092
245 HA ARG 31 HA ARG 31 -3.508 0.292 -0.026
246 HB2 ARG 31 HB2 ARG 31 -2.903 1.455 1.986
247 HB3 ARG 31 HB3 ARG 31 -4.515 2.142 2.175
248 HG2 ARG 31 HG2 ARG 31 -4.513 -0.811 1.999
249 HG3 ARG 31 HG3 ARG 31 -3.446 -0.196 3.259
250 HD2 ARG 31 HD2 ARG 31 -5.651 -0.726 4.172
251 HD3 ARG 31 HD3 ARG 31 -5.188 0.965 4.405
252 HE ARG 31 HE ARG 31 -6.553 1.353 2.238
253 HH11 ARG 31 HH12 ARG 31 -7.666 -1.201 4.411
254 HH12 ARG 31 HH11 ARG 31 -9.124 -1.363 3.440
255 HH21 ARG 31 HH21 ARG 31 -8.318 1.129 1.273
256 HH22 ARG 31 HH22 ARG 31 -9.571 0.020 1.854
257 HA PRO 32 HA PRO 32 -7.750 0.427 -1.696
258 HB2 PRO 32 HB2 PRO 32 -7.230 -2.210 -2.919
259 HB3 PRO 32 HB3 PRO 32 -7.602 -0.615 -3.626
260 HG2 PRO 32 HG2 PRO 32 -5.251 -1.728 -3.959
261 HG3 PRO 32 HG3 PRO 32 -5.413 -0.022 -3.835
262 HD2 PRO 32 HD2 PRO 32 -4.844 -1.948 -1.521
263 HD3 PRO 32 HD3 PRO 32 -3.919 -0.494 -1.939
264 H SER 33 H SER 33 -9.456 -1.533 -2.137
265 HA SER 33 HA SER 33 -9.488 -3.714 -0.325
266 HB2 SER 33 HB2 SER 33 -11.425 -1.465 0.387
267 HB3 SER 33 HB3 SER 33 -11.514 -3.130 1.003
268 HG SER 33 HG SER 33 -9.011 -2.063 1.226
269 H GLY 34 H GLY 34 -11.672 -1.450 -2.165
270 HA2 GLY 34 HA2 GLY 34 -12.294 -3.433 -4.114
271 HA3 GLY 34 HA3 GLY 34 -13.675 -3.058 -3.064