Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
24860 | 2k57 RC | 15825 | cing | 1-original | 4 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 H1 MET 1 H1 MET 1 -12.278 9.027 0.438
2 H2 MET 1 H2 MET 1 -13.853 8.464 0.181
3 H3 MET 1 H3 MET 1 -13.538 10.125 0.187
4 HA MET 1 HA MET 1 -13.856 9.299 -2.055
5 HB2 MET 1 HB2 MET 1 -12.395 11.235 -1.672
6 HB3 MET 1 HB3 MET 1 -11.024 10.167 -1.409
7 HG2 MET 1 HG2 MET 1 -11.064 11.225 -3.650
8 HG3 MET 1 HG3 MET 1 -11.044 9.462 -3.700
9 HE1 MET 1 HE1 MET 1 -14.826 12.009 -4.464
10 HE2 MET 1 HE2 MET 1 -13.227 12.712 -4.208
11 HE3 MET 1 HE3 MET 1 -14.046 11.877 -2.888
12 H ALA 2 H ALA 2 -13.346 7.846 -3.693
13 HA ALA 2 HA ALA 2 -11.542 5.622 -2.946
14 HB1 ALA 2 HB1 ALA 2 -13.069 4.071 -4.054
15 HB2 ALA 2 HB2 ALA 2 -14.176 5.400 -4.407
16 HB3 ALA 2 HB3 ALA 2 -13.868 4.926 -2.735
17 H SER 3 H SER 3 -10.039 5.075 -4.395
18 HA SER 3 HA SER 3 -10.353 5.520 -7.232
19 HB2 SER 3 HB2 SER 3 -8.276 7.092 -5.669
20 HB3 SER 3 HB3 SER 3 -8.237 6.885 -7.418
21 HG SER 3 HG SER 3 -10.676 7.731 -6.692
22 HA PRO 4 HA PRO 4 -7.860 1.870 -7.004
23 HB2 PRO 4 HB2 PRO 4 -7.233 1.561 -9.620
24 HB3 PRO 4 HB3 PRO 4 -8.861 1.284 -8.993
25 HG2 PRO 4 HG2 PRO 4 -7.764 3.694 -10.402
26 HG3 PRO 4 HG3 PRO 4 -9.316 2.868 -10.642
27 HD2 PRO 4 HD2 PRO 4 -9.072 5.142 -9.168
28 HD3 PRO 4 HD3 PRO 4 -10.293 3.900 -8.825
29 H THR 5 H THR 5 -5.900 1.936 -6.071
30 HA THR 5 HA THR 5 -3.679 3.318 -7.469
31 HB THR 5 HB THR 5 -4.066 3.139 -4.463
32 HG1 THR 5 HG1 THR 5 -4.523 5.211 -6.348
33 HG21 THR 5 HG21 THR 5 -1.935 4.534 -6.095
34 HG22 THR 5 HG22 THR 5 -1.700 3.106 -5.085
35 HG23 THR 5 HG23 THR 5 -2.124 4.650 -4.346
36 H VAL 6 H VAL 6 -2.056 1.956 -8.027
37 HA VAL 6 HA VAL 6 -1.890 -0.654 -6.690
38 HB VAL 6 HB VAL 6 -2.073 -0.757 -9.118
39 HG11 VAL 6 HG11 VAL 6 -1.065 1.391 -9.705
40 HG12 VAL 6 HG12 VAL 6 -0.313 0.070 -10.600
41 HG13 VAL 6 HG13 VAL 6 0.521 0.788 -9.222
42 HG21 VAL 6 HG21 VAL 6 -0.131 -2.190 -9.592
43 HG22 VAL 6 HG22 VAL 6 -0.812 -2.514 -7.996
44 HG23 VAL 6 HG23 VAL 6 0.671 -1.571 -8.148
45 H ILE 7 H ILE 7 -0.495 -0.841 -5.075
46 HA ILE 7 HA ILE 7 1.866 0.891 -4.938
47 HB ILE 7 HB ILE 7 0.726 -1.020 -2.881
48 HG12 ILE 7 HG12 ILE 7 0.652 2.010 -3.048
49 HG13 ILE 7 HG13 ILE 7 -0.716 0.928 -3.287
50 HG21 ILE 7 HG21 ILE 7 2.291 0.035 -1.304
51 HG22 ILE 7 HG22 ILE 7 2.993 0.967 -2.628
52 HG23 ILE 7 HG23 ILE 7 3.137 -0.793 -2.611
53 HD11 ILE 7 HD11 ILE 7 -0.580 0.223 -0.964
54 HD12 ILE 7 HD12 ILE 7 -0.752 1.972 -1.088
55 HD13 ILE 7 HD13 ILE 7 0.822 1.266 -0.720
56 H THR 8 H THR 8 3.735 0.186 -5.718
57 HA THR 8 HA THR 8 4.201 -2.697 -6.078
58 HB THR 8 HB THR 8 5.853 -0.392 -7.150
59 HG1 THR 8 HG1 THR 8 4.246 -1.794 -8.923
60 HG21 THR 8 HG21 THR 8 7.036 -2.536 -7.079
61 HG22 THR 8 HG22 THR 8 6.686 -2.068 -8.743
62 HG23 THR 8 HG23 THR 8 5.712 -3.309 -7.953
63 H LEU 9 H LEU 9 5.532 -3.768 -4.719
64 HA LEU 9 HA LEU 9 6.907 -2.301 -2.636
65 HB2 LEU 9 HB2 LEU 9 6.761 -5.284 -3.095
66 HB3 LEU 9 HB3 LEU 9 7.347 -4.488 -1.642
67 HG LEU 9 HG LEU 9 4.502 -4.455 -2.674
68 HD11 LEU 9 HD11 LEU 9 5.121 -6.583 -1.689
69 HD12 LEU 9 HD12 LEU 9 4.011 -5.716 -0.629
70 HD13 LEU 9 HD13 LEU 9 5.734 -5.766 -0.252
71 HD21 LEU 9 HD21 LEU 9 3.960 -3.260 -0.596
72 HD22 LEU 9 HD22 LEU 9 5.042 -2.324 -1.627
73 HD23 LEU 9 HD23 LEU 9 5.679 -3.161 -0.210
74 H ASN 10 H ASN 10 9.091 -3.309 -1.920
75 HA ASN 10 HA ASN 10 11.067 -2.388 -3.616
76 HB2 ASN 10 HB2 ASN 10 11.379 -2.627 -1.217
77 HB3 ASN 10 HB3 ASN 10 11.276 -4.376 -1.344
78 HD21 ASN 10 HD21 ASN 10 13.254 -1.576 -1.934
79 HD22 ASN 10 HD22 ASN 10 14.731 -2.437 -2.182
80 H ASP 11 H ASP 11 10.035 -5.771 -3.162
81 HA ASP 11 HA ASP 11 12.027 -6.835 -4.935
82 HB2 ASP 11 HB2 ASP 11 10.884 -8.959 -4.608
83 HB3 ASP 11 HB3 ASP 11 11.045 -8.131 -3.062
84 H GLY 12 H GLY 12 8.859 -5.504 -5.336
85 HA2 GLY 12 HA2 GLY 12 8.281 -4.873 -7.669
86 HA3 GLY 12 HA3 GLY 12 8.753 -6.498 -8.130
87 H ARG 13 H ARG 13 7.299 -7.079 -5.316
88 HA ARG 13 HA ARG 13 4.891 -8.087 -6.342
89 HB2 ARG 13 HB2 ARG 13 5.844 -8.869 -4.236
90 HB3 ARG 13 HB3 ARG 13 5.605 -7.287 -3.506
91 HG2 ARG 13 HG2 ARG 13 3.170 -7.564 -3.725
92 HG3 ARG 13 HG3 ARG 13 3.424 -9.167 -4.419
93 HD2 ARG 13 HD2 ARG 13 4.450 -9.935 -2.361
94 HD3 ARG 13 HD3 ARG 13 4.346 -8.315 -1.669
95 HE ARG 13 HE ARG 13 1.782 -9.237 -2.437
96 HH11 ARG 13 HH11 ARG 13 4.194 -9.719 -0.026
97 HH12 ARG 13 HH12 ARG 13 3.047 -10.145 1.195
98 HH21 ARG 13 HH21 ARG 13 0.315 -9.796 -0.873
99 HH22 ARG 13 HH22 ARG 13 0.865 -10.186 0.719
100 H GLU 14 H GLU 14 3.186 -6.983 -7.134
101 HA GLU 14 HA GLU 14 2.680 -4.243 -6.162
102 HB2 GLU 14 HB2 GLU 14 1.706 -5.579 -8.701
103 HB3 GLU 14 HB3 GLU 14 1.437 -3.900 -8.251
104 HG2 GLU 14 HG2 GLU 14 3.879 -3.532 -8.313
105 HG3 GLU 14 HG3 GLU 14 4.088 -5.192 -8.859
106 H ILE 15 H ILE 15 0.891 -3.793 -5.018
107 HA ILE 15 HA ILE 15 -1.382 -5.687 -5.138
108 HB ILE 15 HB ILE 15 -0.581 -4.020 -2.736
109 HG12 ILE 15 HG12 ILE 15 -0.289 -7.008 -3.207
110 HG13 ILE 15 HG13 ILE 15 1.033 -5.848 -3.155
111 HG21 ILE 15 HG21 ILE 15 -2.706 -6.149 -3.063
112 HG22 ILE 15 HG22 ILE 15 -2.987 -4.417 -2.882
113 HG23 ILE 15 HG23 ILE 15 -2.289 -5.340 -1.552
114 HD11 ILE 15 HD11 ILE 15 -0.793 -6.560 -0.870
115 HD12 ILE 15 HD12 ILE 15 0.518 -5.382 -0.809
116 HD13 ILE 15 HD13 ILE 15 0.875 -7.087 -1.082
117 H GLN 16 H GLN 16 -3.348 -4.836 -5.602
118 HA GLN 16 HA GLN 16 -3.452 -1.965 -6.201
119 HB2 GLN 16 HB2 GLN 16 -5.240 -4.240 -7.095
120 HB3 GLN 16 HB3 GLN 16 -5.413 -2.564 -7.601
121 HG2 GLN 16 HG2 GLN 16 -3.297 -2.624 -8.738
122 HG3 GLN 16 HG3 GLN 16 -2.950 -4.230 -8.097
123 HE21 GLN 16 HE21 GLN 16 -4.801 -2.412 -10.400
124 HE22 GLN 16 HE22 GLN 16 -5.330 -3.755 -11.344
125 H ALA 17 H ALA 17 -4.588 -0.607 -5.001
126 HA ALA 17 HA ALA 17 -6.488 -1.653 -3.012
127 HB1 ALA 17 HB1 ALA 17 -6.106 0.430 -1.794
128 HB2 ALA 17 HB2 ALA 17 -5.056 1.009 -3.089
129 HB3 ALA 17 HB3 ALA 17 -4.582 -0.392 -2.128
130 H VAL 18 H VAL 18 -8.525 -0.641 -2.703
131 HA VAL 18 HA VAL 18 -9.675 0.511 -5.119
132 HB VAL 18 HB VAL 18 -11.844 0.354 -3.925
133 HG11 VAL 18 HG11 VAL 18 -10.188 -2.176 -3.877
134 HG12 VAL 18 HG12 VAL 18 -11.063 -1.528 -5.264
135 HG13 VAL 18 HG13 VAL 18 -11.951 -2.104 -3.854
136 HG21 VAL 18 HG21 VAL 18 -10.169 -0.772 -1.673
137 HG22 VAL 18 HG22 VAL 18 -11.931 -0.832 -1.752
138 HG23 VAL 18 HG23 VAL 18 -11.106 0.722 -1.644
139 H ASP 19 H ASP 19 -8.460 1.669 -2.129
140 HA ASP 19 HA ASP 19 -9.118 4.378 -2.972
141 HB2 ASP 19 HB2 ASP 19 -9.544 4.960 -0.485
142 HB3 ASP 19 HB3 ASP 19 -10.835 4.210 -1.412
143 H THR 20 H THR 20 -7.904 5.959 -1.268
144 HA THR 20 HA THR 20 -5.169 5.416 -1.979
145 HB THR 20 HB THR 20 -4.704 7.691 -1.108
146 HG1 THR 20 HG1 THR 20 -6.038 8.383 0.379
147 HG21 THR 20 HG21 THR 20 -5.486 7.399 -3.423
148 HG22 THR 20 HG22 THR 20 -6.050 8.922 -2.735
149 HG23 THR 20 HG23 THR 20 -7.156 7.555 -2.875
150 HA PRO 21 HA PRO 21 -3.820 3.757 1.879
151 HB2 PRO 21 HB2 PRO 21 -1.152 4.006 1.612
152 HB3 PRO 21 HB3 PRO 21 -2.096 2.903 0.603
153 HG2 PRO 21 HG2 PRO 21 -1.077 5.652 -0.041
154 HG3 PRO 21 HG3 PRO 21 -1.041 4.186 -1.040
155 HD2 PRO 21 HD2 PRO 21 -2.916 6.150 -1.332
156 HD3 PRO 21 HD3 PRO 21 -3.228 4.446 -1.718
157 H LYS 22 H LYS 22 -2.901 4.230 3.908
158 HA LYS 22 HA LYS 22 -2.365 7.081 4.479
159 HB2 LYS 22 HB2 LYS 22 -4.369 6.511 5.606
160 HB3 LYS 22 HB3 LYS 22 -3.752 4.937 6.088
161 HG2 LYS 22 HG2 LYS 22 -2.235 5.982 7.675
162 HG3 LYS 22 HG3 LYS 22 -2.761 7.584 7.157
163 HD2 LYS 22 HD2 LYS 22 -4.964 7.223 8.036
164 HD3 LYS 22 HD3 LYS 22 -4.626 5.518 8.341
165 HE2 LYS 22 HE2 LYS 22 -3.156 7.790 9.685
166 HE3 LYS 22 HE3 LYS 22 -4.568 6.992 10.378
167 HZ1 LYS 22 HZ1 LYS 22 -2.064 5.581 9.636
168 HZ2 LYS 22 HZ2 LYS 22 -3.385 4.932 10.462
169 HZ3 LYS 22 HZ3 LYS 22 -2.419 6.110 11.200
170 H TYR 23 H TYR 23 -0.311 7.510 5.041
171 HA TYR 23 HA TYR 23 1.474 5.438 6.003
172 HB2 TYR 23 HB2 TYR 23 2.398 7.123 4.534
173 HB3 TYR 23 HB3 TYR 23 1.841 8.417 5.585
174 HD1 TYR 23 HD1 TYR 23 3.893 5.291 6.025
175 HD2 TYR 23 HD2 TYR 23 3.538 9.477 6.709
176 HE1 TYR 23 HE1 TYR 23 6.066 5.285 7.180
177 HE2 TYR 23 HE2 TYR 23 5.705 9.481 7.860
178 HH TYR 23 HH TYR 23 7.219 8.040 8.945
179 H ASP 24 H ASP 24 1.471 4.808 8.068
180 HA ASP 24 HA ASP 24 0.312 6.580 10.098
181 HB2 ASP 24 HB2 ASP 24 -0.653 4.320 9.803
182 HB3 ASP 24 HB3 ASP 24 0.905 3.611 10.221
183 H GLU 25 H GLU 25 1.795 7.849 11.024
184 HA GLU 25 HA GLU 25 4.549 7.353 11.263
185 HB2 GLU 25 HB2 GLU 25 3.544 9.590 11.339
186 HB3 GLU 25 HB3 GLU 25 2.769 9.205 12.869
187 HG2 GLU 25 HG2 GLU 25 5.015 8.953 13.890
188 HG3 GLU 25 HG3 GLU 25 5.729 9.466 12.360
189 H GLU 26 H GLU 26 1.891 6.465 13.334
190 HA GLU 26 HA GLU 26 3.296 6.121 15.761
191 HB2 GLU 26 HB2 GLU 26 0.782 4.710 14.842
192 HB3 GLU 26 HB3 GLU 26 1.342 4.861 16.502
193 HG2 GLU 26 HG2 GLU 26 0.453 7.113 14.706
194 HG3 GLU 26 HG3 GLU 26 -0.457 6.421 16.047
195 H SER 27 H SER 27 2.219 3.659 13.396
196 HA SER 27 HA SER 27 3.950 1.672 14.691
197 HB2 SER 27 HB2 SER 27 1.881 1.320 12.504
198 HB3 SER 27 HB3 SER 27 2.754 0.018 13.307
199 HG SER 27 HG SER 27 0.506 1.238 14.069
200 H GLY 28 H GLY 28 3.926 3.699 11.912
201 HA2 GLY 28 HA2 GLY 28 5.725 4.085 10.476
202 HA3 GLY 28 HA3 GLY 28 6.502 2.636 11.085
203 H PHE 29 H PHE 29 3.287 2.081 10.110
204 HA PHE 29 HA PHE 29 4.260 0.707 7.695
205 HB2 PHE 29 HB2 PHE 29 1.661 0.339 9.210
206 HB3 PHE 29 HB3 PHE 29 2.178 -0.610 7.820
207 HD1 PHE 29 HD1 PHE 29 4.524 -1.798 8.117
208 HD2 PHE 29 HD2 PHE 29 2.029 -0.512 11.315
209 HE1 PHE 29 HE1 PHE 29 5.617 -3.412 9.613
210 HE2 PHE 29 HE2 PHE 29 3.122 -2.122 12.818
211 HZ PHE 29 HZ PHE 29 4.917 -3.575 11.970
212 H TYR 30 H TYR 30 2.894 0.663 5.790
213 HA TYR 30 HA TYR 30 1.169 3.012 5.425
214 HB2 TYR 30 HB2 TYR 30 2.571 1.163 3.510
215 HB3 TYR 30 HB3 TYR 30 1.163 2.069 2.971
216 HD1 TYR 30 HD1 TYR 30 4.653 2.385 4.186
217 HD2 TYR 30 HD2 TYR 30 1.283 4.412 2.545
218 HE1 TYR 30 HE1 TYR 30 6.064 4.345 3.709
219 HE2 TYR 30 HE2 TYR 30 2.687 6.370 2.059
220 HH TYR 30 HH TYR 30 4.803 7.377 2.890
221 H GLU 31 H GLU 31 -0.958 2.771 5.594
222 HA GLU 31 HA GLU 31 -2.127 0.079 5.625
223 HB2 GLU 31 HB2 GLU 31 -3.437 2.701 6.387
224 HB3 GLU 31 HB3 GLU 31 -3.994 1.077 6.772
225 HG2 GLU 31 HG2 GLU 31 -1.976 0.774 8.184
226 HG3 GLU 31 HG3 GLU 31 -1.539 2.449 7.862
227 H PHE 32 H PHE 32 -3.130 -0.629 3.815
228 HA PHE 32 HA PHE 32 -4.661 1.292 2.217
229 HB2 PHE 32 HB2 PHE 32 -3.765 0.315 0.097
230 HB3 PHE 32 HB3 PHE 32 -2.575 1.213 1.030
231 HD1 PHE 32 HD1 PHE 32 -0.912 -0.089 2.437
232 HD2 PHE 32 HD2 PHE 32 -3.382 -1.919 -0.512
233 HE1 PHE 32 HE1 PHE 32 0.615 -2.013 2.356
234 HE2 PHE 32 HE2 PHE 32 -1.860 -3.844 -0.591
235 HZ PHE 32 HZ PHE 32 0.144 -3.895 0.843
236 H LYS 33 H LYS 33 -6.410 0.473 1.127
237 HA LYS 33 HA LYS 33 -7.370 -2.099 2.146
238 HB2 LYS 33 HB2 LYS 33 -8.717 -0.023 2.418
239 HB3 LYS 33 HB3 LYS 33 -8.862 0.080 0.669
240 HG2 LYS 33 HG2 LYS 33 -10.000 -2.144 0.700
241 HG3 LYS 33 HG3 LYS 33 -9.974 -2.073 2.465
242 HD2 LYS 33 HD2 LYS 33 -11.315 -0.095 0.613
243 HD3 LYS 33 HD3 LYS 33 -12.126 -1.309 1.605
244 HE2 LYS 33 HE2 LYS 33 -11.574 -0.197 3.608
245 HE3 LYS 33 HE3 LYS 33 -10.351 0.799 2.816
246 HZ1 LYS 33 HZ1 LYS 33 -12.053 1.980 1.655
247 HZ2 LYS 33 HZ2 LYS 33 -12.404 2.013 3.312
248 HZ3 LYS 33 HZ3 LYS 33 -13.263 0.975 2.285
249 H GLN 34 H GLN 34 -6.975 -3.817 0.904
250 HA GLN 34 HA GLN 34 -6.244 -3.811 -1.805
251 HB2 GLN 34 HB2 GLN 34 -7.400 -6.059 -0.136
252 HB3 GLN 34 HB3 GLN 34 -6.620 -6.270 -1.698
253 HG2 GLN 34 HG2 GLN 34 -4.517 -5.503 -0.804
254 HG3 GLN 34 HG3 GLN 34 -5.273 -5.129 0.746
255 HE21 GLN 34 HE21 GLN 34 -5.847 -6.813 2.120
256 HE22 GLN 34 HE22 GLN 34 -5.226 -8.413 1.927
257 H LEU 35 H LEU 35 -7.403 -5.101 -3.539
258 HA LEU 35 HA LEU 35 -9.764 -3.908 -4.346
259 HB2 LEU 35 HB2 LEU 35 -8.705 -6.637 -5.093
260 HB3 LEU 35 HB3 LEU 35 -9.971 -5.790 -5.964
261 HG LEU 35 HG LEU 35 -7.105 -4.855 -5.676
262 HD11 LEU 35 HD11 LEU 35 -6.918 -5.350 -8.059
263 HD12 LEU 35 HD12 LEU 35 -8.567 -5.977 -8.069
264 HD13 LEU 35 HD13 LEU 35 -7.316 -6.802 -7.139
265 HD21 LEU 35 HD21 LEU 35 -9.394 -3.670 -7.255
266 HD22 LEU 35 HD22 LEU 35 -7.720 -3.119 -7.291
267 HD23 LEU 35 HD23 LEU 35 -8.663 -2.976 -5.808
268 H ASP 36 H ASP 36 -9.380 -6.712 -2.268
269 HA ASP 36 HA ASP 36 -12.073 -7.656 -2.504
270 HB2 ASP 36 HB2 ASP 36 -10.516 -8.219 -0.022
271 HB3 ASP 36 HB3 ASP 36 -11.470 -9.310 -1.021
272 H GLY 37 H GLY 37 -10.806 -4.936 -0.999
273 HA2 GLY 37 HA2 GLY 37 -11.905 -3.377 0.356
274 HA3 GLY 37 HA3 GLY 37 -13.142 -4.576 0.706
275 H LYS 38 H LYS 38 -9.968 -5.767 1.069
276 HA LYS 38 HA LYS 38 -10.245 -5.719 3.990
277 HB2 LYS 38 HB2 LYS 38 -8.226 -7.268 2.352
278 HB3 LYS 38 HB3 LYS 38 -8.600 -7.487 4.053
279 HG2 LYS 38 HG2 LYS 38 -10.957 -8.113 3.277
280 HG3 LYS 38 HG3 LYS 38 -10.257 -8.229 1.660
281 HD2 LYS 38 HD2 LYS 38 -9.443 -9.801 4.112
282 HD3 LYS 38 HD3 LYS 38 -10.285 -10.420 2.695
283 HE2 LYS 38 HE2 LYS 38 -7.513 -9.228 2.595
284 HE3 LYS 38 HE3 LYS 38 -7.825 -10.947 2.816
285 HZ1 LYS 38 HZ1 LYS 38 -9.069 -10.874 0.679
286 HZ2 LYS 38 HZ2 LYS 38 -7.410 -10.567 0.527
287 HZ3 LYS 38 HZ3 LYS 38 -8.516 -9.292 0.451
288 H GLN 39 H GLN 39 -9.082 -4.358 5.199
289 HA GLN 39 HA GLN 39 -6.969 -2.751 4.081
290 HB2 GLN 39 HB2 GLN 39 -8.457 -1.769 5.721
291 HB3 GLN 39 HB3 GLN 39 -8.044 -3.009 6.897
292 HG2 GLN 39 HG2 GLN 39 -5.718 -2.154 6.929
293 HG3 GLN 39 HG3 GLN 39 -6.211 -0.861 5.836
294 HE21 GLN 39 HE21 GLN 39 -7.493 0.816 6.637
295 HE22 GLN 39 HE22 GLN 39 -7.707 1.075 8.329
296 H THR 40 H THR 40 -4.841 -3.202 4.063
297 HA THR 40 HA THR 40 -3.744 -4.976 6.152
298 HB THR 40 HB THR 40 -3.808 -6.339 4.143
299 HG1 THR 40 HG1 THR 40 -1.421 -6.598 3.916
300 HG21 THR 40 HG21 THR 40 -3.869 -4.545 2.463
301 HG22 THR 40 HG22 THR 40 -2.593 -5.711 2.110
302 HG23 THR 40 HG23 THR 40 -2.187 -4.150 2.824
303 H ARG 41 H ARG 41 -1.311 -4.742 6.335
304 HA ARG 41 HA ARG 41 -0.462 -1.961 5.856
305 HB2 ARG 41 HB2 ARG 41 -0.382 -3.341 8.554
306 HB3 ARG 41 HB3 ARG 41 0.274 -1.747 8.199
307 HG2 ARG 41 HG2 ARG 41 -1.961 -0.911 7.716
308 HG3 ARG 41 HG3 ARG 41 -2.639 -2.513 7.996
309 HD2 ARG 41 HD2 ARG 41 -1.155 -0.891 10.066
310 HD3 ARG 41 HD3 ARG 41 -2.911 -0.972 9.922
311 HE ARG 41 HE ARG 41 -2.082 -3.579 10.116
312 HH11 ARG 41 HH11 ARG 41 -1.776 -0.759 12.087
313 HH12 ARG 41 HH12 ARG 41 -1.723 -1.679 13.551
314 HH21 ARG 41 HH21 ARG 41 -2.036 -4.717 12.003
315 HH22 ARG 41 HH22 ARG 41 -1.871 -3.873 13.506
316 H ILE 42 H ILE 42 1.629 -1.792 5.251
317 HA ILE 42 HA ILE 42 3.511 -3.942 5.979
318 HB ILE 42 HB ILE 42 2.697 -4.287 3.646
319 HG12 ILE 42 HG12 ILE 42 5.632 -3.536 3.798
320 HG13 ILE 42 HG13 ILE 42 4.955 -5.033 4.434
321 HG21 ILE 42 HG21 ILE 42 4.089 -1.662 3.092
322 HG22 ILE 42 HG22 ILE 42 2.352 -1.955 3.009
323 HG23 ILE 42 HG23 ILE 42 3.436 -2.757 1.872
324 HD11 ILE 42 HD11 ILE 42 5.990 -5.395 2.284
325 HD12 ILE 42 HD12 ILE 42 4.958 -4.167 1.553
326 HD13 ILE 42 HD13 ILE 42 4.248 -5.658 2.178
327 H ASN 43 H ASN 43 5.769 -3.294 6.026
328 HA ASN 43 HA ASN 43 6.066 -0.860 7.380
329 HB2 ASN 43 HB2 ASN 43 7.489 -2.916 7.666
330 HB3 ASN 43 HB3 ASN 43 8.325 -2.469 6.181
331 HD21 ASN 43 HD21 ASN 43 10.295 -2.148 7.195
332 HD22 ASN 43 HD22 ASN 43 10.590 -0.834 8.278
333 H LYS 44 H LYS 44 7.191 1.006 6.943
334 HA LYS 44 HA LYS 44 6.574 2.300 4.573
335 HB2 LYS 44 HB2 LYS 44 8.083 4.101 5.427
336 HB3 LYS 44 HB3 LYS 44 6.914 3.513 6.604
337 HG2 LYS 44 HG2 LYS 44 8.716 2.038 7.537
338 HG3 LYS 44 HG3 LYS 44 9.854 2.860 6.469
339 HD2 LYS 44 HD2 LYS 44 9.371 4.989 7.550
340 HD3 LYS 44 HD3 LYS 44 8.154 4.217 8.570
341 HE2 LYS 44 HE2 LYS 44 11.115 3.604 8.570
342 HE3 LYS 44 HE3 LYS 44 10.257 4.555 9.782
343 HZ1 LYS 44 HZ1 LYS 44 8.956 2.593 10.342
344 HZ2 LYS 44 HZ2 LYS 44 10.608 2.291 10.526
345 HZ3 LYS 44 HZ3 LYS 44 9.787 1.682 9.184
346 H ASP 45 H ASP 45 9.406 0.357 5.195
347 HA ASP 45 HA ASP 45 10.964 1.658 3.106
348 HB2 ASP 45 HB2 ASP 45 12.756 0.122 3.749
349 HB3 ASP 45 HB3 ASP 45 12.086 0.931 5.161
350 H GLN 46 H GLN 46 8.760 -0.940 3.317
351 HA GLN 46 HA GLN 46 9.886 -2.558 1.219
352 HB2 GLN 46 HB2 GLN 46 7.120 -2.633 2.441
353 HB3 GLN 46 HB3 GLN 46 7.814 -3.864 1.393
354 HG2 GLN 46 HG2 GLN 46 8.799 -3.094 4.134
355 HG3 GLN 46 HG3 GLN 46 7.893 -4.546 3.720
356 HE21 GLN 46 HE21 GLN 46 10.961 -2.955 3.594
357 HE22 GLN 46 HE22 GLN 46 11.883 -4.320 3.073
358 H VAL 47 H VAL 47 7.927 0.257 1.238
359 HA VAL 47 HA VAL 47 6.575 -0.352 -1.258
360 HB VAL 47 HB VAL 47 5.331 0.915 0.376
361 HG11 VAL 47 HG11 VAL 47 7.186 2.009 1.534
362 HG12 VAL 47 HG12 VAL 47 5.950 3.173 1.063
363 HG13 VAL 47 HG13 VAL 47 7.447 3.058 0.139
364 HG21 VAL 47 HG21 VAL 47 6.051 2.661 -1.982
365 HG22 VAL 47 HG22 VAL 47 4.593 2.797 -0.998
366 HG23 VAL 47 HG23 VAL 47 4.862 1.358 -1.982
367 H ARG 48 H ARG 48 7.569 -0.168 -3.154
368 HA ARG 48 HA ARG 48 9.863 1.561 -3.529
369 HB2 ARG 48 HB2 ARG 48 9.718 -0.711 -4.557
370 HB3 ARG 48 HB3 ARG 48 8.411 -0.129 -5.581
371 HG2 ARG 48 HG2 ARG 48 9.908 1.480 -6.626
372 HG3 ARG 48 HG3 ARG 48 11.221 0.977 -5.562
373 HD2 ARG 48 HD2 ARG 48 11.592 -0.110 -7.626
374 HD3 ARG 48 HD3 ARG 48 10.963 -1.343 -6.537
375 HE ARG 48 HE ARG 48 8.920 -0.099 -8.116
376 HH11 ARG 48 HH11 ARG 48 11.326 -2.571 -8.084
377 HH12 ARG 48 HH12 ARG 48 10.575 -3.466 -9.361
378 HH21 ARG 48 HH21 ARG 48 8.000 -1.232 -9.787
379 HH22 ARG 48 HH22 ARG 48 8.735 -2.699 -10.337
380 H THR 49 H THR 49 6.748 1.237 -5.272
381 HA THR 49 HA THR 49 6.768 4.157 -5.726
382 HB THR 49 HB THR 49 5.929 3.832 -8.029
383 HG1 THR 49 HG1 THR 49 5.045 1.834 -8.112
384 HG21 THR 49 HG21 THR 49 8.324 4.178 -7.725
385 HG22 THR 49 HG22 THR 49 8.032 3.062 -9.059
386 HG23 THR 49 HG23 THR 49 8.565 2.445 -7.494
387 H VAL 50 H VAL 50 4.849 5.168 -5.512
388 HA VAL 50 HA VAL 50 2.420 3.514 -5.159
389 HB VAL 50 HB VAL 50 2.954 6.287 -4.053
390 HG11 VAL 50 HG11 VAL 50 0.624 4.410 -3.609
391 HG12 VAL 50 HG12 VAL 50 0.590 5.917 -4.527
392 HG13 VAL 50 HG13 VAL 50 0.874 5.951 -2.786
393 HG21 VAL 50 HG21 VAL 50 4.317 4.603 -2.918
394 HG22 VAL 50 HG22 VAL 50 2.879 3.624 -2.620
395 HG23 VAL 50 HG23 VAL 50 3.045 5.203 -1.853
396 H LYS 51 H LYS 51 1.325 3.535 -7.055
397 HA LYS 51 HA LYS 51 0.850 6.130 -8.364
398 HB2 LYS 51 HB2 LYS 51 1.699 3.589 -9.774
399 HB3 LYS 51 HB3 LYS 51 1.162 5.056 -10.584
400 HG2 LYS 51 HG2 LYS 51 3.049 6.277 -9.566
401 HG3 LYS 51 HG3 LYS 51 3.604 4.767 -8.840
402 HD2 LYS 51 HD2 LYS 51 3.932 3.794 -11.042
403 HD3 LYS 51 HD3 LYS 51 3.277 5.245 -11.806
404 HE2 LYS 51 HE2 LYS 51 5.133 6.556 -10.826
405 HE3 LYS 51 HE3 LYS 51 5.800 5.069 -10.154
406 HZ1 LYS 51 HZ1 LYS 51 6.877 5.703 -12.226
407 HZ2 LYS 51 HZ2 LYS 51 5.398 5.611 -13.047
408 HZ3 LYS 51 HZ3 LYS 51 6.087 4.217 -12.381
409 H ASP 52 H ASP 52 -1.059 6.332 -9.502
410 HA ASP 52 HA ASP 52 -3.214 4.575 -8.722
411 HB2 ASP 52 HB2 ASP 52 -3.198 7.028 -10.507
412 HB3 ASP 52 HB3 ASP 52 -4.641 6.203 -9.925
413 H LEU 53 H LEU 53 -4.733 3.649 -10.312
414 HA LEU 53 HA LEU 53 -3.451 2.561 -12.666
415 HB2 LEU 53 HB2 LEU 53 -6.337 2.425 -11.762
416 HB3 LEU 53 HB3 LEU 53 -5.664 1.532 -13.113
417 HG LEU 53 HG LEU 53 -4.956 1.176 -10.193
418 HD11 LEU 53 HD11 LEU 53 -6.318 -0.680 -12.144
419 HD12 LEU 53 HD12 LEU 53 -7.117 0.227 -10.860
420 HD13 LEU 53 HD13 LEU 53 -5.945 -1.025 -10.454
421 HD21 LEU 53 HD21 LEU 53 -3.539 -0.686 -10.954
422 HD22 LEU 53 HD22 LEU 53 -2.962 0.871 -11.546
423 HD23 LEU 53 HD23 LEU 53 -3.833 -0.215 -12.628
424 H LEU 54 H LEU 54 -4.703 5.509 -11.993
425 HA LEU 54 HA LEU 54 -6.019 5.988 -14.568
426 HB2 LEU 54 HB2 LEU 54 -5.708 7.858 -12.213
427 HB3 LEU 54 HB3 LEU 54 -6.809 8.039 -13.568
428 HG LEU 54 HG LEU 54 -6.968 5.868 -11.464
429 HD11 LEU 54 HD11 LEU 54 -8.688 8.318 -11.855
430 HD12 LEU 54 HD12 LEU 54 -7.534 8.053 -10.547
431 HD13 LEU 54 HD13 LEU 54 -8.965 7.032 -10.677
432 HD21 LEU 54 HD21 LEU 54 -7.815 5.105 -13.618
433 HD22 LEU 54 HD22 LEU 54 -8.848 6.531 -13.736
434 HD23 LEU 54 HD23 LEU 54 -9.138 5.332 -12.475
435 H GLU 55 H GLU 55 -2.994 5.724 -14.080
436 HA GLU 55 HA GLU 55 -1.673 8.162 -14.314
437 HB2 GLU 55 HB2 GLU 55 -0.893 5.491 -15.508
438 HB3 GLU 55 HB3 GLU 55 0.185 6.869 -15.335
439 HG2 GLU 55 HG2 GLU 55 -1.145 5.386 -13.073
440 HG3 GLU 55 HG3 GLU 55 0.528 5.192 -13.588
Start of MODEL 2
1 H1 MET 1 H1 MET 1 -15.004 8.855 0.032
2 H2 MET 1 H2 MET 1 -15.619 8.120 -1.360
3 H3 MET 1 H3 MET 1 -15.989 9.737 -1.023
4 HA MET 1 HA MET 1 -14.339 9.578 -2.760
5 HB2 MET 1 HB2 MET 1 -12.678 11.101 -1.789
6 HB3 MET 1 HB3 MET 1 -14.305 11.528 -1.283
7 HG2 MET 1 HG2 MET 1 -13.918 10.464 0.881
8 HG3 MET 1 HG3 MET 1 -12.287 10.023 0.375
9 HE1 MET 1 HE1 MET 1 -12.849 11.586 3.068
10 HE2 MET 1 HE2 MET 1 -11.614 12.844 3.015
11 HE3 MET 1 HE3 MET 1 -11.219 11.199 2.517
12 H ALA 2 H ALA 2 -12.633 8.546 -3.648
13 HA ALA 2 HA ALA 2 -10.507 7.334 -2.215
14 HB1 ALA 2 HB1 ALA 2 -10.992 4.982 -2.545
15 HB2 ALA 2 HB2 ALA 2 -12.534 5.376 -3.309
16 HB3 ALA 2 HB3 ALA 2 -12.283 5.725 -1.600
17 H SER 3 H SER 3 -9.486 5.513 -3.818
18 HA SER 3 HA SER 3 -9.753 6.121 -6.625
19 HB2 SER 3 HB2 SER 3 -8.389 8.050 -5.896
20 HB3 SER 3 HB3 SER 3 -7.211 6.954 -5.179
21 HG SER 3 HG SER 3 -6.327 6.795 -7.067
22 HA PRO 4 HA PRO 4 -7.972 1.993 -6.641
23 HB2 PRO 4 HB2 PRO 4 -7.446 1.728 -9.291
24 HB3 PRO 4 HB3 PRO 4 -9.087 1.652 -8.636
25 HG2 PRO 4 HG2 PRO 4 -7.684 3.945 -9.967
26 HG3 PRO 4 HG3 PRO 4 -9.350 3.372 -10.186
27 HD2 PRO 4 HD2 PRO 4 -8.698 5.515 -8.626
28 HD3 PRO 4 HD3 PRO 4 -10.103 4.478 -8.308
29 H THR 5 H THR 5 -5.991 1.750 -5.772
30 HA THR 5 HA THR 5 -3.718 3.221 -6.947
31 HB THR 5 HB THR 5 -4.020 2.219 -4.102
32 HG1 THR 5 HG1 THR 5 -4.457 4.743 -5.318
33 HG21 THR 5 HG21 THR 5 -1.684 2.289 -4.831
34 HG22 THR 5 HG22 THR 5 -2.007 3.556 -3.649
35 HG23 THR 5 HG23 THR 5 -1.889 3.957 -5.363
36 H VAL 6 H VAL 6 -1.761 2.190 -7.302
37 HA VAL 6 HA VAL 6 -1.663 -0.712 -6.777
38 HB VAL 6 HB VAL 6 -1.763 -0.367 -9.172
39 HG11 VAL 6 HG11 VAL 6 0.691 1.374 -8.895
40 HG12 VAL 6 HG12 VAL 6 -0.937 1.944 -9.260
41 HG13 VAL 6 HG13 VAL 6 -0.091 0.905 -10.407
42 HG21 VAL 6 HG21 VAL 6 1.050 -1.094 -8.331
43 HG22 VAL 6 HG22 VAL 6 0.269 -1.536 -9.850
44 HG23 VAL 6 HG23 VAL 6 -0.337 -2.182 -8.326
45 H ILE 7 H ILE 7 -0.349 -1.094 -5.142
46 HA ILE 7 HA ILE 7 1.828 0.741 -4.512
47 HB ILE 7 HB ILE 7 0.827 -1.687 -2.997
48 HG12 ILE 7 HG12 ILE 7 0.402 1.281 -2.527
49 HG13 ILE 7 HG13 ILE 7 -0.818 0.143 -3.093
50 HG21 ILE 7 HG21 ILE 7 2.812 0.443 -2.173
51 HG22 ILE 7 HG22 ILE 7 3.180 -1.250 -2.507
52 HG23 ILE 7 HG23 ILE 7 2.174 -0.824 -1.124
53 HD11 ILE 7 HD11 ILE 7 -1.135 0.623 -0.755
54 HD12 ILE 7 HD12 ILE 7 0.523 0.142 -0.396
55 HD13 ILE 7 HD13 ILE 7 -0.644 -1.059 -0.952
56 H THR 8 H THR 8 3.601 0.426 -5.697
57 HA THR 8 HA THR 8 4.468 -2.214 -6.522
58 HB THR 8 HB THR 8 5.808 0.483 -6.871
59 HG1 THR 8 HG1 THR 8 4.694 -0.903 -9.027
60 HG21 THR 8 HG21 THR 8 7.445 -1.323 -7.007
61 HG22 THR 8 HG22 THR 8 7.150 -0.646 -8.609
62 HG23 THR 8 HG23 THR 8 6.422 -2.187 -8.157
63 H LEU 9 H LEU 9 5.342 -3.455 -4.932
64 HA LEU 9 HA LEU 9 7.008 -2.375 -2.849
65 HB2 LEU 9 HB2 LEU 9 6.616 -5.264 -3.656
66 HB3 LEU 9 HB3 LEU 9 7.304 -4.691 -2.145
67 HG LEU 9 HG LEU 9 4.436 -4.357 -3.046
68 HD11 LEU 9 HD11 LEU 9 4.942 -6.619 -2.342
69 HD12 LEU 9 HD12 LEU 9 3.927 -5.817 -1.143
70 HD13 LEU 9 HD13 LEU 9 5.654 -6.020 -0.843
71 HD21 LEU 9 HD21 LEU 9 5.770 -3.432 -0.497
72 HD22 LEU 9 HD22 LEU 9 4.039 -3.375 -0.833
73 HD23 LEU 9 HD23 LEU 9 5.153 -2.397 -1.787
74 H ASN 10 H ASN 10 9.272 -2.904 -2.510
75 HA ASN 10 HA ASN 10 10.821 -2.470 -4.844
76 HB2 ASN 10 HB2 ASN 10 11.387 -1.770 -2.452
77 HB3 ASN 10 HB3 ASN 10 11.927 -3.427 -2.199
78 HD21 ASN 10 HD21 ASN 10 14.053 -2.747 -1.837
79 HD22 ASN 10 HD22 ASN 10 15.066 -2.210 -3.128
80 H ASP 11 H ASP 11 9.637 -5.358 -3.445
81 HA ASP 11 HA ASP 11 11.569 -7.164 -4.553
82 HB2 ASP 11 HB2 ASP 11 8.705 -7.692 -3.715
83 HB3 ASP 11 HB3 ASP 11 9.943 -8.912 -3.999
84 H GLY 12 H GLY 12 9.277 -5.221 -6.024
85 HA2 GLY 12 HA2 GLY 12 8.760 -5.150 -8.323
86 HA3 GLY 12 HA3 GLY 12 9.279 -6.821 -8.479
87 H ARG 13 H ARG 13 7.345 -6.619 -5.815
88 HA ARG 13 HA ARG 13 5.087 -7.837 -7.181
89 HB2 ARG 13 HB2 ARG 13 5.948 -8.854 -5.123
90 HB3 ARG 13 HB3 ARG 13 5.628 -7.368 -4.236
91 HG2 ARG 13 HG2 ARG 13 3.229 -7.642 -4.638
92 HG3 ARG 13 HG3 ARG 13 3.549 -9.130 -5.534
93 HD2 ARG 13 HD2 ARG 13 4.542 -10.112 -3.508
94 HD3 ARG 13 HD3 ARG 13 4.177 -8.631 -2.622
95 HE ARG 13 HE ARG 13 1.772 -9.407 -3.622
96 HH11 ARG 13 HH11 ARG 13 4.184 -10.915 -1.690
97 HH12 ARG 13 HH12 ARG 13 3.054 -11.945 -0.883
98 HH21 ARG 13 HH21 ARG 13 0.316 -10.724 -2.568
99 HH22 ARG 13 HH22 ARG 13 0.890 -11.858 -1.391
100 H GLU 14 H GLU 14 3.142 -6.881 -7.540
101 HA GLU 14 HA GLU 14 2.782 -4.119 -6.545
102 HB2 GLU 14 HB2 GLU 14 1.724 -5.454 -9.047
103 HB3 GLU 14 HB3 GLU 14 1.267 -3.836 -8.524
104 HG2 GLU 14 HG2 GLU 14 3.504 -3.038 -8.793
105 HG3 GLU 14 HG3 GLU 14 4.107 -4.666 -9.088
106 H ILE 15 H ILE 15 1.110 -3.653 -5.263
107 HA ILE 15 HA ILE 15 -0.994 -5.693 -4.859
108 HB ILE 15 HB ILE 15 -0.105 -3.484 -2.980
109 HG12 ILE 15 HG12 ILE 15 0.365 -6.481 -2.831
110 HG13 ILE 15 HG13 ILE 15 1.583 -5.279 -3.239
111 HG21 ILE 15 HG21 ILE 15 -2.064 -5.748 -2.543
112 HG22 ILE 15 HG22 ILE 15 -2.477 -4.044 -2.722
113 HG23 ILE 15 HG23 ILE 15 -1.545 -4.583 -1.325
114 HD11 ILE 15 HD11 ILE 15 0.158 -5.544 -0.599
115 HD12 ILE 15 HD12 ILE 15 1.340 -4.297 -1.002
116 HD13 ILE 15 HD13 ILE 15 1.828 -5.990 -0.947
117 H GLN 16 H GLN 16 -3.073 -5.185 -5.367
118 HA GLN 16 HA GLN 16 -3.592 -2.460 -6.342
119 HB2 GLN 16 HB2 GLN 16 -5.090 -5.048 -6.778
120 HB3 GLN 16 HB3 GLN 16 -5.610 -3.489 -7.403
121 HG2 GLN 16 HG2 GLN 16 -3.530 -3.326 -8.702
122 HG3 GLN 16 HG3 GLN 16 -3.043 -4.911 -8.098
123 HE21 GLN 16 HE21 GLN 16 -5.254 -3.198 -10.176
124 HE22 GLN 16 HE22 GLN 16 -5.803 -4.578 -11.054
125 H ALA 17 H ALA 17 -4.867 -1.078 -5.303
126 HA ALA 17 HA ALA 17 -6.621 -2.071 -3.142
127 HB1 ALA 17 HB1 ALA 17 -4.910 0.418 -3.080
128 HB2 ALA 17 HB2 ALA 17 -4.593 -1.079 -2.204
129 HB3 ALA 17 HB3 ALA 17 -6.013 -0.111 -1.809
130 H VAL 18 H VAL 18 -8.539 -0.929 -2.751
131 HA VAL 18 HA VAL 18 -9.522 0.731 -4.959
132 HB VAL 18 HB VAL 18 -11.748 0.437 -3.938
133 HG11 VAL 18 HG11 VAL 18 -10.983 -1.192 -5.576
134 HG12 VAL 18 HG12 VAL 18 -11.997 -1.964 -4.358
135 HG13 VAL 18 HG13 VAL 18 -10.245 -2.157 -4.297
136 HG21 VAL 18 HG21 VAL 18 -11.141 0.322 -1.592
137 HG22 VAL 18 HG22 VAL 18 -10.285 -1.199 -1.854
138 HG23 VAL 18 HG23 VAL 18 -12.038 -1.128 -2.040
139 H ASP 19 H ASP 19 -7.829 1.411 -2.323
140 HA ASP 19 HA ASP 19 -9.050 4.038 -1.941
141 HB2 ASP 19 HB2 ASP 19 -9.852 2.290 -0.175
142 HB3 ASP 19 HB3 ASP 19 -8.231 2.447 0.488
143 H THR 20 H THR 20 -7.534 5.523 -0.731
144 HA THR 20 HA THR 20 -4.927 5.232 -1.940
145 HB THR 20 HB THR 20 -4.491 7.515 -1.020
146 HG1 THR 20 HG1 THR 20 -5.717 8.124 0.598
147 HG21 THR 20 HG21 THR 20 -7.091 7.200 -2.539
148 HG22 THR 20 HG22 THR 20 -5.476 7.260 -3.246
149 HG23 THR 20 HG23 THR 20 -6.138 8.680 -2.434
150 HA PRO 21 HA PRO 21 -3.009 3.421 1.666
151 HB2 PRO 21 HB2 PRO 21 -0.400 3.801 0.900
152 HB3 PRO 21 HB3 PRO 21 -1.427 2.495 0.296
153 HG2 PRO 21 HG2 PRO 21 -0.771 5.130 -0.972
154 HG3 PRO 21 HG3 PRO 21 -0.854 3.522 -1.717
155 HD2 PRO 21 HD2 PRO 21 -2.856 5.308 -1.966
156 HD3 PRO 21 HD3 PRO 21 -3.172 3.563 -1.844
157 H LYS 22 H LYS 22 -3.168 4.572 3.489
158 HA LYS 22 HA LYS 22 -2.048 7.239 3.774
159 HB2 LYS 22 HB2 LYS 22 -4.156 6.908 4.834
160 HB3 LYS 22 HB3 LYS 22 -3.629 5.408 5.584
161 HG2 LYS 22 HG2 LYS 22 -2.041 6.736 6.980
162 HG3 LYS 22 HG3 LYS 22 -2.750 8.204 6.303
163 HD2 LYS 22 HD2 LYS 22 -4.896 7.687 7.261
164 HD3 LYS 22 HD3 LYS 22 -4.340 6.088 7.762
165 HE2 LYS 22 HE2 LYS 22 -3.281 8.724 8.807
166 HE3 LYS 22 HE3 LYS 22 -4.421 7.672 9.647
167 HZ1 LYS 22 HZ1 LYS 22 -2.184 7.329 10.460
168 HZ2 LYS 22 HZ2 LYS 22 -1.636 6.970 8.901
169 HZ3 LYS 22 HZ3 LYS 22 -2.729 5.936 9.666
170 H TYR 23 H TYR 23 -0.011 7.634 4.505
171 HA TYR 23 HA TYR 23 1.539 5.511 5.730
172 HB2 TYR 23 HB2 TYR 23 2.742 7.016 4.260
173 HB3 TYR 23 HB3 TYR 23 2.219 8.416 5.197
174 HD1 TYR 23 HD1 TYR 23 3.730 5.111 6.132
175 HD2 TYR 23 HD2 TYR 23 4.036 9.359 6.324
176 HE1 TYR 23 HE1 TYR 23 5.712 4.900 7.561
177 HE2 TYR 23 HE2 TYR 23 6.027 9.151 7.752
178 HH TYR 23 HH TYR 23 7.147 7.633 9.154
179 H ASP 24 H ASP 24 1.723 5.137 7.846
180 HA ASP 24 HA ASP 24 0.719 7.195 9.711
181 HB2 ASP 24 HB2 ASP 24 -0.607 5.061 9.544
182 HB3 ASP 24 HB3 ASP 24 0.801 4.201 10.163
183 H GLU 25 H GLU 25 2.570 8.252 10.281
184 HA GLU 25 HA GLU 25 5.129 7.177 10.610
185 HB2 GLU 25 HB2 GLU 25 4.720 9.563 10.389
186 HB3 GLU 25 HB3 GLU 25 3.856 9.589 11.919
187 HG2 GLU 25 HG2 GLU 25 5.989 8.904 13.043
188 HG3 GLU 25 HG3 GLU 25 6.802 9.118 11.492
189 H GLU 26 H GLU 26 2.423 7.145 12.786
190 HA GLU 26 HA GLU 26 3.830 6.807 15.228
191 HB2 GLU 26 HB2 GLU 26 0.997 5.972 14.563
192 HB3 GLU 26 HB3 GLU 26 1.662 6.217 16.173
193 HG2 GLU 26 HG2 GLU 26 1.305 8.345 14.063
194 HG3 GLU 26 HG3 GLU 26 0.279 8.101 15.476
195 H SER 27 H SER 27 2.213 4.453 13.088
196 HA SER 27 HA SER 27 3.342 2.221 14.595
197 HB2 SER 27 HB2 SER 27 2.022 0.794 13.107
198 HB3 SER 27 HB3 SER 27 1.012 2.094 13.739
199 HG SER 27 HG SER 27 1.069 3.102 11.794
200 H GLY 28 H GLY 28 3.964 3.974 11.658
201 HA2 GLY 28 HA2 GLY 28 5.912 3.909 10.367
202 HA3 GLY 28 HA3 GLY 28 6.377 2.419 11.168
203 H PHE 29 H PHE 29 3.172 2.323 10.058
204 HA PHE 29 HA PHE 29 4.006 0.729 7.710
205 HB2 PHE 29 HB2 PHE 29 1.510 0.412 9.400
206 HB3 PHE 29 HB3 PHE 29 1.960 -0.590 8.026
207 HD1 PHE 29 HD1 PHE 29 4.162 -1.907 8.203
208 HD2 PHE 29 HD2 PHE 29 2.190 -0.168 11.552
209 HE1 PHE 29 HE1 PHE 29 5.369 -3.433 9.705
210 HE2 PHE 29 HE2 PHE 29 3.399 -1.690 13.058
211 HZ PHE 29 HZ PHE 29 4.990 -3.327 12.134
212 H TYR 30 H TYR 30 2.433 0.602 5.929
213 HA TYR 30 HA TYR 30 0.878 3.070 5.543
214 HB2 TYR 30 HB2 TYR 30 2.016 1.028 3.646
215 HB3 TYR 30 HB3 TYR 30 0.673 2.044 3.136
216 HD1 TYR 30 HD1 TYR 30 4.182 2.168 4.388
217 HD2 TYR 30 HD2 TYR 30 1.034 4.247 2.411
218 HE1 TYR 30 HE1 TYR 30 5.749 3.965 3.781
219 HE2 TYR 30 HE2 TYR 30 2.593 6.045 1.802
220 HH TYR 30 HH TYR 30 5.959 5.747 2.078
221 H GLU 31 H GLU 31 -1.277 3.057 5.602
222 HA GLU 31 HA GLU 31 -2.701 0.509 5.922
223 HB2 GLU 31 HB2 GLU 31 -3.643 3.351 6.424
224 HB3 GLU 31 HB3 GLU 31 -4.518 1.881 6.842
225 HG2 GLU 31 HG2 GLU 31 -2.815 1.279 8.453
226 HG3 GLU 31 HG3 GLU 31 -1.833 2.660 7.971
227 H PHE 32 H PHE 32 -3.743 -0.316 4.191
228 HA PHE 32 HA PHE 32 -5.098 1.479 2.314
229 HB2 PHE 32 HB2 PHE 32 -4.091 0.349 0.350
230 HB3 PHE 32 HB3 PHE 32 -2.898 1.215 1.310
231 HD1 PHE 32 HD1 PHE 32 -1.399 -0.081 2.856
232 HD2 PHE 32 HD2 PHE 32 -3.900 -1.977 -0.029
233 HE1 PHE 32 HE1 PHE 32 -0.046 -2.125 3.028
234 HE2 PHE 32 HE2 PHE 32 -2.547 -4.024 0.143
235 HZ PHE 32 HZ PHE 32 -0.617 -4.098 1.673
236 H LYS 33 H LYS 33 -6.683 0.442 0.985
237 HA LYS 33 HA LYS 33 -7.614 -2.133 2.088
238 HB2 LYS 33 HB2 LYS 33 -9.122 -0.247 2.498
239 HB3 LYS 33 HB3 LYS 33 -9.190 0.089 0.775
240 HG2 LYS 33 HG2 LYS 33 -10.313 -2.021 0.369
241 HG3 LYS 33 HG3 LYS 33 -10.167 -2.454 2.075
242 HD2 LYS 33 HD2 LYS 33 -11.683 -0.056 1.026
243 HD3 LYS 33 HD3 LYS 33 -12.420 -1.598 1.468
244 HE2 LYS 33 HE2 LYS 33 -11.687 -1.334 3.764
245 HE3 LYS 33 HE3 LYS 33 -10.818 0.143 3.350
246 HZ1 LYS 33 HZ1 LYS 33 -13.758 -0.215 3.147
247 HZ2 LYS 33 HZ2 LYS 33 -12.901 1.212 2.835
248 HZ3 LYS 33 HZ3 LYS 33 -12.954 0.586 4.404
249 H GLN 34 H GLN 34 -7.103 -3.773 0.787
250 HA GLN 34 HA GLN 34 -6.394 -3.575 -1.927
251 HB2 GLN 34 HB2 GLN 34 -7.313 -5.998 -0.363
252 HB3 GLN 34 HB3 GLN 34 -6.527 -6.050 -1.934
253 HG2 GLN 34 HG2 GLN 34 -4.520 -5.031 -0.951
254 HG3 GLN 34 HG3 GLN 34 -5.310 -5.026 0.626
255 HE21 GLN 34 HE21 GLN 34 -5.654 -7.004 1.687
256 HE22 GLN 34 HE22 GLN 34 -4.800 -8.435 1.244
257 H LEU 35 H LEU 35 -7.451 -4.854 -3.725
258 HA LEU 35 HA LEU 35 -9.997 -3.951 -4.382
259 HB2 LEU 35 HB2 LEU 35 -8.628 -6.469 -5.346
260 HB3 LEU 35 HB3 LEU 35 -10.030 -5.739 -6.106
261 HG LEU 35 HG LEU 35 -7.255 -4.551 -5.930
262 HD11 LEU 35 HD11 LEU 35 -7.476 -6.355 -7.561
263 HD12 LEU 35 HD12 LEU 35 -7.266 -4.797 -8.360
264 HD13 LEU 35 HD13 LEU 35 -8.864 -5.541 -8.287
265 HD21 LEU 35 HD21 LEU 35 -8.936 -2.785 -5.733
266 HD22 LEU 35 HD22 LEU 35 -9.759 -3.391 -7.172
267 HD23 LEU 35 HD23 LEU 35 -8.135 -2.717 -7.300
268 H ASP 36 H ASP 36 -9.081 -6.812 -2.577
269 HA ASP 36 HA ASP 36 -11.611 -8.124 -2.736
270 HB2 ASP 36 HB2 ASP 36 -9.449 -9.271 -2.296
271 HB3 ASP 36 HB3 ASP 36 -9.383 -8.497 -0.716
272 H GLY 37 H GLY 37 -10.629 -5.391 -1.006
273 HA2 GLY 37 HA2 GLY 37 -12.125 -4.116 0.339
274 HA3 GLY 37 HA3 GLY 37 -12.959 -5.595 0.782
275 H LYS 38 H LYS 38 -9.976 -6.600 1.121
276 HA LYS 38 HA LYS 38 -9.877 -6.291 3.957
277 HB2 LYS 38 HB2 LYS 38 -7.889 -7.421 1.976
278 HB3 LYS 38 HB3 LYS 38 -7.633 -7.439 3.714
279 HG2 LYS 38 HG2 LYS 38 -9.607 -8.834 4.009
280 HG3 LYS 38 HG3 LYS 38 -9.916 -8.783 2.270
281 HD2 LYS 38 HD2 LYS 38 -7.877 -9.971 1.804
282 HD3 LYS 38 HD3 LYS 38 -7.363 -9.855 3.489
283 HE2 LYS 38 HE2 LYS 38 -8.221 -12.090 2.928
284 HE3 LYS 38 HE3 LYS 38 -9.182 -11.298 4.175
285 HZ1 LYS 38 HZ1 LYS 38 -10.496 -12.439 2.434
286 HZ2 LYS 38 HZ2 LYS 38 -9.912 -11.331 1.298
287 HZ3 LYS 38 HZ3 LYS 38 -10.862 -10.799 2.592
288 H GLN 39 H GLN 39 -9.343 -4.365 4.881
289 HA GLN 39 HA GLN 39 -7.250 -2.710 3.708
290 HB2 GLN 39 HB2 GLN 39 -9.233 -1.597 4.632
291 HB3 GLN 39 HB3 GLN 39 -8.901 -2.290 6.214
292 HG2 GLN 39 HG2 GLN 39 -6.910 -0.990 6.453
293 HG3 GLN 39 HG3 GLN 39 -7.003 -0.440 4.780
294 HE21 GLN 39 HE21 GLN 39 -7.001 1.721 5.403
295 HE22 GLN 39 HE22 GLN 39 -8.369 2.473 6.139
296 H THR 40 H THR 40 -5.222 -3.336 4.038
297 HA THR 40 HA THR 40 -4.456 -4.394 6.691
298 HB THR 40 HB THR 40 -4.531 -6.253 5.116
299 HG1 THR 40 HG1 THR 40 -2.828 -6.942 6.148
300 HG21 THR 40 HG21 THR 40 -3.053 -6.353 3.165
301 HG22 THR 40 HG22 THR 40 -2.510 -4.705 3.482
302 HG23 THR 40 HG23 THR 40 -4.185 -5.009 3.026
303 H ARG 41 H ARG 41 -2.003 -4.357 6.987
304 HA ARG 41 HA ARG 41 -0.974 -1.764 6.010
305 HB2 ARG 41 HB2 ARG 41 -0.791 -2.945 8.791
306 HB3 ARG 41 HB3 ARG 41 0.081 -1.509 8.268
307 HG2 ARG 41 HG2 ARG 41 -1.969 -0.314 7.909
308 HG3 ARG 41 HG3 ARG 41 -2.921 -1.767 8.218
309 HD2 ARG 41 HD2 ARG 41 -1.089 -0.511 10.257
310 HD3 ARG 41 HD3 ARG 41 -2.806 -0.129 10.123
311 HE ARG 41 HE ARG 41 -2.847 -2.799 10.355
312 HH11 ARG 41 HH11 ARG 41 -1.180 -0.402 12.181
313 HH12 ARG 41 HH12 ARG 41 -1.247 -1.310 13.648
314 HH21 ARG 41 HH21 ARG 41 -2.942 -3.950 12.264
315 HH22 ARG 41 HH22 ARG 41 -2.244 -3.276 13.697
316 H ILE 42 H ILE 42 1.107 -1.683 5.317
317 HA ILE 42 HA ILE 42 2.850 -4.026 5.803
318 HB ILE 42 HB ILE 42 1.942 -4.054 3.484
319 HG12 ILE 42 HG12 ILE 42 4.923 -3.503 3.604
320 HG13 ILE 42 HG13 ILE 42 4.164 -5.033 4.034
321 HG21 ILE 42 HG21 ILE 42 1.711 -1.652 3.125
322 HG22 ILE 42 HG22 ILE 42 2.699 -2.377 1.857
323 HG23 ILE 42 HG23 ILE 42 3.466 -1.464 3.157
324 HD11 ILE 42 HD11 ILE 42 5.115 -5.138 1.819
325 HD12 ILE 42 HD12 ILE 42 4.159 -3.746 1.315
326 HD13 ILE 42 HD13 ILE 42 3.359 -5.261 1.733
327 H ASN 43 H ASN 43 5.149 -3.576 5.851
328 HA ASN 43 HA ASN 43 5.721 -1.199 7.279
329 HB2 ASN 43 HB2 ASN 43 6.889 -3.445 7.510
330 HB3 ASN 43 HB3 ASN 43 7.787 -3.033 6.052
331 HD21 ASN 43 HD21 ASN 43 9.746 -3.003 7.138
332 HD22 ASN 43 HD22 ASN 43 10.175 -1.758 8.255
333 H LYS 44 H LYS 44 6.879 0.622 6.759
334 HA LYS 44 HA LYS 44 6.344 1.666 4.206
335 HB2 LYS 44 HB2 LYS 44 7.625 3.658 4.989
336 HB3 LYS 44 HB3 LYS 44 6.358 3.123 6.084
337 HG2 LYS 44 HG2 LYS 44 8.051 2.024 7.493
338 HG3 LYS 44 HG3 LYS 44 9.315 2.600 6.404
339 HD2 LYS 44 HD2 LYS 44 8.754 4.905 6.911
340 HD3 LYS 44 HD3 LYS 44 7.398 4.385 7.907
341 HE2 LYS 44 HE2 LYS 44 8.951 3.289 9.454
342 HE3 LYS 44 HE3 LYS 44 10.308 3.811 8.455
343 HZ1 LYS 44 HZ1 LYS 44 9.726 6.101 8.905
344 HZ2 LYS 44 HZ2 LYS 44 9.974 5.267 10.351
345 HZ3 LYS 44 HZ3 LYS 44 8.402 5.623 9.842
346 H ASP 45 H ASP 45 9.045 -0.208 5.153
347 HA ASP 45 HA ASP 45 10.889 1.048 3.298
348 HB2 ASP 45 HB2 ASP 45 12.475 -0.679 3.994
349 HB3 ASP 45 HB3 ASP 45 11.745 0.110 5.387
350 H GLN 46 H GLN 46 8.576 -1.526 3.206
351 HA GLN 46 HA GLN 46 9.741 -2.931 0.983
352 HB2 GLN 46 HB2 GLN 46 6.949 -3.068 2.129
353 HB3 GLN 46 HB3 GLN 46 7.594 -4.166 0.918
354 HG2 GLN 46 HG2 GLN 46 8.665 -3.830 3.716
355 HG3 GLN 46 HG3 GLN 46 7.596 -5.123 3.182
356 HE21 GLN 46 HE21 GLN 46 9.043 -6.742 3.658
357 HE22 GLN 46 HE22 GLN 46 10.494 -7.007 2.763
358 H VAL 47 H VAL 47 7.505 -0.261 1.278
359 HA VAL 47 HA VAL 47 6.466 -0.517 -1.391
360 HB VAL 47 HB VAL 47 5.087 0.534 0.306
361 HG11 VAL 47 HG11 VAL 47 7.161 2.729 0.397
362 HG12 VAL 47 HG12 VAL 47 6.824 1.562 1.675
363 HG13 VAL 47 HG13 VAL 47 5.602 2.750 1.222
364 HG21 VAL 47 HG21 VAL 47 5.888 2.506 -1.841
365 HG22 VAL 47 HG22 VAL 47 4.369 2.514 -0.942
366 HG23 VAL 47 HG23 VAL 47 4.743 1.177 -2.030
367 H ARG 48 H ARG 48 7.518 -0.037 -3.179
368 HA ARG 48 HA ARG 48 9.859 1.654 -3.208
369 HB2 ARG 48 HB2 ARG 48 9.646 -0.425 -4.601
370 HB3 ARG 48 HB3 ARG 48 8.412 0.391 -5.551
371 HG2 ARG 48 HG2 ARG 48 10.485 0.514 -6.738
372 HG3 ARG 48 HG3 ARG 48 10.093 2.130 -6.145
373 HD2 ARG 48 HD2 ARG 48 11.594 1.678 -4.186
374 HD3 ARG 48 HD3 ARG 48 12.081 0.180 -4.981
375 HE ARG 48 HE ARG 48 12.464 2.787 -6.295
376 HH11 ARG 48 HH11 ARG 48 13.737 -0.174 -5.078
377 HH12 ARG 48 HH12 ARG 48 15.315 0.112 -5.714
378 HH21 ARG 48 HH21 ARG 48 14.501 3.153 -7.100
379 HH22 ARG 48 HH22 ARG 48 15.752 1.986 -6.833
380 H THR 49 H THR 49 6.844 1.711 -5.152
381 HA THR 49 HA THR 49 6.912 4.667 -5.068
382 HB THR 49 HB THR 49 6.068 4.745 -7.395
383 HG1 THR 49 HG1 THR 49 5.177 2.850 -7.920
384 HG21 THR 49 HG21 THR 49 8.474 4.974 -7.009
385 HG22 THR 49 HG22 THR 49 8.161 4.137 -8.530
386 HG23 THR 49 HG23 THR 49 8.665 3.223 -7.106
387 H VAL 50 H VAL 50 5.013 5.669 -4.643
388 HA VAL 50 HA VAL 50 2.601 3.998 -4.335
389 HB VAL 50 HB VAL 50 3.145 6.781 -3.258
390 HG11 VAL 50 HG11 VAL 50 0.860 4.879 -2.693
391 HG12 VAL 50 HG12 VAL 50 0.757 6.372 -3.627
392 HG13 VAL 50 HG13 VAL 50 1.125 6.435 -1.903
393 HG21 VAL 50 HG21 VAL 50 3.172 4.107 -1.844
394 HG22 VAL 50 HG22 VAL 50 3.340 5.681 -1.065
395 HG23 VAL 50 HG23 VAL 50 4.578 5.117 -2.188
396 H LYS 51 H LYS 51 1.670 3.960 -6.370
397 HA LYS 51 HA LYS 51 0.739 6.553 -7.405
398 HB2 LYS 51 HB2 LYS 51 2.078 4.372 -9.006
399 HB3 LYS 51 HB3 LYS 51 1.091 5.628 -9.745
400 HG2 LYS 51 HG2 LYS 51 2.631 7.298 -8.601
401 HG3 LYS 51 HG3 LYS 51 3.696 5.926 -8.278
402 HD2 LYS 51 HD2 LYS 51 4.225 5.636 -10.506
403 HD3 LYS 51 HD3 LYS 51 2.716 6.365 -11.071
404 HE2 LYS 51 HE2 LYS 51 5.094 7.800 -9.883
405 HE3 LYS 51 HE3 LYS 51 4.547 7.860 -11.558
406 HZ1 LYS 51 HZ1 LYS 51 3.775 9.810 -10.504
407 HZ2 LYS 51 HZ2 LYS 51 3.174 8.957 -9.170
408 HZ3 LYS 51 HZ3 LYS 51 2.421 8.808 -10.679
409 H ASP 52 H ASP 52 -1.128 6.485 -8.745
410 HA ASP 52 HA ASP 52 -2.950 4.333 -8.022
411 HB2 ASP 52 HB2 ASP 52 -3.484 6.884 -9.560
412 HB3 ASP 52 HB3 ASP 52 -4.701 5.769 -8.946
413 H LEU 53 H LEU 53 -4.313 3.301 -9.626
414 HA LEU 53 HA LEU 53 -3.052 2.566 -12.075
415 HB2 LEU 53 HB2 LEU 53 -5.932 2.261 -11.176
416 HB3 LEU 53 HB3 LEU 53 -5.234 1.481 -12.585
417 HG LEU 53 HG LEU 53 -4.369 1.000 -9.724
418 HD11 LEU 53 HD11 LEU 53 -6.028 -0.699 -11.589
419 HD12 LEU 53 HD12 LEU 53 -6.580 0.092 -10.111
420 HD13 LEU 53 HD13 LEU 53 -5.400 -1.214 -10.022
421 HD21 LEU 53 HD21 LEU 53 -3.076 -0.862 -10.676
422 HD22 LEU 53 HD22 LEU 53 -2.537 0.697 -11.298
423 HD23 LEU 53 HD23 LEU 53 -3.544 -0.350 -12.299
424 H LEU 54 H LEU 54 -5.231 5.077 -11.089
425 HA LEU 54 HA LEU 54 -5.296 6.142 -13.843
426 HB2 LEU 54 HB2 LEU 54 -7.454 6.452 -11.741
427 HB3 LEU 54 HB3 LEU 54 -7.499 7.095 -13.372
428 HG LEU 54 HG LEU 54 -7.499 4.153 -12.663
429 HD11 LEU 54 HD11 LEU 54 -9.757 5.911 -13.624
430 HD12 LEU 54 HD12 LEU 54 -9.582 5.242 -12.002
431 HD13 LEU 54 HD13 LEU 54 -9.832 4.167 -13.376
432 HD21 LEU 54 HD21 LEU 54 -6.459 4.562 -14.820
433 HD22 LEU 54 HD22 LEU 54 -7.835 5.544 -15.322
434 HD23 LEU 54 HD23 LEU 54 -8.042 3.817 -15.036
435 H GLU 55 H GLU 55 -3.509 7.516 -13.526
436 HA GLU 55 HA GLU 55 -3.767 9.580 -11.432
437 HB2 GLU 55 HB2 GLU 55 -1.375 8.838 -13.133
438 HB3 GLU 55 HB3 GLU 55 -1.392 10.125 -11.937
439 HG2 GLU 55 HG2 GLU 55 -1.966 8.356 -10.223
440 HG3 GLU 55 HG3 GLU 55 -1.617 7.161 -11.473
Start of MODEL 3
1 H1 MET 1 H1 MET 1 -13.211 11.519 -6.067
2 H2 MET 1 H2 MET 1 -12.210 10.962 -7.314
3 H3 MET 1 H3 MET 1 -12.062 12.553 -6.763
4 HA MET 1 HA MET 1 -10.271 11.170 -5.949
5 HB2 MET 1 HB2 MET 1 -10.490 11.701 -3.550
6 HB3 MET 1 HB3 MET 1 -10.958 13.049 -4.574
7 HG2 MET 1 HG2 MET 1 -13.327 12.469 -4.213
8 HG3 MET 1 HG3 MET 1 -12.819 11.169 -3.133
9 HE1 MET 1 HE1 MET 1 -14.410 12.224 -1.212
10 HE2 MET 1 HE2 MET 1 -14.873 13.500 -2.341
11 HE3 MET 1 HE3 MET 1 -14.320 13.913 -0.718
12 H ALA 2 H ALA 2 -9.874 9.694 -3.859
13 HA ALA 2 HA ALA 2 -9.811 7.520 -3.184
14 HB1 ALA 2 HB1 ALA 2 -11.882 6.399 -2.668
15 HB2 ALA 2 HB2 ALA 2 -12.783 7.479 -3.734
16 HB3 ALA 2 HB3 ALA 2 -12.055 8.107 -2.258
17 H SER 3 H SER 3 -8.702 7.575 -5.433
18 HA SER 3 HA SER 3 -10.053 5.992 -7.479
19 HB2 SER 3 HB2 SER 3 -7.205 7.050 -7.515
20 HB3 SER 3 HB3 SER 3 -8.160 6.505 -8.893
21 HG SER 3 HG SER 3 -8.000 8.945 -7.859
22 HA PRO 4 HA PRO 4 -8.113 2.089 -6.387
23 HB2 PRO 4 HB2 PRO 4 -7.594 1.066 -8.889
24 HB3 PRO 4 HB3 PRO 4 -9.187 1.027 -8.125
25 HG2 PRO 4 HG2 PRO 4 -8.105 2.961 -10.146
26 HG3 PRO 4 HG3 PRO 4 -9.700 2.183 -10.085
27 HD2 PRO 4 HD2 PRO 4 -9.349 4.723 -9.280
28 HD3 PRO 4 HD3 PRO 4 -10.483 3.639 -8.444
29 H THR 5 H THR 5 -6.090 2.131 -5.552
30 HA THR 5 HA THR 5 -3.902 3.327 -7.140
31 HB THR 5 HB THR 5 -4.065 2.952 -4.136
32 HG1 THR 5 HG1 THR 5 -4.540 5.212 -5.814
33 HG21 THR 5 HG21 THR 5 -2.101 4.407 -4.055
34 HG22 THR 5 HG22 THR 5 -2.062 4.474 -5.817
35 HG23 THR 5 HG23 THR 5 -1.760 2.948 -4.986
36 H VAL 6 H VAL 6 -2.166 2.131 -7.701
37 HA VAL 6 HA VAL 6 -1.909 -0.583 -6.574
38 HB VAL 6 HB VAL 6 -2.209 -0.541 -9.008
39 HG11 VAL 6 HG11 VAL 6 -1.254 1.639 -9.517
40 HG12 VAL 6 HG12 VAL 6 -0.490 0.383 -10.492
41 HG13 VAL 6 HG13 VAL 6 0.356 1.053 -9.097
42 HG21 VAL 6 HG21 VAL 6 -0.288 -1.941 -9.622
43 HG22 VAL 6 HG22 VAL 6 -0.888 -2.343 -8.014
44 HG23 VAL 6 HG23 VAL 6 0.582 -1.383 -8.193
45 H ILE 7 H ILE 7 -0.220 -1.062 -5.323
46 HA ILE 7 HA ILE 7 1.927 0.936 -5.022
47 HB ILE 7 HB ILE 7 1.149 -1.318 -3.153
48 HG12 ILE 7 HG12 ILE 7 0.606 1.661 -2.935
49 HG13 ILE 7 HG13 ILE 7 -0.596 0.435 -3.323
50 HG21 ILE 7 HG21 ILE 7 2.606 -0.163 -1.530
51 HG22 ILE 7 HG22 ILE 7 3.080 0.979 -2.788
52 HG23 ILE 7 HG23 ILE 7 3.499 -0.728 -2.945
53 HD11 ILE 7 HD11 ILE 7 -0.766 1.100 -1.008
54 HD12 ILE 7 HD12 ILE 7 0.925 0.682 -0.737
55 HD13 ILE 7 HD13 ILE 7 -0.244 -0.583 -1.118
56 H THR 8 H THR 8 3.752 0.481 -6.103
57 HA THR 8 HA THR 8 4.543 -2.271 -6.675
58 HB THR 8 HB THR 8 5.920 0.342 -7.380
59 HG1 THR 8 HG1 THR 8 3.968 -1.234 -8.643
60 HG21 THR 8 HG21 THR 8 7.524 -1.500 -7.314
61 HG22 THR 8 HG22 THR 8 7.212 -1.026 -8.984
62 HG23 THR 8 HG23 THR 8 6.465 -2.482 -8.327
63 H LEU 9 H LEU 9 5.889 -3.410 -5.398
64 HA LEU 9 HA LEU 9 7.069 -2.067 -3.091
65 HB2 LEU 9 HB2 LEU 9 6.913 -5.021 -3.708
66 HB3 LEU 9 HB3 LEU 9 7.402 -4.303 -2.180
67 HG LEU 9 HG LEU 9 4.636 -4.169 -3.406
68 HD11 LEU 9 HD11 LEU 9 5.154 -6.360 -2.489
69 HD12 LEU 9 HD12 LEU 9 3.983 -5.528 -1.468
70 HD13 LEU 9 HD13 LEU 9 5.673 -5.625 -0.972
71 HD21 LEU 9 HD21 LEU 9 5.157 -2.105 -2.210
72 HD22 LEU 9 HD22 LEU 9 5.651 -3.036 -0.794
73 HD23 LEU 9 HD23 LEU 9 3.969 -3.061 -1.324
74 H ASN 10 H ASN 10 9.214 -2.582 -2.351
75 HA ASN 10 HA ASN 10 11.274 -2.128 -4.164
76 HB2 ASN 10 HB2 ASN 10 11.309 -1.769 -1.675
77 HB3 ASN 10 HB3 ASN 10 11.493 -3.504 -1.469
78 HD21 ASN 10 HD21 ASN 10 13.215 -1.227 -0.746
79 HD22 ASN 10 HD22 ASN 10 14.754 -1.574 -1.447
80 H ASP 11 H ASP 11 9.954 -5.130 -2.912
81 HA ASP 11 HA ASP 11 11.838 -6.944 -3.968
82 HB2 ASP 11 HB2 ASP 11 8.889 -7.484 -3.554
83 HB3 ASP 11 HB3 ASP 11 10.223 -8.633 -3.455
84 H GLY 12 H GLY 12 9.121 -5.293 -5.415
85 HA2 GLY 12 HA2 GLY 12 9.113 -5.142 -7.884
86 HA3 GLY 12 HA3 GLY 12 9.452 -6.865 -7.908
87 H ARG 13 H ARG 13 7.497 -7.188 -5.590
88 HA ARG 13 HA ARG 13 5.213 -7.894 -7.093
89 HB2 ARG 13 HB2 ARG 13 5.735 -9.023 -5.015
90 HB3 ARG 13 HB3 ARG 13 5.567 -7.527 -4.108
91 HG2 ARG 13 HG2 ARG 13 3.175 -7.464 -4.652
92 HG3 ARG 13 HG3 ARG 13 3.344 -8.969 -5.557
93 HD2 ARG 13 HD2 ARG 13 4.000 -10.139 -3.525
94 HD3 ARG 13 HD3 ARG 13 3.920 -8.635 -2.609
95 HE ARG 13 HE ARG 13 1.426 -8.871 -3.659
96 HH11 ARG 13 HH11 ARG 13 3.409 -11.003 -1.821
97 HH12 ARG 13 HH12 ARG 13 2.064 -11.739 -1.023
98 HH21 ARG 13 HH21 ARG 13 -0.281 -9.815 -2.637
99 HH22 ARG 13 HH22 ARG 13 -0.011 -11.067 -1.478
100 H GLU 14 H GLU 14 3.213 -6.931 -7.378
101 HA GLU 14 HA GLU 14 2.917 -4.153 -6.392
102 HB2 GLU 14 HB2 GLU 14 1.807 -5.426 -8.907
103 HB3 GLU 14 HB3 GLU 14 1.388 -3.813 -8.343
104 HG2 GLU 14 HG2 GLU 14 3.739 -3.137 -8.561
105 HG3 GLU 14 HG3 GLU 14 4.134 -4.749 -9.158
106 H ILE 15 H ILE 15 1.225 -3.719 -5.093
107 HA ILE 15 HA ILE 15 -0.937 -5.728 -4.864
108 HB ILE 15 HB ILE 15 -0.107 -3.721 -2.747
109 HG12 ILE 15 HG12 ILE 15 0.547 -6.685 -2.934
110 HG13 ILE 15 HG13 ILE 15 1.697 -5.368 -3.147
111 HG21 ILE 15 HG21 ILE 15 -1.503 -5.089 -1.263
112 HG22 ILE 15 HG22 ILE 15 -1.935 -6.131 -2.620
113 HG23 ILE 15 HG23 ILE 15 -2.442 -4.440 -2.606
114 HD11 ILE 15 HD11 ILE 15 1.887 -6.382 -0.947
115 HD12 ILE 15 HD12 ILE 15 0.199 -6.003 -0.612
116 HD13 ILE 15 HD13 ILE 15 1.370 -4.701 -0.825
117 H GLN 16 H GLN 16 -2.976 -5.098 -5.356
118 HA GLN 16 HA GLN 16 -3.397 -2.309 -6.146
119 HB2 GLN 16 HB2 GLN 16 -5.089 -4.767 -6.627
120 HB3 GLN 16 HB3 GLN 16 -5.427 -3.163 -7.265
121 HG2 GLN 16 HG2 GLN 16 -3.356 -3.224 -8.552
122 HG3 GLN 16 HG3 GLN 16 -2.982 -4.815 -7.891
123 HE21 GLN 16 HE21 GLN 16 -5.004 -3.033 -10.076
124 HE22 GLN 16 HE22 GLN 16 -5.649 -4.398 -10.912
125 H ALA 17 H ALA 17 -4.782 -0.944 -5.196
126 HA ALA 17 HA ALA 17 -6.551 -1.931 -3.046
127 HB1 ALA 17 HB1 ALA 17 -6.029 0.061 -1.733
128 HB2 ALA 17 HB2 ALA 17 -4.904 0.603 -2.980
129 HB3 ALA 17 HB3 ALA 17 -4.567 -0.867 -2.067
130 H VAL 18 H VAL 18 -8.427 -0.564 -2.621
131 HA VAL 18 HA VAL 18 -9.527 0.521 -5.083
132 HB VAL 18 HB VAL 18 -11.641 0.740 -3.837
133 HG11 VAL 18 HG11 VAL 18 -10.285 -1.937 -3.498
134 HG12 VAL 18 HG12 VAL 18 -11.127 -1.368 -4.939
135 HG13 VAL 18 HG13 VAL 18 -12.027 -1.658 -3.449
136 HG21 VAL 18 HG21 VAL 18 -10.074 -0.326 -1.482
137 HG22 VAL 18 HG22 VAL 18 -11.822 -0.101 -1.536
138 HG23 VAL 18 HG23 VAL 18 -10.750 1.296 -1.632
139 H ASP 19 H ASP 19 -7.992 1.790 -2.300
140 HA ASP 19 HA ASP 19 -8.397 4.483 -3.336
141 HB2 ASP 19 HB2 ASP 19 -8.775 5.394 -1.030
142 HB3 ASP 19 HB3 ASP 19 -10.106 4.430 -1.658
143 H THR 20 H THR 20 -6.928 6.063 -1.877
144 HA THR 20 HA THR 20 -4.271 5.055 -2.371
145 HB THR 20 HB THR 20 -3.468 7.292 -1.853
146 HG1 THR 20 HG1 THR 20 -4.912 7.732 -0.087
147 HG21 THR 20 HG21 THR 20 -4.445 6.940 -4.073
148 HG22 THR 20 HG22 THR 20 -4.737 8.586 -3.510
149 HG23 THR 20 HG23 THR 20 -6.035 7.392 -3.453
150 HA PRO 21 HA PRO 21 -3.462 3.394 1.638
151 HB2 PRO 21 HB2 PRO 21 -0.706 3.568 1.615
152 HB3 PRO 21 HB3 PRO 21 -1.637 2.311 0.793
153 HG2 PRO 21 HG2 PRO 21 -0.483 4.846 -0.322
154 HG3 PRO 21 HG3 PRO 21 -0.468 3.212 -1.013
155 HD2 PRO 21 HD2 PRO 21 -2.204 5.051 -1.877
156 HD3 PRO 21 HD3 PRO 21 -2.690 3.351 -1.707
157 H LYS 22 H LYS 22 -3.542 4.206 3.617
158 HA LYS 22 HA LYS 22 -2.654 6.915 4.210
159 HB2 LYS 22 HB2 LYS 22 -4.760 6.341 5.156
160 HB3 LYS 22 HB3 LYS 22 -4.162 4.798 5.750
161 HG2 LYS 22 HG2 LYS 22 -2.688 6.069 7.332
162 HG3 LYS 22 HG3 LYS 22 -3.512 7.544 6.821
163 HD2 LYS 22 HD2 LYS 22 -5.618 6.724 7.652
164 HD3 LYS 22 HD3 LYS 22 -4.922 5.134 7.977
165 HE2 LYS 22 HE2 LYS 22 -4.187 7.724 9.359
166 HE3 LYS 22 HE3 LYS 22 -5.152 6.414 10.042
167 HZ1 LYS 22 HZ1 LYS 22 -3.194 4.952 9.782
168 HZ2 LYS 22 HZ2 LYS 22 -2.908 6.245 10.839
169 HZ3 LYS 22 HZ3 LYS 22 -2.289 6.286 9.271
170 H TYR 23 H TYR 23 -0.558 7.261 4.802
171 HA TYR 23 HA TYR 23 1.049 5.123 5.918
172 HB2 TYR 23 HB2 TYR 23 2.140 6.665 4.400
173 HB3 TYR 23 HB3 TYR 23 1.679 8.041 5.396
174 HD1 TYR 23 HD1 TYR 23 3.480 4.772 5.859
175 HD2 TYR 23 HD2 TYR 23 3.385 8.953 6.678
176 HE1 TYR 23 HE1 TYR 23 5.606 4.578 7.081
177 HE2 TYR 23 HE2 TYR 23 5.508 8.764 7.903
178 HH TYR 23 HH TYR 23 6.812 7.033 9.085
179 H ASP 24 H ASP 24 0.898 4.581 7.996
180 HA ASP 24 HA ASP 24 0.101 6.604 9.970
181 HB2 ASP 24 HB2 ASP 24 -1.091 4.371 9.820
182 HB3 ASP 24 HB3 ASP 24 0.397 3.619 10.396
183 H GLU 25 H GLU 25 1.930 7.735 10.428
184 HA GLU 25 HA GLU 25 4.542 6.686 10.464
185 HB2 GLU 25 HB2 GLU 25 3.978 9.073 10.125
186 HB3 GLU 25 HB3 GLU 25 3.513 9.188 11.817
187 HG2 GLU 25 HG2 GLU 25 5.805 8.674 12.492
188 HG3 GLU 25 HG3 GLU 25 6.271 8.521 10.798
189 H GLU 26 H GLU 26 2.135 6.982 12.981
190 HA GLU 26 HA GLU 26 3.776 6.718 15.240
191 HB2 GLU 26 HB2 GLU 26 0.922 5.769 14.887
192 HB3 GLU 26 HB3 GLU 26 1.730 6.065 16.422
193 HG2 GLU 26 HG2 GLU 26 1.075 8.126 14.317
194 HG3 GLU 26 HG3 GLU 26 0.251 7.903 15.861
195 H SER 27 H SER 27 2.149 4.223 13.285
196 HA SER 27 HA SER 27 3.471 2.095 14.780
197 HB2 SER 27 HB2 SER 27 2.208 0.561 13.354
198 HB3 SER 27 HB3 SER 27 1.131 1.800 13.998
199 HG SER 27 HG SER 27 0.819 2.560 12.050
200 H GLY 28 H GLY 28 3.889 3.852 11.802
201 HA2 GLY 28 HA2 GLY 28 5.872 3.955 10.550
202 HA3 GLY 28 HA3 GLY 28 6.424 2.482 11.326
203 H PHE 29 H PHE 29 3.236 2.229 10.160
204 HA PHE 29 HA PHE 29 4.204 0.719 7.805
205 HB2 PHE 29 HB2 PHE 29 1.683 0.221 9.409
206 HB3 PHE 29 HB3 PHE 29 2.293 -0.764 8.083
207 HD1 PHE 29 HD1 PHE 29 4.618 -1.837 8.409
208 HD2 PHE 29 HD2 PHE 29 2.268 -0.298 11.606
209 HE1 PHE 29 HE1 PHE 29 5.900 -3.200 10.006
210 HE2 PHE 29 HE2 PHE 29 3.547 -1.656 13.205
211 HZ PHE 29 HZ PHE 29 5.370 -3.107 12.407
212 H TYR 30 H TYR 30 2.737 0.554 5.977
213 HA TYR 30 HA TYR 30 1.003 2.899 5.610
214 HB2 TYR 30 HB2 TYR 30 2.188 0.910 3.659
215 HB3 TYR 30 HB3 TYR 30 0.944 2.063 3.195
216 HD1 TYR 30 HD1 TYR 30 4.424 1.795 4.483
217 HD2 TYR 30 HD2 TYR 30 1.498 4.293 2.652
218 HE1 TYR 30 HE1 TYR 30 6.155 3.480 4.020
219 HE2 TYR 30 HE2 TYR 30 3.226 5.983 2.187
220 HH TYR 30 HH TYR 30 6.563 5.338 2.510
221 H GLU 31 H GLU 31 -1.124 2.659 5.861
222 HA GLU 31 HA GLU 31 -2.305 -0.031 5.869
223 HB2 GLU 31 HB2 GLU 31 -3.536 2.596 6.765
224 HB3 GLU 31 HB3 GLU 31 -4.205 0.989 7.012
225 HG2 GLU 31 HG2 GLU 31 -2.305 0.425 8.457
226 HG3 GLU 31 HG3 GLU 31 -1.654 2.046 8.223
227 H PHE 32 H PHE 32 -3.344 -0.705 4.084
228 HA PHE 32 HA PHE 32 -4.714 1.279 2.390
229 HB2 PHE 32 HB2 PHE 32 -3.862 0.112 0.357
230 HB3 PHE 32 HB3 PHE 32 -2.595 0.890 1.295
231 HD1 PHE 32 HD1 PHE 32 -1.110 -0.516 2.756
232 HD2 PHE 32 HD2 PHE 32 -3.822 -2.226 -0.053
233 HE1 PHE 32 HE1 PHE 32 0.122 -2.642 2.858
234 HE2 PHE 32 HE2 PHE 32 -2.588 -4.348 0.048
235 HZ PHE 32 HZ PHE 32 -0.611 -4.559 1.507
236 H LYS 33 H LYS 33 -6.540 0.587 1.326
237 HA LYS 33 HA LYS 33 -7.652 -1.967 2.249
238 HB2 LYS 33 HB2 LYS 33 -8.975 0.090 2.631
239 HB3 LYS 33 HB3 LYS 33 -9.022 0.371 0.893
240 HG2 LYS 33 HG2 LYS 33 -10.229 -1.779 0.618
241 HG3 LYS 33 HG3 LYS 33 -10.258 -1.952 2.374
242 HD2 LYS 33 HD2 LYS 33 -11.515 0.289 0.783
243 HD3 LYS 33 HD3 LYS 33 -12.373 -1.057 1.537
244 HE2 LYS 33 HE2 LYS 33 -11.622 -0.288 3.745
245 HE3 LYS 33 HE3 LYS 33 -10.765 1.054 2.987
246 HZ1 LYS 33 HZ1 LYS 33 -12.893 1.871 2.153
247 HZ2 LYS 33 HZ2 LYS 33 -12.889 1.771 3.842
248 HZ3 LYS 33 HZ3 LYS 33 -13.700 0.604 2.930
249 H GLN 34 H GLN 34 -7.214 -3.616 0.929
250 HA GLN 34 HA GLN 34 -6.562 -3.377 -1.814
251 HB2 GLN 34 HB2 GLN 34 -7.316 -5.789 -0.152
252 HB3 GLN 34 HB3 GLN 34 -6.698 -5.878 -1.798
253 HG2 GLN 34 HG2 GLN 34 -4.603 -4.944 -1.150
254 HG3 GLN 34 HG3 GLN 34 -5.209 -4.554 0.459
255 HE21 GLN 34 HE21 GLN 34 -5.398 -6.182 1.980
256 HE22 GLN 34 HE22 GLN 34 -4.649 -7.727 1.777
257 H LEU 35 H LEU 35 -7.721 -4.898 -3.473
258 HA LEU 35 HA LEU 35 -10.101 -3.655 -4.197
259 HB2 LEU 35 HB2 LEU 35 -9.096 -6.368 -5.067
260 HB3 LEU 35 HB3 LEU 35 -10.320 -5.423 -5.898
261 HG LEU 35 HG LEU 35 -7.419 -4.630 -5.541
262 HD11 LEU 35 HD11 LEU 35 -7.255 -4.969 -7.959
263 HD12 LEU 35 HD12 LEU 35 -8.923 -5.542 -7.994
264 HD13 LEU 35 HD13 LEU 35 -7.694 -6.459 -7.123
265 HD21 LEU 35 HD21 LEU 35 -8.884 -2.675 -5.561
266 HD22 LEU 35 HD22 LEU 35 -9.644 -3.244 -7.049
267 HD23 LEU 35 HD23 LEU 35 -7.944 -2.769 -7.049
268 H ASP 36 H ASP 36 -9.646 -6.585 -2.305
269 HA ASP 36 HA ASP 36 -12.459 -7.289 -2.315
270 HB2 ASP 36 HB2 ASP 36 -10.328 -8.396 -0.479
271 HB3 ASP 36 HB3 ASP 36 -11.820 -9.171 -1.008
272 H GLY 37 H GLY 37 -11.142 -4.732 -0.969
273 HA2 GLY 37 HA2 GLY 37 -11.863 -3.364 0.762
274 HA3 GLY 37 HA3 GLY 37 -12.940 -4.647 1.291
275 H LYS 38 H LYS 38 -9.906 -5.953 0.941
276 HA LYS 38 HA LYS 38 -9.565 -6.307 3.753
277 HB2 LYS 38 HB2 LYS 38 -7.527 -6.914 1.597
278 HB3 LYS 38 HB3 LYS 38 -7.609 -7.614 3.206
279 HG2 LYS 38 HG2 LYS 38 -9.870 -8.572 2.493
280 HG3 LYS 38 HG3 LYS 38 -9.409 -8.122 0.850
281 HD2 LYS 38 HD2 LYS 38 -7.853 -9.958 2.688
282 HD3 LYS 38 HD3 LYS 38 -8.863 -10.472 1.339
283 HE2 LYS 38 HE2 LYS 38 -6.563 -8.582 0.911
284 HE3 LYS 38 HE3 LYS 38 -6.298 -10.322 1.004
285 HZ1 LYS 38 HZ1 LYS 38 -6.560 -9.629 -1.276
286 HZ2 LYS 38 HZ2 LYS 38 -8.063 -8.933 -0.941
287 HZ3 LYS 38 HZ3 LYS 38 -7.864 -10.604 -0.829
288 H GLN 39 H GLN 39 -9.145 -4.367 4.830
289 HA GLN 39 HA GLN 39 -6.963 -2.659 3.952
290 HB2 GLN 39 HB2 GLN 39 -9.008 -1.692 4.972
291 HB3 GLN 39 HB3 GLN 39 -8.620 -2.509 6.483
292 HG2 GLN 39 HG2 GLN 39 -6.520 -1.226 6.613
293 HG3 GLN 39 HG3 GLN 39 -6.962 -0.380 5.133
294 HE21 GLN 39 HE21 GLN 39 -7.581 -0.724 8.527
295 HE22 GLN 39 HE22 GLN 39 -8.571 0.684 8.688
296 H THR 40 H THR 40 -4.910 -3.174 4.377
297 HA THR 40 HA THR 40 -4.228 -4.388 6.976
298 HB THR 40 HB THR 40 -4.330 -6.267 5.431
299 HG1 THR 40 HG1 THR 40 -1.958 -6.804 5.568
300 HG21 THR 40 HG21 THR 40 -2.819 -6.416 3.501
301 HG22 THR 40 HG22 THR 40 -2.286 -4.759 3.785
302 HG23 THR 40 HG23 THR 40 -3.957 -5.082 3.319
303 H ARG 41 H ARG 41 -1.791 -4.435 7.307
304 HA ARG 41 HA ARG 41 -0.726 -1.793 6.540
305 HB2 ARG 41 HB2 ARG 41 0.301 -3.635 8.713
306 HB3 ARG 41 HB3 ARG 41 0.722 -1.948 8.463
307 HG2 ARG 41 HG2 ARG 41 -1.567 -1.296 9.055
308 HG3 ARG 41 HG3 ARG 41 -1.973 -2.993 9.320
309 HD2 ARG 41 HD2 ARG 41 -0.029 -1.286 10.875
310 HD3 ARG 41 HD3 ARG 41 -1.505 -2.054 11.462
311 HE ARG 41 HE ARG 41 0.609 -3.814 10.481
312 HH11 ARG 41 HH11 ARG 41 -1.008 -2.454 13.203
313 HH12 ARG 41 HH12 ARG 41 -0.348 -3.614 14.301
314 HH21 ARG 41 HH21 ARG 41 1.440 -5.288 11.895
315 HH22 ARG 41 HH22 ARG 41 1.014 -5.203 13.570
316 H ILE 42 H ILE 42 1.485 -1.575 5.909
317 HA ILE 42 HA ILE 42 3.066 -4.006 5.517
318 HB ILE 42 HB ILE 42 1.914 -3.585 3.348
319 HG12 ILE 42 HG12 ILE 42 4.908 -3.116 3.224
320 HG13 ILE 42 HG13 ILE 42 4.151 -4.686 3.473
321 HG21 ILE 42 HG21 ILE 42 1.752 -1.145 3.482
322 HG22 ILE 42 HG22 ILE 42 2.527 -1.652 1.982
323 HG23 ILE 42 HG23 ILE 42 3.503 -1.014 3.305
324 HD11 ILE 42 HD11 ILE 42 3.897 -2.948 1.030
325 HD12 ILE 42 HD12 ILE 42 3.069 -4.485 1.280
326 HD13 ILE 42 HD13 ILE 42 4.828 -4.437 1.178
327 H ASN 43 H ASN 43 5.290 -3.679 5.751
328 HA ASN 43 HA ASN 43 6.000 -1.478 7.364
329 HB2 ASN 43 HB2 ASN 43 7.033 -3.875 7.211
330 HB3 ASN 43 HB3 ASN 43 8.085 -3.159 5.993
331 HD21 ASN 43 HD21 ASN 43 9.640 -1.666 6.643
332 HD22 ASN 43 HD22 ASN 43 10.031 -1.390 8.302
333 H LYS 44 H LYS 44 7.231 0.348 7.005
334 HA LYS 44 HA LYS 44 6.647 1.702 4.646
335 HB2 LYS 44 HB2 LYS 44 8.066 3.507 5.519
336 HB3 LYS 44 HB3 LYS 44 6.991 2.849 6.744
337 HG2 LYS 44 HG2 LYS 44 8.888 1.494 7.612
338 HG3 LYS 44 HG3 LYS 44 9.942 2.301 6.450
339 HD2 LYS 44 HD2 LYS 44 9.335 4.483 7.482
340 HD3 LYS 44 HD3 LYS 44 8.390 3.612 8.693
341 HE2 LYS 44 HE2 LYS 44 11.370 3.400 8.233
342 HE3 LYS 44 HE3 LYS 44 10.569 4.185 9.591
343 HZ1 LYS 44 HZ1 LYS 44 11.309 2.045 10.275
344 HZ2 LYS 44 HZ2 LYS 44 10.568 1.286 8.957
345 HZ3 LYS 44 HZ3 LYS 44 9.624 1.988 10.169
346 H ASP 45 H ASP 45 9.381 -0.340 5.241
347 HA ASP 45 HA ASP 45 11.074 0.907 3.254
348 HB2 ASP 45 HB2 ASP 45 12.623 -0.944 3.696
349 HB3 ASP 45 HB3 ASP 45 12.088 -0.186 5.191
350 H GLN 46 H GLN 46 8.543 -1.374 3.191
351 HA GLN 46 HA GLN 46 9.465 -2.980 0.998
352 HB2 GLN 46 HB2 GLN 46 6.681 -2.661 2.142
353 HB3 GLN 46 HB3 GLN 46 7.183 -3.919 1.021
354 HG2 GLN 46 HG2 GLN 46 8.274 -3.526 3.803
355 HG3 GLN 46 HG3 GLN 46 7.045 -4.702 3.350
356 HE21 GLN 46 HE21 GLN 46 10.399 -3.887 3.250
357 HE22 GLN 46 HE22 GLN 46 10.961 -5.406 2.646
358 H VAL 47 H VAL 47 7.686 0.018 1.229
359 HA VAL 47 HA VAL 47 6.476 -0.206 -1.374
360 HB VAL 47 HB VAL 47 5.333 1.087 0.322
361 HG11 VAL 47 HG11 VAL 47 7.704 2.957 0.270
362 HG12 VAL 47 HG12 VAL 47 7.252 1.887 1.597
363 HG13 VAL 47 HG13 VAL 47 6.197 3.227 1.146
364 HG21 VAL 47 HG21 VAL 47 6.321 2.855 -1.924
365 HG22 VAL 47 HG22 VAL 47 4.876 3.138 -0.954
366 HG23 VAL 47 HG23 VAL 47 4.969 1.725 -2.006
367 H ARG 48 H ARG 48 7.583 -0.029 -3.221
368 HA ARG 48 HA ARG 48 9.977 1.595 -3.458
369 HB2 ARG 48 HB2 ARG 48 9.845 -0.497 -4.715
370 HB3 ARG 48 HB3 ARG 48 8.392 0.055 -5.539
371 HG2 ARG 48 HG2 ARG 48 9.693 1.846 -6.615
372 HG3 ARG 48 HG3 ARG 48 11.149 1.263 -5.806
373 HD2 ARG 48 HD2 ARG 48 9.469 -0.342 -7.742
374 HD3 ARG 48 HD3 ARG 48 10.973 0.481 -8.149
375 HE ARG 48 HE ARG 48 11.466 -1.234 -5.998
376 HH11 ARG 48 HH11 ARG 48 10.660 -1.428 -9.344
377 HH12 ARG 48 HH12 ARG 48 11.458 -2.946 -9.551
378 HH21 ARG 48 HH21 ARG 48 12.463 -3.191 -6.283
379 HH22 ARG 48 HH22 ARG 48 12.448 -3.942 -7.841
380 H THR 49 H THR 49 6.820 1.587 -5.142
381 HA THR 49 HA THR 49 6.737 4.514 -5.067
382 HB THR 49 HB THR 49 6.054 4.607 -7.492
383 HG1 THR 49 HG1 THR 49 6.986 2.705 -8.708
384 HG21 THR 49 HG21 THR 49 8.308 5.296 -6.812
385 HG22 THR 49 HG22 THR 49 8.332 4.523 -8.399
386 HG23 THR 49 HG23 THR 49 8.872 3.633 -6.976
387 H VAL 50 H VAL 50 4.606 5.390 -5.615
388 HA VAL 50 HA VAL 50 2.392 3.438 -5.399
389 HB VAL 50 HB VAL 50 2.596 6.058 -3.880
390 HG11 VAL 50 HG11 VAL 50 0.387 3.991 -3.888
391 HG12 VAL 50 HG12 VAL 50 0.296 5.611 -4.578
392 HG13 VAL 50 HG13 VAL 50 0.469 5.403 -2.836
393 HG21 VAL 50 HG21 VAL 50 3.998 4.298 -2.908
394 HG22 VAL 50 HG22 VAL 50 2.608 3.213 -2.851
395 HG23 VAL 50 HG23 VAL 50 2.630 4.673 -1.862
396 H LYS 51 H LYS 51 1.286 3.604 -7.273
397 HA LYS 51 HA LYS 51 0.599 6.299 -8.282
398 HB2 LYS 51 HB2 LYS 51 1.443 3.880 -9.887
399 HB3 LYS 51 HB3 LYS 51 0.625 5.263 -10.601
400 HG2 LYS 51 HG2 LYS 51 2.473 6.713 -9.890
401 HG3 LYS 51 HG3 LYS 51 3.298 5.311 -9.205
402 HD2 LYS 51 HD2 LYS 51 3.545 4.308 -11.371
403 HD3 LYS 51 HD3 LYS 51 2.501 5.522 -12.113
404 HE2 LYS 51 HE2 LYS 51 5.192 6.061 -10.846
405 HE3 LYS 51 HE3 LYS 51 4.884 5.930 -12.578
406 HZ1 LYS 51 HZ1 LYS 51 4.946 8.233 -11.896
407 HZ2 LYS 51 HZ2 LYS 51 3.725 7.969 -10.757
408 HZ3 LYS 51 HZ3 LYS 51 3.389 7.832 -12.411
409 H ASP 52 H ASP 52 -1.401 6.454 -9.446
410 HA ASP 52 HA ASP 52 -3.428 4.562 -8.556
411 HB2 ASP 52 HB2 ASP 52 -3.709 7.092 -10.206
412 HB3 ASP 52 HB3 ASP 52 -5.032 6.158 -9.516
413 H LEU 53 H LEU 53 -4.796 3.392 -9.966
414 HA LEU 53 HA LEU 53 -3.661 2.501 -12.430
415 HB2 LEU 53 HB2 LEU 53 -6.415 2.072 -11.255
416 HB3 LEU 53 HB3 LEU 53 -5.825 1.272 -12.700
417 HG LEU 53 HG LEU 53 -4.651 0.973 -9.927
418 HD11 LEU 53 HD11 LEU 53 -6.289 -0.954 -11.577
419 HD12 LEU 53 HD12 LEU 53 -6.830 -0.103 -10.129
420 HD13 LEU 53 HD13 LEU 53 -5.540 -1.298 -10.016
421 HD21 LEU 53 HD21 LEU 53 -3.310 -0.827 -10.940
422 HD22 LEU 53 HD22 LEU 53 -2.936 0.751 -11.630
423 HD23 LEU 53 HD23 LEU 53 -3.938 -0.388 -12.528
424 H LEU 54 H LEU 54 -5.555 5.192 -11.613
425 HA LEU 54 HA LEU 54 -6.193 5.679 -14.457
426 HB2 LEU 54 HB2 LEU 54 -7.794 6.533 -12.032
427 HB3 LEU 54 HB3 LEU 54 -8.134 7.029 -13.681
428 HG LEU 54 HG LEU 54 -8.246 4.180 -12.663
429 HD11 LEU 54 HD11 LEU 54 -10.484 6.091 -13.343
430 HD12 LEU 54 HD12 LEU 54 -10.035 5.543 -11.727
431 HD13 LEU 54 HD13 LEU 54 -10.667 4.392 -12.903
432 HD21 LEU 54 HD21 LEU 54 -7.635 4.328 -15.035
433 HD22 LEU 54 HD22 LEU 54 -9.054 5.330 -15.339
434 HD23 LEU 54 HD23 LEU 54 -9.250 3.655 -14.821
435 H GLU 55 H GLU 55 -4.151 6.775 -14.673
436 HA GLU 55 HA GLU 55 -4.189 9.497 -13.507
437 HB2 GLU 55 HB2 GLU 55 -1.822 7.891 -14.515
438 HB3 GLU 55 HB3 GLU 55 -1.740 9.578 -14.028
439 HG2 GLU 55 HG2 GLU 55 -2.546 8.869 -11.759
440 HG3 GLU 55 HG3 GLU 55 -2.356 7.197 -12.285
Start of MODEL 4
1 H1 MET 1 H1 MET 1 -15.286 8.145 -2.653
2 H2 MET 1 H2 MET 1 -15.699 7.425 -4.129
3 H3 MET 1 H3 MET 1 -16.287 8.958 -3.745
4 HA MET 1 HA MET 1 -14.488 9.087 -5.354
5 HB2 MET 1 HB2 MET 1 -13.810 10.187 -2.613
6 HB3 MET 1 HB3 MET 1 -13.106 10.745 -4.125
7 HG2 MET 1 HG2 MET 1 -15.316 11.475 -4.886
8 HG3 MET 1 HG3 MET 1 -16.021 10.910 -3.371
9 HE1 MET 1 HE1 MET 1 -12.554 12.733 -3.908
10 HE2 MET 1 HE2 MET 1 -13.031 14.416 -3.677
11 HE3 MET 1 HE3 MET 1 -13.628 13.514 -5.070
12 H ALA 2 H ALA 2 -14.141 6.473 -3.669
13 HA ALA 2 HA ALA 2 -11.494 6.172 -2.875
14 HB1 ALA 2 HB1 ALA 2 -11.831 3.778 -3.125
15 HB2 ALA 2 HB2 ALA 2 -13.252 4.060 -4.134
16 HB3 ALA 2 HB3 ALA 2 -13.271 4.525 -2.433
17 H SER 3 H SER 3 -9.781 6.745 -4.073
18 HA SER 3 HA SER 3 -9.744 6.397 -6.957
19 HB2 SER 3 HB2 SER 3 -7.614 7.507 -5.102
20 HB3 SER 3 HB3 SER 3 -7.597 7.595 -6.863
21 HG SER 3 HG SER 3 -9.905 8.572 -5.723
22 HA PRO 4 HA PRO 4 -8.039 2.236 -6.365
23 HB2 PRO 4 HB2 PRO 4 -7.578 1.812 -9.073
24 HB3 PRO 4 HB3 PRO 4 -9.102 1.490 -8.240
25 HG2 PRO 4 HG2 PRO 4 -8.297 3.878 -9.863
26 HG3 PRO 4 HG3 PRO 4 -9.847 3.015 -9.831
27 HD2 PRO 4 HD2 PRO 4 -9.537 5.341 -8.546
28 HD3 PRO 4 HD3 PRO 4 -10.516 4.035 -7.844
29 H THR 5 H THR 5 -6.025 2.031 -5.614
30 HA THR 5 HA THR 5 -3.806 3.382 -7.031
31 HB THR 5 HB THR 5 -4.167 3.069 -4.035
32 HG1 THR 5 HG1 THR 5 -5.408 4.763 -5.103
33 HG21 THR 5 HG21 THR 5 -1.802 2.880 -4.667
34 HG22 THR 5 HG22 THR 5 -2.114 4.399 -3.827
35 HG23 THR 5 HG23 THR 5 -1.923 4.384 -5.580
36 H VAL 6 H VAL 6 -2.037 2.178 -7.490
37 HA VAL 6 HA VAL 6 -1.856 -0.539 -6.366
38 HB VAL 6 HB VAL 6 -2.012 -0.471 -8.813
39 HG11 VAL 6 HG11 VAL 6 -0.212 0.458 -10.184
40 HG12 VAL 6 HG12 VAL 6 0.580 1.078 -8.736
41 HG13 VAL 6 HG13 VAL 6 -0.992 1.714 -9.222
42 HG21 VAL 6 HG21 VAL 6 -0.063 -1.875 -9.322
43 HG22 VAL 6 HG22 VAL 6 -0.776 -2.294 -7.764
44 HG23 VAL 6 HG23 VAL 6 0.708 -1.343 -7.828
45 H ILE 7 H ILE 7 -0.169 -1.102 -5.125
46 HA ILE 7 HA ILE 7 1.949 0.900 -4.669
47 HB ILE 7 HB ILE 7 0.966 -1.324 -2.862
48 HG12 ILE 7 HG12 ILE 7 0.684 1.690 -2.642
49 HG13 ILE 7 HG13 ILE 7 -0.604 0.567 -3.066
50 HG21 ILE 7 HG21 ILE 7 2.445 -0.348 -1.153
51 HG22 ILE 7 HG22 ILE 7 3.083 0.772 -2.357
52 HG23 ILE 7 HG23 ILE 7 3.350 -0.962 -2.537
53 HD11 ILE 7 HD11 ILE 7 0.852 0.651 -0.431
54 HD12 ILE 7 HD12 ILE 7 -0.466 -0.442 -0.855
55 HD13 ILE 7 HD13 ILE 7 -0.759 1.294 -0.750
56 H THR 8 H THR 8 3.752 0.424 -5.799
57 HA THR 8 HA THR 8 4.513 -2.336 -6.344
58 HB THR 8 HB THR 8 6.036 0.203 -7.003
59 HG1 THR 8 HG1 THR 8 4.272 -1.346 -8.643
60 HG21 THR 8 HG21 THR 8 6.312 -2.626 -8.043
61 HG22 THR 8 HG22 THR 8 7.467 -1.767 -7.023
62 HG23 THR 8 HG23 THR 8 7.174 -1.224 -8.675
63 H LEU 9 H LEU 9 5.632 -3.486 -4.890
64 HA LEU 9 HA LEU 9 7.007 -2.208 -2.689
65 HB2 LEU 9 HB2 LEU 9 6.855 -5.148 -3.379
66 HB3 LEU 9 HB3 LEU 9 7.356 -4.457 -1.843
67 HG LEU 9 HG LEU 9 4.573 -4.329 -3.023
68 HD11 LEU 9 HD11 LEU 9 5.182 -6.546 -2.190
69 HD12 LEU 9 HD12 LEU 9 3.953 -5.791 -1.175
70 HD13 LEU 9 HD13 LEU 9 5.632 -5.843 -0.636
71 HD21 LEU 9 HD21 LEU 9 5.626 -3.273 -0.395
72 HD22 LEU 9 HD22 LEU 9 3.931 -3.321 -0.878
73 HD23 LEU 9 HD23 LEU 9 5.069 -2.307 -1.764
74 H ASN 10 H ASN 10 9.203 -3.236 -2.047
75 HA ASN 10 HA ASN 10 11.143 -2.297 -3.816
76 HB2 ASN 10 HB2 ASN 10 11.398 -2.626 -1.338
77 HB3 ASN 10 HB3 ASN 10 11.576 -4.352 -1.634
78 HD21 ASN 10 HD21 ASN 10 13.052 -1.243 -1.879
79 HD22 ASN 10 HD22 ASN 10 14.635 -1.800 -2.293
80 H ASP 11 H ASP 11 10.048 -5.626 -3.260
81 HA ASP 11 HA ASP 11 11.965 -6.857 -4.986
82 HB2 ASP 11 HB2 ASP 11 9.325 -7.937 -3.962
83 HB3 ASP 11 HB3 ASP 11 10.644 -8.890 -4.638
84 H GLY 12 H GLY 12 9.490 -4.874 -5.849
85 HA2 GLY 12 HA2 GLY 12 8.780 -4.437 -8.051
86 HA3 GLY 12 HA3 GLY 12 9.287 -6.051 -8.520
87 H ARG 13 H ARG 13 7.709 -6.875 -5.933
88 HA ARG 13 HA ARG 13 5.320 -7.675 -7.239
89 HB2 ARG 13 HB2 ARG 13 6.388 -8.893 -5.337
90 HB3 ARG 13 HB3 ARG 13 5.884 -7.594 -4.261
91 HG2 ARG 13 HG2 ARG 13 3.539 -8.073 -4.774
92 HG3 ARG 13 HG3 ARG 13 4.040 -9.367 -5.862
93 HD2 ARG 13 HD2 ARG 13 5.121 -10.504 -3.936
94 HD3 ARG 13 HD3 ARG 13 4.479 -9.245 -2.876
95 HE ARG 13 HE ARG 13 2.525 -10.640 -4.501
96 HH11 ARG 13 HH11 ARG 13 4.112 -10.452 -1.451
97 HH12 ARG 13 HH12 ARG 13 2.870 -11.330 -0.631
98 HH21 ARG 13 HH21 ARG 13 0.949 -11.769 -3.445
99 HH22 ARG 13 HH22 ARG 13 1.110 -12.090 -1.752
100 H GLU 14 H GLU 14 3.309 -6.730 -7.309
101 HA GLU 14 HA GLU 14 3.073 -4.090 -5.991
102 HB2 GLU 14 HB2 GLU 14 1.872 -4.941 -8.634
103 HB3 GLU 14 HB3 GLU 14 1.805 -3.333 -7.921
104 HG2 GLU 14 HG2 GLU 14 4.160 -3.031 -8.200
105 HG3 GLU 14 HG3 GLU 14 4.373 -4.712 -8.683
106 H ILE 15 H ILE 15 1.209 -3.579 -4.924
107 HA ILE 15 HA ILE 15 -0.829 -5.707 -4.685
108 HB ILE 15 HB ILE 15 -0.294 -3.455 -2.729
109 HG12 ILE 15 HG12 ILE 15 0.585 -6.357 -2.577
110 HG13 ILE 15 HG13 ILE 15 1.648 -4.995 -2.906
111 HG21 ILE 15 HG21 ILE 15 -1.945 -5.981 -2.495
112 HG22 ILE 15 HG22 ILE 15 -2.562 -4.333 -2.610
113 HG23 ILE 15 HG23 ILE 15 -1.648 -4.832 -1.188
114 HD11 ILE 15 HD11 ILE 15 0.108 -5.455 -0.362
115 HD12 ILE 15 HD12 ILE 15 1.171 -4.087 -0.692
116 HD13 ILE 15 HD13 ILE 15 1.834 -5.720 -0.603
117 H GLN 16 H GLN 16 -3.011 -5.221 -4.907
118 HA GLN 16 HA GLN 16 -3.558 -2.680 -6.297
119 HB2 GLN 16 HB2 GLN 16 -5.073 -5.299 -6.352
120 HB3 GLN 16 HB3 GLN 16 -5.478 -3.865 -7.288
121 HG2 GLN 16 HG2 GLN 16 -3.397 -4.032 -8.513
122 HG3 GLN 16 HG3 GLN 16 -2.896 -5.404 -7.526
123 HE21 GLN 16 HE21 GLN 16 -5.036 -4.331 -10.055
124 HE22 GLN 16 HE22 GLN 16 -5.497 -5.902 -10.599
125 H ALA 17 H ALA 17 -4.621 -1.155 -5.180
126 HA ALA 17 HA ALA 17 -6.586 -1.976 -3.121
127 HB1 ALA 17 HB1 ALA 17 -4.817 0.470 -3.068
128 HB2 ALA 17 HB2 ALA 17 -4.547 -1.008 -2.145
129 HB3 ALA 17 HB3 ALA 17 -5.972 -0.019 -1.826
130 H VAL 18 H VAL 18 -8.443 -0.640 -2.828
131 HA VAL 18 HA VAL 18 -9.372 0.648 -5.258
132 HB VAL 18 HB VAL 18 -11.547 0.838 -4.134
133 HG11 VAL 18 HG11 VAL 18 -10.990 -1.256 -5.276
134 HG12 VAL 18 HG12 VAL 18 -12.034 -1.545 -3.886
135 HG13 VAL 18 HG13 VAL 18 -10.309 -1.896 -3.781
136 HG21 VAL 18 HG21 VAL 18 -10.142 -0.350 -1.737
137 HG22 VAL 18 HG22 VAL 18 -11.882 -0.090 -1.882
138 HG23 VAL 18 HG23 VAL 18 -10.782 1.289 -1.863
139 H ASP 19 H ASP 19 -8.008 1.666 -2.264
140 HA ASP 19 HA ASP 19 -8.334 4.447 -3.098
141 HB2 ASP 19 HB2 ASP 19 -8.776 5.119 -0.697
142 HB3 ASP 19 HB3 ASP 19 -10.101 4.312 -1.527
143 H THR 20 H THR 20 -6.979 5.886 -1.431
144 HA THR 20 HA THR 20 -4.279 5.004 -1.948
145 HB THR 20 HB THR 20 -3.587 7.233 -1.226
146 HG1 THR 20 HG1 THR 20 -5.735 7.168 0.280
147 HG21 THR 20 HG21 THR 20 -4.473 6.972 -3.508
148 HG22 THR 20 HG22 THR 20 -4.811 8.577 -2.857
149 HG23 THR 20 HG23 THR 20 -6.089 7.363 -2.920
150 HA PRO 21 HA PRO 21 -3.347 3.504 2.129
151 HB2 PRO 21 HB2 PRO 21 -0.642 3.590 2.054
152 HB3 PRO 21 HB3 PRO 21 -1.581 2.419 1.121
153 HG2 PRO 21 HG2 PRO 21 -0.355 5.006 0.221
154 HG3 PRO 21 HG3 PRO 21 -0.348 3.425 -0.584
155 HD2 PRO 21 HD2 PRO 21 -2.065 5.419 -1.269
156 HD3 PRO 21 HD3 PRO 21 -2.481 3.699 -1.420
157 H LYS 22 H LYS 22 -3.075 4.308 4.154
158 HA LYS 22 HA LYS 22 -2.216 7.104 4.492
159 HB2 LYS 22 HB2 LYS 22 -4.366 6.517 5.489
160 HB3 LYS 22 HB3 LYS 22 -3.624 5.188 6.372
161 HG2 LYS 22 HG2 LYS 22 -2.212 6.879 7.572
162 HG3 LYS 22 HG3 LYS 22 -3.168 8.142 6.796
163 HD2 LYS 22 HD2 LYS 22 -4.230 5.984 8.628
164 HD3 LYS 22 HD3 LYS 22 -3.962 7.671 9.066
165 HE2 LYS 22 HE2 LYS 22 -5.608 8.344 7.343
166 HE3 LYS 22 HE3 LYS 22 -5.914 6.639 7.003
167 HZ1 LYS 22 HZ1 LYS 22 -6.354 7.980 9.616
168 HZ2 LYS 22 HZ2 LYS 22 -6.673 6.353 9.270
169 HZ3 LYS 22 HZ3 LYS 22 -7.563 7.566 8.503
170 H TYR 23 H TYR 23 -0.281 7.613 5.451
171 HA TYR 23 HA TYR 23 1.357 5.426 6.510
172 HB2 TYR 23 HB2 TYR 23 2.455 6.888 4.916
173 HB3 TYR 23 HB3 TYR 23 2.047 8.307 5.875
174 HD1 TYR 23 HD1 TYR 23 3.915 5.075 6.133
175 HD2 TYR 23 HD2 TYR 23 3.628 9.132 7.395
176 HE1 TYR 23 HE1 TYR 23 6.029 4.839 7.361
177 HE2 TYR 23 HE2 TYR 23 5.744 8.901 8.627
178 HH TYR 23 HH TYR 23 7.050 6.951 9.690
179 H ASP 24 H ASP 24 1.469 5.021 8.632
180 HA ASP 24 HA ASP 24 0.836 7.149 10.563
181 HB2 ASP 24 HB2 ASP 24 -0.304 4.974 10.840
182 HB3 ASP 24 HB3 ASP 24 1.260 4.177 11.006
183 H GLU 25 H GLU 25 2.466 8.248 11.510
184 HA GLU 25 HA GLU 25 5.163 7.741 10.791
185 HB2 GLU 25 HB2 GLU 25 4.359 9.995 11.182
186 HB3 GLU 25 HB3 GLU 25 3.993 9.611 12.859
187 HG2 GLU 25 HG2 GLU 25 6.370 9.294 13.323
188 HG3 GLU 25 HG3 GLU 25 6.752 9.632 11.635
189 H GLU 26 H GLU 26 3.292 6.706 13.525
190 HA GLU 26 HA GLU 26 5.573 6.286 15.255
191 HB2 GLU 26 HB2 GLU 26 2.658 5.547 15.584
192 HB3 GLU 26 HB3 GLU 26 3.883 5.409 16.843
193 HG2 GLU 26 HG2 GLU 26 4.227 7.799 16.842
194 HG3 GLU 26 HG3 GLU 26 3.141 7.988 15.466
195 H SER 27 H SER 27 3.263 4.150 13.554
196 HA SER 27 HA SER 27 4.822 1.798 14.310
197 HB2 SER 27 HB2 SER 27 3.031 0.500 13.248
198 HB3 SER 27 HB3 SER 27 2.359 1.678 14.375
199 HG SER 27 HG SER 27 1.509 2.784 12.762
200 H GLY 28 H GLY 28 4.320 3.844 11.519
201 HA2 GLY 28 HA2 GLY 28 5.726 4.038 9.674
202 HA3 GLY 28 HA3 GLY 28 6.571 2.589 10.189
203 H PHE 29 H PHE 29 3.231 2.081 10.087
204 HA PHE 29 HA PHE 29 3.521 0.535 7.612
205 HB2 PHE 29 HB2 PHE 29 1.439 0.462 9.810
206 HB3 PHE 29 HB3 PHE 29 1.325 -0.495 8.338
207 HD1 PHE 29 HD1 PHE 29 3.069 -2.231 7.869
208 HD2 PHE 29 HD2 PHE 29 2.809 -0.222 11.612
209 HE1 PHE 29 HE1 PHE 29 4.448 -3.986 8.903
210 HE2 PHE 29 HE2 PHE 29 4.187 -1.973 12.652
211 HZ PHE 29 HZ PHE 29 5.009 -3.859 11.296
212 H TYR 30 H TYR 30 2.075 0.646 5.899
213 HA TYR 30 HA TYR 30 0.435 3.076 5.682
214 HB2 TYR 30 HB2 TYR 30 1.531 1.152 3.625
215 HB3 TYR 30 HB3 TYR 30 0.292 2.336 3.228
216 HD1 TYR 30 HD1 TYR 30 3.772 2.012 4.521
217 HD2 TYR 30 HD2 TYR 30 0.872 4.548 2.698
218 HE1 TYR 30 HE1 TYR 30 5.509 3.697 4.096
219 HE2 TYR 30 HE2 TYR 30 2.607 6.236 2.274
220 HH TYR 30 HH TYR 30 4.767 6.891 3.045
221 H GLU 31 H GLU 31 -1.729 2.962 5.833
222 HA GLU 31 HA GLU 31 -3.023 0.317 5.845
223 HB2 GLU 31 HB2 GLU 31 -4.234 2.985 6.624
224 HB3 GLU 31 HB3 GLU 31 -4.873 1.384 6.972
225 HG2 GLU 31 HG2 GLU 31 -2.886 0.963 8.405
226 HG3 GLU 31 HG3 GLU 31 -2.382 2.628 8.128
227 H PHE 32 H PHE 32 -4.034 -0.345 4.028
228 HA PHE 32 HA PHE 32 -5.504 1.593 2.401
229 HB2 PHE 32 HB2 PHE 32 -4.495 0.686 0.295
230 HB3 PHE 32 HB3 PHE 32 -3.374 1.599 1.295
231 HD1 PHE 32 HD1 PHE 32 -1.692 0.357 2.699
232 HD2 PHE 32 HD2 PHE 32 -4.074 -1.567 -0.271
233 HE1 PHE 32 HE1 PHE 32 -0.126 -1.535 2.668
234 HE2 PHE 32 HE2 PHE 32 -2.508 -3.456 -0.301
235 HZ PHE 32 HZ PHE 32 -0.530 -3.447 1.170
236 H LYS 33 H LYS 33 -7.180 0.749 1.175
237 HA LYS 33 HA LYS 33 -8.097 -1.895 2.044
238 HB2 LYS 33 HB2 LYS 33 -9.561 0.133 2.196
239 HB3 LYS 33 HB3 LYS 33 -9.560 0.215 0.442
240 HG2 LYS 33 HG2 LYS 33 -10.583 -2.053 0.390
241 HG3 LYS 33 HG3 LYS 33 -10.692 -1.994 2.149
242 HD2 LYS 33 HD2 LYS 33 -12.018 -0.073 0.226
243 HD3 LYS 33 HD3 LYS 33 -12.819 -1.383 1.086
244 HE2 LYS 33 HE2 LYS 33 -13.323 0.584 2.289
245 HE3 LYS 33 HE3 LYS 33 -12.092 -0.250 3.233
246 HZ1 LYS 33 HZ1 LYS 33 -10.453 1.272 2.508
247 HZ2 LYS 33 HZ2 LYS 33 -11.784 2.201 2.965
248 HZ3 LYS 33 HZ3 LYS 33 -11.462 1.939 1.328
249 H GLN 34 H GLN 34 -7.675 -3.613 0.791
250 HA GLN 34 HA GLN 34 -6.655 -3.437 -1.853
251 HB2 GLN 34 HB2 GLN 34 -7.759 -5.828 -0.355
252 HB3 GLN 34 HB3 GLN 34 -6.801 -5.907 -1.829
253 HG2 GLN 34 HG2 GLN 34 -4.877 -5.023 -0.693
254 HG3 GLN 34 HG3 GLN 34 -5.820 -4.731 0.769
255 HE21 GLN 34 HE21 GLN 34 -6.465 -6.494 2.026
256 HE22 GLN 34 HE22 GLN 34 -5.698 -8.038 1.900
257 H LEU 35 H LEU 35 -7.593 -4.513 -3.798
258 HA LEU 35 HA LEU 35 -10.241 -3.825 -4.433
259 HB2 LEU 35 HB2 LEU 35 -8.542 -6.026 -5.631
260 HB3 LEU 35 HB3 LEU 35 -10.022 -5.408 -6.337
261 HG LEU 35 HG LEU 35 -7.438 -3.879 -5.977
262 HD11 LEU 35 HD11 LEU 35 -7.381 -5.528 -7.780
263 HD12 LEU 35 HD12 LEU 35 -7.362 -3.881 -8.409
264 HD13 LEU 35 HD13 LEU 35 -8.848 -4.830 -8.470
265 HD21 LEU 35 HD21 LEU 35 -8.536 -2.066 -7.211
266 HD22 LEU 35 HD22 LEU 35 -9.338 -2.386 -5.674
267 HD23 LEU 35 HD23 LEU 35 -10.054 -2.964 -7.178
268 H ASP 36 H ASP 36 -8.956 -6.509 -2.722
269 HA ASP 36 HA ASP 36 -11.166 -8.293 -2.916
270 HB2 ASP 36 HB2 ASP 36 -8.941 -9.079 -2.347
271 HB3 ASP 36 HB3 ASP 36 -8.899 -8.051 -0.919
272 H GLY 37 H GLY 37 -10.760 -5.366 -1.232
273 HA2 GLY 37 HA2 GLY 37 -12.551 -4.322 -0.062
274 HA3 GLY 37 HA3 GLY 37 -13.147 -5.907 0.401
275 H LYS 38 H LYS 38 -10.668 -6.963 1.391
276 HA LYS 38 HA LYS 38 -10.734 -5.925 4.036
277 HB2 LYS 38 HB2 LYS 38 -8.827 -7.871 2.721
278 HB3 LYS 38 HB3 LYS 38 -8.802 -7.488 4.437
279 HG2 LYS 38 HG2 LYS 38 -11.239 -8.242 4.484
280 HG3 LYS 38 HG3 LYS 38 -10.947 -8.908 2.876
281 HD2 LYS 38 HD2 LYS 38 -9.341 -9.611 5.342
282 HD3 LYS 38 HD3 LYS 38 -10.683 -10.566 4.719
283 HE2 LYS 38 HE2 LYS 38 -8.235 -9.905 3.085
284 HE3 LYS 38 HE3 LYS 38 -8.371 -11.358 4.073
285 HZ1 LYS 38 HZ1 LYS 38 -10.271 -10.630 1.916
286 HZ2 LYS 38 HZ2 LYS 38 -10.227 -12.083 2.778
287 HZ3 LYS 38 HZ3 LYS 38 -8.973 -11.689 1.715
288 H GLN 39 H GLN 39 -9.604 -4.332 4.979
289 HA GLN 39 HA GLN 39 -7.571 -2.915 3.457
290 HB2 GLN 39 HB2 GLN 39 -9.291 -1.643 4.670
291 HB3 GLN 39 HB3 GLN 39 -8.749 -2.338 6.191
292 HG2 GLN 39 HG2 GLN 39 -6.621 -1.210 6.004
293 HG3 GLN 39 HG3 GLN 39 -7.045 -0.604 4.406
294 HE21 GLN 39 HE21 GLN 39 -6.811 1.541 5.005
295 HE22 GLN 39 HE22 GLN 39 -7.924 2.346 6.047
296 H THR 40 H THR 40 -5.481 -3.446 3.580
297 HA THR 40 HA THR 40 -4.485 -4.777 6.029
298 HB THR 40 HB THR 40 -4.469 -6.304 4.101
299 HG1 THR 40 HG1 THR 40 -2.187 -6.814 4.258
300 HG21 THR 40 HG21 THR 40 -4.191 -4.614 2.310
301 HG22 THR 40 HG22 THR 40 -3.005 -5.914 2.190
302 HG23 THR 40 HG23 THR 40 -2.530 -4.347 2.843
303 H ARG 41 H ARG 41 -2.060 -4.559 6.298
304 HA ARG 41 HA ARG 41 -1.170 -1.828 5.621
305 HB2 ARG 41 HB2 ARG 41 -0.930 -3.148 8.338
306 HB3 ARG 41 HB3 ARG 41 -0.312 -1.558 7.906
307 HG2 ARG 41 HG2 ARG 41 -2.527 -0.689 7.641
308 HG3 ARG 41 HG3 ARG 41 -3.231 -2.298 7.810
309 HD2 ARG 41 HD2 ARG 41 -1.752 -0.753 9.943
310 HD3 ARG 41 HD3 ARG 41 -3.491 -1.048 9.872
311 HE ARG 41 HE ARG 41 -1.918 -3.450 9.865
312 HH11 ARG 41 HH11 ARG 41 -3.420 -1.085 11.872
313 HH12 ARG 41 HH12 ARG 41 -3.473 -2.133 13.244
314 HH21 ARG 41 HH21 ARG 41 -2.032 -4.791 11.618
315 HH22 ARG 41 HH22 ARG 41 -2.724 -4.217 13.095
316 H ILE 42 H ILE 42 0.947 -1.625 5.064
317 HA ILE 42 HA ILE 42 2.802 -3.833 5.679
318 HB ILE 42 HB ILE 42 1.987 -4.055 3.325
319 HG12 ILE 42 HG12 ILE 42 4.933 -3.361 3.550
320 HG13 ILE 42 HG13 ILE 42 4.221 -4.884 4.074
321 HG21 ILE 42 HG21 ILE 42 1.683 -1.686 2.803
322 HG22 ILE 42 HG22 ILE 42 2.751 -2.456 1.630
323 HG23 ILE 42 HG23 ILE 42 3.428 -1.431 2.896
324 HD11 ILE 42 HD11 ILE 42 3.537 -5.337 1.763
325 HD12 ILE 42 HD12 ILE 42 5.281 -5.136 1.926
326 HD13 ILE 42 HD13 ILE 42 4.304 -3.830 1.257
327 H ASN 43 H ASN 43 5.049 -3.206 5.784
328 HA ASN 43 HA ASN 43 5.293 -0.707 7.121
329 HB2 ASN 43 HB2 ASN 43 6.532 -2.816 7.732
330 HB3 ASN 43 HB3 ASN 43 7.565 -2.539 6.332
331 HD21 ASN 43 HD21 ASN 43 9.412 -2.225 7.523
332 HD22 ASN 43 HD22 ASN 43 9.664 -0.840 8.522
333 H LYS 44 H LYS 44 6.696 1.018 6.696
334 HA LYS 44 HA LYS 44 6.467 2.123 4.144
335 HB2 LYS 44 HB2 LYS 44 7.992 3.897 5.030
336 HB3 LYS 44 HB3 LYS 44 6.627 3.526 6.075
337 HG2 LYS 44 HG2 LYS 44 8.068 2.159 7.496
338 HG3 LYS 44 HG3 LYS 44 9.445 2.510 6.451
339 HD2 LYS 44 HD2 LYS 44 9.282 4.879 6.993
340 HD3 LYS 44 HD3 LYS 44 7.843 4.575 7.966
341 HE2 LYS 44 HE2 LYS 44 9.149 3.213 9.511
342 HE3 LYS 44 HE3 LYS 44 10.592 3.451 8.526
343 HZ1 LYS 44 HZ1 LYS 44 9.080 5.611 9.881
344 HZ2 LYS 44 HZ2 LYS 44 10.509 5.802 8.997
345 HZ3 LYS 44 HZ3 LYS 44 10.519 4.932 10.449
346 H ASP 45 H ASP 45 9.092 0.185 5.444
347 HA ASP 45 HA ASP 45 11.029 1.131 3.545
348 HB2 ASP 45 HB2 ASP 45 12.492 -0.629 4.457
349 HB3 ASP 45 HB3 ASP 45 11.782 0.365 5.719
350 H GLN 46 H GLN 46 8.468 -1.051 3.311
351 HA GLN 46 HA GLN 46 9.731 -2.718 1.274
352 HB2 GLN 46 HB2 GLN 46 6.920 -2.776 2.399
353 HB3 GLN 46 HB3 GLN 46 7.583 -3.944 1.264
354 HG2 GLN 46 HG2 GLN 46 8.694 -3.437 4.014
355 HG3 GLN 46 HG3 GLN 46 7.535 -4.705 3.632
356 HE21 GLN 46 HE21 GLN 46 8.990 -6.289 4.301
357 HE22 GLN 46 HE22 GLN 46 10.357 -6.742 3.349
358 H VAL 47 H VAL 47 7.532 0.009 1.442
359 HA VAL 47 HA VAL 47 6.474 -0.363 -1.211
360 HB VAL 47 HB VAL 47 5.065 0.767 0.378
361 HG11 VAL 47 HG11 VAL 47 7.211 2.887 0.564
362 HG12 VAL 47 HG12 VAL 47 6.752 1.748 1.829
363 HG13 VAL 47 HG13 VAL 47 5.611 2.984 1.299
364 HG21 VAL 47 HG21 VAL 47 6.007 2.718 -1.734
365 HG22 VAL 47 HG22 VAL 47 4.469 2.791 -0.876
366 HG23 VAL 47 HG23 VAL 47 4.811 1.440 -1.958
367 H ARG 48 H ARG 48 7.622 -0.058 -2.982
368 HA ARG 48 HA ARG 48 9.902 1.727 -3.082
369 HB2 ARG 48 HB2 ARG 48 9.833 -0.509 -4.228
370 HB3 ARG 48 HB3 ARG 48 8.639 0.150 -5.336
371 HG2 ARG 48 HG2 ARG 48 10.271 1.812 -6.107
372 HG3 ARG 48 HG3 ARG 48 11.468 1.139 -4.996
373 HD2 ARG 48 HD2 ARG 48 11.218 -1.053 -6.165
374 HD3 ARG 48 HD3 ARG 48 10.167 -0.256 -7.339
375 HE ARG 48 HE ARG 48 12.687 1.061 -7.092
376 HH11 ARG 48 HH11 ARG 48 11.086 -1.596 -8.589
377 HH12 ARG 48 HH12 ARG 48 12.256 -1.729 -9.847
378 HH21 ARG 48 HH21 ARG 48 14.192 0.864 -8.700
379 HH22 ARG 48 HH22 ARG 48 14.011 -0.370 -9.901
380 H THR 49 H THR 49 6.849 1.463 -4.954
381 HA THR 49 HA THR 49 6.779 4.404 -5.208
382 HB THR 49 HB THR 49 6.100 4.288 -7.556
383 HG1 THR 49 HG1 THR 49 6.331 2.216 -8.649
384 HG21 THR 49 HG21 THR 49 8.503 4.519 -7.096
385 HG22 THR 49 HG22 THR 49 8.214 3.613 -8.583
386 HG23 THR 49 HG23 THR 49 8.671 2.762 -7.108
387 H VAL 50 H VAL 50 4.708 5.316 -5.436
388 HA VAL 50 HA VAL 50 2.415 3.472 -5.101
389 HB VAL 50 HB VAL 50 2.665 6.290 -4.005
390 HG11 VAL 50 HG11 VAL 50 0.366 5.702 -4.630
391 HG12 VAL 50 HG12 VAL 50 0.544 5.850 -2.883
392 HG13 VAL 50 HG13 VAL 50 0.463 4.252 -3.627
393 HG21 VAL 50 HG21 VAL 50 2.727 3.634 -2.559
394 HG22 VAL 50 HG22 VAL 50 2.686 5.217 -1.786
395 HG23 VAL 50 HG23 VAL 50 4.080 4.747 -2.758
396 H LYS 51 H LYS 51 1.269 3.415 -6.944
397 HA LYS 51 HA LYS 51 0.940 5.901 -8.516
398 HB2 LYS 51 HB2 LYS 51 1.333 3.102 -9.599
399 HB3 LYS 51 HB3 LYS 51 0.978 4.525 -10.569
400 HG2 LYS 51 HG2 LYS 51 3.114 5.526 -9.727
401 HG3 LYS 51 HG3 LYS 51 3.475 3.966 -8.980
402 HD2 LYS 51 HD2 LYS 51 2.977 4.432 -11.928
403 HD3 LYS 51 HD3 LYS 51 4.559 4.215 -11.181
404 HE2 LYS 51 HE2 LYS 51 4.124 1.959 -10.660
405 HE3 LYS 51 HE3 LYS 51 2.391 2.139 -10.934
406 HZ1 LYS 51 HZ1 LYS 51 3.538 0.972 -12.750
407 HZ2 LYS 51 HZ2 LYS 51 4.458 2.358 -13.055
408 HZ3 LYS 51 HZ3 LYS 51 2.782 2.394 -13.273
409 H ASP 52 H ASP 52 -0.937 5.771 -10.074
410 HA ASP 52 HA ASP 52 -3.274 4.632 -8.743
411 HB2 ASP 52 HB2 ASP 52 -3.044 6.411 -11.187
412 HB3 ASP 52 HB3 ASP 52 -4.555 5.929 -10.421
413 H LEU 53 H LEU 53 -4.630 3.066 -9.641
414 HA LEU 53 HA LEU 53 -3.559 1.250 -11.549
415 HB2 LEU 53 HB2 LEU 53 -6.319 1.571 -10.374
416 HB3 LEU 53 HB3 LEU 53 -5.951 0.324 -11.551
417 HG LEU 53 HG LEU 53 -4.573 0.599 -8.868
418 HD11 LEU 53 HD11 LEU 53 -6.921 0.001 -8.577
419 HD12 LEU 53 HD12 LEU 53 -5.868 -1.360 -8.198
420 HD13 LEU 53 HD13 LEU 53 -6.737 -1.320 -9.732
421 HD21 LEU 53 HD21 LEU 53 -3.699 -1.635 -9.358
422 HD22 LEU 53 HD22 LEU 53 -3.185 -0.472 -10.581
423 HD23 LEU 53 HD23 LEU 53 -4.488 -1.607 -10.935
424 H LEU 54 H LEU 54 -5.274 4.183 -11.912
425 HA LEU 54 HA LEU 54 -6.013 3.563 -14.695
426 HB2 LEU 54 HB2 LEU 54 -6.906 5.823 -12.892
427 HB3 LEU 54 HB3 LEU 54 -7.446 5.573 -14.544
428 HG LEU 54 HG LEU 54 -7.961 3.703 -12.218
429 HD11 LEU 54 HD11 LEU 54 -9.830 5.533 -13.725
430 HD12 LEU 54 HD12 LEU 54 -9.264 5.755 -12.069
431 HD13 LEU 54 HD13 LEU 54 -10.297 4.384 -12.470
432 HD21 LEU 54 HD21 LEU 54 -7.735 2.463 -14.303
433 HD22 LEU 54 HD22 LEU 54 -8.884 3.545 -15.092
434 HD23 LEU 54 HD23 LEU 54 -9.419 2.495 -13.780
435 H GLU 55 H GLU 55 -3.256 4.101 -13.994
436 HA GLU 55 HA GLU 55 -2.551 6.769 -14.676
437 HB2 GLU 55 HB2 GLU 55 -0.257 5.863 -15.033
438 HB3 GLU 55 HB3 GLU 55 -0.952 5.445 -13.475
439 HG2 GLU 55 HG2 GLU 55 -1.396 3.201 -14.210
440 HG3 GLU 55 HG3 GLU 55 -0.898 3.596 -15.854
Start of MODEL 5
1 H1 MET 1 H1 MET 1 -10.641 12.185 -2.758
2 H2 MET 1 H2 MET 1 -9.882 11.080 -3.792
3 H3 MET 1 H3 MET 1 -9.425 11.167 -2.167
4 HA MET 1 HA MET 1 -11.540 10.352 -1.442
5 HB2 MET 1 HB2 MET 1 -13.252 9.660 -3.047
6 HB3 MET 1 HB3 MET 1 -12.889 11.369 -3.242
7 HG2 MET 1 HG2 MET 1 -11.564 10.909 -5.208
8 HG3 MET 1 HG3 MET 1 -11.774 9.172 -4.981
9 HE1 MET 1 HE1 MET 1 -12.390 10.780 -7.703
10 HE2 MET 1 HE2 MET 1 -13.887 9.991 -8.204
11 HE3 MET 1 HE3 MET 1 -12.563 9.032 -7.543
12 H ALA 2 H ALA 2 -12.400 7.982 -1.958
13 HA ALA 2 HA ALA 2 -10.189 6.218 -2.070
14 HB1 ALA 2 HB1 ALA 2 -12.240 5.649 -0.882
15 HB2 ALA 2 HB2 ALA 2 -11.858 4.423 -2.091
16 HB3 ALA 2 HB3 ALA 2 -13.128 5.606 -2.404
17 H SER 3 H SER 3 -9.084 6.720 -3.997
18 HA SER 3 HA SER 3 -10.397 5.961 -6.523
19 HB2 SER 3 HB2 SER 3 -7.796 7.456 -6.054
20 HB3 SER 3 HB3 SER 3 -8.514 7.117 -7.630
21 HG SER 3 HG SER 3 -8.979 9.177 -6.043
22 HA PRO 4 HA PRO 4 -8.093 2.168 -6.762
23 HB2 PRO 4 HB2 PRO 4 -7.633 2.001 -9.470
24 HB3 PRO 4 HB3 PRO 4 -9.178 1.614 -8.707
25 HG2 PRO 4 HG2 PRO 4 -8.324 4.142 -10.075
26 HG3 PRO 4 HG3 PRO 4 -9.864 3.271 -10.197
27 HD2 PRO 4 HD2 PRO 4 -9.609 5.466 -8.665
28 HD3 PRO 4 HD3 PRO 4 -10.644 4.109 -8.174
29 H THR 5 H THR 5 -6.083 2.124 -5.962
30 HA THR 5 HA THR 5 -3.898 3.492 -7.423
31 HB THR 5 HB THR 5 -4.164 3.188 -4.414
32 HG1 THR 5 HG1 THR 5 -4.469 5.408 -6.173
33 HG21 THR 5 HG21 THR 5 -2.001 4.525 -6.054
34 HG22 THR 5 HG22 THR 5 -1.831 3.030 -5.133
35 HG23 THR 5 HG23 THR 5 -2.124 4.553 -4.294
36 H VAL 6 H VAL 6 -2.177 2.242 -7.939
37 HA VAL 6 HA VAL 6 -1.994 -0.448 -6.755
38 HB VAL 6 HB VAL 6 -2.193 -0.456 -9.185
39 HG11 VAL 6 HG11 VAL 6 -0.460 0.477 -10.637
40 HG12 VAL 6 HG12 VAL 6 0.363 1.157 -9.232
41 HG13 VAL 6 HG13 VAL 6 -1.242 1.740 -9.682
42 HG21 VAL 6 HG21 VAL 6 -0.230 -1.826 -9.722
43 HG22 VAL 6 HG22 VAL 6 -0.878 -2.224 -8.130
44 HG23 VAL 6 HG23 VAL 6 0.578 -1.239 -8.269
45 H ILE 7 H ILE 7 -0.417 -0.885 -5.365
46 HA ILE 7 HA ILE 7 1.787 1.038 -5.044
47 HB ILE 7 HB ILE 7 0.784 -1.081 -3.129
48 HG12 ILE 7 HG12 ILE 7 0.487 1.939 -3.083
49 HG13 ILE 7 HG13 ILE 7 -0.798 0.786 -3.426
50 HG21 ILE 7 HG21 ILE 7 2.268 -0.002 -1.483
51 HG22 ILE 7 HG22 ILE 7 2.890 1.056 -2.751
52 HG23 ILE 7 HG23 ILE 7 3.168 -0.684 -2.836
53 HD11 ILE 7 HD11 ILE 7 -0.962 1.613 -1.163
54 HD12 ILE 7 HD12 ILE 7 0.679 1.070 -0.820
55 HD13 ILE 7 HD13 ILE 7 -0.587 -0.109 -1.160
56 H THR 8 H THR 8 3.684 0.498 -5.893
57 HA THR 8 HA THR 8 4.376 -2.292 -6.421
58 HB THR 8 HB THR 8 5.961 0.224 -7.035
59 HG1 THR 8 HG1 THR 8 3.876 -1.059 -8.347
60 HG21 THR 8 HG21 THR 8 7.377 -1.770 -6.912
61 HG22 THR 8 HG22 THR 8 7.222 -1.217 -8.579
62 HG23 THR 8 HG23 THR 8 6.301 -2.614 -8.025
63 H LEU 9 H LEU 9 5.524 -3.472 -5.005
64 HA LEU 9 HA LEU 9 6.754 -2.166 -2.712
65 HB2 LEU 9 HB2 LEU 9 6.478 -5.113 -3.335
66 HB3 LEU 9 HB3 LEU 9 6.992 -4.425 -1.798
67 HG LEU 9 HG LEU 9 4.249 -4.069 -3.037
68 HD11 LEU 9 HD11 LEU 9 4.608 -6.371 -2.318
69 HD12 LEU 9 HD12 LEU 9 3.469 -5.552 -1.248
70 HD13 LEU 9 HD13 LEU 9 5.136 -5.807 -0.732
71 HD21 LEU 9 HD21 LEU 9 3.652 -3.120 -0.846
72 HD22 LEU 9 HD22 LEU 9 4.884 -2.165 -1.668
73 HD23 LEU 9 HD23 LEU 9 5.340 -3.235 -0.343
74 H ASN 10 H ASN 10 8.903 -2.605 -2.008
75 HA ASN 10 HA ASN 10 10.979 -2.477 -3.841
76 HB2 ASN 10 HB2 ASN 10 11.358 -1.817 -1.570
77 HB3 ASN 10 HB3 ASN 10 10.893 -3.400 -0.959
78 HD21 ASN 10 HD21 ASN 10 13.372 -1.609 -2.644
79 HD22 ASN 10 HD22 ASN 10 14.647 -2.734 -2.338
80 H ASP 11 H ASP 11 9.361 -5.257 -2.484
81 HA ASP 11 HA ASP 11 11.097 -7.310 -3.302
82 HB2 ASP 11 HB2 ASP 11 9.254 -7.572 -1.674
83 HB3 ASP 11 HB3 ASP 11 8.081 -7.342 -2.966
84 H GLY 12 H GLY 12 8.952 -5.309 -5.112
85 HA2 GLY 12 HA2 GLY 12 9.068 -5.245 -7.523
86 HA3 GLY 12 HA3 GLY 12 9.325 -6.985 -7.517
87 H ARG 13 H ARG 13 7.243 -7.429 -5.503
88 HA ARG 13 HA ARG 13 5.028 -7.892 -7.186
89 HB2 ARG 13 HB2 ARG 13 5.611 -9.148 -5.077
90 HB3 ARG 13 HB3 ARG 13 5.016 -7.770 -4.161
91 HG2 ARG 13 HG2 ARG 13 2.808 -8.095 -5.381
92 HG3 ARG 13 HG3 ARG 13 3.456 -9.644 -5.922
93 HD2 ARG 13 HD2 ARG 13 3.890 -10.153 -3.465
94 HD3 ARG 13 HD3 ARG 13 2.902 -8.741 -3.099
95 HE ARG 13 HE ARG 13 1.993 -11.314 -3.886
96 HH11 ARG 13 HH11 ARG 13 1.207 -7.966 -4.145
97 HH12 ARG 13 HH12 ARG 13 -0.485 -8.271 -4.305
98 HH21 ARG 13 HH21 ARG 13 -0.179 -11.675 -4.093
99 HH22 ARG 13 HH22 ARG 13 -1.259 -10.335 -4.277
100 H GLU 14 H GLU 14 3.089 -6.804 -7.471
101 HA GLU 14 HA GLU 14 2.824 -4.165 -6.162
102 HB2 GLU 14 HB2 GLU 14 1.865 -5.050 -8.895
103 HB3 GLU 14 HB3 GLU 14 1.504 -3.489 -8.166
104 HG2 GLU 14 HG2 GLU 14 3.898 -2.965 -8.112
105 HG3 GLU 14 HG3 GLU 14 4.250 -4.523 -8.857
106 H ILE 15 H ILE 15 0.863 -3.556 -5.305
107 HA ILE 15 HA ILE 15 -1.295 -5.586 -5.289
108 HB ILE 15 HB ILE 15 -0.605 -3.754 -2.973
109 HG12 ILE 15 HG12 ILE 15 -0.027 -6.712 -3.322
110 HG13 ILE 15 HG13 ILE 15 1.173 -5.424 -3.310
111 HG21 ILE 15 HG21 ILE 15 -2.513 -6.094 -3.165
112 HG22 ILE 15 HG22 ILE 15 -2.967 -4.390 -3.093
113 HG23 ILE 15 HG23 ILE 15 -2.177 -5.153 -1.711
114 HD11 ILE 15 HD11 ILE 15 -0.574 -6.262 -1.006
115 HD12 ILE 15 HD12 ILE 15 0.573 -4.920 -0.982
116 HD13 ILE 15 HD13 ILE 15 1.153 -6.571 -1.195
117 H GLN 16 H GLN 16 -3.303 -4.854 -5.815
118 HA GLN 16 HA GLN 16 -3.606 -1.992 -6.400
119 HB2 GLN 16 HB2 GLN 16 -5.457 -4.285 -7.086
120 HB3 GLN 16 HB3 GLN 16 -5.585 -2.632 -7.670
121 HG2 GLN 16 HG2 GLN 16 -3.422 -2.894 -8.819
122 HG3 GLN 16 HG3 GLN 16 -3.362 -4.573 -8.280
123 HE21 GLN 16 HE21 GLN 16 -4.864 -2.315 -10.440
124 HE22 GLN 16 HE22 GLN 16 -5.676 -3.481 -11.419
125 H ALA 17 H ALA 17 -4.955 -0.656 -5.306
126 HA ALA 17 HA ALA 17 -6.642 -1.824 -3.178
127 HB1 ALA 17 HB1 ALA 17 -6.058 0.067 -1.746
128 HB2 ALA 17 HB2 ALA 17 -5.011 0.714 -3.010
129 HB3 ALA 17 HB3 ALA 17 -4.617 -0.821 -2.238
130 H VAL 18 H VAL 18 -8.617 -0.864 -2.748
131 HA VAL 18 HA VAL 18 -9.735 0.875 -4.804
132 HB VAL 18 HB VAL 18 -11.889 0.546 -3.606
133 HG11 VAL 18 HG11 VAL 18 -10.388 -2.006 -4.215
134 HG12 VAL 18 HG12 VAL 18 -11.257 -1.005 -5.377
135 HG13 VAL 18 HG13 VAL 18 -12.142 -1.847 -4.106
136 HG21 VAL 18 HG21 VAL 18 -10.245 -1.193 -1.756
137 HG22 VAL 18 HG22 VAL 18 -12.006 -1.084 -1.764
138 HG23 VAL 18 HG23 VAL 18 -11.038 0.326 -1.333
139 H ASP 19 H ASP 19 -8.321 1.222 -1.742
140 HA ASP 19 HA ASP 19 -9.289 4.004 -1.539
141 HB2 ASP 19 HB2 ASP 19 -8.647 2.009 0.641
142 HB3 ASP 19 HB3 ASP 19 -8.628 3.742 0.951
143 H THR 20 H THR 20 -7.709 5.563 -0.772
144 HA THR 20 HA THR 20 -5.120 5.088 -1.946
145 HB THR 20 HB THR 20 -4.642 7.455 -1.347
146 HG1 THR 20 HG1 THR 20 -6.901 8.463 -0.661
147 HG21 THR 20 HG21 THR 20 -5.730 6.933 -3.475
148 HG22 THR 20 HG22 THR 20 -6.317 8.468 -2.829
149 HG23 THR 20 HG23 THR 20 -7.313 7.018 -2.699
150 HA PRO 21 HA PRO 21 -3.169 3.561 1.705
151 HB2 PRO 21 HB2 PRO 21 -0.556 4.006 1.025
152 HB3 PRO 21 HB3 PRO 21 -1.536 2.700 0.345
153 HG2 PRO 21 HG2 PRO 21 -0.923 5.403 -0.810
154 HG3 PRO 21 HG3 PRO 21 -0.889 3.817 -1.605
155 HD2 PRO 21 HD2 PRO 21 -2.970 5.491 -1.907
156 HD3 PRO 21 HD3 PRO 21 -3.206 3.731 -1.809
157 H LYS 22 H LYS 22 -3.042 4.481 3.638
158 HA LYS 22 HA LYS 22 -2.056 7.230 3.939
159 HB2 LYS 22 HB2 LYS 22 -4.191 6.639 5.033
160 HB3 LYS 22 HB3 LYS 22 -3.376 5.373 5.943
161 HG2 LYS 22 HG2 LYS 22 -1.893 7.242 6.884
162 HG3 LYS 22 HG3 LYS 22 -3.089 8.356 6.220
163 HD2 LYS 22 HD2 LYS 22 -3.583 7.930 8.555
164 HD3 LYS 22 HD3 LYS 22 -4.842 7.206 7.550
165 HE2 LYS 22 HE2 LYS 22 -3.807 5.013 7.785
166 HE3 LYS 22 HE3 LYS 22 -2.481 5.714 8.711
167 HZ1 LYS 22 HZ1 LYS 22 -5.318 5.784 9.571
168 HZ2 LYS 22 HZ2 LYS 22 -3.969 6.244 10.476
169 HZ3 LYS 22 HZ3 LYS 22 -4.204 4.617 10.079
170 H TYR 23 H TYR 23 -0.001 7.606 4.640
171 HA TYR 23 HA TYR 23 1.581 5.446 5.754
172 HB2 TYR 23 HB2 TYR 23 2.735 7.001 4.293
173 HB3 TYR 23 HB3 TYR 23 2.252 8.367 5.298
174 HD1 TYR 23 HD1 TYR 23 4.018 5.082 5.696
175 HD2 TYR 23 HD2 TYR 23 3.866 9.204 6.759
176 HE1 TYR 23 HE1 TYR 23 6.059 4.806 7.034
177 HE2 TYR 23 HE2 TYR 23 5.912 8.935 8.100
178 HH TYR 23 HH TYR 23 7.099 7.011 9.299
179 H ASP 24 H ASP 24 1.362 4.898 7.819
180 HA ASP 24 HA ASP 24 0.630 6.926 9.804
181 HB2 ASP 24 HB2 ASP 24 -0.662 4.816 9.780
182 HB3 ASP 24 HB3 ASP 24 0.819 3.912 10.084
183 H GLU 25 H GLU 25 2.370 8.026 10.471
184 HA GLU 25 HA GLU 25 5.019 6.980 10.462
185 HB2 GLU 25 HB2 GLU 25 4.585 9.351 10.113
186 HB3 GLU 25 HB3 GLU 25 3.885 9.488 11.720
187 HG2 GLU 25 HG2 GLU 25 6.045 8.992 12.726
188 HG3 GLU 25 HG3 GLU 25 6.758 8.793 11.126
189 H GLU 26 H GLU 26 2.515 7.170 12.879
190 HA GLU 26 HA GLU 26 4.061 6.870 15.204
191 HB2 GLU 26 HB2 GLU 26 1.283 5.750 14.769
192 HB3 GLU 26 HB3 GLU 26 2.021 6.190 16.304
193 HG2 GLU 26 HG2 GLU 26 1.253 8.083 14.087
194 HG3 GLU 26 HG3 GLU 26 0.391 7.849 15.603
195 H SER 27 H SER 27 2.389 4.351 13.281
196 HA SER 27 HA SER 27 3.842 2.247 14.683
197 HB2 SER 27 HB2 SER 27 1.864 2.039 12.396
198 HB3 SER 27 HB3 SER 27 2.489 0.695 13.348
199 HG SER 27 HG SER 27 0.650 2.699 14.056
200 H GLY 28 H GLY 28 4.070 3.966 11.662
201 HA2 GLY 28 HA2 GLY 28 5.983 4.025 10.295
202 HA3 GLY 28 HA3 GLY 28 6.543 2.534 11.033
203 H PHE 29 H PHE 29 3.282 2.417 10.012
204 HA PHE 29 HA PHE 29 4.102 0.749 7.715
205 HB2 PHE 29 HB2 PHE 29 1.619 0.529 9.438
206 HB3 PHE 29 HB3 PHE 29 1.986 -0.494 8.054
207 HD1 PHE 29 HD1 PHE 29 4.021 -1.988 8.165
208 HD2 PHE 29 HD2 PHE 29 2.465 0.035 11.570
209 HE1 PHE 29 HE1 PHE 29 5.231 -3.544 9.637
210 HE2 PHE 29 HE2 PHE 29 3.677 -1.511 13.049
211 HZ PHE 29 HZ PHE 29 5.063 -3.303 12.083
212 H TYR 30 H TYR 30 2.750 0.684 5.850
213 HA TYR 30 HA TYR 30 1.043 3.035 5.399
214 HB2 TYR 30 HB2 TYR 30 2.346 1.032 3.548
215 HB3 TYR 30 HB3 TYR 30 1.052 2.083 2.988
216 HD1 TYR 30 HD1 TYR 30 4.496 2.094 4.409
217 HD2 TYR 30 HD2 TYR 30 1.491 4.319 2.356
218 HE1 TYR 30 HE1 TYR 30 6.136 3.862 3.925
219 HE2 TYR 30 HE2 TYR 30 3.129 6.089 1.875
220 HH TYR 30 HH TYR 30 5.282 6.925 2.876
221 H GLU 31 H GLU 31 -1.104 2.812 5.573
222 HA GLU 31 HA GLU 31 -2.258 0.099 5.589
223 HB2 GLU 31 HB2 GLU 31 -3.478 2.663 6.644
224 HB3 GLU 31 HB3 GLU 31 -4.103 1.033 6.861
225 HG2 GLU 31 HG2 GLU 31 -2.038 0.475 8.141
226 HG3 GLU 31 HG3 GLU 31 -1.560 2.167 8.020
227 H PHE 32 H PHE 32 -3.402 -0.525 3.869
228 HA PHE 32 HA PHE 32 -5.076 1.406 2.445
229 HB2 PHE 32 HB2 PHE 32 -4.248 0.640 0.230
230 HB3 PHE 32 HB3 PHE 32 -3.024 1.491 1.162
231 HD1 PHE 32 HD1 PHE 32 -1.239 0.149 2.341
232 HD2 PHE 32 HD2 PHE 32 -3.880 -1.559 -0.536
233 HE1 PHE 32 HE1 PHE 32 0.315 -1.731 2.030
234 HE2 PHE 32 HE2 PHE 32 -2.328 -3.440 -0.844
235 HZ PHE 32 HZ PHE 32 -0.226 -3.529 0.436
236 H LYS 33 H LYS 33 -6.666 0.398 1.024
237 HA LYS 33 HA LYS 33 -7.467 -2.247 2.066
238 HB2 LYS 33 HB2 LYS 33 -8.981 -0.309 2.497
239 HB3 LYS 33 HB3 LYS 33 -9.191 -0.129 0.761
240 HG2 LYS 33 HG2 LYS 33 -10.072 -2.505 0.744
241 HG3 LYS 33 HG3 LYS 33 -10.093 -2.414 2.508
242 HD2 LYS 33 HD2 LYS 33 -11.582 -0.597 0.603
243 HD3 LYS 33 HD3 LYS 33 -12.292 -1.884 1.577
244 HE2 LYS 33 HE2 LYS 33 -11.905 -0.707 3.593
245 HE3 LYS 33 HE3 LYS 33 -10.795 0.419 2.812
246 HZ1 LYS 33 HZ1 LYS 33 -12.648 1.319 1.556
247 HZ2 LYS 33 HZ2 LYS 33 -12.927 1.451 3.219
248 HZ3 LYS 33 HZ3 LYS 33 -13.720 0.257 2.322
249 H GLN 34 H GLN 34 -6.996 -3.860 0.698
250 HA GLN 34 HA GLN 34 -6.364 -3.606 -2.027
251 HB2 GLN 34 HB2 GLN 34 -7.333 -6.070 -0.558
252 HB3 GLN 34 HB3 GLN 34 -6.478 -6.062 -2.094
253 HG2 GLN 34 HG2 GLN 34 -4.501 -5.135 -1.002
254 HG3 GLN 34 HG3 GLN 34 -5.360 -5.105 0.540
255 HE21 GLN 34 HE21 GLN 34 -5.773 -7.072 1.605
256 HE22 GLN 34 HE22 GLN 34 -4.936 -8.523 1.188
257 H LEU 35 H LEU 35 -7.504 -4.751 -3.862
258 HA LEU 35 HA LEU 35 -10.132 -3.816 -4.256
259 HB2 LEU 35 HB2 LEU 35 -8.781 -6.122 -5.672
260 HB3 LEU 35 HB3 LEU 35 -10.184 -5.243 -6.248
261 HG LEU 35 HG LEU 35 -7.374 -4.159 -5.967
262 HD11 LEU 35 HD11 LEU 35 -7.466 -3.982 -8.406
263 HD12 LEU 35 HD12 LEU 35 -9.066 -4.725 -8.405
264 HD13 LEU 35 HD13 LEU 35 -7.662 -5.650 -7.870
265 HD21 LEU 35 HD21 LEU 35 -9.880 -2.763 -6.920
266 HD22 LEU 35 HD22 LEU 35 -8.241 -2.116 -7.012
267 HD23 LEU 35 HD23 LEU 35 -8.985 -2.409 -5.440
268 H ASP 36 H ASP 36 -8.962 -6.647 -2.689
269 HA ASP 36 HA ASP 36 -11.341 -8.233 -2.831
270 HB2 ASP 36 HB2 ASP 36 -9.106 -8.371 -0.792
271 HB3 ASP 36 HB3 ASP 36 -10.242 -9.654 -1.201
272 H GLY 37 H GLY 37 -10.626 -5.410 -1.138
273 HA2 GLY 37 HA2 GLY 37 -12.089 -4.288 0.334
274 HA3 GLY 37 HA3 GLY 37 -12.864 -5.820 0.706
275 H LYS 38 H LYS 38 -9.710 -6.542 0.901
276 HA LYS 38 HA LYS 38 -9.714 -6.471 3.792
277 HB2 LYS 38 HB2 LYS 38 -7.646 -7.513 1.844
278 HB3 LYS 38 HB3 LYS 38 -7.587 -7.727 3.587
279 HG2 LYS 38 HG2 LYS 38 -9.727 -8.988 3.451
280 HG3 LYS 38 HG3 LYS 38 -9.641 -8.859 1.691
281 HD2 LYS 38 HD2 LYS 38 -7.524 -10.074 1.685
282 HD3 LYS 38 HD3 LYS 38 -7.542 -10.151 3.448
283 HE2 LYS 38 HE2 LYS 38 -8.278 -12.267 2.567
284 HE3 LYS 38 HE3 LYS 38 -9.648 -11.455 3.322
285 HZ1 LYS 38 HZ1 LYS 38 -9.091 -11.483 0.406
286 HZ2 LYS 38 HZ2 LYS 38 -10.447 -10.806 1.160
287 HZ3 LYS 38 HZ3 LYS 38 -10.210 -12.477 1.187
288 H GLN 39 H GLN 39 -8.965 -4.771 4.928
289 HA GLN 39 HA GLN 39 -7.043 -2.904 3.800
290 HB2 GLN 39 HB2 GLN 39 -8.891 -2.126 5.286
291 HB3 GLN 39 HB3 GLN 39 -8.174 -3.031 6.614
292 HG2 GLN 39 HG2 GLN 39 -6.119 -1.635 6.362
293 HG3 GLN 39 HG3 GLN 39 -6.978 -0.669 5.165
294 HE21 GLN 39 HE21 GLN 39 -8.709 0.639 5.861
295 HE22 GLN 39 HE22 GLN 39 -8.896 1.086 7.518
296 H THR 40 H THR 40 -4.911 -3.410 3.789
297 HA THR 40 HA THR 40 -3.867 -5.084 5.998
298 HB THR 40 HB THR 40 -3.796 -6.318 3.896
299 HG1 THR 40 HG1 THR 40 -2.080 -6.943 5.034
300 HG21 THR 40 HG21 THR 40 -3.706 -4.470 2.307
301 HG22 THR 40 HG22 THR 40 -2.365 -5.580 2.032
302 HG23 THR 40 HG23 THR 40 -2.085 -4.048 2.858
303 H ARG 41 H ARG 41 -1.716 -4.701 6.723
304 HA ARG 41 HA ARG 41 -0.783 -1.923 6.289
305 HB2 ARG 41 HB2 ARG 41 -0.381 -3.595 8.784
306 HB3 ARG 41 HB3 ARG 41 -0.053 -1.878 8.588
307 HG2 ARG 41 HG2 ARG 41 -2.409 -1.391 8.436
308 HG3 ARG 41 HG3 ARG 41 -2.804 -3.110 8.444
309 HD2 ARG 41 HD2 ARG 41 -3.214 -2.416 10.643
310 HD3 ARG 41 HD3 ARG 41 -1.635 -3.193 10.720
311 HE ARG 41 HE ARG 41 -1.843 -0.272 10.481
312 HH11 ARG 41 HH11 ARG 41 -0.732 -3.057 12.182
313 HH12 ARG 41 HH12 ARG 41 0.060 -2.118 13.402
314 HH21 ARG 41 HH21 ARG 41 -0.833 0.905 12.071
315 HH22 ARG 41 HH22 ARG 41 0.006 0.085 13.343
316 H ILE 42 H ILE 42 1.248 -1.743 5.450
317 HA ILE 42 HA ILE 42 3.140 -3.981 5.851
318 HB ILE 42 HB ILE 42 2.160 -4.056 3.560
319 HG12 ILE 42 HG12 ILE 42 5.104 -3.344 3.530
320 HG13 ILE 42 HG13 ILE 42 4.474 -4.883 4.109
321 HG21 ILE 42 HG21 ILE 42 1.810 -1.672 3.200
322 HG22 ILE 42 HG22 ILE 42 2.807 -2.351 1.913
323 HG23 ILE 42 HG23 ILE 42 3.552 -1.398 3.195
324 HD11 ILE 42 HD11 ILE 42 5.309 -5.061 1.840
325 HD12 ILE 42 HD12 ILE 42 4.195 -3.800 1.315
326 HD13 ILE 42 HD13 ILE 42 3.570 -5.345 1.893
327 H ASN 43 H ASN 43 5.378 -3.403 5.990
328 HA ASN 43 HA ASN 43 5.727 -0.962 7.387
329 HB2 ASN 43 HB2 ASN 43 6.978 -3.074 7.862
330 HB3 ASN 43 HB3 ASN 43 7.919 -2.796 6.396
331 HD21 ASN 43 HD21 ASN 43 9.855 -2.574 7.516
332 HD22 ASN 43 HD22 ASN 43 10.205 -1.198 8.495
333 H LYS 44 H LYS 44 7.107 0.777 6.980
334 HA LYS 44 HA LYS 44 6.716 2.029 4.522
335 HB2 LYS 44 HB2 LYS 44 8.341 3.736 5.410
336 HB3 LYS 44 HB3 LYS 44 7.007 3.337 6.487
337 HG2 LYS 44 HG2 LYS 44 8.510 1.805 7.726
338 HG3 LYS 44 HG3 LYS 44 9.842 2.325 6.691
339 HD2 LYS 44 HD2 LYS 44 9.656 4.590 7.512
340 HD3 LYS 44 HD3 LYS 44 8.204 4.180 8.429
341 HE2 LYS 44 HE2 LYS 44 9.507 2.662 9.834
342 HE3 LYS 44 HE3 LYS 44 10.956 3.022 8.897
343 HZ1 LYS 44 HZ1 LYS 44 10.915 5.262 9.656
344 HZ2 LYS 44 HZ2 LYS 44 10.784 4.264 11.012
345 HZ3 LYS 44 HZ3 LYS 44 9.419 5.056 10.410
346 H ASP 45 H ASP 45 9.265 -0.178 5.351
347 HA ASP 45 HA ASP 45 11.107 0.887 3.374
348 HB2 ASP 45 HB2 ASP 45 12.578 -0.965 4.019
349 HB3 ASP 45 HB3 ASP 45 12.009 -0.078 5.427
350 H GLN 46 H GLN 46 8.569 -1.447 3.442
351 HA GLN 46 HA GLN 46 9.564 -3.013 1.223
352 HB2 GLN 46 HB2 GLN 46 6.861 -3.056 2.582
353 HB3 GLN 46 HB3 GLN 46 7.429 -4.230 1.405
354 HG2 GLN 46 HG2 GLN 46 8.777 -3.727 4.043
355 HG3 GLN 46 HG3 GLN 46 7.547 -4.959 3.793
356 HE21 GLN 46 HE21 GLN 46 8.970 -6.609 4.327
357 HE22 GLN 46 HE22 GLN 46 10.243 -7.113 3.277
358 H VAL 47 H VAL 47 7.796 -0.099 1.496
359 HA VAL 47 HA VAL 47 6.408 -0.440 -1.042
360 HB VAL 47 HB VAL 47 5.233 0.769 0.702
361 HG11 VAL 47 HG11 VAL 47 7.492 2.769 0.584
362 HG12 VAL 47 HG12 VAL 47 7.104 1.699 1.932
363 HG13 VAL 47 HG13 VAL 47 5.984 2.981 1.475
364 HG21 VAL 47 HG21 VAL 47 6.030 2.615 -1.556
365 HG22 VAL 47 HG22 VAL 47 4.586 2.771 -0.554
366 HG23 VAL 47 HG23 VAL 47 4.773 1.380 -1.624
367 H ARG 48 H ARG 48 7.447 -0.174 -2.900
368 HA ARG 48 HA ARG 48 9.858 1.426 -3.116
369 HB2 ARG 48 HB2 ARG 48 9.560 -0.754 -4.315
370 HB3 ARG 48 HB3 ARG 48 8.314 0.002 -5.298
371 HG2 ARG 48 HG2 ARG 48 10.005 1.632 -6.108
372 HG3 ARG 48 HG3 ARG 48 11.236 0.745 -5.206
373 HD2 ARG 48 HD2 ARG 48 10.587 -1.302 -6.515
374 HD3 ARG 48 HD3 ARG 48 9.562 -0.266 -7.510
375 HE ARG 48 HE ARG 48 12.497 -0.070 -7.325
376 HH11 ARG 48 HH11 ARG 48 9.558 0.477 -9.066
377 HH12 ARG 48 HH12 ARG 48 10.389 0.980 -10.494
378 HH21 ARG 48 HH21 ARG 48 13.523 0.572 -9.161
379 HH22 ARG 48 HH22 ARG 48 12.595 1.021 -10.551
380 H THR 49 H THR 49 6.793 1.386 -4.949
381 HA THR 49 HA THR 49 6.784 4.330 -5.033
382 HB THR 49 HB THR 49 6.128 4.278 -7.448
383 HG1 THR 49 HG1 THR 49 6.785 2.268 -8.567
384 HG21 THR 49 HG21 THR 49 8.438 4.822 -6.840
385 HG22 THR 49 HG22 THR 49 8.377 3.927 -8.359
386 HG23 THR 49 HG23 THR 49 8.859 3.109 -6.871
387 H VAL 50 H VAL 50 4.732 5.265 -5.279
388 HA VAL 50 HA VAL 50 2.420 3.418 -5.198
389 HB VAL 50 HB VAL 50 2.653 6.142 -3.885
390 HG11 VAL 50 HG11 VAL 50 0.380 4.147 -3.864
391 HG12 VAL 50 HG12 VAL 50 0.387 5.729 -4.645
392 HG13 VAL 50 HG13 VAL 50 0.460 5.617 -2.889
393 HG21 VAL 50 HG21 VAL 50 2.542 4.916 -1.756
394 HG22 VAL 50 HG22 VAL 50 3.961 4.457 -2.696
395 HG23 VAL 50 HG23 VAL 50 2.560 3.389 -2.637
396 H LYS 51 H LYS 51 1.247 3.538 -7.034
397 HA LYS 51 HA LYS 51 1.011 6.148 -8.406
398 HB2 LYS 51 HB2 LYS 51 1.458 3.477 -9.774
399 HB3 LYS 51 HB3 LYS 51 1.227 5.022 -10.579
400 HG2 LYS 51 HG2 LYS 51 3.312 5.851 -9.592
401 HG3 LYS 51 HG3 LYS 51 3.543 4.299 -8.789
402 HD2 LYS 51 HD2 LYS 51 3.458 4.761 -11.778
403 HD3 LYS 51 HD3 LYS 51 4.905 4.458 -10.815
404 HE2 LYS 51 HE2 LYS 51 4.510 2.347 -11.620
405 HE3 LYS 51 HE3 LYS 51 3.585 2.277 -10.125
406 HZ1 LYS 51 HZ1 LYS 51 2.293 1.385 -11.931
407 HZ2 LYS 51 HZ2 LYS 51 2.504 2.791 -12.846
408 HZ3 LYS 51 HZ3 LYS 51 1.584 2.834 -11.432
409 H ASP 52 H ASP 52 -0.989 6.615 -9.278
410 HA ASP 52 HA ASP 52 -3.224 4.932 -8.538
411 HB2 ASP 52 HB2 ASP 52 -3.165 7.497 -10.157
412 HB3 ASP 52 HB3 ASP 52 -4.614 6.708 -9.544
413 H LEU 53 H LEU 53 -4.838 4.149 -10.077
414 HA LEU 53 HA LEU 53 -3.703 3.208 -12.575
415 HB2 LEU 53 HB2 LEU 53 -6.490 2.893 -11.435
416 HB3 LEU 53 HB3 LEU 53 -5.916 2.119 -12.902
417 HG LEU 53 HG LEU 53 -4.870 1.630 -10.104
418 HD11 LEU 53 HD11 LEU 53 -6.439 -0.161 -11.957
419 HD12 LEU 53 HD12 LEU 53 -7.068 0.636 -10.515
420 HD13 LEU 53 HD13 LEU 53 -5.818 -0.599 -10.364
421 HD21 LEU 53 HD21 LEU 53 -3.509 -0.141 -11.132
422 HD22 LEU 53 HD22 LEU 53 -3.060 1.457 -11.724
423 HD23 LEU 53 HD23 LEU 53 -4.036 0.388 -12.729
424 H LEU 54 H LEU 54 -5.203 6.006 -11.576
425 HA LEU 54 HA LEU 54 -6.153 6.688 -14.284
426 HB2 LEU 54 HB2 LEU 54 -6.799 8.059 -11.663
427 HB3 LEU 54 HB3 LEU 54 -7.495 8.427 -13.231
428 HG LEU 54 HG LEU 54 -7.892 5.846 -11.698
429 HD11 LEU 54 HD11 LEU 54 -10.183 6.617 -11.379
430 HD12 LEU 54 HD12 LEU 54 -9.801 8.131 -12.203
431 HD13 LEU 54 HD13 LEU 54 -9.033 7.747 -10.661
432 HD21 LEU 54 HD21 LEU 54 -9.128 6.796 -14.288
433 HD22 LEU 54 HD22 LEU 54 -9.567 5.328 -13.413
434 HD23 LEU 54 HD23 LEU 54 -7.957 5.486 -14.114
435 H GLU 55 H GLU 55 -4.230 7.360 -15.196
436 HA GLU 55 HA GLU 55 -2.775 9.551 -13.839
437 HB2 GLU 55 HB2 GLU 55 -1.721 7.535 -15.839
438 HB3 GLU 55 HB3 GLU 55 -0.782 8.831 -15.107
439 HG2 GLU 55 HG2 GLU 55 -1.150 7.824 -12.893
440 HG3 GLU 55 HG3 GLU 55 -2.048 6.511 -13.654
Start of MODEL 6
1 H1 MET 1 H1 MET 1 -14.520 9.245 -0.168
2 H2 MET 1 H2 MET 1 -15.856 8.493 -0.880
3 H3 MET 1 H3 MET 1 -15.603 10.146 -1.103
4 HA MET 1 HA MET 1 -15.000 8.898 -3.072
5 HB2 MET 1 HB2 MET 1 -12.789 9.876 -3.398
6 HB3 MET 1 HB3 MET 1 -13.833 11.002 -2.545
7 HG2 MET 1 HG2 MET 1 -12.762 10.440 -0.439
8 HG3 MET 1 HG3 MET 1 -11.746 9.252 -1.255
9 HE1 MET 1 HE1 MET 1 -11.461 13.816 -1.910
10 HE2 MET 1 HE2 MET 1 -12.563 13.050 -0.767
11 HE3 MET 1 HE3 MET 1 -12.816 12.859 -2.503
12 H ALA 2 H ALA 2 -13.180 7.635 -4.074
13 HA ALA 2 HA ALA 2 -11.632 5.864 -2.417
14 HB1 ALA 2 HB1 ALA 2 -12.606 3.766 -3.159
15 HB2 ALA 2 HB2 ALA 2 -13.822 4.631 -4.099
16 HB3 ALA 2 HB3 ALA 2 -13.829 4.738 -2.340
17 H SER 3 H SER 3 -9.926 6.781 -3.613
18 HA SER 3 HA SER 3 -9.918 6.595 -6.509
19 HB2 SER 3 HB2 SER 3 -7.735 7.570 -4.642
20 HB3 SER 3 HB3 SER 3 -7.789 7.797 -6.390
21 HG SER 3 HG SER 3 -8.543 9.601 -5.016
22 HA PRO 4 HA PRO 4 -8.142 2.455 -6.257
23 HB2 PRO 4 HB2 PRO 4 -7.783 2.135 -8.962
24 HB3 PRO 4 HB3 PRO 4 -9.325 1.885 -8.137
25 HG2 PRO 4 HG2 PRO 4 -8.352 4.283 -9.650
26 HG3 PRO 4 HG3 PRO 4 -9.950 3.510 -9.683
27 HD2 PRO 4 HD2 PRO 4 -9.494 5.758 -8.271
28 HD3 PRO 4 HD3 PRO 4 -10.609 4.503 -7.687
29 H THR 5 H THR 5 -6.093 2.117 -5.657
30 HA THR 5 HA THR 5 -3.919 3.503 -7.111
31 HB THR 5 HB THR 5 -4.051 3.148 -4.100
32 HG1 THR 5 HG1 THR 5 -5.531 4.745 -4.827
33 HG21 THR 5 HG21 THR 5 -2.097 4.654 -5.853
34 HG22 THR 5 HG22 THR 5 -1.759 3.179 -4.944
35 HG23 THR 5 HG23 THR 5 -2.115 4.682 -4.090
36 H VAL 6 H VAL 6 -1.935 2.392 -7.256
37 HA VAL 6 HA VAL 6 -1.934 -0.391 -6.257
38 HB VAL 6 HB VAL 6 -2.208 -0.430 -8.672
39 HG11 VAL 6 HG11 VAL 6 -1.295 1.726 -9.269
40 HG12 VAL 6 HG12 VAL 6 -0.461 0.465 -10.177
41 HG13 VAL 6 HG13 VAL 6 0.323 1.213 -8.786
42 HG21 VAL 6 HG21 VAL 6 -0.284 -1.823 -9.279
43 HG22 VAL 6 HG22 VAL 6 -0.859 -2.197 -7.654
44 HG23 VAL 6 HG23 VAL 6 0.598 -1.226 -7.873
45 H ILE 7 H ILE 7 -0.316 -0.910 -4.941
46 HA ILE 7 HA ILE 7 1.890 0.996 -4.587
47 HB ILE 7 HB ILE 7 1.010 -1.282 -2.796
48 HG12 ILE 7 HG12 ILE 7 0.579 1.711 -2.512
49 HG13 ILE 7 HG13 ILE 7 -0.661 0.539 -2.953
50 HG21 ILE 7 HG21 ILE 7 2.489 -0.253 -1.122
51 HG22 ILE 7 HG22 ILE 7 3.014 0.931 -2.319
52 HG23 ILE 7 HG23 ILE 7 3.385 -0.778 -2.548
53 HD11 ILE 7 HD11 ILE 7 -0.831 1.173 -0.618
54 HD12 ILE 7 HD12 ILE 7 0.824 0.637 -0.337
55 HD13 ILE 7 HD13 ILE 7 -0.420 -0.535 -0.774
56 H THR 8 H THR 8 3.732 0.557 -5.615
57 HA THR 8 HA THR 8 4.458 -2.160 -6.365
58 HB THR 8 HB THR 8 6.097 0.369 -6.714
59 HG1 THR 8 HG1 THR 8 4.184 -0.844 -8.464
60 HG21 THR 8 HG21 THR 8 7.389 -1.702 -6.937
61 HG22 THR 8 HG22 THR 8 7.217 -0.898 -8.498
62 HG23 THR 8 HG23 THR 8 6.229 -2.308 -8.119
63 H LEU 9 H LEU 9 5.393 -3.448 -4.838
64 HA LEU 9 HA LEU 9 6.860 -2.338 -2.618
65 HB2 LEU 9 HB2 LEU 9 6.584 -5.224 -3.472
66 HB3 LEU 9 HB3 LEU 9 7.233 -4.664 -1.938
67 HG LEU 9 HG LEU 9 4.373 -4.428 -2.894
68 HD11 LEU 9 HD11 LEU 9 4.974 -6.643 -2.090
69 HD12 LEU 9 HD12 LEU 9 3.892 -5.845 -0.951
70 HD13 LEU 9 HD13 LEU 9 5.618 -5.952 -0.601
71 HD21 LEU 9 HD21 LEU 9 3.892 -3.370 -0.742
72 HD22 LEU 9 HD22 LEU 9 5.011 -2.396 -1.694
73 HD23 LEU 9 HD23 LEU 9 5.613 -3.367 -0.349
74 H ASN 10 H ASN 10 9.054 -3.269 -2.043
75 HA ASN 10 HA ASN 10 10.894 -2.314 -3.955
76 HB2 ASN 10 HB2 ASN 10 11.216 -2.282 -1.469
77 HB3 ASN 10 HB3 ASN 10 11.517 -4.016 -1.528
78 HD21 ASN 10 HD21 ASN 10 13.605 -3.787 -0.751
79 HD22 ASN 10 HD22 ASN 10 14.885 -3.140 -1.715
80 H ASP 11 H ASP 11 9.840 -5.569 -3.136
81 HA ASP 11 HA ASP 11 11.776 -6.886 -4.812
82 HB2 ASP 11 HB2 ASP 11 9.235 -7.892 -3.502
83 HB3 ASP 11 HB3 ASP 11 10.388 -8.915 -4.356
84 H GLY 12 H GLY 12 9.403 -4.907 -5.743
85 HA2 GLY 12 HA2 GLY 12 8.797 -4.527 -7.973
86 HA3 GLY 12 HA3 GLY 12 9.249 -6.175 -8.366
87 H ARG 13 H ARG 13 7.433 -6.806 -5.837
88 HA ARG 13 HA ARG 13 5.145 -7.566 -7.355
89 HB2 ARG 13 HB2 ARG 13 5.945 -8.857 -5.414
90 HB3 ARG 13 HB3 ARG 13 5.532 -7.519 -4.348
91 HG2 ARG 13 HG2 ARG 13 3.163 -7.776 -4.964
92 HG3 ARG 13 HG3 ARG 13 3.592 -9.140 -5.999
93 HD2 ARG 13 HD2 ARG 13 4.443 -10.348 -4.033
94 HD3 ARG 13 HD3 ARG 13 4.000 -8.985 -3.005
95 HE ARG 13 HE ARG 13 1.890 -10.257 -4.579
96 HH11 ARG 13 HH11 ARG 13 3.403 -9.831 -1.494
97 HH12 ARG 13 HH12 ARG 13 2.012 -10.376 -0.624
98 HH21 ARG 13 HH21 ARG 13 0.135 -10.985 -3.431
99 HH22 ARG 13 HH22 ARG 13 0.193 -11.022 -1.704
100 H GLU 14 H GLU 14 3.432 -6.335 -7.904
101 HA GLU 14 HA GLU 14 2.923 -3.859 -6.387
102 HB2 GLU 14 HB2 GLU 14 1.927 -4.655 -9.137
103 HB3 GLU 14 HB3 GLU 14 1.661 -3.103 -8.354
104 HG2 GLU 14 HG2 GLU 14 4.133 -2.762 -8.341
105 HG3 GLU 14 HG3 GLU 14 4.292 -4.238 -9.291
106 H ILE 15 H ILE 15 1.127 -3.613 -5.196
107 HA ILE 15 HA ILE 15 -1.020 -5.634 -5.436
108 HB ILE 15 HB ILE 15 -0.204 -4.060 -2.978
109 HG12 ILE 15 HG12 ILE 15 0.134 -7.008 -3.626
110 HG13 ILE 15 HG13 ILE 15 1.427 -5.814 -3.583
111 HG21 ILE 15 HG21 ILE 15 -2.299 -6.216 -3.310
112 HG22 ILE 15 HG22 ILE 15 -2.603 -4.505 -3.012
113 HG23 ILE 15 HG23 ILE 15 -1.814 -5.487 -1.779
114 HD11 ILE 15 HD11 ILE 15 -0.249 -6.704 -1.244
115 HD12 ILE 15 HD12 ILE 15 1.022 -5.481 -1.189
116 HD13 ILE 15 HD13 ILE 15 1.424 -7.156 -1.573
117 H GLN 16 H GLN 16 -3.055 -4.939 -5.838
118 HA GLN 16 HA GLN 16 -3.456 -2.064 -6.236
119 HB2 GLN 16 HB2 GLN 16 -5.106 -4.436 -7.134
120 HB3 GLN 16 HB3 GLN 16 -5.469 -2.757 -7.517
121 HG2 GLN 16 HG2 GLN 16 -3.394 -2.567 -8.769
122 HG3 GLN 16 HG3 GLN 16 -2.959 -4.219 -8.332
123 HE21 GLN 16 HE21 GLN 16 -5.040 -2.228 -10.277
124 HE22 GLN 16 HE22 GLN 16 -5.591 -3.481 -11.325
125 H ALA 17 H ALA 17 -4.916 -0.855 -5.182
126 HA ALA 17 HA ALA 17 -6.687 -2.128 -3.193
127 HB1 ALA 17 HB1 ALA 17 -6.212 -0.327 -1.627
128 HB2 ALA 17 HB2 ALA 17 -5.116 0.424 -2.787
129 HB3 ALA 17 HB3 ALA 17 -4.716 -1.143 -2.084
130 H VAL 18 H VAL 18 -8.659 -1.017 -2.748
131 HA VAL 18 HA VAL 18 -9.767 0.342 -5.026
132 HB VAL 18 HB VAL 18 -11.859 0.448 -3.726
133 HG11 VAL 18 HG11 VAL 18 -10.478 -2.237 -3.618
134 HG12 VAL 18 HG12 VAL 18 -11.363 -1.570 -4.990
135 HG13 VAL 18 HG13 VAL 18 -12.219 -1.977 -3.503
136 HG21 VAL 18 HG21 VAL 18 -10.265 -0.812 -1.486
137 HG22 VAL 18 HG22 VAL 18 -12.005 -0.518 -1.488
138 HG23 VAL 18 HG23 VAL 18 -10.880 0.841 -1.499
139 H ASP 19 H ASP 19 -8.415 1.354 -1.996
140 HA ASP 19 HA ASP 19 -8.938 4.159 -2.728
141 HB2 ASP 19 HB2 ASP 19 -8.871 4.609 -0.193
142 HB3 ASP 19 HB3 ASP 19 -10.332 3.891 -0.860
143 H THR 20 H THR 20 -7.361 5.629 -1.333
144 HA THR 20 HA THR 20 -4.716 4.811 -2.187
145 HB THR 20 HB THR 20 -3.996 7.069 -1.673
146 HG1 THR 20 HG1 THR 20 -4.959 8.072 -0.094
147 HG21 THR 20 HG21 THR 20 -5.181 6.758 -3.789
148 HG22 THR 20 HG22 THR 20 -5.504 8.357 -3.122
149 HG23 THR 20 HG23 THR 20 -6.719 7.085 -2.992
150 HA PRO 21 HA PRO 21 -3.271 3.441 1.771
151 HB2 PRO 21 HB2 PRO 21 -0.596 3.791 1.483
152 HB3 PRO 21 HB3 PRO 21 -1.492 2.528 0.630
153 HG2 PRO 21 HG2 PRO 21 -0.607 5.220 -0.364
154 HG3 PRO 21 HG3 PRO 21 -0.507 3.644 -1.173
155 HD2 PRO 21 HD2 PRO 21 -2.462 5.441 -1.724
156 HD3 PRO 21 HD3 PRO 21 -2.731 3.687 -1.809
157 H LYS 22 H LYS 22 -3.300 4.393 3.716
158 HA LYS 22 HA LYS 22 -2.382 7.166 4.019
159 HB2 LYS 22 HB2 LYS 22 -4.636 6.598 4.849
160 HB3 LYS 22 HB3 LYS 22 -3.939 5.394 5.924
161 HG2 LYS 22 HG2 LYS 22 -2.792 7.127 7.178
162 HG3 LYS 22 HG3 LYS 22 -3.380 8.358 6.058
163 HD2 LYS 22 HD2 LYS 22 -4.744 8.383 8.058
164 HD3 LYS 22 HD3 LYS 22 -5.707 7.789 6.706
165 HE2 LYS 22 HE2 LYS 22 -6.183 6.418 8.611
166 HE3 LYS 22 HE3 LYS 22 -5.234 5.457 7.479
167 HZ1 LYS 22 HZ1 LYS 22 -4.375 5.093 9.642
168 HZ2 LYS 22 HZ2 LYS 22 -4.290 6.749 9.974
169 HZ3 LYS 22 HZ3 LYS 22 -3.251 6.066 8.836
170 H TYR 23 H TYR 23 -0.431 7.582 4.875
171 HA TYR 23 HA TYR 23 1.179 5.414 5.920
172 HB2 TYR 23 HB2 TYR 23 2.246 7.000 4.434
173 HB3 TYR 23 HB3 TYR 23 1.782 8.347 5.467
174 HD1 TYR 23 HD1 TYR 23 3.755 5.165 5.604
175 HD2 TYR 23 HD2 TYR 23 3.355 9.175 6.986
176 HE1 TYR 23 HE1 TYR 23 5.893 4.960 6.804
177 HE2 TYR 23 HE2 TYR 23 5.491 8.980 8.190
178 HH TYR 23 HH TYR 23 6.904 7.110 9.165
179 H ASP 24 H ASP 24 1.530 4.949 8.010
180 HA ASP 24 HA ASP 24 0.648 6.871 10.056
181 HB2 ASP 24 HB2 ASP 24 -0.324 4.571 10.106
182 HB3 ASP 24 HB3 ASP 24 1.294 3.929 10.391
183 H GLU 25 H GLU 25 2.233 8.135 10.783
184 HA GLU 25 HA GLU 25 5.006 7.524 10.412
185 HB2 GLU 25 HB2 GLU 25 4.131 9.809 10.244
186 HB3 GLU 25 HB3 GLU 25 3.642 9.761 11.933
187 HG2 GLU 25 HG2 GLU 25 5.977 9.602 12.620
188 HG3 GLU 25 HG3 GLU 25 6.483 9.603 10.930
189 H GLU 26 H GLU 26 2.755 7.246 13.067
190 HA GLU 26 HA GLU 26 4.678 7.124 15.160
191 HB2 GLU 26 HB2 GLU 26 1.809 6.180 15.065
192 HB3 GLU 26 HB3 GLU 26 2.780 6.275 16.530
193 HG2 GLU 26 HG2 GLU 26 2.041 8.597 14.751
194 HG3 GLU 26 HG3 GLU 26 1.288 8.196 16.295
195 H SER 27 H SER 27 3.226 4.618 13.118
196 HA SER 27 HA SER 27 4.903 2.636 14.549
197 HB2 SER 27 HB2 SER 27 2.459 2.252 14.793
198 HB3 SER 27 HB3 SER 27 2.340 2.063 13.044
199 HG SER 27 HG SER 27 4.149 0.401 13.536
200 H GLY 28 H GLY 28 4.466 4.188 11.549
201 HA2 GLY 28 HA2 GLY 28 5.944 4.079 9.758
202 HA3 GLY 28 HA3 GLY 28 6.677 2.663 10.481
203 H PHE 29 H PHE 29 3.282 2.356 10.126
204 HA PHE 29 HA PHE 29 3.717 0.563 7.826
205 HB2 PHE 29 HB2 PHE 29 1.495 0.634 9.877
206 HB3 PHE 29 HB3 PHE 29 1.507 -0.434 8.480
207 HD1 PHE 29 HD1 PHE 29 3.436 -2.079 8.253
208 HD2 PHE 29 HD2 PHE 29 2.577 0.004 11.861
209 HE1 PHE 29 HE1 PHE 29 4.709 -3.759 9.522
210 HE2 PHE 29 HE2 PHE 29 3.852 -1.670 13.135
211 HZ PHE 29 HZ PHE 29 4.921 -3.555 11.965
212 H TYR 30 H TYR 30 2.278 0.524 6.054
213 HA TYR 30 HA TYR 30 0.701 2.975 5.610
214 HB2 TYR 30 HB2 TYR 30 1.774 0.864 3.726
215 HB3 TYR 30 HB3 TYR 30 0.597 2.067 3.217
216 HD1 TYR 30 HD1 TYR 30 4.027 1.709 4.638
217 HD2 TYR 30 HD2 TYR 30 1.304 4.191 2.501
218 HE1 TYR 30 HE1 TYR 30 5.851 3.278 4.127
219 HE2 TYR 30 HE2 TYR 30 3.127 5.761 1.990
220 HH TYR 30 HH TYR 30 5.345 6.386 2.918
221 H GLU 31 H GLU 31 -1.474 2.912 5.664
222 HA GLU 31 HA GLU 31 -2.835 0.315 5.871
223 HB2 GLU 31 HB2 GLU 31 -3.819 3.121 6.457
224 HB3 GLU 31 HB3 GLU 31 -4.746 1.648 6.718
225 HG2 GLU 31 HG2 GLU 31 -3.248 0.922 8.431
226 HG3 GLU 31 HG3 GLU 31 -2.116 2.226 8.073
227 H PHE 32 H PHE 32 -3.801 -0.497 4.084
228 HA PHE 32 HA PHE 32 -5.277 1.310 2.323
229 HB2 PHE 32 HB2 PHE 32 -4.278 0.376 0.274
230 HB3 PHE 32 HB3 PHE 32 -3.090 1.216 1.258
231 HD1 PHE 32 HD1 PHE 32 -1.526 -0.178 2.708
232 HD2 PHE 32 HD2 PHE 32 -3.942 -1.859 -0.379
233 HE1 PHE 32 HE1 PHE 32 -0.064 -2.157 2.639
234 HE2 PHE 32 HE2 PHE 32 -2.483 -3.839 -0.444
235 HZ PHE 32 HZ PHE 32 -0.544 -3.988 1.065
236 H LYS 33 H LYS 33 -6.996 0.370 1.216
237 HA LYS 33 HA LYS 33 -7.761 -2.288 2.210
238 HB2 LYS 33 HB2 LYS 33 -9.296 -0.337 2.504
239 HB3 LYS 33 HB3 LYS 33 -9.451 -0.243 0.757
240 HG2 LYS 33 HG2 LYS 33 -10.358 -2.555 0.767
241 HG3 LYS 33 HG3 LYS 33 -10.318 -2.520 2.528
242 HD2 LYS 33 HD2 LYS 33 -11.895 -0.632 0.765
243 HD3 LYS 33 HD3 LYS 33 -12.558 -2.015 1.633
244 HE2 LYS 33 HE2 LYS 33 -13.075 -0.129 2.953
245 HE3 LYS 33 HE3 LYS 33 -11.717 -0.906 3.761
246 HZ1 LYS 33 HZ1 LYS 33 -10.239 0.734 2.885
247 HZ2 LYS 33 HZ2 LYS 33 -11.536 1.538 3.602
248 HZ3 LYS 33 HZ3 LYS 33 -11.450 1.407 1.920
249 H GLN 34 H GLN 34 -7.240 -3.950 0.937
250 HA GLN 34 HA GLN 34 -6.489 -3.779 -1.766
251 HB2 GLN 34 HB2 GLN 34 -7.453 -6.194 -0.217
252 HB3 GLN 34 HB3 GLN 34 -6.594 -6.244 -1.750
253 HG2 GLN 34 HG2 GLN 34 -4.615 -5.321 -0.731
254 HG3 GLN 34 HG3 GLN 34 -5.468 -5.082 0.794
255 HE21 GLN 34 HE21 GLN 34 -5.960 -6.887 2.066
256 HE22 GLN 34 HE22 GLN 34 -5.165 -8.404 1.841
257 H LEU 35 H LEU 35 -7.557 -5.146 -3.537
258 HA LEU 35 HA LEU 35 -9.901 -3.922 -4.343
259 HB2 LEU 35 HB2 LEU 35 -8.807 -6.593 -5.227
260 HB3 LEU 35 HB3 LEU 35 -10.059 -5.701 -6.069
261 HG LEU 35 HG LEU 35 -7.203 -4.784 -5.668
262 HD11 LEU 35 HD11 LEU 35 -7.017 -5.075 -8.096
263 HD12 LEU 35 HD12 LEU 35 -8.654 -5.728 -8.144
264 HD13 LEU 35 HD13 LEU 35 -7.382 -6.597 -7.285
265 HD21 LEU 35 HD21 LEU 35 -9.470 -3.472 -7.180
266 HD22 LEU 35 HD22 LEU 35 -7.793 -2.922 -7.144
267 HD23 LEU 35 HD23 LEU 35 -8.761 -2.896 -5.671
268 H ASP 36 H ASP 36 -9.590 -7.096 -2.750
269 HA ASP 36 HA ASP 36 -12.389 -7.687 -2.991
270 HB2 ASP 36 HB2 ASP 36 -10.295 -8.991 -1.240
271 HB3 ASP 36 HB3 ASP 36 -11.898 -9.635 -1.584
272 H GLY 37 H GLY 37 -10.823 -5.522 -1.015
273 HA2 GLY 37 HA2 GLY 37 -12.136 -4.108 0.396
274 HA3 GLY 37 HA3 GLY 37 -13.157 -5.477 0.786
275 H LYS 38 H LYS 38 -10.096 -6.671 1.015
276 HA LYS 38 HA LYS 38 -10.154 -6.492 3.908
277 HB2 LYS 38 HB2 LYS 38 -8.253 -7.925 2.041
278 HB3 LYS 38 HB3 LYS 38 -8.186 -8.027 3.795
279 HG2 LYS 38 HG2 LYS 38 -10.418 -9.011 3.842
280 HG3 LYS 38 HG3 LYS 38 -10.519 -8.884 2.085
281 HD2 LYS 38 HD2 LYS 38 -9.944 -11.156 2.741
282 HD3 LYS 38 HD3 LYS 38 -8.604 -10.411 1.871
283 HE2 LYS 38 HE2 LYS 38 -7.457 -9.969 3.982
284 HE3 LYS 38 HE3 LYS 38 -8.818 -10.642 4.877
285 HZ1 LYS 38 HZ1 LYS 38 -8.398 -12.786 3.905
286 HZ2 LYS 38 HZ2 LYS 38 -6.979 -12.216 4.629
287 HZ3 LYS 38 HZ3 LYS 38 -7.151 -12.161 2.947
288 H GLN 39 H GLN 39 -9.504 -4.578 4.719
289 HA GLN 39 HA GLN 39 -7.335 -3.025 3.682
290 HB2 GLN 39 HB2 GLN 39 -9.180 -1.987 4.910
291 HB3 GLN 39 HB3 GLN 39 -8.760 -2.897 6.355
292 HG2 GLN 39 HG2 GLN 39 -6.576 -1.717 6.412
293 HG3 GLN 39 HG3 GLN 39 -7.099 -0.754 5.031
294 HE21 GLN 39 HE21 GLN 39 -6.962 1.171 6.192
295 HE22 GLN 39 HE22 GLN 39 -8.099 1.595 7.421
296 H THR 40 H THR 40 -5.225 -3.417 3.946
297 HA THR 40 HA THR 40 -4.322 -4.874 6.358
298 HB THR 40 HB THR 40 -4.182 -6.443 4.532
299 HG1 THR 40 HG1 THR 40 -1.802 -6.674 4.486
300 HG21 THR 40 HG21 THR 40 -4.184 -4.904 2.641
301 HG22 THR 40 HG22 THR 40 -2.804 -5.997 2.531
302 HG23 THR 40 HG23 THR 40 -2.572 -4.336 3.075
303 H ARG 41 H ARG 41 -1.941 -4.606 6.780
304 HA ARG 41 HA ARG 41 -1.020 -1.895 6.037
305 HB2 ARG 41 HB2 ARG 41 -0.830 -3.182 8.773
306 HB3 ARG 41 HB3 ARG 41 -0.119 -1.637 8.326
307 HG2 ARG 41 HG2 ARG 41 -2.325 -0.693 7.952
308 HG3 ARG 41 HG3 ARG 41 -3.074 -2.253 8.308
309 HD2 ARG 41 HD2 ARG 41 -1.450 -0.565 10.220
310 HD3 ARG 41 HD3 ARG 41 -3.199 -0.794 10.254
311 HE ARG 41 HE ARG 41 -2.602 -3.246 10.594
312 HH11 ARG 41 HH11 ARG 41 -0.710 -0.635 11.813
313 HH12 ARG 41 HH12 ARG 41 -0.003 -1.595 13.063
314 HH21 ARG 41 HH21 ARG 41 -1.686 -4.458 12.188
315 HH22 ARG 41 HH22 ARG 41 -0.540 -3.740 13.266
316 H ILE 42 H ILE 42 1.009 -1.810 5.262
317 HA ILE 42 HA ILE 42 2.836 -4.068 5.844
318 HB ILE 42 HB ILE 42 2.027 -4.077 3.488
319 HG12 ILE 42 HG12 ILE 42 4.983 -3.436 3.731
320 HG13 ILE 42 HG13 ILE 42 4.259 -4.991 4.133
321 HG21 ILE 42 HG21 ILE 42 1.736 -1.674 3.182
322 HG22 ILE 42 HG22 ILE 42 2.786 -2.343 1.932
323 HG23 ILE 42 HG23 ILE 42 3.483 -1.438 3.275
324 HD11 ILE 42 HD11 ILE 42 5.309 -5.011 1.938
325 HD12 ILE 42 HD12 ILE 42 4.242 -3.710 1.410
326 HD13 ILE 42 HD13 ILE 42 3.572 -5.289 1.828
327 H ASN 43 H ASN 43 5.110 -3.546 6.003
328 HA ASN 43 HA ASN 43 5.516 -1.170 7.499
329 HB2 ASN 43 HB2 ASN 43 6.713 -3.355 7.851
330 HB3 ASN 43 HB3 ASN 43 7.671 -2.995 6.416
331 HD21 ASN 43 HD21 ASN 43 9.591 -2.881 7.532
332 HD22 ASN 43 HD22 ASN 43 9.967 -1.608 8.636
333 H LYS 44 H LYS 44 7.077 0.510 7.134
334 HA LYS 44 HA LYS 44 6.554 1.824 4.701
335 HB2 LYS 44 HB2 LYS 44 7.901 3.638 5.568
336 HB3 LYS 44 HB3 LYS 44 6.898 2.980 6.853
337 HG2 LYS 44 HG2 LYS 44 8.843 1.698 7.681
338 HG3 LYS 44 HG3 LYS 44 9.839 2.444 6.428
339 HD2 LYS 44 HD2 LYS 44 8.401 3.874 8.672
340 HD3 LYS 44 HD3 LYS 44 10.139 3.593 8.556
341 HE2 LYS 44 HE2 LYS 44 8.492 5.249 6.638
342 HE3 LYS 44 HE3 LYS 44 9.521 5.887 7.917
343 HZ1 LYS 44 HZ1 LYS 44 10.591 5.944 5.740
344 HZ2 LYS 44 HZ2 LYS 44 10.479 4.259 5.623
345 HZ3 LYS 44 HZ3 LYS 44 11.439 4.963 6.822
346 H ASP 45 H ASP 45 9.154 -0.306 5.502
347 HA ASP 45 HA ASP 45 11.055 0.912 3.706
348 HB2 ASP 45 HB2 ASP 45 12.495 -1.010 4.266
349 HB3 ASP 45 HB3 ASP 45 11.878 -0.195 5.696
350 H GLN 46 H GLN 46 8.599 -1.506 3.435
351 HA GLN 46 HA GLN 46 9.751 -2.892 1.199
352 HB2 GLN 46 HB2 GLN 46 6.893 -2.943 2.181
353 HB3 GLN 46 HB3 GLN 46 7.645 -4.106 1.097
354 HG2 GLN 46 HG2 GLN 46 8.336 -3.626 3.985
355 HG3 GLN 46 HG3 GLN 46 7.500 -5.025 3.318
356 HE21 GLN 46 HE21 GLN 46 10.036 -4.738 4.824
357 HE22 GLN 46 HE22 GLN 46 11.223 -5.547 3.866
358 H VAL 47 H VAL 47 7.790 -0.038 1.472
359 HA VAL 47 HA VAL 47 6.606 -0.231 -1.126
360 HB VAL 47 HB VAL 47 5.521 1.107 0.592
361 HG11 VAL 47 HG11 VAL 47 7.460 1.945 1.782
362 HG12 VAL 47 HG12 VAL 47 6.422 3.282 1.291
363 HG13 VAL 47 HG13 VAL 47 7.906 2.943 0.400
364 HG21 VAL 47 HG21 VAL 47 6.440 2.804 -1.737
365 HG22 VAL 47 HG22 VAL 47 5.018 3.104 -0.736
366 HG23 VAL 47 HG23 VAL 47 5.094 1.664 -1.752
367 H ARG 48 H ARG 48 7.690 -0.136 -2.954
368 HA ARG 48 HA ARG 48 10.201 1.271 -3.247
369 HB2 ARG 48 HB2 ARG 48 9.715 -0.896 -4.394
370 HB3 ARG 48 HB3 ARG 48 8.486 -0.084 -5.350
371 HG2 ARG 48 HG2 ARG 48 10.415 -0.278 -6.711
372 HG3 ARG 48 HG3 ARG 48 10.299 1.418 -6.236
373 HD2 ARG 48 HD2 ARG 48 11.988 1.059 -4.506
374 HD3 ARG 48 HD3 ARG 48 12.074 -0.653 -4.929
375 HE ARG 48 HE ARG 48 12.703 1.342 -6.978
376 HH11 ARG 48 HH11 ARG 48 13.793 -1.146 -4.841
377 HH12 ARG 48 HH12 ARG 48 15.307 -1.321 -5.659
378 HH21 ARG 48 HH21 ARG 48 14.634 1.108 -8.003
379 HH22 ARG 48 HH22 ARG 48 15.793 -0.036 -7.411
380 H THR 49 H THR 49 7.125 1.438 -5.056
381 HA THR 49 HA THR 49 7.185 4.364 -5.013
382 HB THR 49 HB THR 49 6.711 4.510 -7.459
383 HG1 THR 49 HG1 THR 49 7.837 2.180 -8.216
384 HG21 THR 49 HG21 THR 49 8.981 4.963 -6.651
385 HG22 THR 49 HG22 THR 49 9.014 4.196 -8.240
386 HG23 THR 49 HG23 THR 49 9.381 3.250 -6.797
387 H VAL 50 H VAL 50 5.138 5.315 -5.255
388 HA VAL 50 HA VAL 50 2.858 3.445 -5.198
389 HB VAL 50 HB VAL 50 2.976 6.334 -4.287
390 HG11 VAL 50 HG11 VAL 50 0.780 4.277 -3.989
391 HG12 VAL 50 HG12 VAL 50 0.742 5.698 -5.033
392 HG13 VAL 50 HG13 VAL 50 0.778 5.892 -3.280
393 HG21 VAL 50 HG21 VAL 50 4.315 4.891 -2.843
394 HG22 VAL 50 HG22 VAL 50 2.957 3.780 -2.662
395 HG23 VAL 50 HG23 VAL 50 2.855 5.412 -2.004
396 H LYS 51 H LYS 51 1.594 3.317 -6.959
397 HA LYS 51 HA LYS 51 1.633 5.566 -8.884
398 HB2 LYS 51 HB2 LYS 51 1.371 2.615 -9.512
399 HB3 LYS 51 HB3 LYS 51 1.371 3.926 -10.686
400 HG2 LYS 51 HG2 LYS 51 3.682 4.481 -10.026
401 HG3 LYS 51 HG3 LYS 51 3.671 3.110 -8.912
402 HD2 LYS 51 HD2 LYS 51 3.212 1.609 -10.848
403 HD3 LYS 51 HD3 LYS 51 3.366 3.002 -11.921
404 HE2 LYS 51 HE2 LYS 51 5.442 1.791 -11.917
405 HE3 LYS 51 HE3 LYS 51 5.684 3.323 -11.082
406 HZ1 LYS 51 HZ1 LYS 51 5.615 2.220 -8.989
407 HZ2 LYS 51 HZ2 LYS 51 6.695 1.374 -9.969
408 HZ3 LYS 51 HZ3 LYS 51 5.149 0.755 -9.692
409 H ASP 52 H ASP 52 -0.269 5.988 -10.070
410 HA ASP 52 HA ASP 52 -2.736 5.282 -8.666
411 HB2 ASP 52 HB2 ASP 52 -2.211 7.274 -10.891
412 HB3 ASP 52 HB3 ASP 52 -3.745 7.074 -10.049
413 H LEU 53 H LEU 53 -4.411 4.097 -9.558
414 HA LEU 53 HA LEU 53 -3.861 2.543 -11.925
415 HB2 LEU 53 HB2 LEU 53 -6.263 2.684 -10.107
416 HB3 LEU 53 HB3 LEU 53 -6.195 1.640 -11.515
417 HG LEU 53 HG LEU 53 -4.336 1.490 -9.130
418 HD11 LEU 53 HD11 LEU 53 -6.577 -0.350 -9.978
419 HD12 LEU 53 HD12 LEU 53 -6.592 0.733 -8.586
420 HD13 LEU 53 HD13 LEU 53 -5.465 -0.622 -8.637
421 HD21 LEU 53 HD21 LEU 53 -3.522 -0.583 -10.165
422 HD22 LEU 53 HD22 LEU 53 -3.216 0.818 -11.191
423 HD23 LEU 53 HD23 LEU 53 -4.542 -0.280 -11.572
424 H LEU 54 H LEU 54 -5.580 5.472 -11.233
425 HA LEU 54 HA LEU 54 -6.566 5.534 -14.016
426 HB2 LEU 54 HB2 LEU 54 -7.481 7.138 -11.622
427 HB3 LEU 54 HB3 LEU 54 -8.069 7.369 -13.259
428 HG LEU 54 HG LEU 54 -8.446 4.894 -11.558
429 HD11 LEU 54 HD11 LEU 54 -10.418 6.979 -12.502
430 HD12 LEU 54 HD12 LEU 54 -9.836 6.763 -10.850
431 HD13 LEU 54 HD13 LEU 54 -10.815 5.509 -11.609
432 HD21 LEU 54 HD21 LEU 54 -8.192 4.289 -13.907
433 HD22 LEU 54 HD22 LEU 54 -9.415 5.476 -14.361
434 HD23 LEU 54 HD23 LEU 54 -9.861 4.076 -13.384
435 H GLU 55 H GLU 55 -4.490 6.125 -14.825
436 HA GLU 55 HA GLU 55 -3.480 8.786 -14.107
437 HB2 GLU 55 HB2 GLU 55 -2.352 6.520 -15.748
438 HB3 GLU 55 HB3 GLU 55 -1.635 8.123 -15.784
439 HG2 GLU 55 HG2 GLU 55 -2.044 6.620 -13.211
440 HG3 GLU 55 HG3 GLU 55 -0.608 6.406 -14.210
Start of MODEL 7
1 H1 MET 1 H1 MET 1 -13.982 9.544 0.949
2 H2 MET 1 H2 MET 1 -14.959 8.334 0.282
3 H3 MET 1 H3 MET 1 -15.460 9.947 0.234
4 HA MET 1 HA MET 1 -14.643 9.191 -1.920
5 HB2 MET 1 HB2 MET 1 -14.468 11.567 -1.203
6 HB3 MET 1 HB3 MET 1 -12.859 11.245 -0.582
7 HG2 MET 1 HG2 MET 1 -12.064 10.756 -2.821
8 HG3 MET 1 HG3 MET 1 -13.689 10.995 -3.466
9 HE1 MET 1 HE1 MET 1 -11.816 14.134 -4.840
10 HE2 MET 1 HE2 MET 1 -12.781 12.714 -5.238
11 HE3 MET 1 HE3 MET 1 -11.136 12.519 -4.634
12 H ALA 2 H ALA 2 -13.033 8.196 -3.159
13 HA ALA 2 HA ALA 2 -10.493 7.502 -1.921
14 HB1 ALA 2 HB1 ALA 2 -10.756 5.106 -2.169
15 HB2 ALA 2 HB2 ALA 2 -12.391 5.325 -2.796
16 HB3 ALA 2 HB3 ALA 2 -12.025 5.748 -1.125
17 H SER 3 H SER 3 -8.903 6.822 -3.365
18 HA SER 3 HA SER 3 -9.614 6.820 -6.240
19 HB2 SER 3 HB2 SER 3 -7.072 7.896 -4.965
20 HB3 SER 3 HB3 SER 3 -7.352 7.764 -6.699
21 HG SER 3 HG SER 3 -8.159 9.691 -6.504
22 HA PRO 4 HA PRO 4 -7.840 2.724 -6.118
23 HB2 PRO 4 HB2 PRO 4 -7.484 2.305 -8.782
24 HB3 PRO 4 HB3 PRO 4 -9.077 2.271 -8.016
25 HG2 PRO 4 HG2 PRO 4 -7.753 4.493 -9.537
26 HG3 PRO 4 HG3 PRO 4 -9.424 3.906 -9.649
27 HD2 PRO 4 HD2 PRO 4 -8.758 6.123 -8.238
28 HD3 PRO 4 HD3 PRO 4 -10.087 5.051 -7.751
29 H THR 5 H THR 5 -5.803 2.452 -5.378
30 HA THR 5 HA THR 5 -3.560 3.624 -6.916
31 HB THR 5 HB THR 5 -3.775 3.362 -3.904
32 HG1 THR 5 HG1 THR 5 -3.707 5.669 -5.596
33 HG21 THR 5 HG21 THR 5 -1.473 2.988 -4.641
34 HG22 THR 5 HG22 THR 5 -1.617 4.546 -3.830
35 HG23 THR 5 HG23 THR 5 -1.520 4.474 -5.590
36 H VAL 6 H VAL 6 -1.873 2.320 -7.410
37 HA VAL 6 HA VAL 6 -1.855 -0.411 -6.299
38 HB VAL 6 HB VAL 6 -2.117 -0.407 -8.713
39 HG11 VAL 6 HG11 VAL 6 0.491 1.115 -8.838
40 HG12 VAL 6 HG12 VAL 6 -1.105 1.754 -9.234
41 HG13 VAL 6 HG13 VAL 6 -0.400 0.473 -10.220
42 HG21 VAL 6 HG21 VAL 6 -0.220 -1.847 -9.326
43 HG22 VAL 6 HG22 VAL 6 -0.841 -2.231 -7.721
44 HG23 VAL 6 HG23 VAL 6 0.651 -1.306 -7.891
45 H ILE 7 H ILE 7 -0.362 -0.811 -4.816
46 HA ILE 7 HA ILE 7 1.954 0.938 -4.525
47 HB ILE 7 HB ILE 7 1.088 -1.378 -2.772
48 HG12 ILE 7 HG12 ILE 7 0.585 1.593 -2.417
49 HG13 ILE 7 HG13 ILE 7 -0.629 0.401 -2.872
50 HG21 ILE 7 HG21 ILE 7 3.455 -0.808 -2.528
51 HG22 ILE 7 HG22 ILE 7 2.547 -0.368 -1.082
52 HG23 ILE 7 HG23 ILE 7 3.029 0.879 -2.232
53 HD11 ILE 7 HD11 ILE 7 -0.335 -0.714 -0.714
54 HD12 ILE 7 HD12 ILE 7 -0.799 0.976 -0.523
55 HD13 ILE 7 HD13 ILE 7 0.875 0.488 -0.261
56 H THR 8 H THR 8 3.607 0.430 -5.876
57 HA THR 8 HA THR 8 4.325 -2.330 -6.436
58 HB THR 8 HB THR 8 5.836 0.205 -7.151
59 HG1 THR 8 HG1 THR 8 3.604 -1.013 -8.246
60 HG21 THR 8 HG21 THR 8 7.214 -1.843 -7.221
61 HG22 THR 8 HG22 THR 8 6.947 -1.172 -8.831
62 HG23 THR 8 HG23 THR 8 6.034 -2.586 -8.302
63 H LEU 9 H LEU 9 5.684 -3.521 -5.238
64 HA LEU 9 HA LEU 9 7.077 -2.238 -3.004
65 HB2 LEU 9 HB2 LEU 9 6.592 -5.173 -3.535
66 HB3 LEU 9 HB3 LEU 9 7.253 -4.486 -2.063
67 HG LEU 9 HG LEU 9 4.439 -4.122 -3.106
68 HD11 LEU 9 HD11 LEU 9 4.832 -6.316 -2.139
69 HD12 LEU 9 HD12 LEU 9 3.794 -5.351 -1.091
70 HD13 LEU 9 HD13 LEU 9 5.495 -5.574 -0.681
71 HD21 LEU 9 HD21 LEU 9 5.731 -2.978 -0.625
72 HD22 LEU 9 HD22 LEU 9 4.015 -2.887 -1.028
73 HD23 LEU 9 HD23 LEU 9 5.204 -2.069 -2.043
74 H ASN 10 H ASN 10 9.224 -3.022 -2.376
75 HA ASN 10 HA ASN 10 11.160 -2.742 -4.342
76 HB2 ASN 10 HB2 ASN 10 11.755 -2.394 -2.055
77 HB3 ASN 10 HB3 ASN 10 11.291 -4.032 -1.610
78 HD21 ASN 10 HD21 ASN 10 12.683 -5.728 -2.067
79 HD22 ASN 10 HD22 ASN 10 14.323 -5.478 -2.539
80 H ASP 11 H ASP 11 9.873 -5.765 -2.967
81 HA ASP 11 HA ASP 11 11.591 -7.440 -4.526
82 HB2 ASP 11 HB2 ASP 11 9.166 -8.024 -2.830
83 HB3 ASP 11 HB3 ASP 11 10.078 -9.278 -3.666
84 H GLY 12 H GLY 12 9.161 -5.586 -5.634
85 HA2 GLY 12 HA2 GLY 12 8.644 -5.629 -7.956
86 HA3 GLY 12 HA3 GLY 12 8.821 -7.373 -7.946
87 H ARG 13 H ARG 13 7.058 -7.342 -5.399
88 HA ARG 13 HA ARG 13 4.641 -8.003 -6.694
89 HB2 ARG 13 HB2 ARG 13 5.206 -8.967 -4.530
90 HB3 ARG 13 HB3 ARG 13 5.162 -7.377 -3.775
91 HG2 ARG 13 HG2 ARG 13 2.755 -7.215 -4.311
92 HG3 ARG 13 HG3 ARG 13 2.819 -8.841 -4.989
93 HD2 ARG 13 HD2 ARG 13 3.402 -9.756 -2.817
94 HD3 ARG 13 HD3 ARG 13 3.467 -8.134 -2.122
95 HE ARG 13 HE ARG 13 0.944 -8.384 -3.189
96 HH11 ARG 13 HH11 ARG 13 2.779 -10.083 -0.808
97 HH12 ARG 13 HH12 ARG 13 1.376 -10.520 0.101
98 HH21 ARG 13 HH21 ARG 13 -0.831 -8.952 -2.025
99 HH22 ARG 13 HH22 ARG 13 -0.653 -9.885 -0.579
100 H GLU 14 H GLU 14 2.827 -6.862 -7.177
101 HA GLU 14 HA GLU 14 2.693 -4.036 -6.310
102 HB2 GLU 14 HB2 GLU 14 1.340 -5.382 -8.662
103 HB3 GLU 14 HB3 GLU 14 1.186 -3.686 -8.229
104 HG2 GLU 14 HG2 GLU 14 3.583 -3.369 -8.641
105 HG3 GLU 14 HG3 GLU 14 3.719 -5.068 -9.098
106 H ILE 15 H ILE 15 1.082 -3.455 -4.955
107 HA ILE 15 HA ILE 15 -1.142 -5.362 -4.553
108 HB ILE 15 HB ILE 15 -0.160 -3.301 -2.564
109 HG12 ILE 15 HG12 ILE 15 0.426 -6.282 -2.685
110 HG13 ILE 15 HG13 ILE 15 1.591 -4.993 -2.966
111 HG21 ILE 15 HG21 ILE 15 -2.075 -5.628 -2.328
112 HG22 ILE 15 HG22 ILE 15 -2.473 -3.911 -2.232
113 HG23 ILE 15 HG23 ILE 15 -1.494 -4.664 -0.972
114 HD11 ILE 15 HD11 ILE 15 0.174 -5.564 -0.370
115 HD12 ILE 15 HD12 ILE 15 1.327 -4.259 -0.647
116 HD13 ILE 15 HD13 ILE 15 1.855 -5.939 -0.753
117 H GLN 16 H GLN 16 -2.965 -4.707 -5.475
118 HA GLN 16 HA GLN 16 -3.384 -1.870 -6.058
119 HB2 GLN 16 HB2 GLN 16 -4.890 -4.331 -6.973
120 HB3 GLN 16 HB3 GLN 16 -5.192 -2.691 -7.531
121 HG2 GLN 16 HG2 GLN 16 -3.032 -2.574 -8.569
122 HG3 GLN 16 HG3 GLN 16 -2.559 -4.120 -7.864
123 HE21 GLN 16 HE21 GLN 16 -4.491 -2.553 -10.285
124 HE22 GLN 16 HE22 GLN 16 -4.837 -3.965 -11.211
125 H ALA 17 H ALA 17 -4.562 -0.656 -4.730
126 HA ALA 17 HA ALA 17 -6.568 -1.937 -2.987
127 HB1 ALA 17 HB1 ALA 17 -6.182 -0.158 -1.392
128 HB2 ALA 17 HB2 ALA 17 -5.067 0.638 -2.507
129 HB3 ALA 17 HB3 ALA 17 -4.653 -0.929 -1.812
130 H VAL 18 H VAL 18 -8.461 -0.662 -2.424
131 HA VAL 18 HA VAL 18 -9.589 0.728 -4.707
132 HB VAL 18 HB VAL 18 -11.692 0.734 -3.429
133 HG11 VAL 18 HG11 VAL 18 -10.304 -1.951 -3.419
134 HG12 VAL 18 HG12 VAL 18 -11.162 -1.226 -4.779
135 HG13 VAL 18 HG13 VAL 18 -12.047 -1.696 -3.328
136 HG21 VAL 18 HG21 VAL 18 -10.783 1.033 -1.175
137 HG22 VAL 18 HG22 VAL 18 -10.093 -0.589 -1.228
138 HG23 VAL 18 HG23 VAL 18 -11.844 -0.373 -1.242
139 H ASP 19 H ASP 19 -7.997 1.600 -1.824
140 HA ASP 19 HA ASP 19 -8.747 4.414 -2.237
141 HB2 ASP 19 HB2 ASP 19 -8.747 4.784 0.197
142 HB3 ASP 19 HB3 ASP 19 -9.970 3.611 -0.274
143 H THR 20 H THR 20 -7.152 5.944 -1.256
144 HA THR 20 HA THR 20 -4.468 5.135 -1.947
145 HB THR 20 HB THR 20 -3.829 7.476 -1.404
146 HG1 THR 20 HG1 THR 20 -5.271 8.889 -0.591
147 HG21 THR 20 HG21 THR 20 -4.608 6.933 -3.662
148 HG22 THR 20 HG22 THR 20 -5.098 8.562 -3.197
149 HG23 THR 20 HG23 THR 20 -6.273 7.248 -3.171
150 HA PRO 21 HA PRO 21 -3.569 3.456 2.075
151 HB2 PRO 21 HB2 PRO 21 -0.786 3.638 1.816
152 HB3 PRO 21 HB3 PRO 21 -1.789 2.290 1.274
153 HG2 PRO 21 HG2 PRO 21 -0.736 4.617 -0.290
154 HG3 PRO 21 HG3 PRO 21 -0.865 2.911 -0.764
155 HD2 PRO 21 HD2 PRO 21 -2.623 4.693 -1.667
156 HD3 PRO 21 HD3 PRO 21 -3.163 3.073 -1.172
157 H LYS 22 H LYS 22 -3.755 4.528 3.936
158 HA LYS 22 HA LYS 22 -2.631 7.199 4.262
159 HB2 LYS 22 HB2 LYS 22 -4.926 6.682 5.045
160 HB3 LYS 22 HB3 LYS 22 -4.264 5.525 6.193
161 HG2 LYS 22 HG2 LYS 22 -3.114 7.308 7.375
162 HG3 LYS 22 HG3 LYS 22 -3.669 8.484 6.183
163 HD2 LYS 22 HD2 LYS 22 -5.143 8.758 7.985
164 HD3 LYS 22 HD3 LYS 22 -6.042 7.769 6.840
165 HE2 LYS 22 HE2 LYS 22 -4.553 6.733 9.257
166 HE3 LYS 22 HE3 LYS 22 -6.291 6.996 9.167
167 HZ1 LYS 22 HZ1 LYS 22 -5.881 4.711 8.809
168 HZ2 LYS 22 HZ2 LYS 22 -4.693 5.018 7.650
169 HZ3 LYS 22 HZ3 LYS 22 -6.312 5.354 7.306
170 H TYR 23 H TYR 23 -0.720 7.599 5.193
171 HA TYR 23 HA TYR 23 0.799 5.380 6.324
172 HB2 TYR 23 HB2 TYR 23 1.906 6.708 4.637
173 HB3 TYR 23 HB3 TYR 23 1.579 8.193 5.520
174 HD1 TYR 23 HD1 TYR 23 3.316 4.904 6.024
175 HD2 TYR 23 HD2 TYR 23 3.302 9.093 6.787
176 HE1 TYR 23 HE1 TYR 23 5.494 4.702 7.143
177 HE2 TYR 23 HE2 TYR 23 5.481 8.898 7.907
178 HH TYR 23 HH TYR 23 6.835 7.193 9.032
179 H ASP 24 H ASP 24 1.200 5.103 8.439
180 HA ASP 24 HA ASP 24 0.597 7.286 10.315
181 HB2 ASP 24 HB2 ASP 24 -0.389 5.036 10.750
182 HB3 ASP 24 HB3 ASP 24 1.239 4.384 10.919
183 H GLU 25 H GLU 25 2.221 8.535 10.953
184 HA GLU 25 HA GLU 25 4.905 8.106 10.181
185 HB2 GLU 25 HB2 GLU 25 3.894 10.331 10.459
186 HB3 GLU 25 HB3 GLU 25 3.763 10.060 12.191
187 HG2 GLU 25 HG2 GLU 25 6.244 9.874 12.289
188 HG3 GLU 25 HG3 GLU 25 6.300 10.314 10.581
189 H GLU 26 H GLU 26 3.195 7.441 13.172
190 HA GLU 26 HA GLU 26 5.515 7.183 14.826
191 HB2 GLU 26 HB2 GLU 26 2.746 6.043 15.274
192 HB3 GLU 26 HB3 GLU 26 3.989 6.280 16.496
193 HG2 GLU 26 HG2 GLU 26 3.844 8.695 16.204
194 HG3 GLU 26 HG3 GLU 26 2.635 8.479 14.939
195 H SER 27 H SER 27 3.368 4.778 13.288
196 HA SER 27 HA SER 27 5.057 2.589 14.220
197 HB2 SER 27 HB2 SER 27 3.322 1.117 13.314
198 HB3 SER 27 HB3 SER 27 2.598 2.365 14.328
199 HG SER 27 HG SER 27 1.619 3.182 12.647
200 H GLY 28 H GLY 28 4.432 4.321 11.247
201 HA2 GLY 28 HA2 GLY 28 5.803 4.340 9.353
202 HA3 GLY 28 HA3 GLY 28 6.655 2.936 9.974
203 H PHE 29 H PHE 29 3.283 2.512 10.016
204 HA PHE 29 HA PHE 29 3.481 0.742 7.679
205 HB2 PHE 29 HB2 PHE 29 1.537 0.811 9.992
206 HB3 PHE 29 HB3 PHE 29 1.346 -0.251 8.601
207 HD1 PHE 29 HD1 PHE 29 3.086 -1.985 8.135
208 HD2 PHE 29 HD2 PHE 29 3.029 0.255 11.756
209 HE1 PHE 29 HE1 PHE 29 4.544 -3.662 9.193
210 HE2 PHE 29 HE2 PHE 29 4.482 -1.418 12.819
211 HZ PHE 29 HZ PHE 29 5.245 -3.378 11.538
212 H TYR 30 H TYR 30 1.989 0.728 6.022
213 HA TYR 30 HA TYR 30 0.297 3.118 5.717
214 HB2 TYR 30 HB2 TYR 30 1.335 1.097 3.711
215 HB3 TYR 30 HB3 TYR 30 0.137 2.319 3.305
216 HD1 TYR 30 HD1 TYR 30 3.652 1.816 4.385
217 HD2 TYR 30 HD2 TYR 30 0.783 4.568 2.844
218 HE1 TYR 30 HE1 TYR 30 5.453 3.413 3.881
219 HE2 TYR 30 HE2 TYR 30 2.583 6.163 2.339
220 HH TYR 30 HH TYR 30 4.857 6.665 3.072
221 H GLU 31 H GLU 31 -1.866 2.963 5.861
222 HA GLU 31 HA GLU 31 -3.114 0.305 6.013
223 HB2 GLU 31 HB2 GLU 31 -4.234 3.021 6.751
224 HB3 GLU 31 HB3 GLU 31 -5.031 1.474 7.009
225 HG2 GLU 31 HG2 GLU 31 -3.244 0.809 8.546
226 HG3 GLU 31 HG3 GLU 31 -2.448 2.363 8.292
227 H PHE 32 H PHE 32 -4.283 -0.459 4.362
228 HA PHE 32 HA PHE 32 -5.834 1.275 2.631
229 HB2 PHE 32 HB2 PHE 32 -4.731 0.475 0.545
230 HB3 PHE 32 HB3 PHE 32 -3.659 1.446 1.550
231 HD1 PHE 32 HD1 PHE 32 -1.909 0.319 2.930
232 HD2 PHE 32 HD2 PHE 32 -4.213 -1.785 0.032
233 HE1 PHE 32 HE1 PHE 32 -0.268 -1.510 2.957
234 HE2 PHE 32 HE2 PHE 32 -2.572 -3.612 0.059
235 HZ PHE 32 HZ PHE 32 -0.595 -3.478 1.519
236 H LYS 33 H LYS 33 -7.364 0.138 1.342
237 HA LYS 33 HA LYS 33 -7.759 -2.683 2.128
238 HB2 LYS 33 HB2 LYS 33 -9.570 -1.104 2.716
239 HB3 LYS 33 HB3 LYS 33 -9.745 -0.680 1.019
240 HG2 LYS 33 HG2 LYS 33 -10.359 -3.042 0.542
241 HG3 LYS 33 HG3 LYS 33 -10.300 -3.368 2.276
242 HD2 LYS 33 HD2 LYS 33 -12.139 -1.406 0.884
243 HD3 LYS 33 HD3 LYS 33 -12.597 -2.976 1.549
244 HE2 LYS 33 HE2 LYS 33 -12.011 -2.200 3.797
245 HE3 LYS 33 HE3 LYS 33 -11.526 -0.636 3.142
246 HZ1 LYS 33 HZ1 LYS 33 -14.263 -1.791 3.108
247 HZ2 LYS 33 HZ2 LYS 33 -13.823 -0.338 2.364
248 HZ3 LYS 33 HZ3 LYS 33 -13.728 -0.487 4.042
249 H GLN 34 H GLN 34 -7.128 -4.128 0.621
250 HA GLN 34 HA GLN 34 -6.485 -3.521 -2.047
251 HB2 GLN 34 HB2 GLN 34 -7.172 -6.186 -0.790
252 HB3 GLN 34 HB3 GLN 34 -6.467 -5.993 -2.390
253 HG2 GLN 34 HG2 GLN 34 -4.483 -4.965 -1.399
254 HG3 GLN 34 HG3 GLN 34 -5.191 -5.137 0.207
255 HE21 GLN 34 HE21 GLN 34 -5.333 -7.189 1.126
256 HE22 GLN 34 HE22 GLN 34 -4.424 -8.529 0.527
257 H LEU 35 H LEU 35 -7.486 -4.307 -4.035
258 HA LEU 35 HA LEU 35 -10.120 -3.567 -4.440
259 HB2 LEU 35 HB2 LEU 35 -8.539 -5.617 -6.006
260 HB3 LEU 35 HB3 LEU 35 -10.016 -4.848 -6.560
261 HG LEU 35 HG LEU 35 -7.381 -3.453 -6.035
262 HD11 LEU 35 HD11 LEU 35 -8.822 -4.056 -8.622
263 HD12 LEU 35 HD12 LEU 35 -7.346 -4.832 -8.048
264 HD13 LEU 35 HD13 LEU 35 -7.336 -3.118 -8.458
265 HD21 LEU 35 HD21 LEU 35 -8.464 -1.476 -7.000
266 HD22 LEU 35 HD22 LEU 35 -9.260 -1.995 -5.514
267 HD23 LEU 35 HD23 LEU 35 -9.994 -2.353 -7.077
268 H ASP 36 H ASP 36 -8.881 -6.652 -3.376
269 HA ASP 36 HA ASP 36 -11.252 -8.183 -3.794
270 HB2 ASP 36 HB2 ASP 36 -9.050 -8.782 -1.811
271 HB3 ASP 36 HB3 ASP 36 -10.105 -9.928 -2.636
272 H GLY 37 H GLY 37 -10.948 -5.636 -1.801
273 HA2 GLY 37 HA2 GLY 37 -12.280 -4.886 -0.071
274 HA3 GLY 37 HA3 GLY 37 -13.120 -6.428 -0.096
275 H LYS 38 H LYS 38 -9.671 -6.360 0.248
276 HA LYS 38 HA LYS 38 -9.947 -7.149 3.084
277 HB2 LYS 38 HB2 LYS 38 -7.891 -8.081 1.065
278 HB3 LYS 38 HB3 LYS 38 -7.972 -8.583 2.750
279 HG2 LYS 38 HG2 LYS 38 -10.121 -9.650 2.357
280 HG3 LYS 38 HG3 LYS 38 -10.115 -9.089 0.685
281 HD2 LYS 38 HD2 LYS 38 -9.441 -11.416 0.765
282 HD3 LYS 38 HD3 LYS 38 -8.071 -10.420 0.271
283 HE2 LYS 38 HE2 LYS 38 -7.165 -10.519 2.540
284 HE3 LYS 38 HE3 LYS 38 -8.554 -11.473 3.063
285 HZ1 LYS 38 HZ1 LYS 38 -7.875 -13.218 1.527
286 HZ2 LYS 38 HZ2 LYS 38 -6.638 -12.871 2.626
287 HZ3 LYS 38 HZ3 LYS 38 -6.542 -12.303 1.039
288 H GLN 39 H GLN 39 -9.206 -5.573 4.380
289 HA GLN 39 HA GLN 39 -7.176 -3.700 3.461
290 HB2 GLN 39 HB2 GLN 39 -9.190 -2.946 4.745
291 HB3 GLN 39 HB3 GLN 39 -8.566 -3.804 6.151
292 HG2 GLN 39 HG2 GLN 39 -6.507 -2.376 5.997
293 HG3 GLN 39 HG3 GLN 39 -7.323 -1.442 4.745
294 HE21 GLN 39 HE21 GLN 39 -7.361 0.450 5.914
295 HE22 GLN 39 HE22 GLN 39 -8.330 0.661 7.328
296 H THR 40 H THR 40 -5.097 -3.552 4.190
297 HA THR 40 HA THR 40 -4.236 -5.114 6.506
298 HB THR 40 HB THR 40 -3.859 -6.706 4.711
299 HG1 THR 40 HG1 THR 40 -1.423 -6.705 4.880
300 HG21 THR 40 HG21 THR 40 -3.753 -5.145 2.820
301 HG22 THR 40 HG22 THR 40 -2.349 -6.212 2.838
302 HG23 THR 40 HG23 THR 40 -2.195 -4.546 3.392
303 H ARG 41 H ARG 41 -1.952 -4.621 7.133
304 HA ARG 41 HA ARG 41 -1.191 -1.870 6.345
305 HB2 ARG 41 HB2 ARG 41 -0.788 -3.276 9.001
306 HB3 ARG 41 HB3 ARG 41 -0.101 -1.708 8.598
307 HG2 ARG 41 HG2 ARG 41 -2.352 -0.779 8.343
308 HG3 ARG 41 HG3 ARG 41 -3.049 -2.350 8.740
309 HD2 ARG 41 HD2 ARG 41 -2.020 -2.254 10.959
310 HD3 ARG 41 HD3 ARG 41 -1.285 -0.701 10.561
311 HE ARG 41 HE ARG 41 -3.798 -0.057 10.218
312 HH11 ARG 41 HH11 ARG 41 -2.454 -1.994 12.730
313 HH12 ARG 41 HH12 ARG 41 -3.703 -1.591 13.852
314 HH21 ARG 41 HH21 ARG 41 -5.370 0.471 11.665
315 HH22 ARG 41 HH22 ARG 41 -5.345 -0.218 13.256
316 H ILE 42 H ILE 42 0.718 -1.645 5.345
317 HA ILE 42 HA ILE 42 2.719 -3.815 5.607
318 HB ILE 42 HB ILE 42 1.650 -3.559 3.334
319 HG12 ILE 42 HG12 ILE 42 4.639 -3.042 3.427
320 HG13 ILE 42 HG13 ILE 42 3.885 -4.613 3.687
321 HG21 ILE 42 HG21 ILE 42 1.458 -1.112 3.335
322 HG22 ILE 42 HG22 ILE 42 2.334 -1.691 1.918
323 HG23 ILE 42 HG23 ILE 42 3.216 -0.975 3.268
324 HD11 ILE 42 HD11 ILE 42 4.770 -4.415 1.443
325 HD12 ILE 42 HD12 ILE 42 3.768 -2.994 1.150
326 HD13 ILE 42 HD13 ILE 42 3.015 -4.569 1.410
327 H ASN 43 H ASN 43 4.965 -3.206 5.652
328 HA ASN 43 HA ASN 43 5.352 -0.772 7.148
329 HB2 ASN 43 HB2 ASN 43 6.466 -2.914 7.753
330 HB3 ASN 43 HB3 ASN 43 7.435 -2.793 6.287
331 HD21 ASN 43 HD21 ASN 43 9.355 -2.690 7.446
332 HD22 ASN 43 HD22 ASN 43 9.817 -1.290 8.346
333 H LYS 44 H LYS 44 6.781 0.911 6.696
334 HA LYS 44 HA LYS 44 6.570 1.953 4.096
335 HB2 LYS 44 HB2 LYS 44 7.957 3.805 4.929
336 HB3 LYS 44 HB3 LYS 44 6.674 3.378 6.054
337 HG2 LYS 44 HG2 LYS 44 8.306 2.106 7.400
338 HG3 LYS 44 HG3 LYS 44 9.583 2.610 6.290
339 HD2 LYS 44 HD2 LYS 44 7.869 4.443 7.981
340 HD3 LYS 44 HD3 LYS 44 9.551 4.011 8.296
341 HE2 LYS 44 HE2 LYS 44 10.216 5.069 6.186
342 HE3 LYS 44 HE3 LYS 44 8.535 5.496 5.866
343 HZ1 LYS 44 HZ1 LYS 44 8.544 6.866 7.857
344 HZ2 LYS 44 HZ2 LYS 44 9.759 7.354 6.785
345 HZ3 LYS 44 HZ3 LYS 44 10.159 6.457 8.156
346 H ASP 45 H ASP 45 8.942 -0.222 5.282
347 HA ASP 45 HA ASP 45 11.100 0.720 3.617
348 HB2 ASP 45 HB2 ASP 45 12.298 -1.280 4.360
349 HB3 ASP 45 HB3 ASP 45 11.570 -0.444 5.725
350 H GLN 46 H GLN 46 8.391 -1.361 3.190
351 HA GLN 46 HA GLN 46 9.483 -2.918 1.027
352 HB2 GLN 46 HB2 GLN 46 6.687 -2.617 2.127
353 HB3 GLN 46 HB3 GLN 46 7.075 -3.674 0.775
354 HG2 GLN 46 HG2 GLN 46 8.288 -3.879 3.527
355 HG3 GLN 46 HG3 GLN 46 6.940 -4.852 2.939
356 HE21 GLN 46 HE21 GLN 46 9.653 -5.607 3.817
357 HE22 GLN 46 HE22 GLN 46 10.322 -6.506 2.507
358 H VAL 47 H VAL 47 7.749 0.112 1.230
359 HA VAL 47 HA VAL 47 6.543 -0.027 -1.338
360 HB VAL 47 HB VAL 47 5.605 1.427 0.347
361 HG11 VAL 47 HG11 VAL 47 8.121 3.083 0.108
362 HG12 VAL 47 HG12 VAL 47 7.649 2.106 1.498
363 HG13 VAL 47 HG13 VAL 47 6.684 3.510 1.044
364 HG21 VAL 47 HG21 VAL 47 6.643 2.990 -2.019
365 HG22 VAL 47 HG22 VAL 47 5.275 3.449 -1.006
366 HG23 VAL 47 HG23 VAL 47 5.193 1.985 -1.988
367 H ARG 48 H ARG 48 7.585 -0.098 -3.174
368 HA ARG 48 HA ARG 48 10.149 1.160 -3.629
369 HB2 ARG 48 HB2 ARG 48 9.726 -0.978 -4.647
370 HB3 ARG 48 HB3 ARG 48 8.245 -0.401 -5.388
371 HG2 ARG 48 HG2 ARG 48 9.541 1.043 -6.877
372 HG3 ARG 48 HG3 ARG 48 11.038 0.488 -6.117
373 HD2 ARG 48 HD2 ARG 48 10.642 -1.771 -6.863
374 HD3 ARG 48 HD3 ARG 48 9.047 -1.337 -7.473
375 HE ARG 48 HE ARG 48 11.035 0.216 -8.745
376 HH11 ARG 48 HH11 ARG 48 9.762 -2.979 -8.663
377 HH12 ARG 48 HH12 ARG 48 10.221 -3.333 -10.287
378 HH21 ARG 48 HH21 ARG 48 11.599 -0.229 -10.845
379 HH22 ARG 48 HH22 ARG 48 11.236 -1.782 -11.516
380 H THR 49 H THR 49 6.969 1.436 -5.247
381 HA THR 49 HA THR 49 7.205 4.346 -5.325
382 HB THR 49 HB THR 49 6.574 4.406 -7.771
383 HG1 THR 49 HG1 THR 49 5.948 2.290 -8.144
384 HG21 THR 49 HG21 THR 49 8.861 4.923 -7.035
385 HG22 THR 49 HG22 THR 49 8.852 4.123 -8.606
386 HG23 THR 49 HG23 THR 49 9.286 3.216 -7.158
387 H VAL 50 H VAL 50 5.276 5.265 -4.935
388 HA VAL 50 HA VAL 50 2.857 3.612 -4.981
389 HB VAL 50 HB VAL 50 3.251 6.424 -3.915
390 HG11 VAL 50 HG11 VAL 50 0.918 4.518 -3.625
391 HG12 VAL 50 HG12 VAL 50 0.930 6.036 -4.523
392 HG13 VAL 50 HG13 VAL 50 1.092 6.051 -2.768
393 HG21 VAL 50 HG21 VAL 50 3.218 5.391 -1.693
394 HG22 VAL 50 HG22 VAL 50 4.558 4.779 -2.663
395 HG23 VAL 50 HG23 VAL 50 3.115 3.792 -2.431
396 H LYS 51 H LYS 51 1.815 3.554 -6.897
397 HA LYS 51 HA LYS 51 1.303 6.115 -8.284
398 HB2 LYS 51 HB2 LYS 51 1.853 3.401 -9.498
399 HB3 LYS 51 HB3 LYS 51 1.149 4.734 -10.404
400 HG2 LYS 51 HG2 LYS 51 3.181 6.085 -9.856
401 HG3 LYS 51 HG3 LYS 51 3.887 4.629 -9.149
402 HD2 LYS 51 HD2 LYS 51 3.805 3.486 -11.265
403 HD3 LYS 51 HD3 LYS 51 2.889 4.806 -11.994
404 HE2 LYS 51 HE2 LYS 51 4.843 6.299 -11.606
405 HE3 LYS 51 HE3 LYS 51 5.748 4.900 -11.028
406 HZ1 LYS 51 HZ1 LYS 51 6.132 5.468 -13.395
407 HZ2 LYS 51 HZ2 LYS 51 4.520 5.073 -13.722
408 HZ3 LYS 51 HZ3 LYS 51 5.582 3.883 -13.161
409 H ASP 52 H ASP 52 -0.741 6.338 -9.294
410 HA ASP 52 HA ASP 52 -2.857 4.754 -8.078
411 HB2 ASP 52 HB2 ASP 52 -3.072 7.104 -9.979
412 HB3 ASP 52 HB3 ASP 52 -4.365 6.426 -8.993
413 H LEU 53 H LEU 53 -4.384 3.524 -9.242
414 HA LEU 53 HA LEU 53 -3.635 2.344 -11.700
415 HB2 LEU 53 HB2 LEU 53 -6.351 2.510 -10.373
416 HB3 LEU 53 HB3 LEU 53 -5.999 1.519 -11.778
417 HG LEU 53 HG LEU 53 -4.766 1.194 -9.033
418 HD11 LEU 53 HD11 LEU 53 -6.751 -0.528 -10.522
419 HD12 LEU 53 HD12 LEU 53 -7.096 0.472 -9.110
420 HD13 LEU 53 HD13 LEU 53 -6.012 -0.911 -8.967
421 HD21 LEU 53 HD21 LEU 53 -3.763 -0.856 -9.961
422 HD22 LEU 53 HD22 LEU 53 -3.169 0.596 -10.765
423 HD23 LEU 53 HD23 LEU 53 -4.373 -0.419 -11.558
424 H LEU 54 H LEU 54 -5.517 5.172 -10.899
425 HA LEU 54 HA LEU 54 -5.564 5.907 -13.762
426 HB2 LEU 54 HB2 LEU 54 -7.501 6.801 -11.610
427 HB3 LEU 54 HB3 LEU 54 -7.527 7.313 -13.286
428 HG LEU 54 HG LEU 54 -8.073 4.516 -12.272
429 HD11 LEU 54 HD11 LEU 54 -9.901 6.582 -13.495
430 HD12 LEU 54 HD12 LEU 54 -9.889 6.068 -11.808
431 HD13 LEU 54 HD13 LEU 54 -10.352 4.929 -13.073
432 HD21 LEU 54 HD21 LEU 54 -6.968 4.412 -14.429
433 HD22 LEU 54 HD22 LEU 54 -8.083 5.609 -15.088
434 HD23 LEU 54 HD23 LEU 54 -8.677 4.018 -14.612
435 H GLU 55 H GLU 55 -3.395 6.753 -13.407
436 HA GLU 55 HA GLU 55 -2.791 8.743 -11.475
437 HB2 GLU 55 HB2 GLU 55 -1.427 8.091 -14.097
438 HB3 GLU 55 HB3 GLU 55 -0.762 9.152 -12.864
439 HG2 GLU 55 HG2 GLU 55 -0.652 7.311 -11.291
440 HG3 GLU 55 HG3 GLU 55 -1.404 6.233 -12.470
Start of MODEL 8
1 H1 MET 1 H1 MET 1 -14.861 9.791 -0.514
2 H2 MET 1 H2 MET 1 -13.455 9.044 0.062
3 H3 MET 1 H3 MET 1 -14.794 8.108 -0.377
4 HA MET 1 HA MET 1 -14.579 8.835 -2.673
5 HB2 MET 1 HB2 MET 1 -12.049 10.149 -1.650
6 HB3 MET 1 HB3 MET 1 -12.483 9.981 -3.348
7 HG2 MET 1 HG2 MET 1 -14.036 11.532 -1.279
8 HG3 MET 1 HG3 MET 1 -12.974 12.218 -2.508
9 HE1 MET 1 HE1 MET 1 -13.622 10.443 -5.063
10 HE2 MET 1 HE2 MET 1 -13.489 12.202 -5.094
11 HE3 MET 1 HE3 MET 1 -14.890 11.410 -5.818
12 H ALA 2 H ALA 2 -13.441 7.500 -4.141
13 HA ALA 2 HA ALA 2 -11.376 5.723 -3.066
14 HB1 ALA 2 HB1 ALA 2 -12.580 3.701 -3.788
15 HB2 ALA 2 HB2 ALA 2 -13.980 4.695 -4.195
16 HB3 ALA 2 HB3 ALA 2 -13.445 4.570 -2.519
17 H SER 3 H SER 3 -10.105 4.716 -4.633
18 HA SER 3 HA SER 3 -10.583 5.195 -7.462
19 HB2 SER 3 HB2 SER 3 -8.453 6.423 -7.798
20 HB3 SER 3 HB3 SER 3 -9.565 7.330 -6.771
21 HG SER 3 HG SER 3 -7.526 5.634 -5.729
22 HA PRO 4 HA PRO 4 -8.216 1.394 -7.602
23 HB2 PRO 4 HB2 PRO 4 -7.476 1.439 -10.238
24 HB3 PRO 4 HB3 PRO 4 -9.089 0.977 -9.692
25 HG2 PRO 4 HG2 PRO 4 -8.138 3.603 -10.776
26 HG3 PRO 4 HG3 PRO 4 -9.638 2.724 -11.129
27 HD2 PRO 4 HD2 PRO 4 -9.562 4.818 -9.419
28 HD3 PRO 4 HD3 PRO 4 -10.665 3.447 -9.181
29 H THR 5 H THR 5 -6.292 1.383 -6.603
30 HA THR 5 HA THR 5 -4.087 3.036 -7.686
31 HB THR 5 HB THR 5 -4.684 2.550 -4.746
32 HG1 THR 5 HG1 THR 5 -4.659 5.109 -5.908
33 HG21 THR 5 HG21 THR 5 -2.539 4.241 -6.053
34 HG22 THR 5 HG22 THR 5 -2.278 2.738 -5.168
35 HG23 THR 5 HG23 THR 5 -2.878 4.165 -4.324
36 H VAL 6 H VAL 6 -1.966 2.179 -7.469
37 HA VAL 6 HA VAL 6 -1.806 -0.643 -6.628
38 HB VAL 6 HB VAL 6 -1.906 -0.574 -9.072
39 HG11 VAL 6 HG11 VAL 6 -1.009 1.677 -9.430
40 HG12 VAL 6 HG12 VAL 6 -0.155 0.480 -10.404
41 HG13 VAL 6 HG13 VAL 6 0.592 1.121 -8.940
42 HG21 VAL 6 HG21 VAL 6 0.164 -1.829 -9.553
43 HG22 VAL 6 HG22 VAL 6 -0.592 -2.338 -8.043
44 HG23 VAL 6 HG23 VAL 6 0.831 -1.296 -8.009
45 H ILE 7 H ILE 7 -0.205 -1.103 -5.278
46 HA ILE 7 HA ILE 7 1.926 0.887 -4.831
47 HB ILE 7 HB ILE 7 0.890 -1.263 -2.960
48 HG12 ILE 7 HG12 ILE 7 0.553 1.751 -2.880
49 HG13 ILE 7 HG13 ILE 7 -0.706 0.588 -3.279
50 HG21 ILE 7 HG21 ILE 7 2.312 -0.227 -1.258
51 HG22 ILE 7 HG22 ILE 7 2.931 0.907 -2.457
52 HG23 ILE 7 HG23 ILE 7 3.275 -0.815 -2.615
53 HD11 ILE 7 HD11 ILE 7 -0.937 1.403 -1.005
54 HD12 ILE 7 HD12 ILE 7 0.690 0.840 -0.622
55 HD13 ILE 7 HD13 ILE 7 -0.576 -0.323 -1.015
56 H THR 8 H THR 8 3.759 0.331 -5.880
57 HA THR 8 HA THR 8 4.419 -2.474 -6.345
58 HB THR 8 HB THR 8 6.022 -0.033 -7.164
59 HG1 THR 8 HG1 THR 8 3.871 -1.388 -8.440
60 HG21 THR 8 HG21 THR 8 7.308 -2.109 -7.179
61 HG22 THR 8 HG22 THR 8 6.992 -1.577 -8.832
62 HG23 THR 8 HG23 THR 8 6.055 -2.900 -8.137
63 H LEU 9 H LEU 9 5.568 -3.597 -4.892
64 HA LEU 9 HA LEU 9 7.137 -2.270 -2.840
65 HB2 LEU 9 HB2 LEU 9 6.811 -5.233 -3.348
66 HB3 LEU 9 HB3 LEU 9 7.409 -4.478 -1.877
67 HG LEU 9 HG LEU 9 4.585 -4.298 -2.952
68 HD11 LEU 9 HD11 LEU 9 5.088 -6.484 -2.017
69 HD12 LEU 9 HD12 LEU 9 3.984 -5.597 -0.967
70 HD13 LEU 9 HD13 LEU 9 5.689 -5.736 -0.536
71 HD21 LEU 9 HD21 LEU 9 4.067 -3.125 -0.857
72 HD22 LEU 9 HD22 LEU 9 5.211 -2.223 -1.850
73 HD23 LEU 9 HD23 LEU 9 5.780 -3.117 -0.440
74 H ASN 10 H ASN 10 9.351 -3.275 -2.288
75 HA ASN 10 HA ASN 10 11.140 -2.713 -4.387
76 HB2 ASN 10 HB2 ASN 10 11.714 -2.470 -1.996
77 HB3 ASN 10 HB3 ASN 10 11.695 -4.222 -1.816
78 HD21 ASN 10 HD21 ASN 10 13.387 -5.429 -2.659
79 HD22 ASN 10 HD22 ASN 10 14.862 -4.709 -3.197
80 H ASP 11 H ASP 11 9.795 -5.771 -3.273
81 HA ASP 11 HA ASP 11 11.454 -7.533 -4.717
82 HB2 ASP 11 HB2 ASP 11 8.543 -7.811 -3.924
83 HB3 ASP 11 HB3 ASP 11 9.555 -9.133 -4.498
84 H GLY 12 H GLY 12 9.095 -5.315 -5.856
85 HA2 GLY 12 HA2 GLY 12 8.520 -4.949 -8.132
86 HA3 GLY 12 HA3 GLY 12 8.992 -6.605 -8.499
87 H ARG 13 H ARG 13 7.383 -7.062 -5.814
88 HA ARG 13 HA ARG 13 4.953 -7.962 -6.976
89 HB2 ARG 13 HB2 ARG 13 6.007 -8.986 -4.986
90 HB3 ARG 13 HB3 ARG 13 5.680 -7.524 -4.066
91 HG2 ARG 13 HG2 ARG 13 3.272 -7.892 -4.333
92 HG3 ARG 13 HG3 ARG 13 3.604 -9.360 -5.256
93 HD2 ARG 13 HD2 ARG 13 4.790 -10.286 -3.295
94 HD3 ARG 13 HD3 ARG 13 4.359 -8.843 -2.379
95 HE ARG 13 HE ARG 13 1.961 -9.700 -3.155
96 HH11 ARG 13 HH11 ARG 13 4.630 -11.458 -1.859
97 HH12 ARG 13 HH12 ARG 13 3.619 -12.580 -1.014
98 HH21 ARG 13 HH21 ARG 13 0.674 -11.175 -2.086
99 HH22 ARG 13 HH22 ARG 13 1.416 -12.436 -1.160
100 H GLU 14 H GLU 14 3.124 -6.846 -7.367
101 HA GLU 14 HA GLU 14 2.849 -4.154 -6.190
102 HB2 GLU 14 HB2 GLU 14 1.699 -5.251 -8.769
103 HB3 GLU 14 HB3 GLU 14 1.456 -3.617 -8.159
104 HG2 GLU 14 HG2 GLU 14 3.861 -3.192 -8.337
105 HG3 GLU 14 HG3 GLU 14 4.107 -4.832 -8.939
106 H ILE 15 H ILE 15 1.161 -3.696 -4.925
107 HA ILE 15 HA ILE 15 -1.047 -5.651 -4.725
108 HB ILE 15 HB ILE 15 -0.157 -3.633 -2.647
109 HG12 ILE 15 HG12 ILE 15 0.304 -6.633 -2.750
110 HG13 ILE 15 HG13 ILE 15 1.538 -5.404 -2.997
111 HG21 ILE 15 HG21 ILE 15 -2.144 -5.908 -2.488
112 HG22 ILE 15 HG22 ILE 15 -2.529 -4.187 -2.508
113 HG23 ILE 15 HG23 ILE 15 -1.650 -4.875 -1.144
114 HD11 ILE 15 HD11 ILE 15 -0.004 -5.865 -0.454
115 HD12 ILE 15 HD12 ILE 15 1.242 -4.641 -0.701
116 HD13 ILE 15 HD13 ILE 15 1.661 -6.353 -0.766
117 H GLN 16 H GLN 16 -3.037 -4.993 -5.348
118 HA GLN 16 HA GLN 16 -3.392 -2.176 -6.074
119 HB2 GLN 16 HB2 GLN 16 -5.110 -4.569 -6.754
120 HB3 GLN 16 HB3 GLN 16 -5.303 -2.941 -7.395
121 HG2 GLN 16 HG2 GLN 16 -3.067 -3.124 -8.436
122 HG3 GLN 16 HG3 GLN 16 -2.964 -4.785 -7.855
123 HE21 GLN 16 HE21 GLN 16 -4.474 -2.638 -10.121
124 HE22 GLN 16 HE22 GLN 16 -5.179 -3.858 -11.115
125 H ALA 17 H ALA 17 -4.700 -0.830 -5.011
126 HA ALA 17 HA ALA 17 -6.575 -1.926 -3.002
127 HB1 ALA 17 HB1 ALA 17 -4.990 0.644 -2.866
128 HB2 ALA 17 HB2 ALA 17 -4.677 -0.822 -1.936
129 HB3 ALA 17 HB3 ALA 17 -6.160 0.093 -1.665
130 H VAL 18 H VAL 18 -8.450 -0.514 -2.515
131 HA VAL 18 HA VAL 18 -9.484 0.739 -4.962
132 HB VAL 18 HB VAL 18 -11.703 0.639 -3.859
133 HG11 VAL 18 HG11 VAL 18 -10.238 -2.001 -3.894
134 HG12 VAL 18 HG12 VAL 18 -10.951 -1.202 -5.294
135 HG13 VAL 18 HG13 VAL 18 -11.986 -1.785 -3.991
136 HG21 VAL 18 HG21 VAL 18 -10.210 -0.769 -1.637
137 HG22 VAL 18 HG22 VAL 18 -11.965 -0.650 -1.774
138 HG23 VAL 18 HG23 VAL 18 -10.999 0.805 -1.531
139 H ASP 19 H ASP 19 -7.947 1.741 -2.204
140 HA ASP 19 HA ASP 19 -8.892 4.471 -2.572
141 HB2 ASP 19 HB2 ASP 19 -8.897 4.700 0.025
142 HB3 ASP 19 HB3 ASP 19 -10.309 4.045 -0.792
143 H THR 20 H THR 20 -7.579 5.969 -0.996
144 HA THR 20 HA THR 20 -4.837 5.658 -1.829
145 HB THR 20 HB THR 20 -4.496 7.887 -0.791
146 HG1 THR 20 HG1 THR 20 -6.043 7.636 0.918
147 HG21 THR 20 HG21 THR 20 -5.297 7.772 -3.102
148 HG22 THR 20 HG22 THR 20 -6.009 9.154 -2.266
149 HG23 THR 20 HG23 THR 20 -6.966 7.696 -2.532
150 HA PRO 21 HA PRO 21 -3.458 3.756 1.989
151 HB2 PRO 21 HB2 PRO 21 -0.780 3.910 1.548
152 HB3 PRO 21 HB3 PRO 21 -1.822 2.750 0.717
153 HG2 PRO 21 HG2 PRO 21 -0.791 5.398 -0.251
154 HG3 PRO 21 HG3 PRO 21 -0.863 3.845 -1.111
155 HD2 PRO 21 HD2 PRO 21 -2.703 5.797 -1.497
156 HD3 PRO 21 HD3 PRO 21 -3.116 4.073 -1.594
157 H LYS 22 H LYS 22 -3.174 4.568 3.987
158 HA LYS 22 HA LYS 22 -2.287 7.340 4.317
159 HB2 LYS 22 HB2 LYS 22 -4.349 6.676 5.447
160 HB3 LYS 22 HB3 LYS 22 -3.504 5.375 6.278
161 HG2 LYS 22 HG2 LYS 22 -2.083 7.101 7.396
162 HG3 LYS 22 HG3 LYS 22 -3.099 8.342 6.662
163 HD2 LYS 22 HD2 LYS 22 -4.047 6.176 8.549
164 HD3 LYS 22 HD3 LYS 22 -3.758 7.861 8.980
165 HE2 LYS 22 HE2 LYS 22 -5.494 8.545 7.361
166 HE3 LYS 22 HE3 LYS 22 -5.807 6.845 7.006
167 HZ1 LYS 22 HZ1 LYS 22 -7.381 7.774 8.602
168 HZ2 LYS 22 HZ2 LYS 22 -6.118 8.115 9.673
169 HZ3 LYS 22 HZ3 LYS 22 -6.484 6.512 9.284
170 H TYR 23 H TYR 23 -0.378 7.925 5.258
171 HA TYR 23 HA TYR 23 1.465 5.803 6.104
172 HB2 TYR 23 HB2 TYR 23 2.357 7.411 4.510
173 HB3 TYR 23 HB3 TYR 23 1.921 8.749 5.565
174 HD1 TYR 23 HD1 TYR 23 4.004 5.640 5.560
175 HD2 TYR 23 HD2 TYR 23 3.558 9.632 6.982
176 HE1 TYR 23 HE1 TYR 23 6.225 5.514 6.603
177 HE2 TYR 23 HE2 TYR 23 5.781 9.510 8.027
178 HH TYR 23 HH TYR 23 7.327 7.682 8.887
179 H ASP 24 H ASP 24 1.476 5.267 8.223
180 HA ASP 24 HA ASP 24 0.973 7.396 10.208
181 HB2 ASP 24 HB2 ASP 24 -0.608 5.492 10.281
182 HB3 ASP 24 HB3 ASP 24 0.742 4.394 10.565
183 H GLU 25 H GLU 25 2.699 8.133 11.275
184 HA GLU 25 HA GLU 25 5.282 6.938 10.964
185 HB2 GLU 25 HB2 GLU 25 5.079 9.341 11.043
186 HB3 GLU 25 HB3 GLU 25 4.292 9.270 12.613
187 HG2 GLU 25 HG2 GLU 25 6.365 8.430 13.613
188 HG3 GLU 25 HG3 GLU 25 7.159 8.528 12.041
189 H GLU 26 H GLU 26 2.989 7.192 13.650
190 HA GLU 26 HA GLU 26 4.686 6.343 15.714
191 HB2 GLU 26 HB2 GLU 26 1.680 6.087 15.454
192 HB3 GLU 26 HB3 GLU 26 2.580 5.898 16.957
193 HG2 GLU 26 HG2 GLU 26 3.264 8.187 16.924
194 HG3 GLU 26 HG3 GLU 26 2.640 8.408 15.291
195 H SER 27 H SER 27 2.607 4.428 13.552
196 HA SER 27 HA SER 27 3.625 1.949 14.742
197 HB2 SER 27 HB2 SER 27 1.517 2.436 12.622
198 HB3 SER 27 HB3 SER 27 2.050 0.827 13.112
199 HG SER 27 HG SER 27 0.517 2.709 14.500
200 H GLY 28 H GLY 28 4.066 3.916 11.864
201 HA2 GLY 28 HA2 GLY 28 5.924 3.852 10.451
202 HA3 GLY 28 HA3 GLY 28 6.410 2.337 11.185
203 H PHE 29 H PHE 29 3.155 2.374 10.133
204 HA PHE 29 HA PHE 29 3.917 0.767 7.765
205 HB2 PHE 29 HB2 PHE 29 1.475 0.442 9.532
206 HB3 PHE 29 HB3 PHE 29 1.871 -0.551 8.136
207 HD1 PHE 29 HD1 PHE 29 4.171 -1.791 8.242
208 HD2 PHE 29 HD2 PHE 29 2.120 -0.260 11.646
209 HE1 PHE 29 HE1 PHE 29 5.424 -3.335 9.686
210 HE2 PHE 29 HE2 PHE 29 3.375 -1.802 13.096
211 HZ PHE 29 HZ PHE 29 5.030 -3.341 12.116
212 H TYR 30 H TYR 30 2.359 0.710 5.994
213 HA TYR 30 HA TYR 30 0.771 3.172 5.696
214 HB2 TYR 30 HB2 TYR 30 1.870 1.160 3.737
215 HB3 TYR 30 HB3 TYR 30 0.544 2.215 3.273
216 HD1 TYR 30 HD1 TYR 30 4.126 2.086 4.144
217 HD2 TYR 30 HD2 TYR 30 0.899 4.573 2.889
218 HE1 TYR 30 HE1 TYR 30 5.724 3.838 3.503
219 HE2 TYR 30 HE2 TYR 30 2.496 6.326 2.251
220 HH TYR 30 HH TYR 30 4.777 7.023 2.768
221 H GLU 31 H GLU 31 -1.413 3.108 5.829
222 HA GLU 31 HA GLU 31 -2.741 0.489 6.011
223 HB2 GLU 31 HB2 GLU 31 -3.887 3.226 6.620
224 HB3 GLU 31 HB3 GLU 31 -4.607 1.671 7.011
225 HG2 GLU 31 HG2 GLU 31 -2.663 1.219 8.501
226 HG3 GLU 31 HG3 GLU 31 -2.115 2.868 8.202
227 H PHE 32 H PHE 32 -3.744 -0.291 4.254
228 HA PHE 32 HA PHE 32 -5.267 1.518 2.529
229 HB2 PHE 32 HB2 PHE 32 -4.299 0.519 0.466
230 HB3 PHE 32 HB3 PHE 32 -3.118 1.428 1.399
231 HD1 PHE 32 HD1 PHE 32 -1.447 0.187 2.807
232 HD2 PHE 32 HD2 PHE 32 -3.978 -1.789 -0.003
233 HE1 PHE 32 HE1 PHE 32 0.040 -1.765 2.843
234 HE2 PHE 32 HE2 PHE 32 -2.483 -3.745 0.038
235 HZ PHE 32 HZ PHE 32 -0.473 -3.735 1.460
236 H LYS 33 H LYS 33 -6.850 0.458 1.198
237 HA LYS 33 HA LYS 33 -7.612 -2.206 2.228
238 HB2 LYS 33 HB2 LYS 33 -9.165 -0.270 2.615
239 HB3 LYS 33 HB3 LYS 33 -9.374 -0.155 0.875
240 HG2 LYS 33 HG2 LYS 33 -10.223 -2.506 0.898
241 HG3 LYS 33 HG3 LYS 33 -10.168 -2.444 2.660
242 HD2 LYS 33 HD2 LYS 33 -11.814 -0.666 0.852
243 HD3 LYS 33 HD3 LYS 33 -12.419 -1.987 1.848
244 HE2 LYS 33 HE2 LYS 33 -12.919 -0.007 3.034
245 HE3 LYS 33 HE3 LYS 33 -11.522 -0.704 3.852
246 HZ1 LYS 33 HZ1 LYS 33 -11.214 1.364 1.761
247 HZ2 LYS 33 HZ2 LYS 33 -10.113 0.914 2.958
248 HZ3 LYS 33 HZ3 LYS 33 -11.502 1.786 3.367
249 H GLN 34 H GLN 34 -7.019 -3.780 0.867
250 HA GLN 34 HA GLN 34 -6.360 -3.458 -1.845
251 HB2 GLN 34 HB2 GLN 34 -7.092 -5.968 -0.319
252 HB3 GLN 34 HB3 GLN 34 -6.342 -5.944 -1.912
253 HG2 GLN 34 HG2 GLN 34 -4.357 -4.921 -1.033
254 HG3 GLN 34 HG3 GLN 34 -5.110 -4.708 0.546
255 HE21 GLN 34 HE21 GLN 34 -5.357 -6.489 1.891
256 HE22 GLN 34 HE22 GLN 34 -4.495 -7.963 1.630
257 H LEU 35 H LEU 35 -7.379 -4.687 -3.685
258 HA LEU 35 HA LEU 35 -9.838 -3.677 -4.366
259 HB2 LEU 35 HB2 LEU 35 -8.596 -6.248 -5.343
260 HB3 LEU 35 HB3 LEU 35 -9.943 -5.439 -6.120
261 HG LEU 35 HG LEU 35 -7.135 -4.352 -5.835
262 HD11 LEU 35 HD11 LEU 35 -7.071 -4.570 -8.272
263 HD12 LEU 35 HD12 LEU 35 -8.679 -5.296 -8.251
264 HD13 LEU 35 HD13 LEU 35 -7.326 -6.130 -7.489
265 HD21 LEU 35 HD21 LEU 35 -9.571 -3.120 -7.141
266 HD22 LEU 35 HD22 LEU 35 -7.923 -2.495 -7.252
267 HD23 LEU 35 HD23 LEU 35 -8.747 -2.533 -5.695
268 H ASP 36 H ASP 36 -9.239 -6.846 -2.879
269 HA ASP 36 HA ASP 36 -11.946 -7.740 -3.101
270 HB2 ASP 36 HB2 ASP 36 -10.027 -8.863 -1.083
271 HB3 ASP 36 HB3 ASP 36 -11.220 -9.701 -2.072
272 H GLY 37 H GLY 37 -10.756 -5.345 -1.201
273 HA2 GLY 37 HA2 GLY 37 -11.977 -4.192 0.464
274 HA3 GLY 37 HA3 GLY 37 -12.850 -5.673 0.828
275 H LYS 38 H LYS 38 -9.718 -6.598 0.598
276 HA LYS 38 HA LYS 38 -9.460 -6.980 3.412
277 HB2 LYS 38 HB2 LYS 38 -7.362 -7.393 1.266
278 HB3 LYS 38 HB3 LYS 38 -7.312 -8.030 2.903
279 HG2 LYS 38 HG2 LYS 38 -9.471 -9.259 2.320
280 HG3 LYS 38 HG3 LYS 38 -9.121 -8.835 0.642
281 HD2 LYS 38 HD2 LYS 38 -7.304 -10.391 2.493
282 HD3 LYS 38 HD3 LYS 38 -8.294 -11.084 1.210
283 HE2 LYS 38 HE2 LYS 38 -6.218 -8.976 0.649
284 HE3 LYS 38 HE3 LYS 38 -5.806 -10.686 0.729
285 HZ1 LYS 38 HZ1 LYS 38 -6.225 -10.014 -1.533
286 HZ2 LYS 38 HZ2 LYS 38 -7.767 -9.454 -1.132
287 HZ3 LYS 38 HZ3 LYS 38 -7.415 -11.103 -1.037
288 H GLN 39 H GLN 39 -9.264 -5.063 4.538
289 HA GLN 39 HA GLN 39 -7.298 -3.074 3.800
290 HB2 GLN 39 HB2 GLN 39 -9.421 -2.457 4.928
291 HB3 GLN 39 HB3 GLN 39 -8.909 -3.351 6.353
292 HG2 GLN 39 HG2 GLN 39 -6.957 -1.825 6.554
293 HG3 GLN 39 HG3 GLN 39 -7.599 -0.887 5.204
294 HE21 GLN 39 HE21 GLN 39 -7.842 0.962 6.456
295 HE22 GLN 39 HE22 GLN 39 -9.063 1.102 7.669
296 H THR 40 H THR 40 -5.179 -3.170 4.308
297 HA THR 40 HA THR 40 -4.310 -4.540 6.744
298 HB THR 40 HB THR 40 -4.258 -6.337 5.080
299 HG1 THR 40 HG1 THR 40 -1.542 -5.886 5.203
300 HG21 THR 40 HG21 THR 40 -4.033 -4.990 3.046
301 HG22 THR 40 HG22 THR 40 -2.762 -6.209 3.129
302 HG23 THR 40 HG23 THR 40 -2.397 -4.528 3.518
303 H ARG 41 H ARG 41 -1.948 -4.258 7.132
304 HA ARG 41 HA ARG 41 -0.967 -1.699 6.025
305 HB2 ARG 41 HB2 ARG 41 -0.460 -2.855 8.777
306 HB3 ARG 41 HB3 ARG 41 0.166 -1.328 8.171
307 HG2 ARG 41 HG2 ARG 41 -2.125 -0.463 7.994
308 HG3 ARG 41 HG3 ARG 41 -2.744 -1.991 8.623
309 HD2 ARG 41 HD2 ARG 41 -0.930 -0.053 10.066
310 HD3 ARG 41 HD3 ARG 41 -2.641 -0.329 10.395
311 HE ARG 41 HE ARG 41 -1.030 -2.699 10.612
312 HH11 ARG 41 HH11 ARG 41 -2.117 0.103 12.309
313 HH12 ARG 41 HH12 ARG 41 -1.956 -0.652 13.857
314 HH21 ARG 41 HH21 ARG 41 -0.799 -3.622 12.589
315 HH22 ARG 41 HH22 ARG 41 -1.223 -2.743 14.019
316 H ILE 42 H ILE 42 1.221 -1.511 5.532
317 HA ILE 42 HA ILE 42 2.902 -3.914 5.804
318 HB ILE 42 HB ILE 42 1.992 -3.827 3.492
319 HG12 ILE 42 HG12 ILE 42 4.975 -3.282 3.627
320 HG13 ILE 42 HG13 ILE 42 4.218 -4.830 3.987
321 HG21 ILE 42 HG21 ILE 42 1.768 -1.403 3.273
322 HG22 ILE 42 HG22 ILE 42 2.724 -2.070 1.950
323 HG23 ILE 42 HG23 ILE 42 3.523 -1.229 3.280
324 HD11 ILE 42 HD11 ILE 42 5.167 -4.812 1.761
325 HD12 ILE 42 HD12 ILE 42 4.177 -3.418 1.331
326 HD13 ILE 42 HD13 ILE 42 3.411 -4.967 1.687
327 H ASN 43 H ASN 43 5.204 -3.490 5.840
328 HA ASN 43 HA ASN 43 5.858 -1.227 7.386
329 HB2 ASN 43 HB2 ASN 43 7.015 -3.545 7.250
330 HB3 ASN 43 HB3 ASN 43 7.925 -2.851 5.914
331 HD21 ASN 43 HD21 ASN 43 9.873 -2.949 7.009
332 HD22 ASN 43 HD22 ASN 43 10.244 -1.915 8.339
333 H LYS 44 H LYS 44 6.774 0.706 6.923
334 HA LYS 44 HA LYS 44 6.150 1.862 4.451
335 HB2 LYS 44 HB2 LYS 44 7.337 3.871 5.345
336 HB3 LYS 44 HB3 LYS 44 6.152 3.180 6.445
337 HG2 LYS 44 HG2 LYS 44 8.046 2.003 7.602
338 HG3 LYS 44 HG3 LYS 44 9.152 2.952 6.605
339 HD2 LYS 44 HD2 LYS 44 8.291 5.014 7.541
340 HD3 LYS 44 HD3 LYS 44 7.054 4.130 8.437
341 HE2 LYS 44 HE2 LYS 44 8.856 4.733 9.930
342 HE3 LYS 44 HE3 LYS 44 8.829 2.985 9.712
343 HZ1 LYS 44 HZ1 LYS 44 11.076 3.832 9.617
344 HZ2 LYS 44 HZ2 LYS 44 10.668 4.878 8.355
345 HZ3 LYS 44 HZ3 LYS 44 10.636 3.209 8.111
346 H ASP 45 H ASP 45 9.013 0.109 5.213
347 HA ASP 45 HA ASP 45 10.625 1.601 3.285
348 HB2 ASP 45 HB2 ASP 45 12.490 0.231 4.028
349 HB3 ASP 45 HB3 ASP 45 11.653 0.934 5.406
350 H GLN 46 H GLN 46 8.542 -1.054 3.241
351 HA GLN 46 HA GLN 46 9.897 -2.662 1.274
352 HB2 GLN 46 HB2 GLN 46 7.002 -2.681 2.177
353 HB3 GLN 46 HB3 GLN 46 7.748 -3.902 1.154
354 HG2 GLN 46 HG2 GLN 46 8.582 -3.253 3.972
355 HG3 GLN 46 HG3 GLN 46 7.553 -4.604 3.501
356 HE21 GLN 46 HE21 GLN 46 10.175 -4.550 4.815
357 HE22 GLN 46 HE22 GLN 46 11.205 -5.529 3.836
358 H VAL 47 H VAL 47 7.698 0.019 1.162
359 HA VAL 47 HA VAL 47 6.738 -0.497 -1.501
360 HB VAL 47 HB VAL 47 5.278 0.651 0.039
361 HG11 VAL 47 HG11 VAL 47 6.961 1.753 1.427
362 HG12 VAL 47 HG12 VAL 47 5.731 2.894 0.886
363 HG13 VAL 47 HG13 VAL 47 7.320 2.877 0.116
364 HG21 VAL 47 HG21 VAL 47 6.180 2.504 -2.175
365 HG22 VAL 47 HG22 VAL 47 4.629 2.581 -1.338
366 HG23 VAL 47 HG23 VAL 47 5.028 1.179 -2.331
367 H ARG 48 H ARG 48 7.807 -0.085 -3.328
368 HA ARG 48 HA ARG 48 10.061 1.730 -3.412
369 HB2 ARG 48 HB2 ARG 48 10.118 -0.366 -4.707
370 HB3 ARG 48 HB3 ARG 48 8.727 0.166 -5.643
371 HG2 ARG 48 HG2 ARG 48 10.015 1.993 -6.584
372 HG3 ARG 48 HG3 ARG 48 11.399 1.565 -5.579
373 HD2 ARG 48 HD2 ARG 48 11.724 0.750 -7.842
374 HD3 ARG 48 HD3 ARG 48 11.549 -0.605 -6.728
375 HE ARG 48 HE ARG 48 9.591 -1.193 -7.785
376 HH11 ARG 48 HH11 ARG 48 10.579 1.916 -8.892
377 HH12 ARG 48 HH12 ARG 48 9.484 1.909 -10.226
378 HH21 ARG 48 HH21 ARG 48 8.202 -1.195 -9.517
379 HH22 ARG 48 HH22 ARG 48 8.142 0.170 -10.572
380 H THR 49 H THR 49 6.992 1.528 -5.246
381 HA THR 49 HA THR 49 6.788 4.464 -5.224
382 HB THR 49 HB THR 49 6.171 4.496 -7.643
383 HG1 THR 49 HG1 THR 49 5.621 2.325 -7.967
384 HG21 THR 49 HG21 THR 49 8.455 5.097 -6.987
385 HG22 THR 49 HG22 THR 49 8.441 4.277 -8.550
386 HG23 THR 49 HG23 THR 49 8.940 3.404 -7.101
387 H VAL 50 H VAL 50 4.728 5.190 -4.961
388 HA VAL 50 HA VAL 50 2.511 3.246 -5.201
389 HB VAL 50 HB VAL 50 2.561 5.858 -3.657
390 HG11 VAL 50 HG11 VAL 50 0.461 3.685 -3.773
391 HG12 VAL 50 HG12 VAL 50 0.324 5.307 -4.456
392 HG13 VAL 50 HG13 VAL 50 0.428 5.093 -2.710
393 HG21 VAL 50 HG21 VAL 50 4.002 4.194 -2.615
394 HG22 VAL 50 HG22 VAL 50 2.691 3.014 -2.647
395 HG23 VAL 50 HG23 VAL 50 2.555 4.459 -1.642
396 H LYS 51 H LYS 51 1.528 3.440 -7.146
397 HA LYS 51 HA LYS 51 0.950 6.163 -8.148
398 HB2 LYS 51 HB2 LYS 51 1.716 3.718 -9.758
399 HB3 LYS 51 HB3 LYS 51 1.060 5.187 -10.464
400 HG2 LYS 51 HG2 LYS 51 2.999 6.436 -9.545
401 HG3 LYS 51 HG3 LYS 51 3.677 4.899 -8.999
402 HD2 LYS 51 HD2 LYS 51 3.747 4.092 -11.299
403 HD3 LYS 51 HD3 LYS 51 2.989 5.582 -11.863
404 HE2 LYS 51 HE2 LYS 51 4.931 6.858 -11.048
405 HE3 LYS 51 HE3 LYS 51 5.695 5.352 -10.542
406 HZ1 LYS 51 HZ1 LYS 51 6.501 6.113 -12.694
407 HZ2 LYS 51 HZ2 LYS 51 4.938 6.040 -13.329
408 HZ3 LYS 51 HZ3 LYS 51 5.716 4.623 -12.839
409 H ASP 52 H ASP 52 -1.014 6.400 -9.360
410 HA ASP 52 HA ASP 52 -3.108 4.509 -8.605
411 HB2 ASP 52 HB2 ASP 52 -3.278 7.167 -10.050
412 HB3 ASP 52 HB3 ASP 52 -4.651 6.220 -9.485
413 H LEU 53 H LEU 53 -4.424 3.405 -10.106
414 HA LEU 53 HA LEU 53 -3.336 2.792 -12.669
415 HB2 LEU 53 HB2 LEU 53 -6.144 2.344 -11.620
416 HB3 LEU 53 HB3 LEU 53 -5.476 1.617 -13.068
417 HG LEU 53 HG LEU 53 -4.622 1.094 -10.217
418 HD11 LEU 53 HD11 LEU 53 -5.369 -1.192 -10.680
419 HD12 LEU 53 HD12 LEU 53 -5.898 -0.695 -12.287
420 HD13 LEU 53 HD13 LEU 53 -6.680 -0.030 -10.855
421 HD21 LEU 53 HD21 LEU 53 -3.033 -0.530 -11.135
422 HD22 LEU 53 HD22 LEU 53 -2.651 1.111 -11.651
423 HD23 LEU 53 HD23 LEU 53 -3.438 -0.003 -12.769
424 H LEU 54 H LEU 54 -5.817 4.985 -11.485
425 HA LEU 54 HA LEU 54 -5.755 6.404 -14.082
426 HB2 LEU 54 HB2 LEU 54 -7.945 6.511 -11.990
427 HB3 LEU 54 HB3 LEU 54 -7.966 7.274 -13.569
428 HG LEU 54 HG LEU 54 -7.989 4.289 -13.068
429 HD11 LEU 54 HD11 LEU 54 -10.089 5.304 -12.408
430 HD12 LEU 54 HD12 LEU 54 -10.298 4.387 -13.899
431 HD13 LEU 54 HD13 LEU 54 -10.196 6.147 -13.953
432 HD21 LEU 54 HD21 LEU 54 -6.867 4.896 -15.165
433 HD22 LEU 54 HD22 LEU 54 -8.289 5.818 -15.654
434 HD23 LEU 54 HD23 LEU 54 -8.397 4.068 -15.454
435 H GLU 55 H GLU 55 -3.873 7.561 -13.448
436 HA GLU 55 HA GLU 55 -3.475 8.847 -10.987
437 HB2 GLU 55 HB2 GLU 55 -2.305 9.419 -13.715
438 HB3 GLU 55 HB3 GLU 55 -1.749 10.195 -12.237
439 HG2 GLU 55 HG2 GLU 55 -1.055 8.078 -11.323
440 HG3 GLU 55 HG3 GLU 55 -1.745 7.215 -12.698
Start of MODEL 9
1 H1 MET 1 H1 MET 1 -12.018 11.460 0.625
2 H2 MET 1 H2 MET 1 -12.608 12.745 -0.296
3 H3 MET 1 H3 MET 1 -10.971 12.322 -0.383
4 HA MET 1 HA MET 1 -13.249 10.656 -1.286
5 HB2 MET 1 HB2 MET 1 -11.104 12.116 -2.856
6 HB3 MET 1 HB3 MET 1 -12.312 11.042 -3.551
7 HG2 MET 1 HG2 MET 1 -12.941 13.349 -3.885
8 HG3 MET 1 HG3 MET 1 -14.082 12.560 -2.797
9 HE1 MET 1 HE1 MET 1 -13.919 15.721 -3.115
10 HE2 MET 1 HE2 MET 1 -14.017 16.231 -1.430
11 HE3 MET 1 HE3 MET 1 -15.033 14.911 -2.012
12 H ALA 2 H ALA 2 -12.306 8.898 -2.849
13 HA ALA 2 HA ALA 2 -9.761 7.835 -1.790
14 HB1 ALA 2 HB1 ALA 2 -10.692 5.585 -1.757
15 HB2 ALA 2 HB2 ALA 2 -12.248 6.204 -2.313
16 HB3 ALA 2 HB3 ALA 2 -11.636 6.659 -0.723
17 H SER 3 H SER 3 -8.428 6.825 -3.259
18 HA SER 3 HA SER 3 -9.345 6.657 -6.065
19 HB2 SER 3 HB2 SER 3 -7.947 8.622 -5.927
20 HB3 SER 3 HB3 SER 3 -6.709 7.746 -5.030
21 HG SER 3 HG SER 3 -5.900 7.126 -6.857
22 HA PRO 4 HA PRO 4 -7.746 2.457 -5.745
23 HB2 PRO 4 HB2 PRO 4 -7.664 1.940 -8.447
24 HB3 PRO 4 HB3 PRO 4 -9.128 1.829 -7.465
25 HG2 PRO 4 HG2 PRO 4 -8.199 4.062 -9.235
26 HG3 PRO 4 HG3 PRO 4 -9.827 3.380 -9.052
27 HD2 PRO 4 HD2 PRO 4 -9.121 5.690 -7.857
28 HD3 PRO 4 HD3 PRO 4 -10.232 4.541 -7.082
29 H THR 5 H THR 5 -5.650 2.173 -5.247
30 HA THR 5 HA THR 5 -3.589 3.427 -6.970
31 HB THR 5 HB THR 5 -3.398 2.965 -3.979
32 HG1 THR 5 HG1 THR 5 -3.978 5.328 -5.472
33 HG21 THR 5 HG21 THR 5 -1.228 2.938 -5.076
34 HG22 THR 5 HG22 THR 5 -1.416 4.424 -4.145
35 HG23 THR 5 HG23 THR 5 -1.600 4.453 -5.899
36 H VAL 6 H VAL 6 -1.933 2.163 -7.683
37 HA VAL 6 HA VAL 6 -1.758 -0.593 -6.666
38 HB VAL 6 HB VAL 6 -1.989 -0.415 -9.092
39 HG11 VAL 6 HG11 VAL 6 0.617 1.113 -9.044
40 HG12 VAL 6 HG12 VAL 6 -0.966 1.766 -9.463
41 HG13 VAL 6 HG13 VAL 6 -0.218 0.545 -10.490
42 HG21 VAL 6 HG21 VAL 6 -0.084 -1.810 -9.748
43 HG22 VAL 6 HG22 VAL 6 -0.728 -2.293 -8.179
44 HG23 VAL 6 HG23 VAL 6 0.762 -1.355 -8.269
45 H ILE 7 H ILE 7 -0.297 -0.992 -5.161
46 HA ILE 7 HA ILE 7 2.001 0.797 -4.822
47 HB ILE 7 HB ILE 7 0.958 -1.386 -2.997
48 HG12 ILE 7 HG12 ILE 7 0.709 1.633 -2.789
49 HG13 ILE 7 HG13 ILE 7 -0.593 0.530 -3.229
50 HG21 ILE 7 HG21 ILE 7 2.458 -0.429 -1.305
51 HG22 ILE 7 HG22 ILE 7 3.084 0.706 -2.500
52 HG23 ILE 7 HG23 ILE 7 3.358 -1.025 -2.700
53 HD11 ILE 7 HD11 ILE 7 -0.800 1.213 -0.926
54 HD12 ILE 7 HD12 ILE 7 0.832 0.641 -0.579
55 HD13 ILE 7 HD13 ILE 7 -0.432 -0.510 -1.013
56 H THR 8 H THR 8 3.777 0.225 -5.935
57 HA THR 8 HA THR 8 4.360 -2.595 -6.472
58 HB THR 8 HB THR 8 5.889 -0.132 -7.362
59 HG1 THR 8 HG1 THR 8 3.567 -1.285 -8.271
60 HG21 THR 8 HG21 THR 8 6.868 -1.649 -9.049
61 HG22 THR 8 HG22 THR 8 6.020 -3.009 -8.309
62 HG23 THR 8 HG23 THR 8 7.268 -2.148 -7.407
63 H LEU 9 H LEU 9 5.532 -3.726 -5.059
64 HA LEU 9 HA LEU 9 7.071 -2.410 -2.993
65 HB2 LEU 9 HB2 LEU 9 6.714 -5.366 -3.515
66 HB3 LEU 9 HB3 LEU 9 7.355 -4.638 -2.054
67 HG LEU 9 HG LEU 9 4.511 -4.409 -3.059
68 HD11 LEU 9 HD11 LEU 9 5.024 -6.593 -2.111
69 HD12 LEU 9 HD12 LEU 9 3.954 -5.685 -1.044
70 HD13 LEU 9 HD13 LEU 9 5.669 -5.827 -0.658
71 HD21 LEU 9 HD21 LEU 9 4.061 -3.211 -0.966
72 HD22 LEU 9 HD22 LEU 9 5.208 -2.335 -1.982
73 HD23 LEU 9 HD23 LEU 9 5.783 -3.239 -0.580
74 H ASN 10 H ASN 10 9.273 -3.148 -2.426
75 HA ASN 10 HA ASN 10 11.077 -2.634 -4.489
76 HB2 ASN 10 HB2 ASN 10 11.645 -2.213 -2.176
77 HB3 ASN 10 HB3 ASN 10 11.552 -3.928 -1.799
78 HD21 ASN 10 HD21 ASN 10 13.252 -5.252 -2.330
79 HD22 ASN 10 HD22 ASN 10 14.770 -4.656 -2.898
80 H ASP 11 H ASP 11 10.100 -5.780 -3.137
81 HA ASP 11 HA ASP 11 11.939 -7.356 -4.592
82 HB2 ASP 11 HB2 ASP 11 9.228 -8.075 -3.458
83 HB3 ASP 11 HB3 ASP 11 10.383 -9.244 -4.091
84 H GLY 12 H GLY 12 9.249 -5.614 -5.728
85 HA2 GLY 12 HA2 GLY 12 8.854 -5.396 -8.076
86 HA3 GLY 12 HA3 GLY 12 9.399 -7.049 -8.296
87 H ARG 13 H ARG 13 7.290 -6.796 -5.657
88 HA ARG 13 HA ARG 13 5.109 -7.943 -7.245
89 HB2 ARG 13 HB2 ARG 13 5.768 -9.202 -5.277
90 HB3 ARG 13 HB3 ARG 13 5.522 -7.795 -4.251
91 HG2 ARG 13 HG2 ARG 13 3.147 -7.852 -4.638
92 HG3 ARG 13 HG3 ARG 13 3.328 -9.148 -5.822
93 HD2 ARG 13 HD2 ARG 13 4.138 -10.647 -4.076
94 HD3 ARG 13 HD3 ARG 13 4.022 -9.348 -2.891
95 HE ARG 13 HE ARG 13 1.547 -9.391 -3.525
96 HH11 ARG 13 HH11 ARG 13 3.571 -12.182 -3.569
97 HH12 ARG 13 HH12 ARG 13 2.284 -13.258 -3.146
98 HH21 ARG 13 HH21 ARG 13 -0.098 -10.784 -2.974
99 HH22 ARG 13 HH22 ARG 13 0.238 -12.473 -2.800
100 H GLU 14 H GLU 14 3.225 -6.924 -7.643
101 HA GLU 14 HA GLU 14 2.851 -4.219 -6.531
102 HB2 GLU 14 HB2 GLU 14 1.589 -5.545 -8.944
103 HB3 GLU 14 HB3 GLU 14 1.306 -3.885 -8.433
104 HG2 GLU 14 HG2 GLU 14 3.569 -3.275 -8.909
105 HG3 GLU 14 HG3 GLU 14 4.017 -4.957 -9.191
106 H ILE 15 H ILE 15 1.229 -3.785 -5.148
107 HA ILE 15 HA ILE 15 -0.976 -5.740 -4.857
108 HB ILE 15 HB ILE 15 0.082 -3.814 -2.763
109 HG12 ILE 15 HG12 ILE 15 0.338 -6.837 -2.923
110 HG13 ILE 15 HG13 ILE 15 1.639 -5.690 -3.223
111 HG21 ILE 15 HG21 ILE 15 -2.041 -5.961 -2.575
112 HG22 ILE 15 HG22 ILE 15 -2.312 -4.219 -2.527
113 HG23 ILE 15 HG23 ILE 15 -1.427 -5.009 -1.222
114 HD11 ILE 15 HD11 ILE 15 0.197 -6.083 -0.611
115 HD12 ILE 15 HD12 ILE 15 1.491 -4.922 -0.910
116 HD13 ILE 15 HD13 ILE 15 1.818 -6.652 -1.010
117 H GLN 16 H GLN 16 -2.896 -5.018 -5.579
118 HA GLN 16 HA GLN 16 -3.244 -2.161 -6.100
119 HB2 GLN 16 HB2 GLN 16 -4.952 -4.528 -6.900
120 HB3 GLN 16 HB3 GLN 16 -5.220 -2.863 -7.403
121 HG2 GLN 16 HG2 GLN 16 -3.038 -2.865 -8.538
122 HG3 GLN 16 HG3 GLN 16 -2.808 -4.548 -8.064
123 HE21 GLN 16 HE21 GLN 16 -4.583 -2.373 -10.106
124 HE22 GLN 16 HE22 GLN 16 -5.246 -3.572 -11.152
125 H ALA 17 H ALA 17 -4.546 -0.848 -4.987
126 HA ALA 17 HA ALA 17 -6.421 -2.011 -3.021
127 HB1 ALA 17 HB1 ALA 17 -4.774 0.506 -2.717
128 HB2 ALA 17 HB2 ALA 17 -4.471 -1.033 -1.909
129 HB3 ALA 17 HB3 ALA 17 -5.934 -0.119 -1.543
130 H VAL 18 H VAL 18 -8.379 -0.873 -2.646
131 HA VAL 18 HA VAL 18 -9.372 0.579 -4.944
132 HB VAL 18 HB VAL 18 -11.557 0.533 -3.785
133 HG11 VAL 18 HG11 VAL 18 -10.924 -1.331 -5.224
134 HG12 VAL 18 HG12 VAL 18 -11.886 -1.901 -3.858
135 HG13 VAL 18 HG13 VAL 18 -10.136 -2.135 -3.864
136 HG21 VAL 18 HG21 VAL 18 -10.063 -0.914 -1.592
137 HG22 VAL 18 HG22 VAL 18 -11.813 -0.705 -1.687
138 HG23 VAL 18 HG23 VAL 18 -10.767 0.700 -1.475
139 H ASP 19 H ASP 19 -7.993 1.452 -1.947
140 HA ASP 19 HA ASP 19 -8.607 4.251 -2.538
141 HB2 ASP 19 HB2 ASP 19 -8.672 4.618 0.043
142 HB3 ASP 19 HB3 ASP 19 -10.111 4.054 -0.793
143 H THR 20 H THR 20 -7.168 5.681 -0.914
144 HA THR 20 HA THR 20 -4.551 5.137 -1.993
145 HB THR 20 HB THR 20 -3.944 7.379 -1.195
146 HG1 THR 20 HG1 THR 20 -4.972 8.019 0.551
147 HG21 THR 20 HG21 THR 20 -5.095 7.206 -3.337
148 HG22 THR 20 HG22 THR 20 -5.591 8.677 -2.500
149 HG23 THR 20 HG23 THR 20 -6.659 7.274 -2.526
150 HA PRO 21 HA PRO 21 -2.642 3.407 1.636
151 HB2 PRO 21 HB2 PRO 21 -0.039 4.121 1.122
152 HB3 PRO 21 HB3 PRO 21 -0.863 2.770 0.337
153 HG2 PRO 21 HG2 PRO 21 -0.416 5.557 -0.671
154 HG3 PRO 21 HG3 PRO 21 -0.249 4.014 -1.533
155 HD2 PRO 21 HD2 PRO 21 -2.423 5.572 -1.837
156 HD3 PRO 21 HD3 PRO 21 -2.539 3.799 -1.855
157 H LYS 22 H LYS 22 -3.265 4.512 3.425
158 HA LYS 22 HA LYS 22 -2.444 7.254 3.906
159 HB2 LYS 22 HB2 LYS 22 -4.737 6.388 4.415
160 HB3 LYS 22 HB3 LYS 22 -4.035 5.365 5.660
161 HG2 LYS 22 HG2 LYS 22 -3.269 7.365 6.860
162 HG3 LYS 22 HG3 LYS 22 -3.997 8.380 5.613
163 HD2 LYS 22 HD2 LYS 22 -5.468 6.453 7.423
164 HD3 LYS 22 HD3 LYS 22 -5.456 8.210 7.570
165 HE2 LYS 22 HE2 LYS 22 -6.554 6.644 5.227
166 HE3 LYS 22 HE3 LYS 22 -7.512 7.402 6.499
167 HZ1 LYS 22 HZ1 LYS 22 -7.367 8.729 4.442
168 HZ2 LYS 22 HZ2 LYS 22 -5.699 8.879 4.669
169 HZ3 LYS 22 HZ3 LYS 22 -6.765 9.546 5.794
170 H TYR 23 H TYR 23 -0.471 7.659 4.757
171 HA TYR 23 HA TYR 23 1.027 5.567 6.084
172 HB2 TYR 23 HB2 TYR 23 2.260 6.907 4.541
173 HB3 TYR 23 HB3 TYR 23 1.699 8.401 5.280
174 HD1 TYR 23 HD1 TYR 23 3.657 5.327 6.186
175 HD2 TYR 23 HD2 TYR 23 3.143 9.521 6.711
176 HE1 TYR 23 HE1 TYR 23 5.677 5.397 7.592
177 HE2 TYR 23 HE2 TYR 23 5.157 9.599 8.113
178 HH TYR 23 HH TYR 23 6.542 8.212 9.422
179 H ASP 24 H ASP 24 1.354 5.305 8.193
180 HA ASP 24 HA ASP 24 0.748 7.530 10.040
181 HB2 ASP 24 HB2 ASP 24 -0.954 5.849 10.326
182 HB3 ASP 24 HB3 ASP 24 0.253 4.567 10.404
183 H GLU 25 H GLU 25 2.503 8.232 11.094
184 HA GLU 25 HA GLU 25 4.967 6.733 10.948
185 HB2 GLU 25 HB2 GLU 25 4.821 9.218 10.618
186 HB3 GLU 25 HB3 GLU 25 4.482 9.376 12.336
187 HG2 GLU 25 HG2 GLU 25 6.646 8.499 12.907
188 HG3 GLU 25 HG3 GLU 25 6.979 8.101 11.223
189 H GLU 26 H GLU 26 2.443 7.010 13.250
190 HA GLU 26 HA GLU 26 3.937 6.505 15.619
191 HB2 GLU 26 HB2 GLU 26 1.034 5.926 14.978
192 HB3 GLU 26 HB3 GLU 26 1.750 5.782 16.578
193 HG2 GLU 26 HG2 GLU 26 1.554 8.323 14.964
194 HG3 GLU 26 HG3 GLU 26 0.515 7.874 16.314
195 H SER 27 H SER 27 2.197 4.341 13.383
196 HA SER 27 HA SER 27 3.374 1.991 14.678
197 HB2 SER 27 HB2 SER 27 1.944 0.690 13.173
198 HB3 SER 27 HB3 SER 27 0.996 1.933 13.990
199 HG SER 27 HG SER 27 0.742 2.990 12.142
200 H GLY 28 H GLY 28 3.781 3.947 11.820
201 HA2 GLY 28 HA2 GLY 28 5.690 4.021 10.461
202 HA3 GLY 28 HA3 GLY 28 6.211 2.484 11.133
203 H PHE 29 H PHE 29 2.960 2.439 10.130
204 HA PHE 29 HA PHE 29 3.734 0.944 7.697
205 HB2 PHE 29 HB2 PHE 29 1.298 0.562 9.453
206 HB3 PHE 29 HB3 PHE 29 1.691 -0.383 8.024
207 HD1 PHE 29 HD1 PHE 29 3.968 -1.645 8.083
208 HD2 PHE 29 HD2 PHE 29 1.966 -0.184 11.541
209 HE1 PHE 29 HE1 PHE 29 5.217 -3.243 9.472
210 HE2 PHE 29 HE2 PHE 29 3.217 -1.773 12.938
211 HZ PHE 29 HZ PHE 29 4.845 -3.307 11.904
212 H TYR 30 H TYR 30 2.154 0.872 5.946
213 HA TYR 30 HA TYR 30 0.564 3.336 5.655
214 HB2 TYR 30 HB2 TYR 30 1.597 1.315 3.652
215 HB3 TYR 30 HB3 TYR 30 0.399 2.531 3.224
216 HD1 TYR 30 HD1 TYR 30 3.906 2.043 4.346
217 HD2 TYR 30 HD2 TYR 30 1.033 4.783 2.790
218 HE1 TYR 30 HE1 TYR 30 5.699 3.659 3.873
219 HE2 TYR 30 HE2 TYR 30 2.821 6.398 2.315
220 HH TYR 30 HH TYR 30 5.077 6.914 3.059
221 H GLU 31 H GLU 31 -1.641 3.259 5.649
222 HA GLU 31 HA GLU 31 -2.954 0.644 5.876
223 HB2 GLU 31 HB2 GLU 31 -3.990 3.440 6.438
224 HB3 GLU 31 HB3 GLU 31 -4.933 1.968 6.632
225 HG2 GLU 31 HG2 GLU 31 -3.311 1.189 8.326
226 HG3 GLU 31 HG3 GLU 31 -2.445 2.716 8.164
227 H PHE 32 H PHE 32 -3.872 -0.220 4.116
228 HA PHE 32 HA PHE 32 -5.323 1.487 2.233
229 HB2 PHE 32 HB2 PHE 32 -4.209 0.448 0.274
230 HB3 PHE 32 HB3 PHE 32 -3.092 1.388 1.254
231 HD1 PHE 32 HD1 PHE 32 -1.529 0.179 2.824
232 HD2 PHE 32 HD2 PHE 32 -3.834 -1.854 -0.131
233 HE1 PHE 32 HE1 PHE 32 -0.041 -1.764 3.006
234 HE2 PHE 32 HE2 PHE 32 -2.340 -3.805 0.051
235 HZ PHE 32 HZ PHE 32 -0.443 -3.759 1.622
236 H LYS 33 H LYS 33 -7.010 0.468 1.183
237 HA LYS 33 HA LYS 33 -7.692 -2.214 2.171
238 HB2 LYS 33 HB2 LYS 33 -9.305 -0.340 2.447
239 HB3 LYS 33 HB3 LYS 33 -9.405 -0.201 0.697
240 HG2 LYS 33 HG2 LYS 33 -10.271 -2.527 0.613
241 HG3 LYS 33 HG3 LYS 33 -10.272 -2.551 2.376
242 HD2 LYS 33 HD2 LYS 33 -11.839 -0.626 0.645
243 HD3 LYS 33 HD3 LYS 33 -12.500 -2.051 1.442
244 HE2 LYS 33 HE2 LYS 33 -13.070 -0.195 2.801
245 HE3 LYS 33 HE3 LYS 33 -11.763 -1.033 3.631
246 HZ1 LYS 33 HZ1 LYS 33 -10.236 0.631 3.000
247 HZ2 LYS 33 HZ2 LYS 33 -11.605 1.457 3.543
248 HZ3 LYS 33 HZ3 LYS 33 -11.299 1.319 1.883
249 H GLN 34 H GLN 34 -7.001 -3.844 0.901
250 HA GLN 34 HA GLN 34 -6.324 -3.662 -1.815
251 HB2 GLN 34 HB2 GLN 34 -7.121 -6.091 -0.193
252 HB3 GLN 34 HB3 GLN 34 -6.393 -6.158 -1.793
253 HG2 GLN 34 HG2 GLN 34 -4.391 -5.035 -0.915
254 HG3 GLN 34 HG3 GLN 34 -5.120 -5.012 0.691
255 HE21 GLN 34 HE21 GLN 34 -5.305 -6.957 1.841
256 HE22 GLN 34 HE22 GLN 34 -4.421 -8.371 1.391
257 H LEU 35 H LEU 35 -7.344 -4.897 -3.624
258 HA LEU 35 HA LEU 35 -9.890 -3.986 -4.260
259 HB2 LEU 35 HB2 LEU 35 -8.519 -6.463 -5.319
260 HB3 LEU 35 HB3 LEU 35 -9.882 -5.663 -6.075
261 HG LEU 35 HG LEU 35 -7.116 -4.493 -5.728
262 HD11 LEU 35 HD11 LEU 35 -6.976 -4.668 -8.161
263 HD12 LEU 35 HD12 LEU 35 -8.562 -5.439 -8.204
264 HD13 LEU 35 HD13 LEU 35 -7.207 -6.252 -7.419
265 HD21 LEU 35 HD21 LEU 35 -7.944 -2.641 -7.116
266 HD22 LEU 35 HD22 LEU 35 -8.810 -2.749 -5.584
267 HD23 LEU 35 HD23 LEU 35 -9.565 -3.334 -7.067
268 H ASP 36 H ASP 36 -8.968 -6.980 -2.657
269 HA ASP 36 HA ASP 36 -11.512 -8.257 -2.860
270 HB2 ASP 36 HB2 ASP 36 -9.381 -9.465 -2.510
271 HB3 ASP 36 HB3 ASP 36 -9.253 -8.761 -0.903
272 H GLY 37 H GLY 37 -10.501 -5.660 -0.957
273 HA2 GLY 37 HA2 GLY 37 -12.004 -4.490 0.493
274 HA3 GLY 37 HA3 GLY 37 -12.754 -6.022 0.915
275 H LYS 38 H LYS 38 -9.641 -6.811 0.977
276 HA LYS 38 HA LYS 38 -9.449 -6.700 3.833
277 HB2 LYS 38 HB2 LYS 38 -7.543 -7.663 1.698
278 HB3 LYS 38 HB3 LYS 38 -7.161 -7.724 3.414
279 HG2 LYS 38 HG2 LYS 38 -9.089 -9.168 3.805
280 HG3 LYS 38 HG3 LYS 38 -9.494 -9.099 2.088
281 HD2 LYS 38 HD2 LYS 38 -7.457 -10.231 1.495
282 HD3 LYS 38 HD3 LYS 38 -6.861 -10.135 3.155
283 HE2 LYS 38 HE2 LYS 38 -7.720 -12.374 2.590
284 HE3 LYS 38 HE3 LYS 38 -8.612 -11.622 3.912
285 HZ1 LYS 38 HZ1 LYS 38 -10.373 -11.057 2.389
286 HZ2 LYS 38 HZ2 LYS 38 -10.061 -12.717 2.291
287 HZ3 LYS 38 HZ3 LYS 38 -9.504 -11.678 1.076
288 H GLN 39 H GLN 39 -9.216 -4.650 4.621
289 HA GLN 39 HA GLN 39 -7.154 -2.890 3.596
290 HB2 GLN 39 HB2 GLN 39 -9.286 -1.980 4.452
291 HB3 GLN 39 HB3 GLN 39 -8.904 -2.604 6.053
292 HG2 GLN 39 HG2 GLN 39 -6.991 -1.125 6.216
293 HG3 GLN 39 HG3 GLN 39 -7.254 -0.559 4.568
294 HE21 GLN 39 HE21 GLN 39 -7.186 0.934 7.079
295 HE22 GLN 39 HE22 GLN 39 -8.695 1.763 7.173
296 H THR 40 H THR 40 -5.111 -3.472 4.001
297 HA THR 40 HA THR 40 -4.399 -4.327 6.743
298 HB THR 40 HB THR 40 -4.298 -6.271 5.242
299 HG1 THR 40 HG1 THR 40 -2.741 -6.060 6.952
300 HG21 THR 40 HG21 THR 40 -3.840 -5.094 3.128
301 HG22 THR 40 HG22 THR 40 -2.665 -6.378 3.421
302 HG23 THR 40 HG23 THR 40 -2.221 -4.695 3.704
303 H ARG 41 H ARG 41 -2.009 -4.080 7.185
304 HA ARG 41 HA ARG 41 -1.060 -1.532 6.026
305 HB2 ARG 41 HB2 ARG 41 -0.549 -2.589 8.813
306 HB3 ARG 41 HB3 ARG 41 -0.020 -1.040 8.172
307 HG2 ARG 41 HG2 ARG 41 -2.425 -0.418 7.887
308 HG3 ARG 41 HG3 ARG 41 -2.849 -1.912 8.727
309 HD2 ARG 41 HD2 ARG 41 -1.262 0.414 9.819
310 HD3 ARG 41 HD3 ARG 41 -2.878 -0.096 10.306
311 HE ARG 41 HE ARG 41 -1.056 -2.213 10.696
312 HH11 ARG 41 HH11 ARG 41 -1.900 0.855 12.014
313 HH12 ARG 41 HH12 ARG 41 -1.366 0.440 13.604
314 HH21 ARG 41 HH21 ARG 41 -0.316 -2.715 12.721
315 HH22 ARG 41 HH22 ARG 41 -0.448 -1.550 13.992
316 H ILE 42 H ILE 42 0.920 -1.490 5.126
317 HA ILE 42 HA ILE 42 2.761 -3.744 5.665
318 HB ILE 42 HB ILE 42 1.856 -3.682 3.329
319 HG12 ILE 42 HG12 ILE 42 4.847 -3.192 3.512
320 HG13 ILE 42 HG13 ILE 42 4.058 -4.713 3.913
321 HG21 ILE 42 HG21 ILE 42 1.697 -1.255 3.053
322 HG22 ILE 42 HG22 ILE 42 2.671 -1.975 1.771
323 HG23 ILE 42 HG23 ILE 42 3.454 -1.125 3.103
324 HD11 ILE 42 HD11 ILE 42 3.273 -4.902 1.605
325 HD12 ILE 42 HD12 ILE 42 5.031 -4.806 1.707
326 HD13 ILE 42 HD13 ILE 42 4.098 -3.393 1.209
327 H ASN 43 H ASN 43 5.040 -3.243 5.732
328 HA ASN 43 HA ASN 43 5.518 -0.852 7.207
329 HB2 ASN 43 HB2 ASN 43 6.622 -3.056 7.645
330 HB3 ASN 43 HB3 ASN 43 7.571 -2.820 6.179
331 HD21 ASN 43 HD21 ASN 43 9.485 -2.839 7.379
332 HD22 ASN 43 HD22 ASN 43 9.968 -1.495 8.348
333 H LYS 44 H LYS 44 6.875 0.886 6.751
334 HA LYS 44 HA LYS 44 6.484 2.011 4.218
335 HB2 LYS 44 HB2 LYS 44 7.911 3.861 4.992
336 HB3 LYS 44 HB3 LYS 44 6.721 3.385 6.197
337 HG2 LYS 44 HG2 LYS 44 8.369 2.297 7.527
338 HG3 LYS 44 HG3 LYS 44 9.579 2.430 6.248
339 HD2 LYS 44 HD2 LYS 44 9.585 4.859 6.480
340 HD3 LYS 44 HD3 LYS 44 8.325 4.763 7.711
341 HE2 LYS 44 HE2 LYS 44 11.062 3.511 7.960
342 HE3 LYS 44 HE3 LYS 44 10.623 5.082 8.625
343 HZ1 LYS 44 HZ1 LYS 44 9.342 2.501 9.350
344 HZ2 LYS 44 HZ2 LYS 44 8.972 4.015 10.006
345 HZ3 LYS 44 HZ3 LYS 44 10.490 3.320 10.279
346 H ASP 45 H ASP 45 8.990 -0.142 5.142
347 HA ASP 45 HA ASP 45 10.972 0.971 3.342
348 HB2 ASP 45 HB2 ASP 45 12.392 -0.898 4.054
349 HB3 ASP 45 HB3 ASP 45 11.713 -0.049 5.436
350 H GLN 46 H GLN 46 8.503 -1.460 3.194
351 HA GLN 46 HA GLN 46 9.666 -2.975 1.043
352 HB2 GLN 46 HB2 GLN 46 6.797 -2.956 2.009
353 HB3 GLN 46 HB3 GLN 46 7.545 -4.185 1.000
354 HG2 GLN 46 HG2 GLN 46 8.348 -3.553 3.835
355 HG3 GLN 46 HG3 GLN 46 7.285 -4.869 3.358
356 HE21 GLN 46 HE21 GLN 46 8.671 -6.425 4.230
357 HE22 GLN 46 HE22 GLN 46 10.175 -6.833 3.484
358 H VAL 47 H VAL 47 7.550 -0.199 1.217
359 HA VAL 47 HA VAL 47 6.449 -0.496 -1.413
360 HB VAL 47 HB VAL 47 5.174 0.704 0.241
361 HG11 VAL 47 HG11 VAL 47 7.391 2.759 0.281
362 HG12 VAL 47 HG12 VAL 47 7.009 1.627 1.578
363 HG13 VAL 47 HG13 VAL 47 5.850 2.879 1.130
364 HG21 VAL 47 HG21 VAL 47 6.104 2.581 -1.939
365 HG22 VAL 47 HG22 VAL 47 4.604 2.725 -1.023
366 HG23 VAL 47 HG23 VAL 47 4.852 1.348 -2.096
367 H ARG 48 H ARG 48 7.582 -0.276 -3.213
368 HA ARG 48 HA ARG 48 9.963 1.373 -3.373
369 HB2 ARG 48 HB2 ARG 48 9.603 -0.913 -4.496
370 HB3 ARG 48 HB3 ARG 48 8.604 -0.059 -5.663
371 HG2 ARG 48 HG2 ARG 48 10.580 1.385 -6.184
372 HG3 ARG 48 HG3 ARG 48 11.543 0.344 -5.131
373 HD2 ARG 48 HD2 ARG 48 10.705 -1.598 -6.575
374 HD3 ARG 48 HD3 ARG 48 10.176 -0.365 -7.719
375 HE ARG 48 HE ARG 48 12.984 -0.607 -6.853
376 HH11 ARG 48 HH11 ARG 48 10.644 -0.215 -9.356
377 HH12 ARG 48 HH12 ARG 48 11.833 -0.217 -10.605
378 HH21 ARG 48 HH21 ARG 48 14.478 -0.621 -8.468
379 HH22 ARG 48 HH22 ARG 48 13.973 -0.469 -10.117
380 H THR 49 H THR 49 6.976 1.182 -5.331
381 HA THR 49 HA THR 49 7.024 4.114 -5.682
382 HB THR 49 HB THR 49 6.362 3.844 -8.060
383 HG1 THR 49 HG1 THR 49 5.766 1.915 -8.680
384 HG21 THR 49 HG21 THR 49 8.715 4.238 -7.548
385 HG22 THR 49 HG22 THR 49 8.561 3.156 -8.932
386 HG23 THR 49 HG23 THR 49 8.977 2.505 -7.347
387 H VAL 50 H VAL 50 5.000 5.098 -6.110
388 HA VAL 50 HA VAL 50 2.620 3.408 -5.625
389 HB VAL 50 HB VAL 50 3.127 6.156 -4.443
390 HG11 VAL 50 HG11 VAL 50 0.774 4.291 -4.091
391 HG12 VAL 50 HG12 VAL 50 0.771 5.822 -4.967
392 HG13 VAL 50 HG13 VAL 50 1.027 5.807 -3.223
393 HG21 VAL 50 HG21 VAL 50 3.000 3.453 -3.089
394 HG22 VAL 50 HG22 VAL 50 3.163 5.009 -2.273
395 HG23 VAL 50 HG23 VAL 50 4.451 4.428 -3.328
396 H LYS 51 H LYS 51 1.251 3.545 -7.322
397 HA LYS 51 HA LYS 51 1.019 6.120 -8.772
398 HB2 LYS 51 HB2 LYS 51 1.014 3.341 -9.976
399 HB3 LYS 51 HB3 LYS 51 0.684 4.822 -10.863
400 HG2 LYS 51 HG2 LYS 51 2.951 5.603 -10.438
401 HG3 LYS 51 HG3 LYS 51 3.287 4.148 -9.493
402 HD2 LYS 51 HD2 LYS 51 2.977 2.755 -11.456
403 HD3 LYS 51 HD3 LYS 51 2.500 4.159 -12.415
404 HE2 LYS 51 HE2 LYS 51 5.208 3.723 -11.147
405 HE3 LYS 51 HE3 LYS 51 4.823 3.502 -12.854
406 HZ1 LYS 51 HZ1 LYS 51 4.272 5.850 -12.999
407 HZ2 LYS 51 HZ2 LYS 51 5.858 5.638 -12.454
408 HZ3 LYS 51 HZ3 LYS 51 4.643 6.063 -11.362
409 H ASP 52 H ASP 52 -1.024 6.866 -9.067
410 HA ASP 52 HA ASP 52 -3.282 5.281 -8.167
411 HB2 ASP 52 HB2 ASP 52 -3.079 8.099 -9.251
412 HB3 ASP 52 HB3 ASP 52 -4.598 7.353 -8.762
413 H LEU 53 H LEU 53 -4.628 4.142 -9.411
414 HA LEU 53 HA LEU 53 -3.970 3.549 -12.092
415 HB2 LEU 53 HB2 LEU 53 -6.515 2.945 -10.574
416 HB3 LEU 53 HB3 LEU 53 -6.030 2.193 -12.083
417 HG LEU 53 HG LEU 53 -4.578 1.935 -9.437
418 HD11 LEU 53 HD11 LEU 53 -6.228 -0.071 -10.979
419 HD12 LEU 53 HD12 LEU 53 -6.683 0.708 -9.465
420 HD13 LEU 53 HD13 LEU 53 -5.312 -0.398 -9.506
421 HD21 LEU 53 HD21 LEU 53 -3.009 1.870 -11.286
422 HD22 LEU 53 HD22 LEU 53 -4.004 0.677 -12.123
423 HD23 LEU 53 HD23 LEU 53 -3.209 0.255 -10.606
424 H LEU 54 H LEU 54 -6.014 5.999 -10.772
425 HA LEU 54 HA LEU 54 -7.804 6.335 -12.942
426 HB2 LEU 54 HB2 LEU 54 -6.909 8.307 -10.838
427 HB3 LEU 54 HB3 LEU 54 -8.246 8.571 -11.943
428 HG LEU 54 HG LEU 54 -8.103 6.394 -9.845
429 HD11 LEU 54 HD11 LEU 54 -9.772 8.908 -9.932
430 HD12 LEU 54 HD12 LEU 54 -8.381 8.630 -8.884
431 HD13 LEU 54 HD13 LEU 54 -9.836 7.653 -8.693
432 HD21 LEU 54 HD21 LEU 54 -9.379 5.672 -11.791
433 HD22 LEU 54 HD22 LEU 54 -10.340 7.153 -11.733
434 HD23 LEU 54 HD23 LEU 54 -10.452 5.975 -10.425
435 H GLU 55 H GLU 55 -4.509 7.260 -12.565
436 HA GLU 55 HA GLU 55 -4.712 9.290 -14.689
437 HB2 GLU 55 HB2 GLU 55 -2.346 8.641 -12.917
438 HB3 GLU 55 HB3 GLU 55 -2.490 10.010 -14.013
439 HG2 GLU 55 HG2 GLU 55 -4.309 10.915 -12.665
440 HG3 GLU 55 HG3 GLU 55 -4.205 9.529 -11.579
Start of MODEL 10
1 H1 MET 1 H1 MET 1 -11.946 12.365 -1.066
2 H2 MET 1 H2 MET 1 -10.540 11.701 -1.732
3 H3 MET 1 H3 MET 1 -11.221 11.019 -0.341
4 HA MET 1 HA MET 1 -13.190 10.387 -1.571
5 HB2 MET 1 HB2 MET 1 -11.650 11.476 -3.942
6 HB3 MET 1 HB3 MET 1 -13.141 10.549 -4.052
7 HG2 MET 1 HG2 MET 1 -12.830 13.227 -2.706
8 HG3 MET 1 HG3 MET 1 -13.541 12.943 -4.295
9 HE1 MET 1 HE1 MET 1 -15.200 10.282 -3.864
10 HE2 MET 1 HE2 MET 1 -15.829 11.702 -4.701
11 HE3 MET 1 HE3 MET 1 -16.773 10.940 -3.420
12 H ALA 2 H ALA 2 -13.187 8.474 -3.206
13 HA ALA 2 HA ALA 2 -10.854 6.812 -2.502
14 HB1 ALA 2 HB1 ALA 2 -13.660 5.958 -3.214
15 HB2 ALA 2 HB2 ALA 2 -12.985 6.054 -1.588
16 HB3 ALA 2 HB3 ALA 2 -12.338 4.889 -2.743
17 H SER 3 H SER 3 -9.495 6.251 -4.061
18 HA SER 3 HA SER 3 -10.494 5.611 -6.737
19 HB2 SER 3 HB2 SER 3 -8.164 7.498 -6.252
20 HB3 SER 3 HB3 SER 3 -8.647 6.862 -7.823
21 HG SER 3 HG SER 3 -10.644 7.951 -7.572
22 HA PRO 4 HA PRO 4 -7.915 2.087 -5.956
23 HB2 PRO 4 HB2 PRO 4 -7.562 1.271 -8.575
24 HB3 PRO 4 HB3 PRO 4 -8.985 0.908 -7.593
25 HG2 PRO 4 HG2 PRO 4 -8.582 3.069 -9.628
26 HG3 PRO 4 HG3 PRO 4 -9.997 2.032 -9.362
27 HD2 PRO 4 HD2 PRO 4 -9.940 4.565 -8.486
28 HD3 PRO 4 HD3 PRO 4 -10.724 3.283 -7.537
29 H THR 5 H THR 5 -5.794 1.925 -5.575
30 HA THR 5 HA THR 5 -3.869 3.321 -7.335
31 HB THR 5 HB THR 5 -3.777 3.355 -4.301
32 HG1 THR 5 HG1 THR 5 -4.076 5.678 -5.871
33 HG21 THR 5 HG21 THR 5 -1.549 3.382 -5.307
34 HG22 THR 5 HG22 THR 5 -1.931 4.955 -4.607
35 HG23 THR 5 HG23 THR 5 -2.023 4.723 -6.352
36 H VAL 6 H VAL 6 -2.002 2.194 -7.773
37 HA VAL 6 HA VAL 6 -1.770 -0.479 -6.578
38 HB VAL 6 HB VAL 6 -1.861 -0.439 -9.012
39 HG11 VAL 6 HG11 VAL 6 -0.912 1.767 -9.434
40 HG12 VAL 6 HG12 VAL 6 -0.061 0.533 -10.362
41 HG13 VAL 6 HG13 VAL 6 0.674 1.203 -8.904
42 HG21 VAL 6 HG21 VAL 6 0.135 -1.785 -9.486
43 HG22 VAL 6 HG22 VAL 6 -0.577 -2.216 -7.932
44 HG23 VAL 6 HG23 VAL 6 0.877 -1.219 -7.990
45 H ILE 7 H ILE 7 -0.311 -0.875 -5.074
46 HA ILE 7 HA ILE 7 1.954 0.955 -4.684
47 HB ILE 7 HB ILE 7 0.932 -1.259 -2.884
48 HG12 ILE 7 HG12 ILE 7 0.604 1.751 -2.652
49 HG13 ILE 7 HG13 ILE 7 -0.665 0.619 -3.109
50 HG21 ILE 7 HG21 ILE 7 2.393 -0.251 -1.171
51 HG22 ILE 7 HG22 ILE 7 3.013 0.878 -2.376
52 HG23 ILE 7 HG23 ILE 7 3.310 -0.851 -2.553
53 HD11 ILE 7 HD11 ILE 7 -0.907 1.266 -0.801
54 HD12 ILE 7 HD12 ILE 7 0.741 0.745 -0.450
55 HD13 ILE 7 HD13 ILE 7 -0.483 -0.443 -0.902
56 H THR 8 H THR 8 3.735 0.398 -5.798
57 HA THR 8 HA THR 8 4.346 -2.414 -6.332
58 HB THR 8 HB THR 8 5.847 0.075 -7.198
59 HG1 THR 8 HG1 THR 8 3.538 -0.957 -8.057
60 HG21 THR 8 HG21 THR 8 7.274 -1.919 -7.183
61 HG22 THR 8 HG22 THR 8 6.923 -1.411 -8.835
62 HG23 THR 8 HG23 THR 8 6.075 -2.793 -8.139
63 H LEU 9 H LEU 9 5.716 -3.576 -5.128
64 HA LEU 9 HA LEU 9 7.054 -2.275 -2.884
65 HB2 LEU 9 HB2 LEU 9 6.807 -5.219 -3.525
66 HB3 LEU 9 HB3 LEU 9 7.348 -4.523 -2.007
67 HG LEU 9 HG LEU 9 4.560 -4.349 -3.168
68 HD11 LEU 9 HD11 LEU 9 5.085 -6.531 -2.229
69 HD12 LEU 9 HD12 LEU 9 3.929 -5.676 -1.209
70 HD13 LEU 9 HD13 LEU 9 5.624 -5.775 -0.728
71 HD21 LEU 9 HD21 LEU 9 5.662 -3.172 -0.612
72 HD22 LEU 9 HD22 LEU 9 3.959 -3.212 -1.072
73 HD23 LEU 9 HD23 LEU 9 5.106 -2.274 -2.026
74 H ASN 10 H ASN 10 9.265 -2.745 -2.303
75 HA ASN 10 HA ASN 10 11.181 -2.473 -4.313
76 HB2 ASN 10 HB2 ASN 10 11.604 -1.924 -1.949
77 HB3 ASN 10 HB3 ASN 10 11.530 -3.630 -1.527
78 HD21 ASN 10 HD21 ASN 10 13.248 -4.974 -2.085
79 HD22 ASN 10 HD22 ASN 10 14.783 -4.348 -2.568
80 H ASP 11 H ASP 11 9.795 -5.346 -2.880
81 HA ASP 11 HA ASP 11 11.465 -7.338 -3.879
82 HB2 ASP 11 HB2 ASP 11 9.672 -7.746 -2.252
83 HB3 ASP 11 HB3 ASP 11 8.459 -7.370 -3.472
84 H GLY 12 H GLY 12 8.916 -5.508 -5.481
85 HA2 GLY 12 HA2 GLY 12 9.053 -5.335 -7.946
86 HA3 GLY 12 HA3 GLY 12 9.348 -7.067 -7.968
87 H ARG 13 H ARG 13 7.316 -7.370 -5.750
88 HA ARG 13 HA ARG 13 5.047 -7.968 -7.319
89 HB2 ARG 13 HB2 ARG 13 5.551 -9.152 -5.238
90 HB3 ARG 13 HB3 ARG 13 5.320 -7.672 -4.316
91 HG2 ARG 13 HG2 ARG 13 2.950 -7.633 -5.025
92 HG3 ARG 13 HG3 ARG 13 3.200 -9.166 -5.860
93 HD2 ARG 13 HD2 ARG 13 3.784 -10.230 -3.726
94 HD3 ARG 13 HD3 ARG 13 3.542 -8.693 -2.894
95 HE ARG 13 HE ARG 13 1.275 -9.692 -4.405
96 HH11 ARG 13 HH11 ARG 13 2.819 -9.494 -1.333
97 HH12 ARG 13 HH12 ARG 13 1.362 -9.822 -0.460
98 HH21 ARG 13 HH21 ARG 13 -0.586 -10.103 -3.274
99 HH22 ARG 13 HH22 ARG 13 -0.550 -10.128 -1.546
100 H GLU 14 H GLU 14 3.115 -6.912 -7.651
101 HA GLU 14 HA GLU 14 2.893 -4.143 -6.636
102 HB2 GLU 14 HB2 GLU 14 1.667 -5.405 -9.100
103 HB3 GLU 14 HB3 GLU 14 1.400 -3.748 -8.577
104 HG2 GLU 14 HG2 GLU 14 3.750 -3.234 -8.919
105 HG3 GLU 14 HG3 GLU 14 4.068 -4.908 -9.371
106 H ILE 15 H ILE 15 1.220 -3.641 -5.312
107 HA ILE 15 HA ILE 15 -0.967 -5.611 -5.012
108 HB ILE 15 HB ILE 15 -0.053 -3.500 -3.033
109 HG12 ILE 15 HG12 ILE 15 0.323 -6.513 -2.990
110 HG13 ILE 15 HG13 ILE 15 1.589 -5.336 -3.321
111 HG21 ILE 15 HG21 ILE 15 -2.093 -5.717 -2.750
112 HG22 ILE 15 HG22 ILE 15 -2.433 -3.988 -2.829
113 HG23 ILE 15 HG23 ILE 15 -1.553 -4.652 -1.453
114 HD11 ILE 15 HD11 ILE 15 0.086 -5.637 -0.728
115 HD12 ILE 15 HD12 ILE 15 1.340 -4.441 -1.057
116 HD13 ILE 15 HD13 ILE 15 1.738 -6.158 -1.051
117 H GLN 16 H GLN 16 -3.016 -5.014 -5.512
118 HA GLN 16 HA GLN 16 -3.427 -2.250 -6.438
119 HB2 GLN 16 HB2 GLN 16 -5.084 -4.729 -6.977
120 HB3 GLN 16 HB3 GLN 16 -5.343 -3.139 -7.689
121 HG2 GLN 16 HG2 GLN 16 -3.162 -3.275 -8.796
122 HG3 GLN 16 HG3 GLN 16 -2.893 -4.861 -8.078
123 HE21 GLN 16 HE21 GLN 16 -5.971 -3.753 -9.354
124 HE22 GLN 16 HE22 GLN 16 -6.015 -4.841 -10.691
125 H ALA 17 H ALA 17 -4.347 -0.907 -5.016
126 HA ALA 17 HA ALA 17 -6.284 -1.950 -3.053
127 HB1 ALA 17 HB1 ALA 17 -4.719 0.633 -3.038
128 HB2 ALA 17 HB2 ALA 17 -4.346 -0.820 -2.109
129 HB3 ALA 17 HB3 ALA 17 -5.821 0.087 -1.773
130 H VAL 18 H VAL 18 -8.158 -0.549 -2.513
131 HA VAL 18 HA VAL 18 -9.389 0.479 -4.957
132 HB VAL 18 HB VAL 18 -11.504 0.456 -3.711
133 HG11 VAL 18 HG11 VAL 18 -9.937 -2.111 -3.409
134 HG12 VAL 18 HG12 VAL 18 -10.774 -1.577 -4.866
135 HG13 VAL 18 HG13 VAL 18 -11.695 -1.966 -3.412
136 HG21 VAL 18 HG21 VAL 18 -9.821 -0.498 -1.384
137 HG22 VAL 18 HG22 VAL 18 -11.586 -0.488 -1.430
138 HG23 VAL 18 HG23 VAL 18 -10.693 1.032 -1.492
139 H ASP 19 H ASP 19 -7.978 1.737 -2.080
140 HA ASP 19 HA ASP 19 -8.808 4.430 -2.897
141 HB2 ASP 19 HB2 ASP 19 -8.953 5.093 -0.470
142 HB3 ASP 19 HB3 ASP 19 -10.230 4.021 -1.028
143 H THR 20 H THR 20 -7.419 6.096 -1.476
144 HA THR 20 HA THR 20 -4.748 5.654 -2.453
145 HB THR 20 HB THR 20 -4.292 7.950 -1.622
146 HG1 THR 20 HG1 THR 20 -5.809 7.785 0.198
147 HG21 THR 20 HG21 THR 20 -5.257 7.657 -3.856
148 HG22 THR 20 HG22 THR 20 -5.867 9.130 -3.100
149 HG23 THR 20 HG23 THR 20 -6.881 7.688 -3.169
150 HA PRO 21 HA PRO 21 -3.173 3.740 1.215
151 HB2 PRO 21 HB2 PRO 21 -0.487 4.213 0.773
152 HB3 PRO 21 HB3 PRO 21 -1.419 2.904 0.040
153 HG2 PRO 21 HG2 PRO 21 -0.668 5.567 -1.100
154 HG3 PRO 21 HG3 PRO 21 -0.691 3.975 -1.883
155 HD2 PRO 21 HD2 PRO 21 -2.654 5.774 -2.283
156 HD3 PRO 21 HD3 PRO 21 -2.987 4.030 -2.218
157 H LYS 22 H LYS 22 -3.190 4.468 3.184
158 HA LYS 22 HA LYS 22 -2.392 7.206 3.847
159 HB2 LYS 22 HB2 LYS 22 -4.546 6.544 4.650
160 HB3 LYS 22 HB3 LYS 22 -3.920 5.034 5.288
161 HG2 LYS 22 HG2 LYS 22 -2.598 6.390 6.946
162 HG3 LYS 22 HG3 LYS 22 -3.487 7.809 6.379
163 HD2 LYS 22 HD2 LYS 22 -5.581 6.849 7.056
164 HD3 LYS 22 HD3 LYS 22 -4.812 5.305 7.425
165 HE2 LYS 22 HE2 LYS 22 -3.461 6.527 9.172
166 HE3 LYS 22 HE3 LYS 22 -4.512 7.920 8.895
167 HZ1 LYS 22 HZ1 LYS 22 -5.463 5.225 9.700
168 HZ2 LYS 22 HZ2 LYS 22 -6.403 6.627 9.556
169 HZ3 LYS 22 HZ3 LYS 22 -5.226 6.516 10.768
170 H TYR 23 H TYR 23 -0.690 7.694 5.288
171 HA TYR 23 HA TYR 23 0.958 5.379 6.118
172 HB2 TYR 23 HB2 TYR 23 2.139 6.902 4.603
173 HB3 TYR 23 HB3 TYR 23 1.817 8.252 5.689
174 HD1 TYR 23 HD1 TYR 23 3.292 4.807 5.901
175 HD2 TYR 23 HD2 TYR 23 3.589 8.901 7.057
176 HE1 TYR 23 HE1 TYR 23 5.358 4.307 7.130
177 HE2 TYR 23 HE2 TYR 23 5.660 8.406 8.288
178 HH TYR 23 HH TYR 23 6.767 6.483 9.328
179 H ASP 24 H ASP 24 1.348 4.991 8.205
180 HA ASP 24 HA ASP 24 0.538 7.009 10.208
181 HB2 ASP 24 HB2 ASP 24 -0.717 4.841 10.241
182 HB3 ASP 24 HB3 ASP 24 0.799 4.008 10.579
183 H GLU 25 H GLU 25 2.259 8.043 11.082
184 HA GLU 25 HA GLU 25 4.933 7.073 10.760
185 HB2 GLU 25 HB2 GLU 25 4.431 9.467 10.730
186 HB3 GLU 25 HB3 GLU 25 3.883 9.391 12.398
187 HG2 GLU 25 HG2 GLU 25 6.173 8.737 13.083
188 HG3 GLU 25 HG3 GLU 25 6.695 8.922 11.410
189 H GLU 26 H GLU 26 2.641 7.085 13.421
190 HA GLU 26 HA GLU 26 4.387 6.566 15.553
191 HB2 GLU 26 HB2 GLU 26 1.508 5.686 15.227
192 HB3 GLU 26 HB3 GLU 26 2.396 5.721 16.744
193 HG2 GLU 26 HG2 GLU 26 1.678 8.096 15.034
194 HG3 GLU 26 HG3 GLU 26 0.933 7.640 16.567
195 H SER 27 H SER 27 2.516 4.255 13.587
196 HA SER 27 HA SER 27 3.938 2.007 14.784
197 HB2 SER 27 HB2 SER 27 1.465 1.939 14.335
198 HB3 SER 27 HB3 SER 27 1.827 1.951 12.609
199 HG SER 27 HG SER 27 2.686 -0.015 14.486
200 H GLY 28 H GLY 28 4.052 3.916 11.875
201 HA2 GLY 28 HA2 GLY 28 5.834 4.009 10.369
202 HA3 GLY 28 HA3 GLY 28 6.483 2.539 11.074
203 H PHE 29 H PHE 29 3.205 2.256 10.233
204 HA PHE 29 HA PHE 29 3.942 0.710 7.824
205 HB2 PHE 29 HB2 PHE 29 1.643 0.347 9.766
206 HB3 PHE 29 HB3 PHE 29 1.830 -0.571 8.275
207 HD1 PHE 29 HD1 PHE 29 3.783 -2.103 8.016
208 HD2 PHE 29 HD2 PHE 29 2.856 -0.234 11.717
209 HE1 PHE 29 HE1 PHE 29 5.189 -3.744 9.190
210 HE2 PHE 29 HE2 PHE 29 4.258 -1.870 12.902
211 HZ PHE 29 HZ PHE 29 5.426 -3.629 11.636
212 H TYR 30 H TYR 30 2.317 0.593 6.108
213 HA TYR 30 HA TYR 30 0.750 3.063 5.798
214 HB2 TYR 30 HB2 TYR 30 1.744 0.984 3.844
215 HB3 TYR 30 HB3 TYR 30 0.481 2.124 3.397
216 HD1 TYR 30 HD1 TYR 30 4.056 1.773 4.254
217 HD2 TYR 30 HD2 TYR 30 0.986 4.444 2.990
218 HE1 TYR 30 HE1 TYR 30 5.760 3.430 3.616
219 HE2 TYR 30 HE2 TYR 30 2.684 6.101 2.355
220 HH TYR 30 HH TYR 30 5.041 6.652 2.951
221 H GLU 31 H GLU 31 -1.447 3.042 5.730
222 HA GLU 31 HA GLU 31 -2.854 0.487 6.058
223 HB2 GLU 31 HB2 GLU 31 -3.770 3.360 6.384
224 HB3 GLU 31 HB3 GLU 31 -4.831 1.971 6.556
225 HG2 GLU 31 HG2 GLU 31 -3.566 1.192 8.467
226 HG3 GLU 31 HG3 GLU 31 -2.400 2.500 8.261
227 H PHE 32 H PHE 32 -3.660 -0.442 4.270
228 HA PHE 32 HA PHE 32 -4.927 1.226 2.228
229 HB2 PHE 32 HB2 PHE 32 -3.795 0.079 0.379
230 HB3 PHE 32 HB3 PHE 32 -2.633 0.909 1.407
231 HD1 PHE 32 HD1 PHE 32 -1.279 -0.450 3.055
232 HD2 PHE 32 HD2 PHE 32 -3.637 -2.243 -0.012
233 HE1 PHE 32 HE1 PHE 32 -0.002 -2.536 3.291
234 HE2 PHE 32 HE2 PHE 32 -2.361 -4.332 0.230
235 HZ PHE 32 HZ PHE 32 -0.539 -4.482 1.883
236 H LYS 33 H LYS 33 -6.343 0.046 0.790
237 HA LYS 33 HA LYS 33 -7.353 -2.442 2.027
238 HB2 LYS 33 HB2 LYS 33 -8.809 -0.458 2.361
239 HB3 LYS 33 HB3 LYS 33 -8.957 -0.299 0.617
240 HG2 LYS 33 HG2 LYS 33 -10.017 -2.520 0.524
241 HG3 LYS 33 HG3 LYS 33 -9.905 -2.631 2.280
242 HD2 LYS 33 HD2 LYS 33 -11.451 -0.537 0.737
243 HD3 LYS 33 HD3 LYS 33 -12.148 -1.941 1.539
244 HE2 LYS 33 HE2 LYS 33 -12.505 -0.135 3.011
245 HE3 LYS 33 HE3 LYS 33 -11.149 -1.027 3.694
246 HZ1 LYS 33 HZ1 LYS 33 -10.916 1.445 3.655
247 HZ2 LYS 33 HZ2 LYS 33 -10.812 1.365 1.970
248 HZ3 LYS 33 HZ3 LYS 33 -9.638 0.612 2.928
249 H GLN 34 H GLN 34 -6.869 -4.111 0.756
250 HA GLN 34 HA GLN 34 -6.278 -4.019 -1.989
251 HB2 GLN 34 HB2 GLN 34 -7.272 -6.390 -0.381
252 HB3 GLN 34 HB3 GLN 34 -6.426 -6.467 -1.923
253 HG2 GLN 34 HG2 GLN 34 -4.422 -5.549 -0.902
254 HG3 GLN 34 HG3 GLN 34 -5.265 -5.365 0.635
255 HE21 GLN 34 HE21 GLN 34 -5.737 -7.213 1.856
256 HE22 GLN 34 HE22 GLN 34 -4.965 -8.729 1.561
257 H LEU 35 H LEU 35 -7.479 -5.078 -3.765
258 HA LEU 35 HA LEU 35 -9.951 -3.952 -4.264
259 HB2 LEU 35 HB2 LEU 35 -8.840 -6.504 -5.446
260 HB3 LEU 35 HB3 LEU 35 -10.169 -5.577 -6.119
261 HG LEU 35 HG LEU 35 -7.304 -4.636 -5.860
262 HD11 LEU 35 HD11 LEU 35 -7.296 -4.728 -8.309
263 HD12 LEU 35 HD12 LEU 35 -8.922 -5.411 -8.288
264 HD13 LEU 35 HD13 LEU 35 -7.576 -6.316 -7.596
265 HD21 LEU 35 HD21 LEU 35 -8.022 -2.670 -7.112
266 HD22 LEU 35 HD22 LEU 35 -8.896 -2.793 -5.586
267 HD23 LEU 35 HD23 LEU 35 -9.689 -3.249 -7.094
268 H ASP 36 H ASP 36 -9.288 -6.923 -2.556
269 HA ASP 36 HA ASP 36 -11.939 -7.998 -2.708
270 HB2 ASP 36 HB2 ASP 36 -9.803 -8.634 -0.659
271 HB3 ASP 36 HB3 ASP 36 -11.157 -9.654 -1.138
272 H GLY 37 H GLY 37 -11.084 -5.214 -1.299
273 HA2 GLY 37 HA2 GLY 37 -12.111 -3.895 0.300
274 HA3 GLY 37 HA3 GLY 37 -13.235 -5.211 0.604
275 H LYS 38 H LYS 38 -9.865 -5.882 0.781
276 HA LYS 38 HA LYS 38 -10.079 -6.305 3.682
277 HB2 LYS 38 HB2 LYS 38 -8.052 -7.308 1.664
278 HB3 LYS 38 HB3 LYS 38 -8.043 -7.700 3.378
279 HG2 LYS 38 HG2 LYS 38 -10.161 -8.865 3.155
280 HG3 LYS 38 HG3 LYS 38 -10.251 -8.410 1.450
281 HD2 LYS 38 HD2 LYS 38 -8.276 -9.716 0.947
282 HD3 LYS 38 HD3 LYS 38 -8.035 -10.078 2.657
283 HE2 LYS 38 HE2 LYS 38 -10.417 -10.935 1.011
284 HE3 LYS 38 HE3 LYS 38 -9.045 -11.961 1.426
285 HZ1 LYS 38 HZ1 LYS 38 -9.593 -11.714 3.757
286 HZ2 LYS 38 HZ2 LYS 38 -10.922 -12.322 2.907
287 HZ3 LYS 38 HZ3 LYS 38 -10.890 -10.701 3.380
288 H GLN 39 H GLN 39 -9.279 -4.682 4.948
289 HA GLN 39 HA GLN 39 -7.129 -2.984 3.913
290 HB2 GLN 39 HB2 GLN 39 -9.130 -1.973 5.045
291 HB3 GLN 39 HB3 GLN 39 -8.606 -2.729 6.545
292 HG2 GLN 39 HG2 GLN 39 -6.488 -1.456 6.404
293 HG3 GLN 39 HG3 GLN 39 -7.098 -0.655 4.958
294 HE21 GLN 39 HE21 GLN 39 -7.055 1.378 5.866
295 HE22 GLN 39 HE22 GLN 39 -8.146 1.874 7.108
296 H THR 40 H THR 40 -5.057 -3.271 4.440
297 HA THR 40 HA THR 40 -4.322 -4.496 6.995
298 HB THR 40 HB THR 40 -4.414 -6.416 5.467
299 HG1 THR 40 HG1 THR 40 -2.416 -7.204 6.016
300 HG21 THR 40 HG21 THR 40 -2.864 -6.585 3.563
301 HG22 THR 40 HG22 THR 40 -2.358 -4.915 3.830
302 HG23 THR 40 HG23 THR 40 -4.016 -5.268 3.343
303 H ARG 41 H ARG 41 -1.861 -4.412 7.290
304 HA ARG 41 HA ARG 41 -0.934 -1.813 6.231
305 HB2 ARG 41 HB2 ARG 41 -0.331 -3.050 8.924
306 HB3 ARG 41 HB3 ARG 41 0.268 -1.501 8.349
307 HG2 ARG 41 HG2 ARG 41 -2.021 -0.633 8.280
308 HG3 ARG 41 HG3 ARG 41 -2.629 -2.191 8.847
309 HD2 ARG 41 HD2 ARG 41 -0.822 -0.280 10.339
310 HD3 ARG 41 HD3 ARG 41 -2.493 -0.697 10.728
311 HE ARG 41 HE ARG 41 -1.499 -3.065 10.976
312 HH11 ARG 41 HH11 ARG 41 0.011 -0.125 11.926
313 HH12 ARG 41 HH12 ARG 41 1.063 -0.893 13.057
314 HH21 ARG 41 HH21 ARG 41 -0.180 -4.051 12.434
315 HH22 ARG 41 HH22 ARG 41 0.962 -3.118 13.340
316 H ILE 42 H ILE 42 1.107 -1.606 5.436
317 HA ILE 42 HA ILE 42 2.967 -3.888 5.712
318 HB ILE 42 HB ILE 42 1.950 -3.820 3.432
319 HG12 ILE 42 HG12 ILE 42 4.915 -3.182 3.463
320 HG13 ILE 42 HG13 ILE 42 4.225 -4.753 3.862
321 HG21 ILE 42 HG21 ILE 42 1.659 -1.396 3.237
322 HG22 ILE 42 HG22 ILE 42 2.573 -2.041 1.875
323 HG23 ILE 42 HG23 ILE 42 3.410 -1.184 3.171
324 HD11 ILE 42 HD11 ILE 42 5.083 -4.725 1.604
325 HD12 ILE 42 HD12 ILE 42 4.042 -3.361 1.201
326 HD13 ILE 42 HD13 ILE 42 3.330 -4.926 1.597
327 H ASN 43 H ASN 43 5.218 -3.343 5.844
328 HA ASN 43 HA ASN 43 5.613 -0.931 7.299
329 HB2 ASN 43 HB2 ASN 43 6.816 -3.075 7.753
330 HB3 ASN 43 HB3 ASN 43 7.761 -2.805 6.290
331 HD21 ASN 43 HD21 ASN 43 9.700 -2.653 7.411
332 HD22 ASN 43 HD22 ASN 43 10.094 -1.299 8.409
333 H LYS 44 H LYS 44 6.895 0.810 6.905
334 HA LYS 44 HA LYS 44 6.592 2.128 4.505
335 HB2 LYS 44 HB2 LYS 44 8.290 3.728 5.456
336 HB3 LYS 44 HB3 LYS 44 6.956 3.324 6.533
337 HG2 LYS 44 HG2 LYS 44 8.490 1.555 7.529
338 HG3 LYS 44 HG3 LYS 44 9.798 2.345 6.649
339 HD2 LYS 44 HD2 LYS 44 9.425 4.407 7.856
340 HD3 LYS 44 HD3 LYS 44 7.989 3.732 8.634
341 HE2 LYS 44 HE2 LYS 44 10.839 2.792 8.991
342 HE3 LYS 44 HE3 LYS 44 9.874 3.684 10.169
343 HZ1 LYS 44 HZ1 LYS 44 9.958 1.290 10.620
344 HZ2 LYS 44 HZ2 LYS 44 9.203 0.976 9.140
345 HZ3 LYS 44 HZ3 LYS 44 8.383 1.827 10.349
346 H ASP 45 H ASP 45 9.194 -0.064 5.354
347 HA ASP 45 HA ASP 45 11.073 1.029 3.459
348 HB2 ASP 45 HB2 ASP 45 12.486 -0.900 4.083
349 HB3 ASP 45 HB3 ASP 45 11.897 -0.022 5.490
350 H GLN 46 H GLN 46 8.521 -1.284 3.285
351 HA GLN 46 HA GLN 46 9.597 -2.832 1.115
352 HB2 GLN 46 HB2 GLN 46 6.828 -2.666 2.310
353 HB3 GLN 46 HB3 GLN 46 7.263 -3.779 1.022
354 HG2 GLN 46 HG2 GLN 46 8.655 -3.731 3.693
355 HG3 GLN 46 HG3 GLN 46 7.244 -4.728 3.352
356 HE21 GLN 46 HE21 GLN 46 8.373 -6.634 3.676
357 HE22 GLN 46 HE22 GLN 46 9.546 -7.222 2.556
358 H VAL 47 H VAL 47 7.755 0.120 1.272
359 HA VAL 47 HA VAL 47 6.517 -0.186 -1.302
360 HB VAL 47 HB VAL 47 5.412 1.171 0.369
361 HG11 VAL 47 HG11 VAL 47 7.771 3.049 0.173
362 HG12 VAL 47 HG12 VAL 47 7.350 2.045 1.560
363 HG13 VAL 47 HG13 VAL 47 6.282 3.358 1.067
364 HG21 VAL 47 HG21 VAL 47 6.335 2.849 -1.968
365 HG22 VAL 47 HG22 VAL 47 4.894 3.139 -0.993
366 HG23 VAL 47 HG23 VAL 47 5.009 1.686 -1.987
367 H ARG 48 H ARG 48 7.601 -0.142 -3.140
368 HA ARG 48 HA ARG 48 10.031 1.393 -3.509
369 HB2 ARG 48 HB2 ARG 48 9.723 -0.864 -4.510
370 HB3 ARG 48 HB3 ARG 48 8.435 -0.222 -5.516
371 HG2 ARG 48 HG2 ARG 48 10.028 1.252 -6.637
372 HG3 ARG 48 HG3 ARG 48 11.324 0.649 -5.602
373 HD2 ARG 48 HD2 ARG 48 10.979 -1.615 -6.497
374 HD3 ARG 48 HD3 ARG 48 9.701 -0.998 -7.544
375 HE ARG 48 HE ARG 48 12.122 0.414 -7.974
376 HH11 ARG 48 HH11 ARG 48 10.635 -2.629 -8.603
377 HH12 ARG 48 HH12 ARG 48 11.521 -2.880 -10.060
378 HH21 ARG 48 HH21 ARG 48 13.269 0.063 -9.844
379 HH22 ARG 48 HH22 ARG 48 12.995 -1.382 -10.753
380 H THR 49 H THR 49 6.896 1.295 -5.240
381 HA THR 49 HA THR 49 6.952 4.229 -5.525
382 HB THR 49 HB THR 49 6.181 4.094 -7.877
383 HG1 THR 49 HG1 THR 49 6.872 1.788 -8.748
384 HG21 THR 49 HG21 THR 49 8.566 4.456 -7.467
385 HG22 THR 49 HG22 THR 49 8.315 3.494 -8.925
386 HG23 THR 49 HG23 THR 49 8.835 2.712 -7.431
387 H VAL 50 H VAL 50 4.888 5.203 -5.816
388 HA VAL 50 HA VAL 50 2.549 3.412 -5.505
389 HB VAL 50 HB VAL 50 2.932 6.105 -4.163
390 HG11 VAL 50 HG11 VAL 50 0.590 4.195 -4.063
391 HG12 VAL 50 HG12 VAL 50 0.611 5.790 -4.816
392 HG13 VAL 50 HG13 VAL 50 0.773 5.640 -3.067
393 HG21 VAL 50 HG21 VAL 50 4.220 4.362 -3.053
394 HG22 VAL 50 HG22 VAL 50 2.795 3.326 -2.980
395 HG23 VAL 50 HG23 VAL 50 2.842 4.828 -2.057
396 H LYS 51 H LYS 51 1.491 3.516 -7.423
397 HA LYS 51 HA LYS 51 1.002 6.197 -8.578
398 HB2 LYS 51 HB2 LYS 51 1.456 3.607 -10.079
399 HB3 LYS 51 HB3 LYS 51 0.935 5.115 -10.821
400 HG2 LYS 51 HG2 LYS 51 3.051 6.165 -9.965
401 HG3 LYS 51 HG3 LYS 51 3.576 4.551 -9.479
402 HD2 LYS 51 HD2 LYS 51 2.841 5.388 -12.290
403 HD3 LYS 51 HD3 LYS 51 4.484 5.211 -11.675
404 HE2 LYS 51 HE2 LYS 51 4.205 2.856 -11.385
405 HE3 LYS 51 HE3 LYS 51 2.472 2.960 -11.707
406 HZ1 LYS 51 HZ1 LYS 51 3.670 2.133 -13.630
407 HZ2 LYS 51 HZ2 LYS 51 4.636 3.522 -13.667
408 HZ3 LYS 51 HZ3 LYS 51 2.980 3.638 -13.975
409 H ASP 52 H ASP 52 -1.027 6.612 -9.446
410 HA ASP 52 HA ASP 52 -3.166 5.068 -8.258
411 HB2 ASP 52 HB2 ASP 52 -3.239 7.582 -9.946
412 HB3 ASP 52 HB3 ASP 52 -4.608 6.898 -9.073
413 H LEU 53 H LEU 53 -4.629 3.786 -9.284
414 HA LEU 53 HA LEU 53 -4.111 2.911 -11.970
415 HB2 LEU 53 HB2 LEU 53 -6.398 2.260 -10.099
416 HB3 LEU 53 HB3 LEU 53 -6.093 1.452 -11.627
417 HG LEU 53 HG LEU 53 -4.253 1.421 -9.221
418 HD11 LEU 53 HD11 LEU 53 -4.839 -0.961 -9.082
419 HD12 LEU 53 HD12 LEU 53 -6.016 -0.742 -10.378
420 HD13 LEU 53 HD13 LEU 53 -6.239 0.082 -8.833
421 HD21 LEU 53 HD21 LEU 53 -2.970 -0.242 -10.489
422 HD22 LEU 53 HD22 LEU 53 -2.994 1.325 -11.298
423 HD23 LEU 53 HD23 LEU 53 -4.020 0.014 -11.884
424 H LEU 54 H LEU 54 -6.248 5.232 -10.504
425 HA LEU 54 HA LEU 54 -7.331 5.839 -13.186
426 HB2 LEU 54 HB2 LEU 54 -8.609 6.280 -10.487
427 HB3 LEU 54 HB3 LEU 54 -9.219 6.985 -11.973
428 HG LEU 54 HG LEU 54 -9.061 4.035 -11.319
429 HD11 LEU 54 HD11 LEU 54 -11.435 5.867 -11.689
430 HD12 LEU 54 HD12 LEU 54 -10.851 5.220 -10.155
431 HD13 LEU 54 HD13 LEU 54 -11.498 4.131 -11.380
432 HD21 LEU 54 HD21 LEU 54 -8.618 4.388 -13.690
433 HD22 LEU 54 HD22 LEU 54 -10.058 5.398 -13.827
434 HD23 LEU 54 HD23 LEU 54 -10.216 3.680 -13.458
435 H GLU 55 H GLU 55 -5.562 7.168 -13.698
436 HA GLU 55 HA GLU 55 -4.981 9.501 -12.075
437 HB2 GLU 55 HB2 GLU 55 -3.958 8.651 -14.795
438 HB3 GLU 55 HB3 GLU 55 -3.365 10.039 -13.892
439 HG2 GLU 55 HG2 GLU 55 -2.524 8.618 -12.144
440 HG3 GLU 55 HG3 GLU 55 -3.251 7.197 -12.892
Start of MODEL 11
1 H1 MET 1 H1 MET 1 -14.927 8.858 -2.382
2 H2 MET 1 H2 MET 1 -15.228 8.589 -4.026
3 H3 MET 1 H3 MET 1 -15.549 10.099 -3.344
4 HA MET 1 HA MET 1 -13.508 10.071 -4.683
5 HB2 MET 1 HB2 MET 1 -13.229 10.622 -1.720
6 HB3 MET 1 HB3 MET 1 -12.070 11.154 -2.931
7 HG2 MET 1 HG2 MET 1 -13.897 12.430 -4.036
8 HG3 MET 1 HG3 MET 1 -14.955 11.988 -2.696
9 HE1 MET 1 HE1 MET 1 -11.182 14.618 -2.259
10 HE2 MET 1 HE2 MET 1 -11.745 13.954 -3.792
11 HE3 MET 1 HE3 MET 1 -11.099 12.881 -2.550
12 H ALA 2 H ALA 2 -13.941 7.212 -3.616
13 HA ALA 2 HA ALA 2 -11.386 6.366 -2.660
14 HB1 ALA 2 HB1 ALA 2 -12.218 4.102 -2.980
15 HB2 ALA 2 HB2 ALA 2 -13.587 4.715 -3.908
16 HB3 ALA 2 HB3 ALA 2 -13.441 5.100 -2.194
17 H SER 3 H SER 3 -9.932 7.300 -4.178
18 HA SER 3 HA SER 3 -9.928 6.429 -6.932
19 HB2 SER 3 HB2 SER 3 -7.828 7.932 -5.336
20 HB3 SER 3 HB3 SER 3 -7.771 7.658 -7.078
21 HG SER 3 HG SER 3 -8.723 9.730 -6.138
22 HA PRO 4 HA PRO 4 -7.964 2.496 -5.864
23 HB2 PRO 4 HB2 PRO 4 -7.517 1.764 -8.502
24 HB3 PRO 4 HB3 PRO 4 -9.011 1.464 -7.612
25 HG2 PRO 4 HG2 PRO 4 -8.357 3.668 -9.532
26 HG3 PRO 4 HG3 PRO 4 -9.856 2.734 -9.365
27 HD2 PRO 4 HD2 PRO 4 -9.655 5.220 -8.387
28 HD3 PRO 4 HD3 PRO 4 -10.565 3.964 -7.519
29 H THR 5 H THR 5 -5.865 2.071 -5.424
30 HA THR 5 HA THR 5 -3.771 3.602 -6.863
31 HB THR 5 HB THR 5 -3.906 3.101 -3.873
32 HG1 THR 5 HG1 THR 5 -5.294 4.816 -4.784
33 HG21 THR 5 HG21 THR 5 -1.600 3.053 -4.670
34 HG22 THR 5 HG22 THR 5 -1.901 4.531 -3.756
35 HG23 THR 5 HG23 THR 5 -1.842 4.581 -5.518
36 H VAL 6 H VAL 6 -2.014 2.428 -7.510
37 HA VAL 6 HA VAL 6 -1.783 -0.340 -6.529
38 HB VAL 6 HB VAL 6 -1.965 -0.086 -8.985
39 HG11 VAL 6 HG11 VAL 6 0.706 1.315 -8.823
40 HG12 VAL 6 HG12 VAL 6 -0.832 2.077 -9.231
41 HG13 VAL 6 HG13 VAL 6 -0.144 0.853 -10.298
42 HG21 VAL 6 HG21 VAL 6 -0.835 -2.032 -8.073
43 HG22 VAL 6 HG22 VAL 6 0.694 -1.152 -8.019
44 HG23 VAL 6 HG23 VAL 6 -0.054 -1.529 -9.573
45 H ILE 7 H ILE 7 -0.218 -0.868 -5.178
46 HA ILE 7 HA ILE 7 2.024 0.996 -4.752
47 HB ILE 7 HB ILE 7 0.926 -1.138 -2.902
48 HG12 ILE 7 HG12 ILE 7 0.721 1.890 -2.766
49 HG13 ILE 7 HG13 ILE 7 -0.591 0.794 -3.184
50 HG21 ILE 7 HG21 ILE 7 2.419 -0.152 -1.210
51 HG22 ILE 7 HG22 ILE 7 3.086 0.928 -2.436
52 HG23 ILE 7 HG23 ILE 7 3.322 -0.815 -2.573
53 HD11 ILE 7 HD11 ILE 7 -0.490 -0.178 -0.947
54 HD12 ILE 7 HD12 ILE 7 -0.777 1.561 -0.894
55 HD13 ILE 7 HD13 ILE 7 0.826 0.921 -0.532
56 H THR 8 H THR 8 3.736 0.375 -5.940
57 HA THR 8 HA THR 8 4.370 -2.424 -6.397
58 HB THR 8 HB THR 8 6.058 -0.005 -7.102
59 HG1 THR 8 HG1 THR 8 4.429 -1.317 -8.995
60 HG21 THR 8 HG21 THR 8 7.268 -2.131 -7.182
61 HG22 THR 8 HG22 THR 8 7.020 -1.500 -8.809
62 HG23 THR 8 HG23 THR 8 6.016 -2.822 -8.213
63 H LEU 9 H LEU 9 5.478 -3.603 -4.950
64 HA LEU 9 HA LEU 9 7.060 -2.326 -2.867
65 HB2 LEU 9 HB2 LEU 9 6.640 -5.277 -3.397
66 HB3 LEU 9 HB3 LEU 9 7.295 -4.560 -1.934
67 HG LEU 9 HG LEU 9 4.455 -4.228 -2.928
68 HD11 LEU 9 HD11 LEU 9 4.884 -6.489 -2.131
69 HD12 LEU 9 HD12 LEU 9 3.843 -5.616 -1.006
70 HD13 LEU 9 HD13 LEU 9 5.551 -5.850 -0.627
71 HD21 LEU 9 HD21 LEU 9 5.774 -3.268 -0.382
72 HD22 LEU 9 HD22 LEU 9 4.051 -3.163 -0.750
73 HD23 LEU 9 HD23 LEU 9 5.215 -2.257 -1.716
74 H ASN 10 H ASN 10 9.297 -2.865 -2.443
75 HA ASN 10 HA ASN 10 10.993 -2.789 -4.691
76 HB2 ASN 10 HB2 ASN 10 11.580 -1.919 -2.440
77 HB3 ASN 10 HB3 ASN 10 11.675 -3.573 -1.842
78 HD21 ASN 10 HD21 ASN 10 13.434 -4.837 -2.405
79 HD22 ASN 10 HD22 ASN 10 14.856 -4.174 -3.125
80 H ASP 11 H ASP 11 9.700 -5.410 -2.818
81 HA ASP 11 HA ASP 11 11.241 -7.566 -3.661
82 HB2 ASP 11 HB2 ASP 11 9.545 -7.732 -1.920
83 HB3 ASP 11 HB3 ASP 11 8.270 -7.393 -3.085
84 H GLY 12 H GLY 12 8.881 -5.696 -5.430
85 HA2 GLY 12 HA2 GLY 12 8.906 -5.771 -7.863
86 HA3 GLY 12 HA3 GLY 12 9.171 -7.503 -7.756
87 H ARG 13 H ARG 13 7.041 -7.198 -5.433
88 HA ARG 13 HA ARG 13 4.788 -7.956 -7.070
89 HB2 ARG 13 HB2 ARG 13 5.221 -9.175 -5.022
90 HB3 ARG 13 HB3 ARG 13 5.138 -7.696 -4.074
91 HG2 ARG 13 HG2 ARG 13 2.769 -7.483 -4.545
92 HG3 ARG 13 HG3 ARG 13 2.826 -8.898 -5.599
93 HD2 ARG 13 HD2 ARG 13 3.400 -10.315 -3.711
94 HD3 ARG 13 HD3 ARG 13 3.465 -8.911 -2.642
95 HE ARG 13 HE ARG 13 0.966 -8.762 -3.545
96 HH11 ARG 13 HH11 ARG 13 2.735 -11.486 -2.368
97 HH12 ARG 13 HH12 ARG 13 1.318 -12.251 -1.733
98 HH21 ARG 13 HH21 ARG 13 -0.825 -9.761 -2.725
99 HH22 ARG 13 HH22 ARG 13 -0.661 -11.285 -1.922
100 H GLU 14 H GLU 14 3.117 -6.703 -7.680
101 HA GLU 14 HA GLU 14 2.867 -3.995 -6.531
102 HB2 GLU 14 HB2 GLU 14 1.802 -5.122 -9.133
103 HB3 GLU 14 HB3 GLU 14 1.551 -3.474 -8.569
104 HG2 GLU 14 HG2 GLU 14 3.913 -3.012 -8.709
105 HG3 GLU 14 HG3 GLU 14 4.252 -4.687 -9.130
106 H ILE 15 H ILE 15 1.115 -3.457 -5.354
107 HA ILE 15 HA ILE 15 -1.085 -5.427 -5.164
108 HB ILE 15 HB ILE 15 -0.254 -3.414 -3.062
109 HG12 ILE 15 HG12 ILE 15 0.312 -6.395 -3.139
110 HG13 ILE 15 HG13 ILE 15 1.504 -5.143 -3.481
111 HG21 ILE 15 HG21 ILE 15 -2.171 -5.750 -3.003
112 HG22 ILE 15 HG22 ILE 15 -2.575 -4.038 -2.871
113 HG23 ILE 15 HG23 ILE 15 -1.668 -4.832 -1.586
114 HD11 ILE 15 HD11 ILE 15 1.741 -5.998 -1.224
115 HD12 ILE 15 HD12 ILE 15 0.074 -5.552 -0.860
116 HD13 ILE 15 HD13 ILE 15 1.270 -4.301 -1.203
117 H GLN 16 H GLN 16 -3.004 -4.772 -5.952
118 HA GLN 16 HA GLN 16 -3.458 -1.920 -6.429
119 HB2 GLN 16 HB2 GLN 16 -5.041 -4.342 -7.315
120 HB3 GLN 16 HB3 GLN 16 -5.401 -2.679 -7.763
121 HG2 GLN 16 HG2 GLN 16 -3.207 -2.522 -8.871
122 HG3 GLN 16 HG3 GLN 16 -2.895 -4.206 -8.458
123 HE21 GLN 16 HE21 GLN 16 -4.729 -2.050 -10.463
124 HE22 GLN 16 HE22 GLN 16 -5.307 -3.242 -11.566
125 H ALA 17 H ALA 17 -4.479 -0.741 -4.980
126 HA ALA 17 HA ALA 17 -6.454 -1.955 -3.162
127 HB1 ALA 17 HB1 ALA 17 -4.973 0.671 -2.928
128 HB2 ALA 17 HB2 ALA 17 -4.562 -0.824 -2.087
129 HB3 ALA 17 HB3 ALA 17 -6.081 -0.002 -1.732
130 H VAL 18 H VAL 18 -8.466 -0.835 -2.761
131 HA VAL 18 HA VAL 18 -9.597 0.321 -5.151
132 HB VAL 18 HB VAL 18 -11.728 0.365 -3.907
133 HG11 VAL 18 HG11 VAL 18 -11.075 -1.660 -5.093
134 HG12 VAL 18 HG12 VAL 18 -11.972 -2.062 -3.629
135 HG13 VAL 18 HG13 VAL 18 -10.218 -2.242 -3.666
136 HG21 VAL 18 HG21 VAL 18 -10.923 0.886 -1.679
137 HG22 VAL 18 HG22 VAL 18 -10.072 -0.658 -1.592
138 HG23 VAL 18 HG23 VAL 18 -11.834 -0.623 -1.640
139 H ASP 19 H ASP 19 -8.468 1.555 -2.075
140 HA ASP 19 HA ASP 19 -9.092 4.276 -3.018
141 HB2 ASP 19 HB2 ASP 19 -9.344 4.912 -0.556
142 HB3 ASP 19 HB3 ASP 19 -10.658 3.995 -1.281
143 H THR 20 H THR 20 -7.786 5.926 -1.550
144 HA THR 20 HA THR 20 -5.023 5.373 -2.153
145 HB THR 20 HB THR 20 -4.600 7.687 -1.395
146 HG1 THR 20 HG1 THR 20 -6.440 7.533 0.221
147 HG21 THR 20 HG21 THR 20 -5.310 7.351 -3.703
148 HG22 THR 20 HG22 THR 20 -6.001 8.848 -3.071
149 HG23 THR 20 HG23 THR 20 -7.004 7.404 -3.211
150 HA PRO 21 HA PRO 21 -4.035 3.709 1.829
151 HB2 PRO 21 HB2 PRO 21 -1.320 3.813 1.689
152 HB3 PRO 21 HB3 PRO 21 -2.285 2.653 0.768
153 HG2 PRO 21 HG2 PRO 21 -1.125 5.275 -0.125
154 HG3 PRO 21 HG3 PRO 21 -1.102 3.705 -0.955
155 HD2 PRO 21 HD2 PRO 21 -2.874 5.634 -1.607
156 HD3 PRO 21 HD3 PRO 21 -3.300 3.911 -1.674
157 H LYS 22 H LYS 22 -3.339 4.270 3.880
158 HA LYS 22 HA LYS 22 -2.597 7.095 4.329
159 HB2 LYS 22 HB2 LYS 22 -4.687 6.650 5.382
160 HB3 LYS 22 HB3 LYS 22 -4.128 5.106 6.009
161 HG2 LYS 22 HG2 LYS 22 -2.558 6.321 7.494
162 HG3 LYS 22 HG3 LYS 22 -3.236 7.844 6.915
163 HD2 LYS 22 HD2 LYS 22 -5.387 7.309 7.843
164 HD3 LYS 22 HD3 LYS 22 -4.865 5.670 8.236
165 HE2 LYS 22 HE2 LYS 22 -3.759 8.211 9.444
166 HE3 LYS 22 HE3 LYS 22 -4.900 7.117 10.221
167 HZ1 LYS 22 HZ1 LYS 22 -3.200 5.356 10.058
168 HZ2 LYS 22 HZ2 LYS 22 -2.694 6.660 11.015
169 HZ3 LYS 22 HZ3 LYS 22 -2.108 6.488 9.441
170 H TYR 23 H TYR 23 -0.496 7.389 4.895
171 HA TYR 23 HA TYR 23 1.053 5.228 6.057
172 HB2 TYR 23 HB2 TYR 23 2.226 6.685 4.527
173 HB3 TYR 23 HB3 TYR 23 1.760 8.112 5.448
174 HD1 TYR 23 HD1 TYR 23 3.622 4.885 5.895
175 HD2 TYR 23 HD2 TYR 23 3.300 9.001 6.964
176 HE1 TYR 23 HE1 TYR 23 5.679 4.696 7.229
177 HE2 TYR 23 HE2 TYR 23 5.359 8.819 8.299
178 HH TYR 23 HH TYR 23 6.669 7.098 9.442
179 H ASP 24 H ASP 24 1.263 4.835 8.195
180 HA ASP 24 HA ASP 24 0.202 6.833 10.061
181 HB2 ASP 24 HB2 ASP 24 -0.559 4.397 10.114
182 HB3 ASP 24 HB3 ASP 24 1.040 4.010 10.751
183 H GLU 25 H GLU 25 1.558 8.149 11.041
184 HA GLU 25 HA GLU 25 4.362 7.970 10.604
185 HB2 GLU 25 HB2 GLU 25 3.089 10.086 10.662
186 HB3 GLU 25 HB3 GLU 25 2.790 9.853 12.377
187 HG2 GLU 25 HG2 GLU 25 5.116 10.123 12.884
188 HG3 GLU 25 HG3 GLU 25 5.535 10.142 11.169
189 H GLU 26 H GLU 26 2.296 7.100 13.275
190 HA GLU 26 HA GLU 26 4.458 6.913 15.195
191 HB2 GLU 26 HB2 GLU 26 1.605 5.924 15.409
192 HB3 GLU 26 HB3 GLU 26 2.745 6.102 16.735
193 HG2 GLU 26 HG2 GLU 26 1.641 8.347 15.052
194 HG3 GLU 26 HG3 GLU 26 1.104 7.917 16.675
195 H SER 27 H SER 27 2.412 4.604 13.403
196 HA SER 27 HA SER 27 3.773 2.303 14.520
197 HB2 SER 27 HB2 SER 27 1.764 2.437 12.255
198 HB3 SER 27 HB3 SER 27 2.300 0.972 13.074
199 HG SER 27 HG SER 27 0.740 3.103 14.099
200 H GLY 28 H GLY 28 4.034 4.223 11.613
201 HA2 GLY 28 HA2 GLY 28 5.813 4.286 10.116
202 HA3 GLY 28 HA3 GLY 28 6.489 2.866 10.893
203 H PHE 29 H PHE 29 3.239 2.384 10.046
204 HA PHE 29 HA PHE 29 4.065 0.794 7.702
205 HB2 PHE 29 HB2 PHE 29 1.624 0.513 9.473
206 HB3 PHE 29 HB3 PHE 29 1.973 -0.494 8.075
207 HD1 PHE 29 HD1 PHE 29 4.073 -1.931 8.124
208 HD2 PHE 29 HD2 PHE 29 2.492 -0.022 11.586
209 HE1 PHE 29 HE1 PHE 29 5.324 -3.494 9.555
210 HE2 PHE 29 HE2 PHE 29 3.746 -1.575 13.019
211 HZ PHE 29 HZ PHE 29 5.165 -3.315 12.006
212 H TYR 30 H TYR 30 2.584 0.640 5.884
213 HA TYR 30 HA TYR 30 0.891 3.012 5.473
214 HB2 TYR 30 HB2 TYR 30 2.104 0.994 3.580
215 HB3 TYR 30 HB3 TYR 30 0.794 2.051 3.069
216 HD1 TYR 30 HD1 TYR 30 4.317 1.951 4.176
217 HD2 TYR 30 HD2 TYR 30 1.190 4.365 2.591
218 HE1 TYR 30 HE1 TYR 30 5.954 3.702 3.620
219 HE2 TYR 30 HE2 TYR 30 2.815 6.123 2.037
220 HH TYR 30 HH TYR 30 5.023 6.877 2.674
221 H GLU 31 H GLU 31 -1.263 2.835 5.587
222 HA GLU 31 HA GLU 31 -2.499 0.182 5.810
223 HB2 GLU 31 HB2 GLU 31 -3.723 2.898 6.370
224 HB3 GLU 31 HB3 GLU 31 -4.391 1.332 6.808
225 HG2 GLU 31 HG2 GLU 31 -2.476 0.978 8.331
226 HG3 GLU 31 HG3 GLU 31 -1.890 2.590 7.931
227 H PHE 32 H PHE 32 -3.500 -0.641 4.053
228 HA PHE 32 HA PHE 32 -4.908 1.179 2.237
229 HB2 PHE 32 HB2 PHE 32 -3.911 0.092 0.243
230 HB3 PHE 32 HB3 PHE 32 -2.724 0.959 1.210
231 HD1 PHE 32 HD1 PHE 32 -1.165 -0.330 2.690
232 HD2 PHE 32 HD2 PHE 32 -3.704 -2.227 -0.159
233 HE1 PHE 32 HE1 PHE 32 0.220 -2.361 2.808
234 HE2 PHE 32 HE2 PHE 32 -2.326 -4.251 -0.044
235 HZ PHE 32 HZ PHE 32 -0.358 -4.325 1.440
236 H LYS 33 H LYS 33 -6.574 0.265 1.034
237 HA LYS 33 HA LYS 33 -7.522 -2.354 2.011
238 HB2 LYS 33 HB2 LYS 33 -8.941 -0.361 2.461
239 HB3 LYS 33 HB3 LYS 33 -9.071 -0.088 0.729
240 HG2 LYS 33 HG2 LYS 33 -10.161 -2.323 0.525
241 HG3 LYS 33 HG3 LYS 33 -10.151 -2.434 2.288
242 HD2 LYS 33 HD2 LYS 33 -11.538 -0.320 0.624
243 HD3 LYS 33 HD3 LYS 33 -12.317 -1.634 1.507
244 HE2 LYS 33 HE2 LYS 33 -11.738 -0.690 3.605
245 HE3 LYS 33 HE3 LYS 33 -10.609 0.444 2.865
246 HZ1 LYS 33 HZ1 LYS 33 -12.680 1.512 3.515
247 HZ2 LYS 33 HZ2 LYS 33 -13.557 0.487 2.493
248 HZ3 LYS 33 HZ3 LYS 33 -12.448 1.587 1.843
249 H GLN 34 H GLN 34 -7.042 -3.949 0.609
250 HA GLN 34 HA GLN 34 -6.362 -3.532 -2.115
251 HB2 GLN 34 HB2 GLN 34 -7.084 -6.114 -0.710
252 HB3 GLN 34 HB3 GLN 34 -6.290 -5.989 -2.273
253 HG2 GLN 34 HG2 GLN 34 -4.374 -4.883 -1.189
254 HG3 GLN 34 HG3 GLN 34 -5.168 -5.078 0.373
255 HE21 GLN 34 HE21 GLN 34 -5.363 -7.168 1.248
256 HE22 GLN 34 HE22 GLN 34 -4.387 -8.478 0.693
257 H LEU 35 H LEU 35 -7.399 -4.874 -3.925
258 HA LEU 35 HA LEU 35 -10.004 -4.009 -4.458
259 HB2 LEU 35 HB2 LEU 35 -8.519 -6.346 -5.667
260 HB3 LEU 35 HB3 LEU 35 -9.969 -5.625 -6.338
261 HG LEU 35 HG LEU 35 -7.270 -4.286 -6.060
262 HD11 LEU 35 HD11 LEU 35 -7.268 -4.306 -8.501
263 HD12 LEU 35 HD12 LEU 35 -8.809 -5.163 -8.505
264 HD13 LEU 35 HD13 LEU 35 -7.368 -5.941 -7.853
265 HD21 LEU 35 HD21 LEU 35 -8.282 -2.409 -7.282
266 HD22 LEU 35 HD22 LEU 35 -9.045 -2.658 -5.711
267 HD23 LEU 35 HD23 LEU 35 -9.857 -3.199 -7.181
268 H ASP 36 H ASP 36 -8.941 -6.761 -2.674
269 HA ASP 36 HA ASP 36 -11.452 -8.190 -2.827
270 HB2 ASP 36 HB2 ASP 36 -10.295 -9.587 -0.982
271 HB3 ASP 36 HB3 ASP 36 -9.609 -9.614 -2.606
272 H GLY 37 H GLY 37 -10.306 -5.571 -0.997
273 HA2 GLY 37 HA2 GLY 37 -11.841 -4.316 0.343
274 HA3 GLY 37 HA3 GLY 37 -12.640 -5.811 0.791
275 H LYS 38 H LYS 38 -9.469 -6.565 1.091
276 HA LYS 38 HA LYS 38 -9.520 -6.346 3.963
277 HB2 LYS 38 HB2 LYS 38 -7.329 -7.234 2.071
278 HB3 LYS 38 HB3 LYS 38 -7.217 -7.323 3.824
279 HG2 LYS 38 HG2 LYS 38 -9.020 -8.915 3.911
280 HG3 LYS 38 HG3 LYS 38 -9.307 -8.743 2.176
281 HD2 LYS 38 HD2 LYS 38 -7.105 -9.665 1.697
282 HD3 LYS 38 HD3 LYS 38 -6.745 -9.765 3.422
283 HE2 LYS 38 HE2 LYS 38 -8.970 -11.251 2.018
284 HE3 LYS 38 HE3 LYS 38 -7.403 -11.939 2.443
285 HZ1 LYS 38 HZ1 LYS 38 -9.052 -12.510 4.086
286 HZ2 LYS 38 HZ2 LYS 38 -9.418 -10.882 4.353
287 HZ3 LYS 38 HZ3 LYS 38 -7.900 -11.485 4.779
288 H GLN 39 H GLN 39 -9.060 -4.490 5.032
289 HA GLN 39 HA GLN 39 -7.153 -2.585 3.931
290 HB2 GLN 39 HB2 GLN 39 -9.136 -1.720 5.105
291 HB3 GLN 39 HB3 GLN 39 -8.634 -2.541 6.579
292 HG2 GLN 39 HG2 GLN 39 -6.608 -1.154 6.654
293 HG3 GLN 39 HG3 GLN 39 -7.121 -0.333 5.183
294 HE21 GLN 39 HE21 GLN 39 -8.816 1.148 5.283
295 HE22 GLN 39 HE22 GLN 39 -9.382 1.795 6.785
296 H THR 40 H THR 40 -5.217 -3.695 3.918
297 HA THR 40 HA THR 40 -4.224 -4.725 6.503
298 HB THR 40 HB THR 40 -4.288 -6.457 4.813
299 HG1 THR 40 HG1 THR 40 -2.533 -6.673 6.167
300 HG21 THR 40 HG21 THR 40 -2.494 -4.667 3.164
301 HG22 THR 40 HG22 THR 40 -4.176 -5.060 2.802
302 HG23 THR 40 HG23 THR 40 -2.946 -6.324 2.764
303 H ARG 41 H ARG 41 -1.799 -4.589 6.775
304 HA ARG 41 HA ARG 41 -0.846 -1.934 5.889
305 HB2 ARG 41 HB2 ARG 41 -0.614 -3.125 8.662
306 HB3 ARG 41 HB3 ARG 41 0.110 -1.605 8.147
307 HG2 ARG 41 HG2 ARG 41 -2.108 -0.673 7.741
308 HG3 ARG 41 HG3 ARG 41 -2.846 -2.203 8.215
309 HD2 ARG 41 HD2 ARG 41 -1.137 -0.466 9.999
310 HD3 ARG 41 HD3 ARG 41 -2.900 -0.516 10.014
311 HE ARG 41 HE ARG 41 -1.347 -2.951 10.552
312 HH11 ARG 41 HH11 ARG 41 -3.608 -0.560 11.572
313 HH12 ARG 41 HH12 ARG 41 -4.061 -1.439 12.987
314 HH21 ARG 41 HH21 ARG 41 -1.933 -4.061 12.378
315 HH22 ARG 41 HH22 ARG 41 -3.118 -3.389 13.444
316 H ILE 42 H ILE 42 1.256 -1.762 5.300
317 HA ILE 42 HA ILE 42 3.087 -4.004 5.883
318 HB ILE 42 HB ILE 42 2.219 -4.199 3.545
319 HG12 ILE 42 HG12 ILE 42 5.182 -3.551 3.699
320 HG13 ILE 42 HG13 ILE 42 4.458 -5.066 4.229
321 HG21 ILE 42 HG21 ILE 42 1.947 -1.807 3.073
322 HG22 ILE 42 HG22 ILE 42 2.925 -2.604 1.841
323 HG23 ILE 42 HG23 ILE 42 3.700 -1.605 3.072
324 HD11 ILE 42 HD11 ILE 42 5.467 -5.283 2.036
325 HD12 ILE 42 HD12 ILE 42 4.435 -3.994 1.418
326 HD13 ILE 42 HD13 ILE 42 3.721 -5.516 1.952
327 H ASN 43 H ASN 43 5.319 -3.423 6.050
328 HA ASN 43 HA ASN 43 5.684 -0.868 7.242
329 HB2 ASN 43 HB2 ASN 43 6.866 -3.014 7.876
330 HB3 ASN 43 HB3 ASN 43 7.881 -2.794 6.453
331 HD21 ASN 43 HD21 ASN 43 9.758 -2.529 7.617
332 HD22 ASN 43 HD22 ASN 43 10.066 -1.146 8.604
333 H LYS 44 H LYS 44 7.079 0.840 6.647
334 HA LYS 44 HA LYS 44 6.727 1.624 3.950
335 HB2 LYS 44 HB2 LYS 44 8.040 3.651 4.611
336 HB3 LYS 44 HB3 LYS 44 6.652 3.300 5.627
337 HG2 LYS 44 HG2 LYS 44 8.114 2.360 7.336
338 HG3 LYS 44 HG3 LYS 44 9.521 2.659 6.309
339 HD2 LYS 44 HD2 LYS 44 9.185 5.037 6.428
340 HD3 LYS 44 HD3 LYS 44 7.636 4.829 7.247
341 HE2 LYS 44 HE2 LYS 44 8.790 3.881 9.188
342 HE3 LYS 44 HE3 LYS 44 10.339 4.067 8.364
343 HZ1 LYS 44 HZ1 LYS 44 10.088 6.428 8.384
344 HZ2 LYS 44 HZ2 LYS 44 9.824 5.870 9.958
345 HZ3 LYS 44 HZ3 LYS 44 8.512 6.321 8.990
346 H ASP 45 H ASP 45 9.292 -0.189 5.333
347 HA ASP 45 HA ASP 45 11.308 0.739 3.481
348 HB2 ASP 45 HB2 ASP 45 12.718 -1.037 4.418
349 HB3 ASP 45 HB3 ASP 45 11.981 -0.065 5.685
350 H GLN 46 H GLN 46 8.683 -1.356 3.230
351 HA GLN 46 HA GLN 46 9.865 -3.090 1.207
352 HB2 GLN 46 HB2 GLN 46 7.026 -2.951 2.253
353 HB3 GLN 46 HB3 GLN 46 7.655 -4.184 1.168
354 HG2 GLN 46 HG2 GLN 46 8.750 -3.699 3.929
355 HG3 GLN 46 HG3 GLN 46 7.452 -4.839 3.590
356 HE21 GLN 46 HE21 GLN 46 8.668 -6.589 4.300
357 HE22 GLN 46 HE22 GLN 46 9.984 -7.228 3.386
358 H VAL 47 H VAL 47 7.937 -0.183 1.305
359 HA VAL 47 HA VAL 47 6.706 -0.581 -1.264
360 HB VAL 47 HB VAL 47 5.521 0.727 0.383
361 HG11 VAL 47 HG11 VAL 47 7.783 2.721 0.204
362 HG12 VAL 47 HG12 VAL 47 7.412 1.687 1.584
363 HG13 VAL 47 HG13 VAL 47 6.275 2.943 1.094
364 HG21 VAL 47 HG21 VAL 47 6.384 2.442 -1.953
365 HG22 VAL 47 HG22 VAL 47 4.933 2.682 -0.977
366 HG23 VAL 47 HG23 VAL 47 5.100 1.232 -1.968
367 H ARG 48 H ARG 48 7.684 -0.391 -3.145
368 HA ARG 48 HA ARG 48 10.122 1.129 -3.499
369 HB2 ARG 48 HB2 ARG 48 9.832 -1.036 -4.616
370 HB3 ARG 48 HB3 ARG 48 8.449 -0.407 -5.503
371 HG2 ARG 48 HG2 ARG 48 9.928 1.211 -6.625
372 HG3 ARG 48 HG3 ARG 48 11.305 0.535 -5.754
373 HD2 ARG 48 HD2 ARG 48 10.952 -1.626 -6.817
374 HD3 ARG 48 HD3 ARG 48 9.515 -1.012 -7.635
375 HE ARG 48 HE ARG 48 12.074 0.300 -8.162
376 HH11 ARG 48 HH11 ARG 48 9.578 -1.805 -9.234
377 HH12 ARG 48 HH12 ARG 48 10.023 -1.683 -10.897
378 HH21 ARG 48 HH21 ARG 48 12.663 0.435 -10.298
379 HH22 ARG 48 HH22 ARG 48 11.758 -0.430 -11.492
380 H THR 49 H THR 49 6.947 1.191 -5.163
381 HA THR 49 HA THR 49 7.116 4.123 -5.368
382 HB THR 49 HB THR 49 6.405 4.083 -7.746
383 HG1 THR 49 HG1 THR 49 5.580 1.892 -7.722
384 HG21 THR 49 HG21 THR 49 8.773 4.404 -7.249
385 HG22 THR 49 HG22 THR 49 8.571 3.474 -8.734
386 HG23 THR 49 HG23 THR 49 9.022 2.658 -7.239
387 H VAL 50 H VAL 50 5.152 5.174 -5.361
388 HA VAL 50 HA VAL 50 2.717 3.490 -5.238
389 HB VAL 50 HB VAL 50 3.169 6.212 -3.976
390 HG11 VAL 50 HG11 VAL 50 0.797 4.345 -3.791
391 HG12 VAL 50 HG12 VAL 50 0.842 5.900 -4.626
392 HG13 VAL 50 HG13 VAL 50 1.004 5.837 -2.871
393 HG21 VAL 50 HG21 VAL 50 3.110 5.024 -1.831
394 HG22 VAL 50 HG22 VAL 50 4.443 4.464 -2.841
395 HG23 VAL 50 HG23 VAL 50 2.984 3.485 -2.684
396 H LYS 51 H LYS 51 1.304 3.727 -6.881
397 HA LYS 51 HA LYS 51 1.062 6.339 -8.212
398 HB2 LYS 51 HB2 LYS 51 1.489 3.702 -9.631
399 HB3 LYS 51 HB3 LYS 51 0.898 5.152 -10.434
400 HG2 LYS 51 HG2 LYS 51 2.988 6.311 -9.717
401 HG3 LYS 51 HG3 LYS 51 3.579 4.761 -9.117
402 HD2 LYS 51 HD2 LYS 51 3.512 3.818 -11.334
403 HD3 LYS 51 HD3 LYS 51 2.732 5.269 -11.972
404 HE2 LYS 51 HE2 LYS 51 5.520 5.107 -10.817
405 HE3 LYS 51 HE3 LYS 51 5.108 5.248 -12.525
406 HZ1 LYS 51 HZ1 LYS 51 5.706 7.388 -11.635
407 HZ2 LYS 51 HZ2 LYS 51 4.540 7.263 -10.418
408 HZ3 LYS 51 HZ3 LYS 51 4.060 7.391 -12.032
409 H ASP 52 H ASP 52 -0.933 6.677 -9.342
410 HA ASP 52 HA ASP 52 -3.165 5.256 -8.134
411 HB2 ASP 52 HB2 ASP 52 -3.156 7.650 -9.992
412 HB3 ASP 52 HB3 ASP 52 -4.550 7.029 -9.114
413 H LEU 53 H LEU 53 -4.790 4.184 -9.270
414 HA LEU 53 HA LEU 53 -4.093 3.143 -11.889
415 HB2 LEU 53 HB2 LEU 53 -6.449 2.593 -10.075
416 HB3 LEU 53 HB3 LEU 53 -6.189 1.797 -11.618
417 HG LEU 53 HG LEU 53 -4.341 1.618 -9.224
418 HD11 LEU 53 HD11 LEU 53 -6.251 -0.409 -10.389
419 HD12 LEU 53 HD12 LEU 53 -6.411 0.409 -8.834
420 HD13 LEU 53 HD13 LEU 53 -5.084 -0.717 -9.105
421 HD21 LEU 53 HD21 LEU 53 -3.200 -0.132 -10.532
422 HD22 LEU 53 HD22 LEU 53 -3.102 1.450 -11.307
423 HD23 LEU 53 HD23 LEU 53 -4.236 0.241 -11.912
424 H LEU 54 H LEU 54 -5.622 5.877 -10.811
425 HA LEU 54 HA LEU 54 -7.074 6.192 -13.368
426 HB2 LEU 54 HB2 LEU 54 -7.681 7.462 -10.688
427 HB3 LEU 54 HB3 LEU 54 -8.465 7.910 -12.191
428 HG LEU 54 HG LEU 54 -8.644 5.212 -10.832
429 HD11 LEU 54 HD11 LEU 54 -10.725 7.372 -11.202
430 HD12 LEU 54 HD12 LEU 54 -9.895 6.990 -9.692
431 HD13 LEU 54 HD13 LEU 54 -10.968 5.803 -10.430
432 HD21 LEU 54 HD21 LEU 54 -8.711 4.980 -13.262
433 HD22 LEU 54 HD22 LEU 54 -9.975 6.209 -13.357
434 HD23 LEU 54 HD23 LEU 54 -10.297 4.670 -12.556
435 H GLU 55 H GLU 55 -4.820 6.789 -14.070
436 HA GLU 55 HA GLU 55 -3.846 9.394 -13.214
437 HB2 GLU 55 HB2 GLU 55 -2.829 7.416 -15.268
438 HB3 GLU 55 HB3 GLU 55 -2.059 8.964 -14.953
439 HG2 GLU 55 HG2 GLU 55 -2.480 6.859 -12.838
440 HG3 GLU 55 HG3 GLU 55 -1.021 6.982 -13.816
Start of MODEL 12
1 H1 MET 1 H1 MET 1 -12.057 11.912 -2.375
2 H2 MET 1 H2 MET 1 -10.825 11.141 -3.240
3 H3 MET 1 H3 MET 1 -10.864 11.043 -1.551
4 HA MET 1 HA MET 1 -12.872 9.773 -1.592
5 HB2 MET 1 HB2 MET 1 -13.866 9.046 -3.712
6 HB3 MET 1 HB3 MET 1 -13.858 10.799 -3.592
7 HG2 MET 1 HG2 MET 1 -11.975 10.937 -5.096
8 HG3 MET 1 HG3 MET 1 -11.840 9.180 -5.138
9 HE1 MET 1 HE1 MET 1 -15.405 11.519 -6.926
10 HE2 MET 1 HE2 MET 1 -14.062 12.274 -6.068
11 HE3 MET 1 HE3 MET 1 -15.217 11.267 -5.192
12 H ALA 2 H ALA 2 -13.039 7.414 -2.688
13 HA ALA 2 HA ALA 2 -10.376 6.261 -2.361
14 HB1 ALA 2 HB1 ALA 2 -11.519 4.129 -2.138
15 HB2 ALA 2 HB2 ALA 2 -13.053 4.879 -2.581
16 HB3 ALA 2 HB3 ALA 2 -12.252 5.330 -1.077
17 H SER 3 H SER 3 -9.198 6.282 -4.196
18 HA SER 3 HA SER 3 -10.443 5.255 -6.675
19 HB2 SER 3 HB2 SER 3 -8.081 7.132 -6.367
20 HB3 SER 3 HB3 SER 3 -8.653 6.481 -7.902
21 HG SER 3 HG SER 3 -10.715 7.498 -7.373
22 HA PRO 4 HA PRO 4 -7.987 1.571 -6.170
23 HB2 PRO 4 HB2 PRO 4 -7.697 1.100 -8.939
24 HB3 PRO 4 HB3 PRO 4 -8.959 0.456 -7.886
25 HG2 PRO 4 HG2 PRO 4 -9.025 2.826 -9.698
26 HG3 PRO 4 HG3 PRO 4 -10.315 1.671 -9.310
27 HD2 PRO 4 HD2 PRO 4 -10.310 4.126 -8.254
28 HD3 PRO 4 HD3 PRO 4 -10.810 2.725 -7.281
29 H THR 5 H THR 5 -5.922 1.712 -5.575
30 HA THR 5 HA THR 5 -3.973 3.097 -7.328
31 HB THR 5 HB THR 5 -4.053 3.051 -4.296
32 HG1 THR 5 HG1 THR 5 -5.466 4.560 -5.475
33 HG21 THR 5 HG21 THR 5 -1.738 2.929 -5.099
34 HG22 THR 5 HG22 THR 5 -2.079 4.505 -4.380
35 HG23 THR 5 HG23 THR 5 -2.019 4.330 -6.132
36 H VAL 6 H VAL 6 -2.169 1.954 -7.880
37 HA VAL 6 HA VAL 6 -1.790 -0.679 -6.631
38 HB VAL 6 HB VAL 6 -1.952 -0.637 -9.095
39 HG11 VAL 6 HG11 VAL 6 0.611 0.957 -8.990
40 HG12 VAL 6 HG12 VAL 6 -0.961 1.551 -9.528
41 HG13 VAL 6 HG13 VAL 6 -0.130 0.293 -10.446
42 HG21 VAL 6 HG21 VAL 6 0.784 -1.449 -8.086
43 HG22 VAL 6 HG22 VAL 6 0.010 -2.028 -9.562
44 HG23 VAL 6 HG23 VAL 6 -0.683 -2.424 -7.989
45 H ILE 7 H ILE 7 -0.059 -1.173 -5.425
46 HA ILE 7 HA ILE 7 2.027 0.884 -5.053
47 HB ILE 7 HB ILE 7 1.117 -1.274 -3.126
48 HG12 ILE 7 HG12 ILE 7 0.728 1.738 -3.033
49 HG13 ILE 7 HG13 ILE 7 -0.522 0.554 -3.399
50 HG21 ILE 7 HG21 ILE 7 2.594 -0.176 -1.494
51 HG22 ILE 7 HG22 ILE 7 3.156 0.931 -2.747
52 HG23 ILE 7 HG23 ILE 7 3.499 -0.794 -2.874
53 HD11 ILE 7 HD11 ILE 7 0.950 0.831 -0.790
54 HD12 ILE 7 HD12 ILE 7 -0.284 -0.377 -1.148
55 HD13 ILE 7 HD13 ILE 7 -0.707 1.335 -1.118
56 H THR 8 H THR 8 3.786 0.339 -6.232
57 HA THR 8 HA THR 8 4.557 -2.432 -6.640
58 HB THR 8 HB THR 8 6.104 0.063 -7.403
59 HG1 THR 8 HG1 THR 8 4.363 -1.472 -9.072
60 HG21 THR 8 HG21 THR 8 7.170 -1.416 -9.063
61 HG22 THR 8 HG22 THR 8 6.263 -2.785 -8.418
62 HG23 THR 8 HG23 THR 8 7.462 -1.970 -7.415
63 H LEU 9 H LEU 9 5.726 -3.528 -5.190
64 HA LEU 9 HA LEU 9 7.124 -2.140 -3.054
65 HB2 LEU 9 HB2 LEU 9 6.853 -5.108 -3.564
66 HB3 LEU 9 HB3 LEU 9 7.434 -4.358 -2.087
67 HG LEU 9 HG LEU 9 4.623 -4.180 -3.188
68 HD11 LEU 9 HD11 LEU 9 5.141 -6.366 -2.246
69 HD12 LEU 9 HD12 LEU 9 4.008 -5.489 -1.218
70 HD13 LEU 9 HD13 LEU 9 5.706 -5.606 -0.757
71 HD21 LEU 9 HD21 LEU 9 5.772 -3.022 -0.643
72 HD22 LEU 9 HD22 LEU 9 4.075 -2.992 -1.126
73 HD23 LEU 9 HD23 LEU 9 5.274 -2.106 -2.066
74 H ASN 10 H ASN 10 9.336 -2.547 -2.488
75 HA ASN 10 HA ASN 10 11.175 -2.451 -4.619
76 HB2 ASN 10 HB2 ASN 10 11.600 -1.500 -2.373
77 HB3 ASN 10 HB3 ASN 10 11.700 -3.127 -1.709
78 HD21 ASN 10 HD21 ASN 10 13.270 -0.745 -3.704
79 HD22 ASN 10 HD22 ASN 10 14.812 -1.518 -3.752
80 H ASP 11 H ASP 11 9.757 -5.128 -2.966
81 HA ASP 11 HA ASP 11 11.692 -7.092 -3.795
82 HB2 ASP 11 HB2 ASP 11 8.898 -7.403 -2.670
83 HB3 ASP 11 HB3 ASP 11 10.054 -8.714 -2.891
84 H GLY 12 H GLY 12 9.395 -5.412 -5.513
85 HA2 GLY 12 HA2 GLY 12 9.175 -5.724 -7.869
86 HA3 GLY 12 HA3 GLY 12 9.403 -7.448 -7.642
87 H ARG 13 H ARG 13 7.470 -7.446 -5.379
88 HA ARG 13 HA ARG 13 5.142 -8.127 -6.844
89 HB2 ARG 13 HB2 ARG 13 5.644 -9.231 -4.748
90 HB3 ARG 13 HB3 ARG 13 5.569 -7.706 -3.875
91 HG2 ARG 13 HG2 ARG 13 3.171 -7.537 -4.403
92 HG3 ARG 13 HG3 ARG 13 3.259 -9.085 -5.244
93 HD2 ARG 13 HD2 ARG 13 3.918 -10.181 -3.150
94 HD3 ARG 13 HD3 ARG 13 3.833 -8.631 -2.311
95 HE ARG 13 HE ARG 13 1.366 -8.894 -3.403
96 HH11 ARG 13 HH11 ARG 13 3.272 -10.892 -1.353
97 HH12 ARG 13 HH12 ARG 13 1.899 -11.655 -0.635
98 HH21 ARG 13 HH21 ARG 13 -0.388 -9.849 -2.460
99 HH22 ARG 13 HH22 ARG 13 -0.161 -11.070 -1.260
100 H GLU 14 H GLU 14 3.307 -6.997 -7.326
101 HA GLU 14 HA GLU 14 3.074 -4.243 -6.266
102 HB2 GLU 14 HB2 GLU 14 1.881 -5.395 -8.804
103 HB3 GLU 14 HB3 GLU 14 1.696 -3.738 -8.243
104 HG2 GLU 14 HG2 GLU 14 4.162 -3.463 -8.426
105 HG3 GLU 14 HG3 GLU 14 4.244 -5.074 -9.132
106 H ILE 15 H ILE 15 1.370 -3.761 -5.002
107 HA ILE 15 HA ILE 15 -0.806 -5.747 -4.779
108 HB ILE 15 HB ILE 15 0.004 -3.673 -2.723
109 HG12 ILE 15 HG12 ILE 15 0.573 -6.656 -2.768
110 HG13 ILE 15 HG13 ILE 15 1.766 -5.393 -3.049
111 HG21 ILE 15 HG21 ILE 15 -1.903 -6.019 -2.569
112 HG22 ILE 15 HG22 ILE 15 -2.339 -4.310 -2.556
113 HG23 ILE 15 HG23 ILE 15 -1.434 -5.000 -1.208
114 HD11 ILE 15 HD11 ILE 15 0.256 -5.869 -0.487
115 HD12 ILE 15 HD12 ILE 15 1.426 -4.578 -0.764
116 HD13 ILE 15 HD13 ILE 15 1.945 -6.262 -0.803
117 H GLN 16 H GLN 16 -2.828 -5.167 -5.330
118 HA GLN 16 HA GLN 16 -3.294 -2.402 -6.178
119 HB2 GLN 16 HB2 GLN 16 -4.748 -4.985 -6.731
120 HB3 GLN 16 HB3 GLN 16 -5.385 -3.417 -7.207
121 HG2 GLN 16 HG2 GLN 16 -3.524 -3.031 -8.666
122 HG3 GLN 16 HG3 GLN 16 -2.704 -4.478 -8.078
123 HE21 GLN 16 HE21 GLN 16 -3.704 -3.627 -10.783
124 HE22 GLN 16 HE22 GLN 16 -4.648 -4.965 -11.324
125 H ALA 17 H ALA 17 -4.281 -1.052 -4.871
126 HA ALA 17 HA ALA 17 -6.254 -2.041 -2.911
127 HB1 ALA 17 HB1 ALA 17 -4.656 0.524 -2.872
128 HB2 ALA 17 HB2 ALA 17 -4.305 -0.922 -1.926
129 HB3 ALA 17 HB3 ALA 17 -5.788 -0.013 -1.631
130 H VAL 18 H VAL 18 -8.017 -0.394 -2.403
131 HA VAL 18 HA VAL 18 -9.072 0.700 -4.922
132 HB VAL 18 HB VAL 18 -11.279 0.700 -3.816
133 HG11 VAL 18 HG11 VAL 18 -10.592 -1.247 -5.116
134 HG12 VAL 18 HG12 VAL 18 -11.594 -1.733 -3.748
135 HG13 VAL 18 HG13 VAL 18 -9.846 -1.959 -3.684
136 HG21 VAL 18 HG21 VAL 18 -10.537 1.028 -1.506
137 HG22 VAL 18 HG22 VAL 18 -9.828 -0.587 -1.494
138 HG23 VAL 18 HG23 VAL 18 -11.574 -0.392 -1.639
139 H ASP 19 H ASP 19 -7.512 1.776 -2.171
140 HA ASP 19 HA ASP 19 -8.443 4.511 -2.671
141 HB2 ASP 19 HB2 ASP 19 -8.330 4.932 -0.159
142 HB3 ASP 19 HB3 ASP 19 -9.706 4.009 -0.748
143 H THR 20 H THR 20 -6.989 6.105 -1.368
144 HA THR 20 HA THR 20 -4.287 5.643 -2.276
145 HB THR 20 HB THR 20 -3.864 7.967 -1.500
146 HG1 THR 20 HG1 THR 20 -5.469 7.847 0.251
147 HG21 THR 20 HG21 THR 20 -4.752 7.576 -3.766
148 HG22 THR 20 HG22 THR 20 -5.350 9.092 -3.092
149 HG23 THR 20 HG23 THR 20 -6.397 7.674 -3.135
150 HA PRO 21 HA PRO 21 -2.991 3.814 1.592
151 HB2 PRO 21 HB2 PRO 21 -0.280 3.940 1.135
152 HB3 PRO 21 HB3 PRO 21 -1.349 2.706 0.459
153 HG2 PRO 21 HG2 PRO 21 -0.335 5.232 -0.805
154 HG3 PRO 21 HG3 PRO 21 -0.446 3.602 -1.499
155 HD2 PRO 21 HD2 PRO 21 -2.271 5.481 -2.074
156 HD3 PRO 21 HD3 PRO 21 -2.744 3.781 -1.864
157 H LYS 22 H LYS 22 -2.865 4.715 3.529
158 HA LYS 22 HA LYS 22 -1.806 7.420 3.902
159 HB2 LYS 22 HB2 LYS 22 -3.980 6.707 4.916
160 HB3 LYS 22 HB3 LYS 22 -3.103 5.540 5.898
161 HG2 LYS 22 HG2 LYS 22 -1.778 7.557 6.775
162 HG3 LYS 22 HG3 LYS 22 -3.057 8.542 6.060
163 HD2 LYS 22 HD2 LYS 22 -3.330 6.446 8.216
164 HD3 LYS 22 HD3 LYS 22 -3.595 8.182 8.369
165 HE2 LYS 22 HE2 LYS 22 -5.584 8.082 7.071
166 HE3 LYS 22 HE3 LYS 22 -5.236 6.437 6.536
167 HZ1 LYS 22 HZ1 LYS 22 -5.529 5.671 8.805
168 HZ2 LYS 22 HZ2 LYS 22 -6.921 6.472 8.267
169 HZ3 LYS 22 HZ3 LYS 22 -5.854 7.247 9.322
170 H TYR 23 H TYR 23 0.079 7.884 5.100
171 HA TYR 23 HA TYR 23 1.603 5.568 6.103
172 HB2 TYR 23 HB2 TYR 23 2.825 7.036 4.586
173 HB3 TYR 23 HB3 TYR 23 2.486 8.422 5.615
174 HD1 TYR 23 HD1 TYR 23 3.865 4.970 6.108
175 HD2 TYR 23 HD2 TYR 23 4.325 9.140 6.833
176 HE1 TYR 23 HE1 TYR 23 5.933 4.520 7.350
177 HE2 TYR 23 HE2 TYR 23 6.400 8.700 8.076
178 HH TYR 23 HH TYR 23 7.552 6.959 9.197
179 H ASP 24 H ASP 24 1.826 5.178 8.219
180 HA ASP 24 HA ASP 24 1.370 7.374 10.136
181 HB2 ASP 24 HB2 ASP 24 -0.658 6.059 10.141
182 HB3 ASP 24 HB3 ASP 24 0.259 4.562 10.291
183 H GLU 25 H GLU 25 3.191 7.694 11.265
184 HA GLU 25 HA GLU 25 5.296 5.767 11.412
185 HB2 GLU 25 HB2 GLU 25 5.744 8.184 11.411
186 HB3 GLU 25 HB3 GLU 25 4.921 8.345 12.958
187 HG2 GLU 25 HG2 GLU 25 6.617 6.888 13.992
188 HG3 GLU 25 HG3 GLU 25 7.454 6.788 12.445
189 H GLU 26 H GLU 26 2.674 6.665 13.569
190 HA GLU 26 HA GLU 26 3.604 5.674 15.997
191 HB2 GLU 26 HB2 GLU 26 0.757 5.623 14.966
192 HB3 GLU 26 HB3 GLU 26 1.236 5.459 16.649
193 HG2 GLU 26 HG2 GLU 26 1.630 7.890 14.911
194 HG3 GLU 26 HG3 GLU 26 0.437 7.701 16.192
195 H SER 27 H SER 27 1.993 3.930 13.362
196 HA SER 27 HA SER 27 2.540 1.371 14.693
197 HB2 SER 27 HB2 SER 27 1.250 0.363 12.856
198 HB3 SER 27 HB3 SER 27 0.334 1.661 13.619
199 HG SER 27 HG SER 27 0.590 2.910 11.875
200 H GLY 28 H GLY 28 3.684 3.392 12.096
201 HA2 GLY 28 HA2 GLY 28 5.783 3.278 11.068
202 HA3 GLY 28 HA3 GLY 28 5.999 1.664 11.725
203 H PHE 29 H PHE 29 2.990 2.103 10.173
204 HA PHE 29 HA PHE 29 4.006 0.672 7.787
205 HB2 PHE 29 HB2 PHE 29 1.396 0.191 9.243
206 HB3 PHE 29 HB3 PHE 29 1.925 -0.641 7.789
207 HD1 PHE 29 HD1 PHE 29 4.091 -2.024 7.948
208 HD2 PHE 29 HD2 PHE 29 1.919 -0.658 11.348
209 HE1 PHE 29 HE1 PHE 29 5.166 -3.753 9.324
210 HE2 PHE 29 HE2 PHE 29 2.998 -2.385 12.730
211 HZ PHE 29 HZ PHE 29 4.623 -3.936 11.718
212 H TYR 30 H TYR 30 2.443 0.671 5.945
213 HA TYR 30 HA TYR 30 0.969 3.203 5.670
214 HB2 TYR 30 HB2 TYR 30 2.062 1.221 3.674
215 HB3 TYR 30 HB3 TYR 30 0.802 2.355 3.206
216 HD1 TYR 30 HD1 TYR 30 4.294 2.113 4.446
217 HD2 TYR 30 HD2 TYR 30 1.318 4.616 2.709
218 HE1 TYR 30 HE1 TYR 30 6.001 3.823 3.986
219 HE2 TYR 30 HE2 TYR 30 3.017 6.328 2.247
220 HH TYR 30 HH TYR 30 5.212 7.019 3.069
221 H GLU 31 H GLU 31 -1.228 3.238 5.558
222 HA GLU 31 HA GLU 31 -2.662 0.690 5.830
223 HB2 GLU 31 HB2 GLU 31 -3.708 3.510 6.208
224 HB3 GLU 31 HB3 GLU 31 -4.544 2.020 6.622
225 HG2 GLU 31 HG2 GLU 31 -2.734 1.551 8.279
226 HG3 GLU 31 HG3 GLU 31 -2.078 3.151 7.933
227 H PHE 32 H PHE 32 -3.622 -0.170 4.084
228 HA PHE 32 HA PHE 32 -5.029 1.557 2.194
229 HB2 PHE 32 HB2 PHE 32 -3.969 0.504 0.221
230 HB3 PHE 32 HB3 PHE 32 -2.809 1.405 1.193
231 HD1 PHE 32 HD1 PHE 32 -1.276 0.133 2.739
232 HD2 PHE 32 HD2 PHE 32 -3.660 -1.790 -0.226
233 HE1 PHE 32 HE1 PHE 32 0.164 -1.855 2.870
234 HE2 PHE 32 HE2 PHE 32 -2.222 -3.777 -0.095
235 HZ PHE 32 HZ PHE 32 -0.308 -3.813 1.449
236 H LYS 33 H LYS 33 -6.700 0.533 1.066
237 HA LYS 33 HA LYS 33 -7.467 -2.083 2.180
238 HB2 LYS 33 HB2 LYS 33 -9.022 -0.194 2.469
239 HB3 LYS 33 HB3 LYS 33 -9.134 -0.023 0.720
240 HG2 LYS 33 HG2 LYS 33 -10.099 -2.295 0.587
241 HG3 LYS 33 HG3 LYS 33 -10.040 -2.399 2.349
242 HD2 LYS 33 HD2 LYS 33 -11.615 -0.391 0.727
243 HD3 LYS 33 HD3 LYS 33 -12.275 -1.776 1.600
244 HE2 LYS 33 HE2 LYS 33 -11.628 -0.824 3.714
245 HE3 LYS 33 HE3 LYS 33 -10.759 0.485 2.912
246 HZ1 LYS 33 HZ1 LYS 33 -12.911 1.210 3.719
247 HZ2 LYS 33 HZ2 LYS 33 -13.690 0.033 2.789
248 HZ3 LYS 33 HZ3 LYS 33 -12.853 1.292 2.032
249 H GLN 34 H GLN 34 -7.031 -3.797 0.970
250 HA GLN 34 HA GLN 34 -6.275 -3.800 -1.729
251 HB2 GLN 34 HB2 GLN 34 -7.376 -6.034 -0.008
252 HB3 GLN 34 HB3 GLN 34 -6.619 -6.274 -1.577
253 HG2 GLN 34 HG2 GLN 34 -4.510 -5.522 -0.763
254 HG3 GLN 34 HG3 GLN 34 -5.228 -4.961 0.746
255 HE21 GLN 34 HE21 GLN 34 -5.751 -6.449 2.339
256 HE22 GLN 34 HE22 GLN 34 -5.165 -8.076 2.306
257 H LEU 35 H LEU 35 -7.375 -4.987 -3.527
258 HA LEU 35 HA LEU 35 -9.801 -3.856 -4.258
259 HB2 LEU 35 HB2 LEU 35 -8.679 -6.500 -5.205
260 HB3 LEU 35 HB3 LEU 35 -9.934 -5.583 -6.014
261 HG LEU 35 HG LEU 35 -7.041 -4.762 -5.681
262 HD11 LEU 35 HD11 LEU 35 -7.371 -6.503 -7.345
263 HD12 LEU 35 HD12 LEU 35 -6.966 -4.974 -8.122
264 HD13 LEU 35 HD13 LEU 35 -8.634 -5.549 -8.124
265 HD21 LEU 35 HD21 LEU 35 -7.625 -2.845 -7.125
266 HD22 LEU 35 HD22 LEU 35 -8.441 -2.786 -5.562
267 HD23 LEU 35 HD23 LEU 35 -9.329 -3.289 -7.000
268 H ASP 36 H ASP 36 -9.218 -6.807 -2.456
269 HA ASP 36 HA ASP 36 -11.867 -7.865 -2.651
270 HB2 ASP 36 HB2 ASP 36 -9.728 -8.433 -0.584
271 HB3 ASP 36 HB3 ASP 36 -11.137 -9.434 -0.925
272 H GLY 37 H GLY 37 -10.963 -5.078 -1.186
273 HA2 GLY 37 HA2 GLY 37 -12.054 -3.733 0.358
274 HA3 GLY 37 HA3 GLY 37 -13.199 -5.038 0.633
275 H LYS 38 H LYS 38 -9.791 -5.624 0.888
276 HA LYS 38 HA LYS 38 -10.076 -6.018 3.796
277 HB2 LYS 38 HB2 LYS 38 -8.093 -7.219 1.846
278 HB3 LYS 38 HB3 LYS 38 -8.138 -7.547 3.573
279 HG2 LYS 38 HG2 LYS 38 -10.353 -8.543 3.344
280 HG3 LYS 38 HG3 LYS 38 -10.346 -8.180 1.618
281 HD2 LYS 38 HD2 LYS 38 -9.775 -10.523 2.026
282 HD3 LYS 38 HD3 LYS 38 -8.417 -9.659 1.307
283 HE2 LYS 38 HE2 LYS 38 -7.331 -9.487 3.467
284 HE3 LYS 38 HE3 LYS 38 -8.730 -10.208 4.262
285 HZ1 LYS 38 HZ1 LYS 38 -7.014 -11.576 2.258
286 HZ2 LYS 38 HZ2 LYS 38 -8.318 -12.259 3.088
287 HZ3 LYS 38 HZ3 LYS 38 -6.925 -11.798 3.927
288 H GLN 39 H GLN 39 -9.368 -4.277 4.876
289 HA GLN 39 HA GLN 39 -7.299 -2.557 3.812
290 HB2 GLN 39 HB2 GLN 39 -9.348 -1.741 5.038
291 HB3 GLN 39 HB3 GLN 39 -8.657 -2.402 6.514
292 HG2 GLN 39 HG2 GLN 39 -6.750 -0.892 6.313
293 HG3 GLN 39 HG3 GLN 39 -7.401 -0.253 4.804
294 HE21 GLN 39 HE21 GLN 39 -7.605 1.835 5.553
295 HE22 GLN 39 HE22 GLN 39 -8.754 2.294 6.758
296 H THR 40 H THR 40 -5.216 -3.086 4.019
297 HA THR 40 HA THR 40 -4.296 -4.412 6.500
298 HB THR 40 HB THR 40 -4.276 -6.076 4.737
299 HG1 THR 40 HG1 THR 40 -2.254 -6.747 5.145
300 HG21 THR 40 HG21 THR 40 -4.167 -4.587 2.788
301 HG22 THR 40 HG22 THR 40 -2.905 -5.818 2.720
302 HG23 THR 40 HG23 THR 40 -2.503 -4.169 3.197
303 H ARG 41 H ARG 41 -1.859 -4.254 6.765
304 HA ARG 41 HA ARG 41 -0.925 -1.555 6.006
305 HB2 ARG 41 HB2 ARG 41 -0.755 -2.887 8.721
306 HB3 ARG 41 HB3 ARG 41 0.066 -1.389 8.302
307 HG2 ARG 41 HG2 ARG 41 -2.023 -0.248 7.998
308 HG3 ARG 41 HG3 ARG 41 -2.924 -1.754 8.173
309 HD2 ARG 41 HD2 ARG 41 -2.247 -1.937 10.494
310 HD3 ARG 41 HD3 ARG 41 -1.217 -0.513 10.337
311 HE ARG 41 HE ARG 41 -3.347 0.735 9.899
312 HH11 ARG 41 HH11 ARG 41 -3.431 -2.214 11.696
313 HH12 ARG 41 HH12 ARG 41 -4.811 -1.717 12.615
314 HH21 ARG 41 HH21 ARG 41 -5.095 1.333 11.069
315 HH22 ARG 41 HH22 ARG 41 -5.729 0.267 12.282
316 H ILE 42 H ILE 42 1.056 -1.528 5.082
317 HA ILE 42 HA ILE 42 2.843 -3.851 5.516
318 HB ILE 42 HB ILE 42 1.908 -3.648 3.193
319 HG12 ILE 42 HG12 ILE 42 4.920 -3.336 3.427
320 HG13 ILE 42 HG13 ILE 42 4.034 -4.838 3.677
321 HG21 ILE 42 HG21 ILE 42 1.875 -1.204 3.025
322 HG22 ILE 42 HG22 ILE 42 2.803 -1.917 1.707
323 HG23 ILE 42 HG23 ILE 42 3.639 -1.170 3.068
324 HD11 ILE 42 HD11 ILE 42 4.214 -3.293 1.101
325 HD12 ILE 42 HD12 ILE 42 3.308 -4.787 1.346
326 HD13 ILE 42 HD13 ILE 42 5.065 -4.787 1.493
327 H ASN 43 H ASN 43 5.181 -3.418 5.458
328 HA ASN 43 HA ASN 43 5.803 -1.259 7.178
329 HB2 ASN 43 HB2 ASN 43 6.980 -3.495 7.079
330 HB3 ASN 43 HB3 ASN 43 7.819 -2.909 5.646
331 HD21 ASN 43 HD21 ASN 43 9.821 -3.039 6.687
332 HD22 ASN 43 HD22 ASN 43 10.292 -1.912 7.906
333 H LYS 44 H LYS 44 7.202 0.513 6.889
334 HA LYS 44 HA LYS 44 6.478 2.091 4.687
335 HB2 LYS 44 HB2 LYS 44 8.066 3.761 5.642
336 HB3 LYS 44 HB3 LYS 44 6.921 3.108 6.805
337 HG2 LYS 44 HG2 LYS 44 8.646 1.599 7.669
338 HG3 LYS 44 HG3 LYS 44 9.800 2.248 6.505
339 HD2 LYS 44 HD2 LYS 44 8.398 4.009 8.513
340 HD3 LYS 44 HD3 LYS 44 9.885 3.153 8.906
341 HE2 LYS 44 HE2 LYS 44 10.537 5.329 8.248
342 HE3 LYS 44 HE3 LYS 44 10.925 4.277 6.892
343 HZ1 LYS 44 HZ1 LYS 44 8.475 5.944 7.070
344 HZ2 LYS 44 HZ2 LYS 44 8.993 5.044 5.732
345 HZ3 LYS 44 HZ3 LYS 44 9.877 6.391 6.241
346 H ASP 45 H ASP 45 9.409 0.158 5.131
347 HA ASP 45 HA ASP 45 10.817 1.618 3.052
348 HB2 ASP 45 HB2 ASP 45 12.686 0.109 3.506
349 HB3 ASP 45 HB3 ASP 45 12.059 0.803 4.997
350 H GLN 46 H GLN 46 8.631 -0.951 3.112
351 HA GLN 46 HA GLN 46 9.695 -2.491 0.936
352 HB2 GLN 46 HB2 GLN 46 6.968 -2.466 2.239
353 HB3 GLN 46 HB3 GLN 46 7.448 -3.608 0.989
354 HG2 GLN 46 HG2 GLN 46 8.769 -3.312 3.687
355 HG3 GLN 46 HG3 GLN 46 7.602 -4.558 3.247
356 HE21 GLN 46 HE21 GLN 46 8.234 -6.211 1.851
357 HE22 GLN 46 HE22 GLN 46 9.888 -6.523 1.480
358 H VAL 47 H VAL 47 7.576 0.271 1.169
359 HA VAL 47 HA VAL 47 6.352 -0.076 -1.411
360 HB VAL 47 HB VAL 47 5.119 1.082 0.332
361 HG11 VAL 47 HG11 VAL 47 6.985 2.080 1.547
362 HG12 VAL 47 HG12 VAL 47 5.765 3.290 1.155
363 HG13 VAL 47 HG13 VAL 47 7.259 3.211 0.221
364 HG21 VAL 47 HG21 VAL 47 5.846 2.949 -1.937
365 HG22 VAL 47 HG22 VAL 47 4.413 3.084 -0.915
366 HG23 VAL 47 HG23 VAL 47 4.612 1.690 -1.976
367 H ARG 48 H ARG 48 7.471 0.175 -3.258
368 HA ARG 48 HA ARG 48 9.669 2.055 -3.468
369 HB2 ARG 48 HB2 ARG 48 9.718 -0.123 -4.669
370 HB3 ARG 48 HB3 ARG 48 8.361 0.411 -5.653
371 HG2 ARG 48 HG2 ARG 48 9.782 2.324 -6.436
372 HG3 ARG 48 HG3 ARG 48 11.137 1.587 -5.582
373 HD2 ARG 48 HD2 ARG 48 10.857 -0.449 -6.966
374 HD3 ARG 48 HD3 ARG 48 9.560 0.356 -7.851
375 HE ARG 48 HE ARG 48 12.272 1.502 -7.791
376 HH11 ARG 48 HH11 ARG 48 9.616 0.229 -9.599
377 HH12 ARG 48 HH12 ARG 48 10.296 0.699 -11.116
378 HH21 ARG 48 HH21 ARG 48 13.106 2.100 -9.727
379 HH22 ARG 48 HH22 ARG 48 12.242 1.756 -11.189
380 H THR 49 H THR 49 6.554 1.678 -5.197
381 HA THR 49 HA THR 49 6.511 4.601 -5.659
382 HB THR 49 HB THR 49 5.671 4.279 -7.923
383 HG1 THR 49 HG1 THR 49 5.422 2.223 -8.794
384 HG21 THR 49 HG21 THR 49 8.109 4.386 -7.640
385 HG22 THR 49 HG22 THR 49 7.664 3.356 -9.003
386 HG23 THR 49 HG23 THR 49 8.168 2.632 -7.477
387 H VAL 50 H VAL 50 4.380 5.469 -6.192
388 HA VAL 50 HA VAL 50 2.069 3.782 -5.481
389 HB VAL 50 HB VAL 50 2.530 6.579 -4.389
390 HG11 VAL 50 HG11 VAL 50 0.191 4.705 -3.997
391 HG12 VAL 50 HG12 VAL 50 0.183 6.210 -4.919
392 HG13 VAL 50 HG13 VAL 50 0.423 6.249 -3.173
393 HG21 VAL 50 HG21 VAL 50 2.421 3.924 -2.938
394 HG22 VAL 50 HG22 VAL 50 2.576 5.511 -2.182
395 HG23 VAL 50 HG23 VAL 50 3.867 4.896 -3.212
396 H LYS 51 H LYS 51 0.987 3.727 -7.393
397 HA LYS 51 HA LYS 51 0.275 6.307 -8.637
398 HB2 LYS 51 HB2 LYS 51 1.244 3.830 -10.073
399 HB3 LYS 51 HB3 LYS 51 0.373 5.124 -10.885
400 HG2 LYS 51 HG2 LYS 51 2.171 6.695 -10.104
401 HG3 LYS 51 HG3 LYS 51 3.068 5.280 -9.552
402 HD2 LYS 51 HD2 LYS 51 3.264 4.426 -11.763
403 HD3 LYS 51 HD3 LYS 51 2.085 5.582 -12.388
404 HE2 LYS 51 HE2 LYS 51 4.800 6.285 -11.264
405 HE3 LYS 51 HE3 LYS 51 4.399 6.187 -12.978
406 HZ1 LYS 51 HZ1 LYS 51 3.189 8.071 -11.021
407 HZ2 LYS 51 HZ2 LYS 51 2.798 7.980 -12.665
408 HZ3 LYS 51 HZ3 LYS 51 4.343 8.466 -12.191
409 H ASP 52 H ASP 52 -1.695 6.351 -9.812
410 HA ASP 52 HA ASP 52 -3.747 4.681 -8.675
411 HB2 ASP 52 HB2 ASP 52 -3.935 6.793 -10.844
412 HB3 ASP 52 HB3 ASP 52 -5.295 6.071 -9.990
413 H LEU 53 H LEU 53 -5.295 3.462 -9.939
414 HA LEU 53 HA LEU 53 -4.157 2.168 -12.307
415 HB2 LEU 53 HB2 LEU 53 -6.629 1.556 -10.673
416 HB3 LEU 53 HB3 LEU 53 -6.132 0.642 -12.086
417 HG LEU 53 HG LEU 53 -4.557 0.890 -9.513
418 HD11 LEU 53 HD11 LEU 53 -6.126 -1.427 -10.651
419 HD12 LEU 53 HD12 LEU 53 -6.545 -0.479 -9.224
420 HD13 LEU 53 HD13 LEU 53 -5.099 -1.487 -9.216
421 HD21 LEU 53 HD21 LEU 53 -3.099 -0.828 -10.492
422 HD22 LEU 53 HD22 LEU 53 -3.084 0.659 -11.440
423 HD23 LEU 53 HD23 LEU 53 -4.006 -0.736 -12.002
424 H LEU 54 H LEU 54 -6.005 4.831 -11.694
425 HA LEU 54 HA LEU 54 -7.696 4.536 -14.090
426 HB2 LEU 54 HB2 LEU 54 -7.877 6.524 -11.817
427 HB3 LEU 54 HB3 LEU 54 -8.980 6.437 -13.179
428 HG LEU 54 HG LEU 54 -8.606 4.314 -11.056
429 HD11 LEU 54 HD11 LEU 54 -10.920 6.167 -11.624
430 HD12 LEU 54 HD12 LEU 54 -9.830 6.252 -10.240
431 HD13 LEU 54 HD13 LEU 54 -10.907 4.870 -10.428
432 HD21 LEU 54 HD21 LEU 54 -9.084 3.261 -13.179
433 HD22 LEU 54 HD22 LEU 54 -10.421 4.375 -13.469
434 HD23 LEU 54 HD23 LEU 54 -10.520 3.199 -12.159
435 H GLU 55 H GLU 55 -4.713 5.592 -13.560
436 HA GLU 55 HA GLU 55 -4.929 8.103 -15.056
437 HB2 GLU 55 HB2 GLU 55 -2.418 8.227 -14.610
438 HB3 GLU 55 HB3 GLU 55 -3.485 8.369 -13.223
439 HG2 GLU 55 HG2 GLU 55 -3.005 6.136 -12.524
440 HG3 GLU 55 HG3 GLU 55 -2.134 5.797 -14.019
Start of MODEL 13
1 H1 MET 1 H1 MET 1 -13.518 9.411 0.211
2 H2 MET 1 H2 MET 1 -14.654 8.536 -0.679
3 H3 MET 1 H3 MET 1 -14.763 10.220 -0.596
4 HA MET 1 HA MET 1 -13.883 9.527 -2.723
5 HB2 MET 1 HB2 MET 1 -11.771 10.827 -0.980
6 HB3 MET 1 HB3 MET 1 -11.844 10.902 -2.735
7 HG2 MET 1 HG2 MET 1 -13.959 12.128 -2.591
8 HG3 MET 1 HG3 MET 1 -13.871 12.061 -0.832
9 HE1 MET 1 HE1 MET 1 -10.648 12.451 -0.470
10 HE2 MET 1 HE2 MET 1 -11.853 13.210 0.572
11 HE3 MET 1 HE3 MET 1 -10.594 14.190 -0.178
12 H ALA 2 H ALA 2 -13.592 7.286 -3.021
13 HA ALA 2 HA ALA 2 -11.037 6.146 -2.142
14 HB1 ALA 2 HB1 ALA 2 -11.911 3.999 -2.851
15 HB2 ALA 2 HB2 ALA 2 -13.336 4.779 -3.547
16 HB3 ALA 2 HB3 ALA 2 -13.077 4.808 -1.802
17 H SER 3 H SER 3 -9.565 5.194 -3.621
18 HA SER 3 HA SER 3 -9.859 5.826 -6.462
19 HB2 SER 3 HB2 SER 3 -8.788 7.843 -5.580
20 HB3 SER 3 HB3 SER 3 -7.550 6.870 -4.785
21 HG SER 3 HG SER 3 -6.487 6.886 -6.593
22 HA PRO 4 HA PRO 4 -7.764 1.866 -6.600
23 HB2 PRO 4 HB2 PRO 4 -7.238 1.793 -9.278
24 HB3 PRO 4 HB3 PRO 4 -8.832 1.454 -8.596
25 HG2 PRO 4 HG2 PRO 4 -7.803 3.983 -9.834
26 HG3 PRO 4 HG3 PRO 4 -9.377 3.194 -10.046
27 HD2 PRO 4 HD2 PRO 4 -9.028 5.327 -8.409
28 HD3 PRO 4 HD3 PRO 4 -10.216 4.052 -8.067
29 H THR 5 H THR 5 -5.773 1.772 -5.764
30 HA THR 5 HA THR 5 -3.601 3.331 -7.035
31 HB THR 5 HB THR 5 -4.013 2.819 -4.071
32 HG1 THR 5 HG1 THR 5 -4.488 4.973 -5.774
33 HG21 THR 5 HG21 THR 5 -1.631 2.664 -4.637
34 HG22 THR 5 HG22 THR 5 -1.969 4.135 -3.725
35 HG23 THR 5 HG23 THR 5 -1.723 4.217 -5.469
36 H VAL 6 H VAL 6 -1.948 2.145 -7.744
37 HA VAL 6 HA VAL 6 -1.611 -0.604 -6.785
38 HB VAL 6 HB VAL 6 -1.732 -0.383 -9.195
39 HG11 VAL 6 HG11 VAL 6 -0.968 1.920 -9.446
40 HG12 VAL 6 HG12 VAL 6 -0.050 0.841 -10.497
41 HG13 VAL 6 HG13 VAL 6 0.671 1.440 -9.003
42 HG21 VAL 6 HG21 VAL 6 0.363 -1.508 -9.826
43 HG22 VAL 6 HG22 VAL 6 -0.290 -2.139 -8.313
44 HG23 VAL 6 HG23 VAL 6 1.079 -1.028 -8.288
45 H ILE 7 H ILE 7 -0.186 -0.961 -5.227
46 HA ILE 7 HA ILE 7 2.013 0.942 -4.788
47 HB ILE 7 HB ILE 7 0.924 -1.224 -2.969
48 HG12 ILE 7 HG12 ILE 7 0.665 1.797 -2.842
49 HG13 ILE 7 HG13 ILE 7 -0.617 0.676 -3.286
50 HG21 ILE 7 HG21 ILE 7 2.349 -0.208 -1.228
51 HG22 ILE 7 HG22 ILE 7 3.038 0.874 -2.438
52 HG23 ILE 7 HG23 ILE 7 3.301 -0.866 -2.558
53 HD11 ILE 7 HD11 ILE 7 -0.878 1.452 -1.007
54 HD12 ILE 7 HD12 ILE 7 0.726 0.848 -0.595
55 HD13 ILE 7 HD13 ILE 7 -0.556 -0.281 -1.035
56 H THR 8 H THR 8 3.858 0.408 -5.787
57 HA THR 8 HA THR 8 4.566 -2.349 -6.367
58 HB THR 8 HB THR 8 6.091 0.228 -6.860
59 HG1 THR 8 HG1 THR 8 5.477 -0.410 -9.110
60 HG21 THR 8 HG21 THR 8 7.655 -1.631 -6.695
61 HG22 THR 8 HG22 THR 8 7.497 -1.129 -8.378
62 HG23 THR 8 HG23 THR 8 6.676 -2.584 -7.813
63 H LEU 9 H LEU 9 5.649 -3.612 -4.989
64 HA LEU 9 HA LEU 9 6.967 -2.471 -2.655
65 HB2 LEU 9 HB2 LEU 9 6.567 -5.368 -3.424
66 HB3 LEU 9 HB3 LEU 9 7.164 -4.788 -1.879
67 HG LEU 9 HG LEU 9 4.382 -4.393 -2.997
68 HD11 LEU 9 HD11 LEU 9 4.787 -6.641 -2.164
69 HD12 LEU 9 HD12 LEU 9 3.695 -5.768 -1.090
70 HD13 LEU 9 HD13 LEU 9 5.387 -5.988 -0.638
71 HD21 LEU 9 HD21 LEU 9 3.865 -3.334 -0.832
72 HD22 LEU 9 HD22 LEU 9 5.033 -2.404 -1.770
73 HD23 LEU 9 HD23 LEU 9 5.578 -3.386 -0.409
74 H ASN 10 H ASN 10 9.046 -3.605 -1.943
75 HA ASN 10 HA ASN 10 11.174 -2.928 -3.559
76 HB2 ASN 10 HB2 ASN 10 11.358 -3.331 -1.147
77 HB3 ASN 10 HB3 ASN 10 11.094 -5.053 -1.401
78 HD21 ASN 10 HD21 ASN 10 13.058 -5.602 -0.486
79 HD22 ASN 10 HD22 ASN 10 14.564 -5.312 -1.279
80 H ASP 11 H ASP 11 9.608 -6.099 -3.296
81 HA ASP 11 HA ASP 11 11.421 -7.573 -4.875
82 HB2 ASP 11 HB2 ASP 11 8.458 -8.067 -4.497
83 HB3 ASP 11 HB3 ASP 11 9.664 -9.256 -4.979
84 H GLY 12 H GLY 12 9.240 -5.152 -5.860
85 HA2 GLY 12 HA2 GLY 12 8.775 -4.460 -8.071
86 HA3 GLY 12 HA3 GLY 12 9.290 -6.038 -8.657
87 H ARG 13 H ARG 13 7.404 -6.692 -6.099
88 HA ARG 13 HA ARG 13 5.169 -7.586 -7.630
89 HB2 ARG 13 HB2 ARG 13 5.943 -8.790 -5.633
90 HB3 ARG 13 HB3 ARG 13 5.561 -7.397 -4.628
91 HG2 ARG 13 HG2 ARG 13 3.165 -7.666 -5.266
92 HG3 ARG 13 HG3 ARG 13 3.608 -9.142 -6.130
93 HD2 ARG 13 HD2 ARG 13 4.439 -10.116 -4.037
94 HD3 ARG 13 HD3 ARG 13 4.013 -8.637 -3.174
95 HE ARG 13 HE ARG 13 1.922 -10.167 -4.559
96 HH11 ARG 13 HH11 ARG 13 3.274 -8.984 -1.614
97 HH12 ARG 13 HH12 ARG 13 1.890 -9.433 -0.683
98 HH21 ARG 13 HH21 ARG 13 0.156 -10.703 -3.342
99 HH22 ARG 13 HH22 ARG 13 0.150 -10.361 -1.644
100 H GLU 14 H GLU 14 3.173 -6.694 -7.883
101 HA GLU 14 HA GLU 14 2.801 -3.946 -6.890
102 HB2 GLU 14 HB2 GLU 14 1.495 -5.423 -9.187
103 HB3 GLU 14 HB3 GLU 14 1.104 -3.775 -8.710
104 HG2 GLU 14 HG2 GLU 14 3.342 -3.040 -9.256
105 HG3 GLU 14 HG3 GLU 14 3.827 -4.695 -9.619
106 H ILE 15 H ILE 15 1.182 -3.448 -5.509
107 HA ILE 15 HA ILE 15 -0.850 -5.507 -4.902
108 HB ILE 15 HB ILE 15 0.025 -3.142 -3.215
109 HG12 ILE 15 HG12 ILE 15 0.528 -6.116 -2.858
110 HG13 ILE 15 HG13 ILE 15 1.731 -4.918 -3.326
111 HG21 ILE 15 HG21 ILE 15 -1.381 -4.140 -1.457
112 HG22 ILE 15 HG22 ILE 15 -1.927 -5.367 -2.599
113 HG23 ILE 15 HG23 ILE 15 -2.329 -3.673 -2.868
114 HD11 ILE 15 HD11 ILE 15 0.270 -5.005 -0.693
115 HD12 ILE 15 HD12 ILE 15 1.491 -3.822 -1.165
116 HD13 ILE 15 HD13 ILE 15 1.932 -5.520 -0.982
117 H GLN 16 H GLN 16 -2.897 -5.136 -5.504
118 HA GLN 16 HA GLN 16 -3.572 -2.522 -6.653
119 HB2 GLN 16 HB2 GLN 16 -5.115 -5.123 -6.793
120 HB3 GLN 16 HB3 GLN 16 -5.432 -3.665 -7.725
121 HG2 GLN 16 HG2 GLN 16 -3.316 -3.922 -8.890
122 HG3 GLN 16 HG3 GLN 16 -2.937 -5.348 -7.923
123 HE21 GLN 16 HE21 GLN 16 -4.813 -4.089 -10.548
124 HE22 GLN 16 HE22 GLN 16 -5.405 -5.609 -11.113
125 H ALA 17 H ALA 17 -4.472 -1.105 -5.285
126 HA ALA 17 HA ALA 17 -6.438 -2.082 -3.305
127 HB1 ALA 17 HB1 ALA 17 -4.753 0.424 -3.207
128 HB2 ALA 17 HB2 ALA 17 -4.447 -1.064 -2.308
129 HB3 ALA 17 HB3 ALA 17 -5.893 -0.111 -1.969
130 H VAL 18 H VAL 18 -8.389 -0.947 -3.012
131 HA VAL 18 HA VAL 18 -9.238 0.743 -5.266
132 HB VAL 18 HB VAL 18 -11.531 0.464 -4.364
133 HG11 VAL 18 HG11 VAL 18 -10.070 -2.145 -4.763
134 HG12 VAL 18 HG12 VAL 18 -10.701 -1.103 -6.039
135 HG13 VAL 18 HG13 VAL 18 -11.810 -1.898 -4.919
136 HG21 VAL 18 HG21 VAL 18 -10.222 -1.341 -2.318
137 HG22 VAL 18 HG22 VAL 18 -11.958 -1.134 -2.551
138 HG23 VAL 18 HG23 VAL 18 -10.977 0.223 -1.995
139 H ASP 19 H ASP 19 -7.750 1.312 -2.467
140 HA ASP 19 HA ASP 19 -9.074 3.888 -2.009
141 HB2 ASP 19 HB2 ASP 19 -9.740 1.854 -0.404
142 HB3 ASP 19 HB3 ASP 19 -8.241 2.302 0.388
143 H THR 20 H THR 20 -7.662 5.296 -0.526
144 HA THR 20 HA THR 20 -5.009 5.271 -1.686
145 HB THR 20 HB THR 20 -4.688 7.446 -0.567
146 HG1 THR 20 HG1 THR 20 -6.583 6.585 1.077
147 HG21 THR 20 HG21 THR 20 -5.769 7.399 -2.752
148 HG22 THR 20 HG22 THR 20 -6.450 8.683 -1.751
149 HG23 THR 20 HG23 THR 20 -7.345 7.181 -1.982
150 HA PRO 21 HA PRO 21 -2.926 3.396 1.767
151 HB2 PRO 21 HB2 PRO 21 -0.375 4.098 1.185
152 HB3 PRO 21 HB3 PRO 21 -1.262 2.875 0.266
153 HG2 PRO 21 HG2 PRO 21 -0.788 5.763 -0.392
154 HG3 PRO 21 HG3 PRO 21 -0.680 4.341 -1.449
155 HD2 PRO 21 HD2 PRO 21 -2.843 5.991 -1.412
156 HD3 PRO 21 HD3 PRO 21 -2.961 4.259 -1.781
157 H LYS 22 H LYS 22 -3.301 4.275 3.698
158 HA LYS 22 HA LYS 22 -2.582 7.012 4.352
159 HB2 LYS 22 HB2 LYS 22 -4.721 6.212 5.112
160 HB3 LYS 22 HB3 LYS 22 -3.992 4.801 5.864
161 HG2 LYS 22 HG2 LYS 22 -2.895 6.256 7.510
162 HG3 LYS 22 HG3 LYS 22 -3.654 7.666 6.760
163 HD2 LYS 22 HD2 LYS 22 -5.854 6.825 7.311
164 HD3 LYS 22 HD3 LYS 22 -5.168 5.321 7.930
165 HE2 LYS 22 HE2 LYS 22 -4.699 8.075 9.077
166 HE3 LYS 22 HE3 LYS 22 -5.795 6.863 9.738
167 HZ1 LYS 22 HZ1 LYS 22 -3.862 5.395 10.041
168 HZ2 LYS 22 HZ2 LYS 22 -3.725 6.831 10.926
169 HZ3 LYS 22 HZ3 LYS 22 -2.848 6.632 9.499
170 H TYR 23 H TYR 23 -0.519 7.416 4.901
171 HA TYR 23 HA TYR 23 1.161 5.370 6.090
172 HB2 TYR 23 HB2 TYR 23 2.124 6.798 4.379
173 HB3 TYR 23 HB3 TYR 23 1.728 8.242 5.305
174 HD1 TYR 23 HD1 TYR 23 3.714 5.083 5.558
175 HD2 TYR 23 HD2 TYR 23 3.373 9.175 6.699
176 HE1 TYR 23 HE1 TYR 23 5.923 4.968 6.622
177 HE2 TYR 23 HE2 TYR 23 5.589 9.064 7.764
178 HH TYR 23 HH TYR 23 7.770 6.625 7.196
179 H ASP 24 H ASP 24 1.320 5.054 8.228
180 HA ASP 24 HA ASP 24 0.731 7.269 10.066
181 HB2 ASP 24 HB2 ASP 24 -0.378 5.075 10.453
182 HB3 ASP 24 HB3 ASP 24 1.206 4.345 10.711
183 H GLU 25 H GLU 25 2.318 8.393 10.980
184 HA GLU 25 HA GLU 25 5.047 7.903 10.324
185 HB2 GLU 25 HB2 GLU 25 4.241 10.159 10.505
186 HB3 GLU 25 HB3 GLU 25 3.705 9.895 12.158
187 HG2 GLU 25 HG2 GLU 25 5.991 9.721 12.918
188 HG3 GLU 25 HG3 GLU 25 6.583 9.836 11.261
189 H GLU 26 H GLU 26 3.156 7.554 13.292
190 HA GLU 26 HA GLU 26 5.342 7.090 15.037
191 HB2 GLU 26 HB2 GLU 26 2.447 6.267 15.366
192 HB3 GLU 26 HB3 GLU 26 3.645 6.388 16.652
193 HG2 GLU 26 HG2 GLU 26 3.833 8.796 16.251
194 HG3 GLU 26 HG3 GLU 26 2.627 8.674 14.970
195 H SER 27 H SER 27 3.227 4.868 13.252
196 HA SER 27 HA SER 27 4.653 2.568 14.387
197 HB2 SER 27 HB2 SER 27 2.124 2.648 14.294
198 HB3 SER 27 HB3 SER 27 2.257 2.499 12.542
199 HG SER 27 HG SER 27 2.041 0.451 13.283
200 H GLY 28 H GLY 28 4.287 4.304 11.365
201 HA2 GLY 28 HA2 GLY 28 5.821 4.300 9.606
202 HA3 GLY 28 HA3 GLY 28 6.603 2.900 10.314
203 H PHE 29 H PHE 29 3.247 2.460 9.983
204 HA PHE 29 HA PHE 29 3.694 0.725 7.643
205 HB2 PHE 29 HB2 PHE 29 1.491 0.718 9.724
206 HB3 PHE 29 HB3 PHE 29 1.531 -0.350 8.327
207 HD1 PHE 29 HD1 PHE 29 3.397 -2.021 8.123
208 HD2 PHE 29 HD2 PHE 29 2.720 0.219 11.673
209 HE1 PHE 29 HE1 PHE 29 4.741 -3.638 9.396
210 HE2 PHE 29 HE2 PHE 29 4.063 -1.394 12.954
211 HZ PHE 29 HZ PHE 29 5.074 -3.328 11.816
212 H TYR 30 H TYR 30 2.231 0.693 5.892
213 HA TYR 30 HA TYR 30 0.553 3.082 5.545
214 HB2 TYR 30 HB2 TYR 30 1.596 1.025 3.583
215 HB3 TYR 30 HB3 TYR 30 0.404 2.240 3.143
216 HD1 TYR 30 HD1 TYR 30 3.878 1.840 4.442
217 HD2 TYR 30 HD2 TYR 30 1.096 4.379 2.444
218 HE1 TYR 30 HE1 TYR 30 5.692 3.410 3.901
219 HE2 TYR 30 HE2 TYR 30 2.910 5.947 1.903
220 HH TYR 30 HH TYR 30 5.178 6.539 2.841
221 H GLU 31 H GLU 31 -1.564 2.894 5.903
222 HA GLU 31 HA GLU 31 -2.828 0.246 5.978
223 HB2 GLU 31 HB2 GLU 31 -3.957 2.905 6.895
224 HB3 GLU 31 HB3 GLU 31 -4.565 1.301 7.287
225 HG2 GLU 31 HG2 GLU 31 -2.543 0.840 8.582
226 HG3 GLU 31 HG3 GLU 31 -1.902 2.425 8.158
227 H PHE 32 H PHE 32 -3.996 -0.393 4.217
228 HA PHE 32 HA PHE 32 -5.590 1.580 2.773
229 HB2 PHE 32 HB2 PHE 32 -4.688 0.858 0.559
230 HB3 PHE 32 HB3 PHE 32 -3.529 1.727 1.553
231 HD1 PHE 32 HD1 PHE 32 -1.739 0.434 2.760
232 HD2 PHE 32 HD2 PHE 32 -4.236 -1.327 -0.208
233 HE1 PHE 32 HE1 PHE 32 -0.113 -1.388 2.481
234 HE2 PHE 32 HE2 PHE 32 -2.614 -3.149 -0.490
235 HZ PHE 32 HZ PHE 32 -0.550 -3.186 0.852
236 H LYS 33 H LYS 33 -6.878 0.528 0.959
237 HA LYS 33 HA LYS 33 -7.984 -2.026 1.968
238 HB2 LYS 33 HB2 LYS 33 -9.421 0.008 2.191
239 HB3 LYS 33 HB3 LYS 33 -9.384 0.188 0.445
240 HG2 LYS 33 HG2 LYS 33 -10.458 -2.058 0.265
241 HG3 LYS 33 HG3 LYS 33 -10.629 -2.057 2.021
242 HD2 LYS 33 HD2 LYS 33 -11.780 0.037 0.166
243 HD3 LYS 33 HD3 LYS 33 -12.684 -1.329 0.808
244 HE2 LYS 33 HE2 LYS 33 -13.253 0.492 2.183
245 HE3 LYS 33 HE3 LYS 33 -12.095 -0.442 3.123
246 HZ1 LYS 33 HZ1 LYS 33 -11.435 2.001 1.557
247 HZ2 LYS 33 HZ2 LYS 33 -10.380 1.135 2.559
248 HZ3 LYS 33 HZ3 LYS 33 -11.694 1.956 3.227
249 H GLN 34 H GLN 34 -7.602 -3.721 0.633
250 HA GLN 34 HA GLN 34 -6.647 -3.337 -2.056
251 HB2 GLN 34 HB2 GLN 34 -7.339 -5.876 -0.558
252 HB3 GLN 34 HB3 GLN 34 -6.499 -5.806 -2.103
253 HG2 GLN 34 HG2 GLN 34 -4.643 -4.619 -1.072
254 HG3 GLN 34 HG3 GLN 34 -5.489 -4.608 0.473
255 HE21 GLN 34 HE21 GLN 34 -5.669 -6.536 1.639
256 HE22 GLN 34 HE22 GLN 34 -4.663 -7.900 1.304
257 H LEU 35 H LEU 35 -7.574 -4.883 -3.845
258 HA LEU 35 HA LEU 35 -10.106 -3.974 -4.613
259 HB2 LEU 35 HB2 LEU 35 -8.759 -6.524 -5.523
260 HB3 LEU 35 HB3 LEU 35 -10.073 -5.710 -6.348
261 HG LEU 35 HG LEU 35 -7.251 -4.675 -6.016
262 HD11 LEU 35 HD11 LEU 35 -7.160 -4.902 -8.456
263 HD12 LEU 35 HD12 LEU 35 -8.780 -5.597 -8.451
264 HD13 LEU 35 HD13 LEU 35 -7.450 -6.451 -7.666
265 HD21 LEU 35 HD21 LEU 35 -9.625 -3.390 -7.370
266 HD22 LEU 35 HD22 LEU 35 -7.960 -2.813 -7.452
267 HD23 LEU 35 HD23 LEU 35 -8.815 -2.817 -5.911
268 H ASP 36 H ASP 36 -9.229 -6.801 -2.743
269 HA ASP 36 HA ASP 36 -11.752 -8.135 -2.890
270 HB2 ASP 36 HB2 ASP 36 -9.703 -8.413 -0.682
271 HB3 ASP 36 HB3 ASP 36 -10.874 -9.612 -1.223
272 H GLY 37 H GLY 37 -10.829 -5.313 -1.311
273 HA2 GLY 37 HA2 GLY 37 -12.117 -3.982 0.127
274 HA3 GLY 37 HA3 GLY 37 -13.131 -5.370 0.485
275 H LYS 38 H LYS 38 -10.310 -6.748 0.843
276 HA LYS 38 HA LYS 38 -10.301 -6.649 3.683
277 HB2 LYS 38 HB2 LYS 38 -8.244 -7.773 1.768
278 HB3 LYS 38 HB3 LYS 38 -8.276 -8.067 3.501
279 HG2 LYS 38 HG2 LYS 38 -10.405 -9.220 3.294
280 HG3 LYS 38 HG3 LYS 38 -10.451 -8.865 1.568
281 HD2 LYS 38 HD2 LYS 38 -9.707 -11.156 1.952
282 HD3 LYS 38 HD3 LYS 38 -8.416 -10.192 1.236
283 HE2 LYS 38 HE2 LYS 38 -7.535 -11.612 3.001
284 HE3 LYS 38 HE3 LYS 38 -7.398 -9.916 3.458
285 HZ1 LYS 38 HZ1 LYS 38 -9.592 -11.703 4.359
286 HZ2 LYS 38 HZ2 LYS 38 -9.266 -10.137 4.905
287 HZ3 LYS 38 HZ3 LYS 38 -8.193 -11.394 5.259
288 H GLN 39 H GLN 39 -9.345 -5.231 5.002
289 HA GLN 39 HA GLN 39 -7.522 -3.231 3.970
290 HB2 GLN 39 HB2 GLN 39 -9.296 -2.694 5.645
291 HB3 GLN 39 HB3 GLN 39 -8.451 -3.697 6.818
292 HG2 GLN 39 HG2 GLN 39 -6.477 -2.210 6.594
293 HG3 GLN 39 HG3 GLN 39 -7.425 -1.172 5.530
294 HE21 GLN 39 HE21 GLN 39 -7.311 0.587 6.897
295 HE22 GLN 39 HE22 GLN 39 -8.129 0.656 8.414
296 H THR 40 H THR 40 -5.333 -3.053 4.419
297 HA THR 40 HA THR 40 -4.078 -5.016 6.194
298 HB THR 40 HB THR 40 -4.054 -6.182 4.060
299 HG1 THR 40 HG1 THR 40 -1.482 -5.772 3.830
300 HG21 THR 40 HG21 THR 40 -4.238 -4.224 2.574
301 HG22 THR 40 HG22 THR 40 -2.905 -5.280 2.104
302 HG23 THR 40 HG23 THR 40 -2.577 -3.778 2.969
303 H ARG 41 H ARG 41 -1.868 -4.539 6.734
304 HA ARG 41 HA ARG 41 -1.004 -1.774 6.128
305 HB2 ARG 41 HB2 ARG 41 -0.629 -3.148 8.802
306 HB3 ARG 41 HB3 ARG 41 -0.243 -1.479 8.400
307 HG2 ARG 41 HG2 ARG 41 -2.669 -1.056 8.052
308 HG3 ARG 41 HG3 ARG 41 -2.993 -2.701 8.605
309 HD2 ARG 41 HD2 ARG 41 -1.721 -0.464 10.189
310 HD3 ARG 41 HD3 ARG 41 -3.317 -1.168 10.441
311 HE ARG 41 HE ARG 41 -1.132 -3.042 10.666
312 HH11 ARG 41 HH11 ARG 41 -3.159 -0.820 12.350
313 HH12 ARG 41 HH12 ARG 41 -2.821 -1.510 13.894
314 HH21 ARG 41 HH21 ARG 41 -0.712 -3.921 12.640
315 HH22 ARG 41 HH22 ARG 41 -1.465 -3.275 14.056
316 H ILE 42 H ILE 42 1.035 -1.628 5.361
317 HA ILE 42 HA ILE 42 2.951 -3.796 5.966
318 HB ILE 42 HB ILE 42 2.072 -4.088 3.674
319 HG12 ILE 42 HG12 ILE 42 4.966 -3.182 3.668
320 HG13 ILE 42 HG13 ILE 42 4.412 -4.738 4.276
321 HG21 ILE 42 HG21 ILE 42 1.546 -1.782 3.134
322 HG22 ILE 42 HG22 ILE 42 2.633 -2.453 1.919
323 HG23 ILE 42 HG23 ILE 42 3.259 -1.360 3.153
324 HD11 ILE 42 HD11 ILE 42 5.320 -4.953 2.048
325 HD12 ILE 42 HD12 ILE 42 4.176 -3.757 1.438
326 HD13 ILE 42 HD13 ILE 42 3.593 -5.309 2.043
327 H ASN 43 H ASN 43 5.122 -3.170 6.243
328 HA ASN 43 HA ASN 43 5.376 -0.569 7.353
329 HB2 ASN 43 HB2 ASN 43 6.512 -2.602 8.251
330 HB3 ASN 43 HB3 ASN 43 7.593 -2.568 6.861
331 HD21 ASN 43 HD21 ASN 43 9.240 -1.100 6.816
332 HD22 ASN 43 HD22 ASN 43 9.641 -0.067 8.138
333 H LYS 44 H LYS 44 6.891 1.049 6.881
334 HA LYS 44 HA LYS 44 6.703 1.998 4.276
335 HB2 LYS 44 HB2 LYS 44 8.218 3.814 5.052
336 HB3 LYS 44 HB3 LYS 44 6.859 3.504 6.124
337 HG2 LYS 44 HG2 LYS 44 8.370 2.170 7.581
338 HG3 LYS 44 HG3 LYS 44 9.720 2.632 6.541
339 HD2 LYS 44 HD2 LYS 44 9.283 5.007 7.053
340 HD3 LYS 44 HD3 LYS 44 7.951 4.527 8.106
341 HE2 LYS 44 HE2 LYS 44 9.506 3.332 9.556
342 HE3 LYS 44 HE3 LYS 44 10.848 3.749 8.491
343 HZ1 LYS 44 HZ1 LYS 44 10.385 6.108 8.973
344 HZ2 LYS 44 HZ2 LYS 44 10.815 5.231 10.355
345 HZ3 LYS 44 HZ3 LYS 44 9.196 5.638 10.082
346 H ASP 45 H ASP 45 9.041 -0.222 5.421
347 HA ASP 45 HA ASP 45 11.183 0.649 3.695
348 HB2 ASP 45 HB2 ASP 45 12.345 -1.397 4.435
349 HB3 ASP 45 HB3 ASP 45 11.737 -0.456 5.787
350 H GLN 46 H GLN 46 8.560 -1.660 3.468
351 HA GLN 46 HA GLN 46 9.673 -3.070 1.216
352 HB2 GLN 46 HB2 GLN 46 6.865 -3.105 2.337
353 HB3 GLN 46 HB3 GLN 46 7.502 -4.235 1.150
354 HG2 GLN 46 HG2 GLN 46 8.512 -3.897 3.971
355 HG3 GLN 46 HG3 GLN 46 7.450 -5.184 3.406
356 HE21 GLN 46 HE21 GLN 46 10.113 -5.320 4.602
357 HE22 GLN 46 HE22 GLN 46 11.086 -6.195 3.476
358 H VAL 47 H VAL 47 7.545 -0.311 1.593
359 HA VAL 47 HA VAL 47 6.405 -0.456 -1.030
360 HB VAL 47 HB VAL 47 5.191 0.687 0.733
361 HG11 VAL 47 HG11 VAL 47 7.046 1.545 2.043
362 HG12 VAL 47 HG12 VAL 47 5.942 2.853 1.627
363 HG13 VAL 47 HG13 VAL 47 7.463 2.676 0.756
364 HG21 VAL 47 HG21 VAL 47 6.052 2.607 -1.441
365 HG22 VAL 47 HG22 VAL 47 4.600 2.757 -0.450
366 HG23 VAL 47 HG23 VAL 47 4.773 1.401 -1.564
367 H ARG 48 H ARG 48 7.544 -0.164 -2.842
368 HA ARG 48 HA ARG 48 9.885 1.542 -2.907
369 HB2 ARG 48 HB2 ARG 48 9.354 -0.716 -4.238
370 HB3 ARG 48 HB3 ARG 48 8.717 0.419 -5.420
371 HG2 ARG 48 HG2 ARG 48 10.980 -0.043 -6.007
372 HG3 ARG 48 HG3 ARG 48 10.933 1.599 -5.360
373 HD2 ARG 48 HD2 ARG 48 11.622 0.652 -3.140
374 HD3 ARG 48 HD3 ARG 48 11.848 -0.904 -3.934
375 HE ARG 48 HE ARG 48 13.334 1.463 -4.844
376 HH11 ARG 48 HH11 ARG 48 13.312 -1.749 -3.585
377 HH12 ARG 48 HH12 ARG 48 15.020 -1.930 -3.729
378 HH21 ARG 48 HH21 ARG 48 15.533 1.208 -5.006
379 HH22 ARG 48 HH22 ARG 48 16.258 -0.280 -4.519
380 H THR 49 H THR 49 6.787 1.483 -4.734
381 HA THR 49 HA THR 49 6.798 4.429 -4.810
382 HB THR 49 HB THR 49 6.240 4.497 -7.206
383 HG1 THR 49 HG1 THR 49 5.389 2.340 -7.374
384 HG21 THR 49 HG21 THR 49 8.593 4.758 -6.581
385 HG22 THR 49 HG22 THR 49 8.441 3.931 -8.132
386 HG23 THR 49 HG23 THR 49 8.821 3.012 -6.675
387 H VAL 50 H VAL 50 4.818 5.305 -4.536
388 HA VAL 50 HA VAL 50 2.439 3.569 -4.649
389 HB VAL 50 HB VAL 50 2.778 6.351 -3.487
390 HG11 VAL 50 HG11 VAL 50 0.375 4.516 -3.385
391 HG12 VAL 50 HG12 VAL 50 0.501 6.005 -4.323
392 HG13 VAL 50 HG13 VAL 50 0.528 6.069 -2.561
393 HG21 VAL 50 HG21 VAL 50 3.934 4.657 -2.171
394 HG22 VAL 50 HG22 VAL 50 2.474 3.667 -2.121
395 HG23 VAL 50 HG23 VAL 50 2.509 5.232 -1.306
396 H LYS 51 H LYS 51 1.261 3.604 -6.501
397 HA LYS 51 HA LYS 51 1.019 6.157 -7.981
398 HB2 LYS 51 HB2 LYS 51 1.415 3.425 -9.223
399 HB3 LYS 51 HB3 LYS 51 1.147 4.923 -10.101
400 HG2 LYS 51 HG2 LYS 51 3.271 5.802 -9.263
401 HG3 LYS 51 HG3 LYS 51 3.541 4.298 -8.374
402 HD2 LYS 51 HD2 LYS 51 3.520 3.046 -10.485
403 HD3 LYS 51 HD3 LYS 51 3.240 4.545 -11.372
404 HE2 LYS 51 HE2 LYS 51 5.404 5.404 -10.519
405 HE3 LYS 51 HE3 LYS 51 5.686 3.843 -9.747
406 HZ1 LYS 51 HZ1 LYS 51 5.597 2.792 -11.918
407 HZ2 LYS 51 HZ2 LYS 51 6.793 3.990 -11.888
408 HZ3 LYS 51 HZ3 LYS 51 5.316 4.288 -12.657
409 H ASP 52 H ASP 52 -0.953 6.497 -9.068
410 HA ASP 52 HA ASP 52 -3.188 4.787 -8.300
411 HB2 ASP 52 HB2 ASP 52 -3.036 7.408 -9.800
412 HB3 ASP 52 HB3 ASP 52 -4.541 6.521 -9.577
413 H LEU 53 H LEU 53 -4.574 3.747 -9.755
414 HA LEU 53 HA LEU 53 -3.358 2.764 -12.174
415 HB2 LEU 53 HB2 LEU 53 -6.085 2.308 -10.950
416 HB3 LEU 53 HB3 LEU 53 -5.535 1.520 -12.417
417 HG LEU 53 HG LEU 53 -4.245 1.221 -9.695
418 HD11 LEU 53 HD11 LEU 53 -5.983 -0.693 -11.260
419 HD12 LEU 53 HD12 LEU 53 -6.429 0.145 -9.773
420 HD13 LEU 53 HD13 LEU 53 -5.143 -1.061 -9.752
421 HD21 LEU 53 HD21 LEU 53 -2.942 -0.562 -10.763
422 HD22 LEU 53 HD22 LEU 53 -2.634 1.005 -11.509
423 HD23 LEU 53 HD23 LEU 53 -3.676 -0.166 -12.318
424 H LEU 54 H LEU 54 -5.412 5.401 -11.406
425 HA LEU 54 HA LEU 54 -6.405 5.642 -14.151
426 HB2 LEU 54 HB2 LEU 54 -7.026 7.339 -11.728
427 HB3 LEU 54 HB3 LEU 54 -7.792 7.475 -13.300
428 HG LEU 54 HG LEU 54 -8.015 5.146 -11.385
429 HD11 LEU 54 HD11 LEU 54 -10.062 7.157 -12.327
430 HD12 LEU 54 HD12 LEU 54 -9.327 7.085 -10.724
431 HD13 LEU 54 HD13 LEU 54 -10.374 5.778 -11.271
432 HD21 LEU 54 HD21 LEU 54 -9.597 4.183 -12.996
433 HD22 LEU 54 HD22 LEU 54 -7.977 4.323 -13.681
434 HD23 LEU 54 HD23 LEU 54 -9.229 5.481 -14.132
435 H GLU 55 H GLU 55 -4.443 6.146 -15.162
436 HA GLU 55 HA GLU 55 -3.219 8.740 -14.501
437 HB2 GLU 55 HB2 GLU 55 -2.283 6.358 -16.088
438 HB3 GLU 55 HB3 GLU 55 -1.485 7.915 -16.241
439 HG2 GLU 55 HG2 GLU 55 -1.848 6.540 -13.593
440 HG3 GLU 55 HG3 GLU 55 -0.465 6.234 -14.641
Start of MODEL 14
1 H1 MET 1 H1 MET 1 -14.481 8.750 -0.954
2 H2 MET 1 H2 MET 1 -14.761 10.417 -1.008
3 H3 MET 1 H3 MET 1 -13.369 9.819 -0.261
4 HA MET 1 HA MET 1 -14.011 9.594 -3.147
5 HB2 MET 1 HB2 MET 1 -11.936 11.312 -1.754
6 HB3 MET 1 HB3 MET 1 -12.179 11.198 -3.493
7 HG2 MET 1 HG2 MET 1 -13.177 13.224 -2.671
8 HG3 MET 1 HG3 MET 1 -14.441 12.124 -3.219
9 HE1 MET 1 HE1 MET 1 -12.709 13.834 -0.159
10 HE2 MET 1 HE2 MET 1 -12.347 12.135 0.148
11 HE3 MET 1 HE3 MET 1 -13.456 13.006 1.206
12 H ALA 2 H ALA 2 -13.321 7.583 -3.686
13 HA ALA 2 HA ALA 2 -10.619 6.755 -2.801
14 HB1 ALA 2 HB1 ALA 2 -12.349 5.464 -1.626
15 HB2 ALA 2 HB2 ALA 2 -11.369 4.450 -2.684
16 HB3 ALA 2 HB3 ALA 2 -12.993 4.929 -3.177
17 H SER 3 H SER 3 -9.264 6.032 -4.347
18 HA SER 3 HA SER 3 -10.325 5.579 -7.069
19 HB2 SER 3 HB2 SER 3 -7.690 6.924 -6.380
20 HB3 SER 3 HB3 SER 3 -8.324 6.643 -8.002
21 HG SER 3 HG SER 3 -8.884 8.633 -6.225
22 HA PRO 4 HA PRO 4 -8.014 1.732 -6.955
23 HB2 PRO 4 HB2 PRO 4 -7.365 1.526 -9.622
24 HB3 PRO 4 HB3 PRO 4 -8.941 1.088 -8.958
25 HG2 PRO 4 HG2 PRO 4 -8.100 3.620 -10.327
26 HG3 PRO 4 HG3 PRO 4 -9.597 2.688 -10.524
27 HD2 PRO 4 HD2 PRO 4 -9.517 4.927 -9.035
28 HD3 PRO 4 HD3 PRO 4 -10.530 3.541 -8.575
29 H THR 5 H THR 5 -6.028 1.770 -6.046
30 HA THR 5 HA THR 5 -3.874 3.318 -7.365
31 HB THR 5 HB THR 5 -4.279 2.992 -4.374
32 HG1 THR 5 HG1 THR 5 -4.293 5.525 -5.509
33 HG21 THR 5 HG21 THR 5 -1.908 3.140 -4.969
34 HG22 THR 5 HG22 THR 5 -2.440 4.614 -4.159
35 HG23 THR 5 HG23 THR 5 -2.222 4.598 -5.911
36 H VAL 6 H VAL 6 -2.073 2.191 -7.841
37 HA VAL 6 HA VAL 6 -1.793 -0.514 -6.724
38 HB VAL 6 HB VAL 6 -1.844 -0.412 -9.164
39 HG11 VAL 6 HG11 VAL 6 -0.954 1.833 -9.506
40 HG12 VAL 6 HG12 VAL 6 -0.049 0.650 -10.450
41 HG13 VAL 6 HG13 VAL 6 0.637 1.298 -8.959
42 HG21 VAL 6 HG21 VAL 6 0.193 -1.683 -9.634
43 HG22 VAL 6 HG22 VAL 6 -0.517 -2.171 -8.096
44 HG23 VAL 6 HG23 VAL 6 0.904 -1.123 -8.120
45 H ILE 7 H ILE 7 -0.426 -0.790 -5.110
46 HA ILE 7 HA ILE 7 1.876 1.009 -4.775
47 HB ILE 7 HB ILE 7 0.705 -1.017 -2.846
48 HG12 ILE 7 HG12 ILE 7 0.539 2.018 -2.864
49 HG13 ILE 7 HG13 ILE 7 -0.785 0.919 -3.238
50 HG21 ILE 7 HG21 ILE 7 2.178 0.026 -1.175
51 HG22 ILE 7 HG22 ILE 7 2.879 1.044 -2.434
52 HG23 ILE 7 HG23 ILE 7 3.099 -0.705 -2.489
53 HD11 ILE 7 HD11 ILE 7 -1.012 1.781 -0.999
54 HD12 ILE 7 HD12 ILE 7 0.603 1.207 -0.581
55 HD13 ILE 7 HD13 ILE 7 -0.679 0.051 -0.942
56 H THR 8 H THR 8 3.671 0.313 -5.772
57 HA THR 8 HA THR 8 4.168 -2.544 -6.146
58 HB THR 8 HB THR 8 5.831 -0.173 -7.052
59 HG1 THR 8 HG1 THR 8 3.509 -1.116 -7.984
60 HG21 THR 8 HG21 THR 8 7.136 -2.252 -6.891
61 HG22 THR 8 HG22 THR 8 6.901 -1.771 -8.572
62 HG23 THR 8 HG23 THR 8 5.939 -3.081 -7.888
63 H LEU 9 H LEU 9 5.520 -3.717 -4.890
64 HA LEU 9 HA LEU 9 6.992 -2.389 -2.756
65 HB2 LEU 9 HB2 LEU 9 6.771 -5.357 -3.287
66 HB3 LEU 9 HB3 LEU 9 7.281 -4.576 -1.794
67 HG LEU 9 HG LEU 9 4.492 -4.529 -2.970
68 HD11 LEU 9 HD11 LEU 9 5.074 -6.677 -1.990
69 HD12 LEU 9 HD12 LEU 9 3.894 -5.834 -0.988
70 HD13 LEU 9 HD13 LEU 9 5.590 -5.877 -0.505
71 HD21 LEU 9 HD21 LEU 9 5.555 -3.270 -0.437
72 HD22 LEU 9 HD22 LEU 9 3.855 -3.368 -0.897
73 HD23 LEU 9 HD23 LEU 9 4.977 -2.416 -1.868
74 H ASN 10 H ASN 10 9.245 -3.168 -2.265
75 HA ASN 10 HA ASN 10 10.877 -2.411 -4.427
76 HB2 ASN 10 HB2 ASN 10 11.421 -1.996 -2.050
77 HB3 ASN 10 HB3 ASN 10 11.724 -3.718 -1.832
78 HD21 ASN 10 HD21 ASN 10 13.629 -4.584 -2.559
79 HD22 ASN 10 HD22 ASN 10 14.927 -3.622 -3.173
80 H ASP 11 H ASP 11 9.851 -5.580 -3.415
81 HA ASP 11 HA ASP 11 11.970 -7.024 -4.711
82 HB2 ASP 11 HB2 ASP 11 10.642 -9.010 -4.246
83 HB3 ASP 11 HB3 ASP 11 10.668 -7.967 -2.827
84 H GLY 12 H GLY 12 9.027 -5.573 -5.791
85 HA2 GLY 12 HA2 GLY 12 8.832 -5.287 -8.241
86 HA3 GLY 12 HA3 GLY 12 9.256 -6.984 -8.392
87 H ARG 13 H ARG 13 7.357 -7.049 -5.784
88 HA ARG 13 HA ARG 13 5.044 -7.984 -7.194
89 HB2 ARG 13 HB2 ARG 13 5.679 -8.993 -5.075
90 HB3 ARG 13 HB3 ARG 13 5.499 -7.451 -4.248
91 HG2 ARG 13 HG2 ARG 13 3.089 -7.481 -4.724
92 HG3 ARG 13 HG3 ARG 13 3.277 -9.037 -5.537
93 HD2 ARG 13 HD2 ARG 13 4.082 -10.029 -3.442
94 HD3 ARG 13 HD3 ARG 13 3.889 -8.472 -2.632
95 HE ARG 13 HE ARG 13 1.453 -9.262 -3.828
96 HH11 ARG 13 HH11 ARG 13 3.492 -10.020 -1.159
97 HH12 ARG 13 HH12 ARG 13 2.189 -10.613 -0.190
98 HH21 ARG 13 HH21 ARG 13 -0.215 -10.005 -2.566
99 HH22 ARG 13 HH22 ARG 13 0.113 -10.591 -0.973
100 H GLU 14 H GLU 14 3.214 -6.913 -7.760
101 HA GLU 14 HA GLU 14 2.858 -4.150 -6.787
102 HB2 GLU 14 HB2 GLU 14 1.672 -5.563 -9.188
103 HB3 GLU 14 HB3 GLU 14 1.270 -3.922 -8.702
104 HG2 GLU 14 HG2 GLU 14 3.571 -3.221 -9.077
105 HG3 GLU 14 HG3 GLU 14 4.019 -4.870 -9.510
106 H ILE 15 H ILE 15 1.245 -3.674 -5.426
107 HA ILE 15 HA ILE 15 -0.939 -5.637 -5.070
108 HB ILE 15 HB ILE 15 0.099 -3.617 -3.060
109 HG12 ILE 15 HG12 ILE 15 0.386 -6.638 -3.138
110 HG13 ILE 15 HG13 ILE 15 1.677 -5.477 -3.434
111 HG21 ILE 15 HG21 ILE 15 -2.013 -5.767 -2.779
112 HG22 ILE 15 HG22 ILE 15 -2.289 -4.024 -2.790
113 HG23 ILE 15 HG23 ILE 15 -1.391 -4.764 -1.467
114 HD11 ILE 15 HD11 ILE 15 0.207 -5.904 -0.839
115 HD12 ILE 15 HD12 ILE 15 1.437 -4.671 -1.120
116 HD13 ILE 15 HD13 ILE 15 1.865 -6.377 -1.213
117 H GLN 16 H GLN 16 -2.867 -4.993 -5.810
118 HA GLN 16 HA GLN 16 -3.291 -2.160 -6.430
119 HB2 GLN 16 HB2 GLN 16 -4.901 -4.606 -7.197
120 HB3 GLN 16 HB3 GLN 16 -5.209 -2.966 -7.757
121 HG2 GLN 16 HG2 GLN 16 -3.052 -2.929 -8.892
122 HG3 GLN 16 HG3 GLN 16 -2.691 -4.542 -8.284
123 HE21 GLN 16 HE21 GLN 16 -4.603 -2.697 -10.526
124 HE22 GLN 16 HE22 GLN 16 -5.124 -4.032 -11.483
125 H ALA 17 H ALA 17 -4.731 -0.886 -5.420
126 HA ALA 17 HA ALA 17 -6.481 -2.091 -3.362
127 HB1 ALA 17 HB1 ALA 17 -4.575 -0.964 -2.333
128 HB2 ALA 17 HB2 ALA 17 -6.078 -0.117 -1.966
129 HB3 ALA 17 HB3 ALA 17 -4.976 0.525 -3.186
130 H VAL 18 H VAL 18 -8.427 -0.927 -2.852
131 HA VAL 18 HA VAL 18 -9.485 0.663 -5.095
132 HB VAL 18 HB VAL 18 -11.726 0.186 -4.159
133 HG11 VAL 18 HG11 VAL 18 -10.772 -1.290 -5.863
134 HG12 VAL 18 HG12 VAL 18 -11.805 -2.187 -4.750
135 HG13 VAL 18 HG13 VAL 18 -10.049 -2.292 -4.602
136 HG21 VAL 18 HG21 VAL 18 -11.118 -0.033 -1.803
137 HG22 VAL 18 HG22 VAL 18 -10.232 -1.517 -2.155
138 HG23 VAL 18 HG23 VAL 18 -11.984 -1.465 -2.358
139 H ASP 19 H ASP 19 -8.007 1.240 -2.266
140 HA ASP 19 HA ASP 19 -9.288 3.872 -1.968
141 HB2 ASP 19 HB2 ASP 19 -8.555 1.948 0.245
142 HB3 ASP 19 HB3 ASP 19 -8.698 3.676 0.533
143 H THR 20 H THR 20 -7.825 5.499 -0.993
144 HA THR 20 HA THR 20 -5.143 5.228 -2.029
145 HB THR 20 HB THR 20 -4.812 7.559 -1.189
146 HG1 THR 20 HG1 THR 20 -6.697 8.644 -0.378
147 HG21 THR 20 HG21 THR 20 -5.656 7.158 -3.454
148 HG22 THR 20 HG22 THR 20 -6.364 8.619 -2.766
149 HG23 THR 20 HG23 THR 20 -7.310 7.134 -2.842
150 HA PRO 21 HA PRO 21 -3.290 3.766 1.690
151 HB2 PRO 21 HB2 PRO 21 -0.691 4.281 1.199
152 HB3 PRO 21 HB3 PRO 21 -1.602 3.077 0.277
153 HG2 PRO 21 HG2 PRO 21 -0.924 5.905 -0.461
154 HG3 PRO 21 HG3 PRO 21 -0.829 4.437 -1.454
155 HD2 PRO 21 HD2 PRO 21 -2.911 6.201 -1.589
156 HD3 PRO 21 HD3 PRO 21 -3.080 4.469 -1.939
157 H LYS 22 H LYS 22 -2.672 4.399 3.692
158 HA LYS 22 HA LYS 22 -2.075 7.255 4.180
159 HB2 LYS 22 HB2 LYS 22 -4.086 6.389 5.342
160 HB3 LYS 22 HB3 LYS 22 -3.114 5.121 6.075
161 HG2 LYS 22 HG2 LYS 22 -1.724 7.039 7.092
162 HG3 LYS 22 HG3 LYS 22 -3.076 8.075 6.640
163 HD2 LYS 22 HD2 LYS 22 -3.153 5.690 8.493
164 HD3 LYS 22 HD3 LYS 22 -3.323 7.383 8.945
165 HE2 LYS 22 HE2 LYS 22 -5.432 7.531 7.788
166 HE3 LYS 22 HE3 LYS 22 -5.237 5.901 7.139
167 HZ1 LYS 22 HZ1 LYS 22 -5.331 5.025 9.378
168 HZ2 LYS 22 HZ2 LYS 22 -6.718 5.936 9.052
169 HZ3 LYS 22 HZ3 LYS 22 -5.493 6.582 10.017
170 H TYR 23 H TYR 23 0.002 7.748 4.921
171 HA TYR 23 HA TYR 23 1.670 5.561 5.918
172 HB2 TYR 23 HB2 TYR 23 2.800 7.176 4.487
173 HB3 TYR 23 HB3 TYR 23 2.299 8.504 5.533
174 HD1 TYR 23 HD1 TYR 23 4.251 5.315 5.630
175 HD2 TYR 23 HD2 TYR 23 3.764 9.235 7.218
176 HE1 TYR 23 HE1 TYR 23 6.283 5.015 6.978
177 HE2 TYR 23 HE2 TYR 23 5.801 8.945 8.564
178 HH TYR 23 HH TYR 23 7.126 7.046 9.526
179 H ASP 24 H ASP 24 1.617 5.002 8.002
180 HA ASP 24 HA ASP 24 0.616 6.921 9.981
181 HB2 ASP 24 HB2 ASP 24 -0.442 4.715 9.958
182 HB3 ASP 24 HB3 ASP 24 1.123 3.944 10.207
183 H GLU 25 H GLU 25 2.160 8.188 10.762
184 HA GLU 25 HA GLU 25 4.918 7.536 10.829
185 HB2 GLU 25 HB2 GLU 25 4.018 9.829 10.616
186 HB3 GLU 25 HB3 GLU 25 3.424 9.739 12.266
187 HG2 GLU 25 HG2 GLU 25 5.751 9.492 13.057
188 HG3 GLU 25 HG3 GLU 25 6.309 9.672 11.392
189 H GLU 26 H GLU 26 2.341 6.982 13.071
190 HA GLU 26 HA GLU 26 3.856 6.958 15.472
191 HB2 GLU 26 HB2 GLU 26 1.200 5.663 14.823
192 HB3 GLU 26 HB3 GLU 26 1.867 5.824 16.442
193 HG2 GLU 26 HG2 GLU 26 1.132 8.103 14.605
194 HG3 GLU 26 HG3 GLU 26 0.179 7.529 15.973
195 H SER 27 H SER 27 2.961 4.366 13.198
196 HA SER 27 HA SER 27 4.742 2.560 14.735
197 HB2 SER 27 HB2 SER 27 2.357 1.847 14.743
198 HB3 SER 27 HB3 SER 27 2.417 1.715 12.985
199 HG SER 27 HG SER 27 2.808 -0.306 13.877
200 H GLY 28 H GLY 28 3.992 3.813 11.542
201 HA2 GLY 28 HA2 GLY 28 5.794 4.083 9.972
202 HA3 GLY 28 HA3 GLY 28 6.519 2.614 10.595
203 H PHE 29 H PHE 29 3.148 2.338 10.067
204 HA PHE 29 HA PHE 29 3.698 0.641 7.727
205 HB2 PHE 29 HB2 PHE 29 1.425 0.640 9.721
206 HB3 PHE 29 HB3 PHE 29 1.443 -0.367 8.277
207 HD1 PHE 29 HD1 PHE 29 3.236 -2.093 8.014
208 HD2 PHE 29 HD2 PHE 29 2.624 0.008 11.664
209 HE1 PHE 29 HE1 PHE 29 4.512 -3.816 9.213
210 HE2 PHE 29 HE2 PHE 29 3.900 -1.715 12.871
211 HZ PHE 29 HZ PHE 29 4.844 -3.632 11.643
212 H TYR 30 H TYR 30 2.266 0.594 5.934
213 HA TYR 30 HA TYR 30 0.790 3.082 5.437
214 HB2 TYR 30 HB2 TYR 30 1.931 0.970 3.609
215 HB3 TYR 30 HB3 TYR 30 0.726 2.116 3.035
216 HD1 TYR 30 HD1 TYR 30 4.167 1.819 4.383
217 HD2 TYR 30 HD2 TYR 30 1.314 4.355 2.498
218 HE1 TYR 30 HE1 TYR 30 5.937 3.457 3.908
219 HE2 TYR 30 HE2 TYR 30 3.079 5.997 2.025
220 HH TYR 30 HH TYR 30 5.266 6.636 2.818
221 H GLU 31 H GLU 31 -1.358 3.104 5.499
222 HA GLU 31 HA GLU 31 -2.830 0.574 5.756
223 HB2 GLU 31 HB2 GLU 31 -3.609 3.427 6.407
224 HB3 GLU 31 HB3 GLU 31 -4.630 2.020 6.681
225 HG2 GLU 31 HG2 GLU 31 -3.176 1.160 8.328
226 HG3 GLU 31 HG3 GLU 31 -1.895 2.288 7.888
227 H PHE 32 H PHE 32 -3.980 -0.181 4.085
228 HA PHE 32 HA PHE 32 -5.532 1.606 2.409
229 HB2 PHE 32 HB2 PHE 32 -4.591 0.766 0.282
230 HB3 PHE 32 HB3 PHE 32 -3.392 1.638 1.232
231 HD1 PHE 32 HD1 PHE 32 -1.664 0.333 2.519
232 HD2 PHE 32 HD2 PHE 32 -4.240 -1.487 -0.350
233 HE1 PHE 32 HE1 PHE 32 -0.144 -1.593 2.377
234 HE2 PHE 32 HE2 PHE 32 -2.718 -3.414 -0.493
235 HZ PHE 32 HZ PHE 32 -0.668 -3.469 0.875
236 H LYS 33 H LYS 33 -6.967 0.417 0.916
237 HA LYS 33 HA LYS 33 -7.711 -2.203 2.044
238 HB2 LYS 33 HB2 LYS 33 -9.422 -0.432 2.193
239 HB3 LYS 33 HB3 LYS 33 -9.394 -0.261 0.443
240 HG2 LYS 33 HG2 LYS 33 -10.149 -2.602 0.230
241 HG3 LYS 33 HG3 LYS 33 -10.240 -2.710 1.986
242 HD2 LYS 33 HD2 LYS 33 -11.821 -0.775 0.283
243 HD3 LYS 33 HD3 LYS 33 -12.438 -2.300 0.917
244 HE2 LYS 33 HE2 LYS 33 -13.220 -0.653 2.402
245 HE3 LYS 33 HE3 LYS 33 -11.858 -1.401 3.227
246 HZ1 LYS 33 HZ1 LYS 33 -11.680 1.136 1.697
247 HZ2 LYS 33 HZ2 LYS 33 -10.487 0.461 2.690
248 HZ3 LYS 33 HZ3 LYS 33 -11.917 1.052 3.370
249 H GLN 34 H GLN 34 -7.098 -3.892 0.884
250 HA GLN 34 HA GLN 34 -6.163 -3.790 -1.785
251 HB2 GLN 34 HB2 GLN 34 -7.053 -6.182 -0.153
252 HB3 GLN 34 HB3 GLN 34 -6.112 -6.255 -1.636
253 HG2 GLN 34 HG2 GLN 34 -4.292 -5.033 -0.537
254 HG3 GLN 34 HG3 GLN 34 -5.230 -4.994 0.957
255 HE21 GLN 34 HE21 GLN 34 -5.492 -6.913 2.137
256 HE22 GLN 34 HE22 GLN 34 -4.510 -8.302 1.846
257 H LEU 35 H LEU 35 -7.018 -5.257 -3.555
258 HA LEU 35 HA LEU 35 -9.551 -4.529 -4.439
259 HB2 LEU 35 HB2 LEU 35 -7.941 -6.984 -5.153
260 HB3 LEU 35 HB3 LEU 35 -9.346 -6.427 -6.043
261 HG LEU 35 HG LEU 35 -6.735 -4.929 -5.742
262 HD11 LEU 35 HD11 LEU 35 -6.478 -5.365 -8.138
263 HD12 LEU 35 HD12 LEU 35 -7.959 -6.324 -8.126
264 HD13 LEU 35 HD13 LEU 35 -6.550 -6.864 -7.213
265 HD21 LEU 35 HD21 LEU 35 -8.660 -3.410 -5.864
266 HD22 LEU 35 HD22 LEU 35 -9.202 -4.215 -7.336
267 HD23 LEU 35 HD23 LEU 35 -7.676 -3.328 -7.325
268 H ASP 36 H ASP 36 -8.657 -7.113 -2.293
269 HA ASP 36 HA ASP 36 -11.037 -8.666 -2.544
270 HB2 ASP 36 HB2 ASP 36 -9.061 -8.543 -0.253
271 HB3 ASP 36 HB3 ASP 36 -10.226 -9.829 -0.550
272 H GLY 37 H GLY 37 -10.669 -5.605 -1.307
273 HA2 GLY 37 HA2 GLY 37 -12.099 -4.275 -0.055
274 HA3 GLY 37 HA3 GLY 37 -13.146 -5.670 0.166
275 H LYS 38 H LYS 38 -9.753 -5.704 0.986
276 HA LYS 38 HA LYS 38 -10.458 -5.917 3.852
277 HB2 LYS 38 HB2 LYS 38 -8.208 -7.280 2.345
278 HB3 LYS 38 HB3 LYS 38 -8.530 -7.443 4.066
279 HG2 LYS 38 HG2 LYS 38 -10.676 -8.505 3.575
280 HG3 LYS 38 HG3 LYS 38 -10.381 -8.310 1.847
281 HD2 LYS 38 HD2 LYS 38 -9.847 -10.583 2.518
282 HD3 LYS 38 HD3 LYS 38 -8.372 -9.737 2.044
283 HE2 LYS 38 HE2 LYS 38 -8.026 -11.075 4.066
284 HE3 LYS 38 HE3 LYS 38 -7.820 -9.356 4.392
285 HZ1 LYS 38 HZ1 LYS 38 -10.285 -10.909 4.970
286 HZ2 LYS 38 HZ2 LYS 38 -10.012 -9.288 5.353
287 HZ3 LYS 38 HZ3 LYS 38 -9.111 -10.499 6.111
288 H GLN 39 H GLN 39 -9.403 -4.614 5.269
289 HA GLN 39 HA GLN 39 -7.464 -2.699 4.222
290 HB2 GLN 39 HB2 GLN 39 -9.259 -1.838 5.631
291 HB3 GLN 39 HB3 GLN 39 -8.791 -2.920 6.938
292 HG2 GLN 39 HG2 GLN 39 -6.591 -1.737 7.040
293 HG3 GLN 39 HG3 GLN 39 -7.208 -0.592 5.849
294 HE21 GLN 39 HE21 GLN 39 -6.969 1.119 7.309
295 HE22 GLN 39 HE22 GLN 39 -8.036 1.332 8.652
296 H THR 40 H THR 40 -5.324 -2.975 4.415
297 HA THR 40 HA THR 40 -4.278 -4.567 6.669
298 HB THR 40 HB THR 40 -4.221 -6.039 4.722
299 HG1 THR 40 HG1 THR 40 -2.101 -6.620 4.971
300 HG21 THR 40 HG21 THR 40 -2.884 -5.509 2.742
301 HG22 THR 40 HG22 THR 40 -2.502 -3.919 3.407
302 HG23 THR 40 HG23 THR 40 -4.162 -4.313 2.959
303 H ARG 41 H ARG 41 -1.888 -4.240 6.979
304 HA ARG 41 HA ARG 41 -1.052 -1.506 6.234
305 HB2 ARG 41 HB2 ARG 41 -0.584 -2.738 8.964
306 HB3 ARG 41 HB3 ARG 41 -0.235 -1.087 8.466
307 HG2 ARG 41 HG2 ARG 41 -2.659 -0.680 8.208
308 HG3 ARG 41 HG3 ARG 41 -2.974 -2.321 8.777
309 HD2 ARG 41 HD2 ARG 41 -3.259 -1.017 10.692
310 HD3 ARG 41 HD3 ARG 41 -1.619 -1.638 10.865
311 HE ARG 41 HE ARG 41 -1.874 0.967 9.621
312 HH11 ARG 41 HH11 ARG 41 -1.186 -0.799 12.501
313 HH12 ARG 41 HH12 ARG 41 -0.571 0.594 13.323
314 HH21 ARG 41 HH21 ARG 41 -1.120 2.736 10.694
315 HH22 ARG 41 HH22 ARG 41 -0.516 2.562 12.309
316 H ILE 42 H ILE 42 0.944 -1.471 5.323
317 HA ILE 42 HA ILE 42 2.729 -3.785 5.804
318 HB ILE 42 HB ILE 42 1.763 -3.777 3.526
319 HG12 ILE 42 HG12 ILE 42 4.744 -3.211 3.556
320 HG13 ILE 42 HG13 ILE 42 4.006 -4.750 3.990
321 HG21 ILE 42 HG21 ILE 42 2.436 -2.076 1.895
322 HG22 ILE 42 HG22 ILE 42 3.265 -1.179 3.167
323 HG23 ILE 42 HG23 ILE 42 1.512 -1.364 3.219
324 HD11 ILE 42 HD11 ILE 42 3.123 -4.948 1.712
325 HD12 ILE 42 HD12 ILE 42 4.881 -4.821 1.744
326 HD13 ILE 42 HD13 ILE 42 3.906 -3.424 1.291
327 H ASN 43 H ASN 43 4.963 -3.403 6.021
328 HA ASN 43 HA ASN 43 5.585 -1.001 7.362
329 HB2 ASN 43 HB2 ASN 43 6.645 -3.260 7.746
330 HB3 ASN 43 HB3 ASN 43 7.605 -2.980 6.296
331 HD21 ASN 43 HD21 ASN 43 9.543 -2.954 7.414
332 HD22 ASN 43 HD22 ASN 43 9.988 -1.661 8.467
333 H LYS 44 H LYS 44 7.051 0.652 6.892
334 HA LYS 44 HA LYS 44 6.648 1.799 4.353
335 HB2 LYS 44 HB2 LYS 44 8.142 3.607 5.170
336 HB3 LYS 44 HB3 LYS 44 6.862 3.184 6.299
337 HG2 LYS 44 HG2 LYS 44 8.470 1.840 7.598
338 HG3 LYS 44 HG3 LYS 44 9.751 2.324 6.485
339 HD2 LYS 44 HD2 LYS 44 8.100 4.219 8.168
340 HD3 LYS 44 HD3 LYS 44 9.726 3.664 8.568
341 HE2 LYS 44 HE2 LYS 44 10.594 4.701 6.529
342 HE3 LYS 44 HE3 LYS 44 8.968 5.229 6.095
343 HZ1 LYS 44 HZ1 LYS 44 8.906 6.630 8.020
344 HZ2 LYS 44 HZ2 LYS 44 10.311 6.983 7.147
345 HZ3 LYS 44 HZ3 LYS 44 10.399 6.056 8.558
346 H ASP 45 H ASP 45 9.256 -0.259 5.420
347 HA ASP 45 HA ASP 45 11.108 0.760 3.433
348 HB2 ASP 45 HB2 ASP 45 12.665 -0.915 4.233
349 HB3 ASP 45 HB3 ASP 45 11.941 -0.079 5.600
350 H GLN 46 H GLN 46 8.519 -1.383 3.360
351 HA GLN 46 HA GLN 46 9.571 -3.210 1.374
352 HB2 GLN 46 HB2 GLN 46 6.689 -2.803 2.203
353 HB3 GLN 46 HB3 GLN 46 7.368 -4.209 1.395
354 HG2 GLN 46 HG2 GLN 46 8.160 -3.319 4.154
355 HG3 GLN 46 HG3 GLN 46 6.894 -4.495 3.832
356 HE21 GLN 46 HE21 GLN 46 8.032 -6.056 5.001
357 HE22 GLN 46 HE22 GLN 46 9.423 -6.844 4.351
358 H VAL 47 H VAL 47 7.831 -0.187 1.353
359 HA VAL 47 HA VAL 47 6.608 -0.577 -1.213
360 HB VAL 47 HB VAL 47 5.497 0.826 0.415
361 HG11 VAL 47 HG11 VAL 47 7.839 2.717 0.156
362 HG12 VAL 47 HG12 VAL 47 7.451 1.732 1.566
363 HG13 VAL 47 HG13 VAL 47 6.358 3.021 1.065
364 HG21 VAL 47 HG21 VAL 47 6.412 2.414 -1.992
365 HG22 VAL 47 HG22 VAL 47 4.992 2.769 -1.007
366 HG23 VAL 47 HG23 VAL 47 5.064 1.276 -1.943
367 H ARG 48 H ARG 48 7.532 -0.401 -3.106
368 HA ARG 48 HA ARG 48 10.009 1.031 -3.551
369 HB2 ARG 48 HB2 ARG 48 9.537 -1.074 -4.737
370 HB3 ARG 48 HB3 ARG 48 8.125 -0.347 -5.487
371 HG2 ARG 48 HG2 ARG 48 9.622 1.266 -6.638
372 HG3 ARG 48 HG3 ARG 48 11.006 0.417 -5.947
373 HD2 ARG 48 HD2 ARG 48 10.300 -1.647 -7.076
374 HD3 ARG 48 HD3 ARG 48 8.924 -0.794 -7.774
375 HE ARG 48 HE ARG 48 11.543 0.304 -8.379
376 HH11 ARG 48 HH11 ARG 48 8.935 -1.706 -9.420
377 HH12 ARG 48 HH12 ARG 48 9.453 -1.699 -11.067
378 HH21 ARG 48 HH21 ARG 48 12.189 0.276 -10.501
379 HH22 ARG 48 HH22 ARG 48 11.262 -0.606 -11.668
380 H THR 49 H THR 49 6.774 1.227 -5.043
381 HA THR 49 HA THR 49 6.892 4.154 -5.047
382 HB THR 49 HB THR 49 6.125 4.241 -7.431
383 HG1 THR 49 HG1 THR 49 6.253 2.417 -8.694
384 HG21 THR 49 HG21 THR 49 8.469 4.699 -6.889
385 HG22 THR 49 HG22 THR 49 8.327 3.889 -8.450
386 HG23 THR 49 HG23 THR 49 8.846 2.981 -7.029
387 H VAL 50 H VAL 50 4.879 5.171 -5.125
388 HA VAL 50 HA VAL 50 2.493 3.416 -5.011
389 HB VAL 50 HB VAL 50 2.884 6.121 -3.694
390 HG11 VAL 50 HG11 VAL 50 0.524 4.225 -3.594
391 HG12 VAL 50 HG12 VAL 50 0.567 5.788 -4.410
392 HG13 VAL 50 HG13 VAL 50 0.690 5.708 -2.653
393 HG21 VAL 50 HG21 VAL 50 2.668 3.367 -2.460
394 HG22 VAL 50 HG22 VAL 50 2.781 4.889 -1.576
395 HG23 VAL 50 HG23 VAL 50 4.135 4.341 -2.564
396 H LYS 51 H LYS 51 1.195 3.602 -6.737
397 HA LYS 51 HA LYS 51 1.020 6.212 -8.111
398 HB2 LYS 51 HB2 LYS 51 1.391 3.498 -9.379
399 HB3 LYS 51 HB3 LYS 51 0.817 4.899 -10.273
400 HG2 LYS 51 HG2 LYS 51 2.891 6.086 -9.766
401 HG3 LYS 51 HG3 LYS 51 3.476 4.683 -8.867
402 HD2 LYS 51 HD2 LYS 51 3.680 3.380 -10.805
403 HD3 LYS 51 HD3 LYS 51 2.616 4.436 -11.735
404 HE2 LYS 51 HE2 LYS 51 5.377 5.162 -10.745
405 HE3 LYS 51 HE3 LYS 51 4.971 4.685 -12.396
406 HZ1 LYS 51 HZ1 LYS 51 5.041 7.031 -12.351
407 HZ2 LYS 51 HZ2 LYS 51 4.090 7.124 -10.953
408 HZ3 LYS 51 HZ3 LYS 51 3.409 6.617 -12.419
409 H ASP 52 H ASP 52 -0.991 6.938 -8.290
410 HA ASP 52 HA ASP 52 -3.311 5.265 -7.992
411 HB2 ASP 52 HB2 ASP 52 -3.184 8.087 -9.103
412 HB3 ASP 52 HB3 ASP 52 -4.597 7.269 -8.445
413 H LEU 53 H LEU 53 -4.394 4.199 -9.597
414 HA LEU 53 HA LEU 53 -3.313 4.045 -12.215
415 HB2 LEU 53 HB2 LEU 53 -5.988 3.113 -11.158
416 HB3 LEU 53 HB3 LEU 53 -5.347 2.705 -12.741
417 HG LEU 53 HG LEU 53 -4.130 1.922 -10.082
418 HD11 LEU 53 HD11 LEU 53 -5.505 0.248 -12.185
419 HD12 LEU 53 HD12 LEU 53 -6.158 0.670 -10.603
420 HD13 LEU 53 HD13 LEU 53 -4.730 -0.356 -10.720
421 HD21 LEU 53 HD21 LEU 53 -2.402 2.326 -11.759
422 HD22 LEU 53 HD22 LEU 53 -3.236 1.264 -12.894
423 HD23 LEU 53 HD23 LEU 53 -2.545 0.604 -11.410
424 H LEU 54 H LEU 54 -5.754 6.051 -10.782
425 HA LEU 54 HA LEU 54 -6.453 7.250 -13.358
426 HB2 LEU 54 HB2 LEU 54 -7.381 7.968 -10.567
427 HB3 LEU 54 HB3 LEU 54 -8.016 8.627 -12.062
428 HG LEU 54 HG LEU 54 -8.240 5.736 -11.196
429 HD11 LEU 54 HD11 LEU 54 -10.618 6.227 -10.901
430 HD12 LEU 54 HD12 LEU 54 -10.318 7.925 -11.274
431 HD13 LEU 54 HD13 LEU 54 -9.618 7.201 -9.824
432 HD21 LEU 54 HD21 LEU 54 -8.137 5.967 -13.627
433 HD22 LEU 54 HD22 LEU 54 -9.432 7.164 -13.576
434 HD23 LEU 54 HD23 LEU 54 -9.752 5.496 -13.101
435 H GLU 55 H GLU 55 -4.388 8.098 -13.870
436 HA GLU 55 HA GLU 55 -3.371 10.221 -12.090
437 HB2 GLU 55 HB2 GLU 55 -1.255 9.723 -13.720
438 HB3 GLU 55 HB3 GLU 55 -1.525 8.928 -12.180
439 HG2 GLU 55 HG2 GLU 55 -0.939 7.269 -13.782
440 HG3 GLU 55 HG3 GLU 55 -2.642 7.065 -13.388
Start of MODEL 15
1 H1 MET 1 H1 MET 1 -15.739 10.421 -3.661
2 H2 MET 1 H2 MET 1 -14.103 10.684 -4.010
3 H3 MET 1 H3 MET 1 -14.553 10.006 -2.528
4 HA MET 1 HA MET 1 -15.387 8.042 -3.618
5 HB2 MET 1 HB2 MET 1 -16.052 9.069 -5.736
6 HB3 MET 1 HB3 MET 1 -14.370 9.398 -6.131
7 HG2 MET 1 HG2 MET 1 -13.927 6.979 -6.191
8 HG3 MET 1 HG3 MET 1 -15.631 6.673 -5.847
9 HE1 MET 1 HE1 MET 1 -14.072 5.425 -8.351
10 HE2 MET 1 HE2 MET 1 -15.271 5.637 -9.625
11 HE3 MET 1 HE3 MET 1 -15.772 5.110 -8.018
12 H ALA 2 H ALA 2 -14.017 6.395 -3.199
13 HA ALA 2 HA ALA 2 -11.298 6.777 -2.618
14 HB1 ALA 2 HB1 ALA 2 -11.167 4.346 -2.440
15 HB2 ALA 2 HB2 ALA 2 -12.712 4.187 -3.279
16 HB3 ALA 2 HB3 ALA 2 -12.643 4.949 -1.691
17 H SER 3 H SER 3 -9.610 7.072 -3.952
18 HA SER 3 HA SER 3 -9.782 6.336 -6.767
19 HB2 SER 3 HB2 SER 3 -7.569 7.735 -5.229
20 HB3 SER 3 HB3 SER 3 -7.598 7.498 -6.975
21 HG SER 3 HG SER 3 -8.900 9.344 -5.425
22 HA PRO 4 HA PRO 4 -7.845 2.378 -5.882
23 HB2 PRO 4 HB2 PRO 4 -7.473 1.635 -8.497
24 HB3 PRO 4 HB3 PRO 4 -9.009 1.478 -7.638
25 HG2 PRO 4 HG2 PRO 4 -8.101 3.630 -9.519
26 HG3 PRO 4 HG3 PRO 4 -9.672 2.811 -9.429
27 HD2 PRO 4 HD2 PRO 4 -9.303 5.266 -8.393
28 HD3 PRO 4 HD3 PRO 4 -10.372 4.081 -7.612
29 H THR 5 H THR 5 -5.788 2.264 -5.213
30 HA THR 5 HA THR 5 -3.649 3.458 -6.880
31 HB THR 5 HB THR 5 -3.682 3.112 -3.867
32 HG1 THR 5 HG1 THR 5 -4.540 5.141 -5.477
33 HG21 THR 5 HG21 THR 5 -1.596 4.358 -5.671
34 HG22 THR 5 HG22 THR 5 -1.429 2.852 -4.768
35 HG23 THR 5 HG23 THR 5 -1.574 4.383 -3.908
36 H VAL 6 H VAL 6 -2.157 2.075 -7.666
37 HA VAL 6 HA VAL 6 -1.876 -0.578 -6.429
38 HB VAL 6 HB VAL 6 -2.206 -0.534 -8.880
39 HG11 VAL 6 HG11 VAL 6 -1.094 1.581 -9.398
40 HG12 VAL 6 HG12 VAL 6 -0.428 0.266 -10.367
41 HG13 VAL 6 HG13 VAL 6 0.467 0.874 -8.975
42 HG21 VAL 6 HG21 VAL 6 -1.014 -2.401 -7.858
43 HG22 VAL 6 HG22 VAL 6 0.514 -1.539 -8.019
44 HG23 VAL 6 HG23 VAL 6 -0.363 -2.055 -9.459
45 H ILE 7 H ILE 7 -0.134 -1.116 -5.246
46 HA ILE 7 HA ILE 7 2.052 0.864 -5.051
47 HB ILE 7 HB ILE 7 1.143 -1.173 -3.003
48 HG12 ILE 7 HG12 ILE 7 0.853 1.849 -3.067
49 HG13 ILE 7 HG13 ILE 7 -0.450 0.686 -3.278
50 HG21 ILE 7 HG21 ILE 7 2.717 -0.047 -1.480
51 HG22 ILE 7 HG22 ILE 7 3.277 0.964 -2.813
52 HG23 ILE 7 HG23 ILE 7 3.547 -0.781 -2.853
53 HD11 ILE 7 HD11 ILE 7 -0.476 1.629 -1.052
54 HD12 ILE 7 HD12 ILE 7 1.179 1.087 -0.779
55 HD13 ILE 7 HD13 ILE 7 -0.113 -0.095 -0.983
56 H THR 8 H THR 8 3.883 0.280 -6.040
57 HA THR 8 HA THR 8 4.617 -2.508 -6.424
58 HB THR 8 HB THR 8 6.301 -0.038 -6.963
59 HG1 THR 8 HG1 THR 8 4.330 -1.345 -8.524
60 HG21 THR 8 HG21 THR 8 7.584 -2.131 -6.863
61 HG22 THR 8 HG22 THR 8 7.528 -1.496 -8.509
62 HG23 THR 8 HG23 THR 8 6.500 -2.854 -8.051
63 H LEU 9 H LEU 9 5.848 -3.678 -5.001
64 HA LEU 9 HA LEU 9 6.837 -2.299 -2.628
65 HB2 LEU 9 HB2 LEU 9 6.563 -5.239 -3.242
66 HB3 LEU 9 HB3 LEU 9 7.181 -4.600 -1.730
67 HG LEU 9 HG LEU 9 4.371 -4.306 -2.810
68 HD11 LEU 9 HD11 LEU 9 4.903 -6.486 -1.826
69 HD12 LEU 9 HD12 LEU 9 3.759 -5.589 -0.828
70 HD13 LEU 9 HD13 LEU 9 5.455 -5.688 -0.351
71 HD21 LEU 9 HD21 LEU 9 3.867 -3.097 -0.736
72 HD22 LEU 9 HD22 LEU 9 5.044 -2.224 -1.717
73 HD23 LEU 9 HD23 LEU 9 5.574 -3.126 -0.298
74 H ASN 10 H ASN 10 8.830 -3.404 -1.615
75 HA ASN 10 HA ASN 10 11.095 -2.679 -3.124
76 HB2 ASN 10 HB2 ASN 10 10.851 -2.647 -0.618
77 HB3 ASN 10 HB3 ASN 10 11.002 -4.398 -0.629
78 HD21 ASN 10 HD21 ASN 10 12.640 -2.263 0.561
79 HD22 ASN 10 HD22 ASN 10 14.243 -2.537 -0.019
80 H ASP 11 H ASP 11 9.726 -5.852 -2.303
81 HA ASP 11 HA ASP 11 11.791 -7.385 -3.535
82 HB2 ASP 11 HB2 ASP 11 10.234 -9.273 -3.263
83 HB3 ASP 11 HB3 ASP 11 10.336 -8.306 -1.790
84 H GLY 12 H GLY 12 8.975 -5.777 -4.766
85 HA2 GLY 12 HA2 GLY 12 9.072 -5.345 -7.212
86 HA3 GLY 12 HA3 GLY 12 9.391 -7.058 -7.408
87 H ARG 13 H ARG 13 7.291 -7.459 -5.138
88 HA ARG 13 HA ARG 13 5.089 -8.014 -6.817
89 HB2 ARG 13 HB2 ARG 13 5.409 -9.241 -4.746
90 HB3 ARG 13 HB3 ARG 13 5.226 -7.766 -3.802
91 HG2 ARG 13 HG2 ARG 13 2.891 -7.583 -4.621
92 HG3 ARG 13 HG3 ARG 13 3.098 -9.126 -5.451
93 HD2 ARG 13 HD2 ARG 13 3.481 -10.249 -3.334
94 HD3 ARG 13 HD3 ARG 13 3.400 -8.709 -2.474
95 HE ARG 13 HE ARG 13 1.047 -9.412 -4.014
96 HH11 ARG 13 HH11 ARG 13 2.595 -9.586 -0.948
97 HH12 ARG 13 HH12 ARG 13 1.107 -9.685 -0.075
98 HH21 ARG 13 HH21 ARG 13 -0.858 -9.574 -2.899
99 HH22 ARG 13 HH22 ARG 13 -0.837 -9.673 -1.174
100 H GLU 14 H GLU 14 3.301 -6.862 -7.385
101 HA GLU 14 HA GLU 14 2.961 -4.179 -6.193
102 HB2 GLU 14 HB2 GLU 14 2.007 -5.208 -8.879
103 HB3 GLU 14 HB3 GLU 14 1.732 -3.587 -8.253
104 HG2 GLU 14 HG2 GLU 14 4.173 -3.222 -8.214
105 HG3 GLU 14 HG3 GLU 14 4.399 -4.814 -8.931
106 H ILE 15 H ILE 15 1.076 -3.672 -5.177
107 HA ILE 15 HA ILE 15 -1.085 -5.699 -5.195
108 HB ILE 15 HB ILE 15 -0.346 -3.804 -2.947
109 HG12 ILE 15 HG12 ILE 15 -0.015 -6.815 -3.154
110 HG13 ILE 15 HG13 ILE 15 1.290 -5.639 -3.252
111 HG21 ILE 15 HG21 ILE 15 -2.438 -5.991 -3.055
112 HG22 ILE 15 HG22 ILE 15 -2.747 -4.254 -3.019
113 HG23 ILE 15 HG23 ILE 15 -2.009 -5.046 -1.628
114 HD11 ILE 15 HD11 ILE 15 -0.459 -6.156 -0.857
115 HD12 ILE 15 HD12 ILE 15 0.822 -4.949 -0.951
116 HD13 ILE 15 HD13 ILE 15 1.215 -6.664 -1.065
117 H GLN 16 H GLN 16 -2.952 -5.037 -6.084
118 HA GLN 16 HA GLN 16 -3.425 -2.219 -6.615
119 HB2 GLN 16 HB2 GLN 16 -5.180 -4.603 -7.244
120 HB3 GLN 16 HB3 GLN 16 -5.371 -2.974 -7.879
121 HG2 GLN 16 HG2 GLN 16 -3.151 -3.206 -8.978
122 HG3 GLN 16 HG3 GLN 16 -3.112 -4.886 -8.440
123 HE21 GLN 16 HE21 GLN 16 -4.534 -2.624 -10.635
124 HE22 GLN 16 HE22 GLN 16 -5.355 -3.780 -11.616
125 H ALA 17 H ALA 17 -4.355 -0.950 -5.155
126 HA ALA 17 HA ALA 17 -6.369 -2.067 -3.307
127 HB1 ALA 17 HB1 ALA 17 -5.853 -0.170 -1.840
128 HB2 ALA 17 HB2 ALA 17 -4.680 0.425 -3.017
129 HB3 ALA 17 HB3 ALA 17 -4.409 -1.115 -2.202
130 H VAL 18 H VAL 18 -8.378 -1.100 -3.109
131 HA VAL 18 HA VAL 18 -9.265 0.555 -5.320
132 HB VAL 18 HB VAL 18 -11.522 0.354 -4.278
133 HG11 VAL 18 HG11 VAL 18 -9.997 -2.217 -4.686
134 HG12 VAL 18 HG12 VAL 18 -10.844 -1.283 -5.916
135 HG13 VAL 18 HG13 VAL 18 -11.756 -2.090 -4.640
136 HG21 VAL 18 HG21 VAL 18 -10.063 -1.306 -2.211
137 HG22 VAL 18 HG22 VAL 18 -11.817 -1.194 -2.370
138 HG23 VAL 18 HG23 VAL 18 -10.879 0.234 -1.934
139 H ASP 19 H ASP 19 -7.993 1.155 -2.272
140 HA ASP 19 HA ASP 19 -9.071 3.902 -2.251
141 HB2 ASP 19 HB2 ASP 19 -9.976 2.272 -0.442
142 HB3 ASP 19 HB3 ASP 19 -8.376 2.395 0.275
143 H THR 20 H THR 20 -7.579 5.473 -1.190
144 HA THR 20 HA THR 20 -4.895 5.002 -2.150
145 HB THR 20 HB THR 20 -4.449 7.340 -1.565
146 HG1 THR 20 HG1 THR 20 -5.541 8.028 0.122
147 HG21 THR 20 HG21 THR 20 -6.154 8.407 -3.005
148 HG22 THR 20 HG22 THR 20 -7.128 6.939 -2.919
149 HG23 THR 20 HG23 THR 20 -5.543 6.906 -3.697
150 HA PRO 21 HA PRO 21 -3.087 3.650 1.618
151 HB2 PRO 21 HB2 PRO 21 -0.481 4.298 1.208
152 HB3 PRO 21 HB3 PRO 21 -1.296 2.993 0.337
153 HG2 PRO 21 HG2 PRO 21 -0.738 5.802 -0.552
154 HG3 PRO 21 HG3 PRO 21 -0.554 4.286 -1.455
155 HD2 PRO 21 HD2 PRO 21 -2.694 5.929 -1.770
156 HD3 PRO 21 HD3 PRO 21 -2.803 4.168 -1.962
157 H LYS 22 H LYS 22 -3.077 4.443 3.606
158 HA LYS 22 HA LYS 22 -2.314 7.244 4.117
159 HB2 LYS 22 HB2 LYS 22 -4.480 6.742 4.990
160 HB3 LYS 22 HB3 LYS 22 -3.929 5.222 5.681
161 HG2 LYS 22 HG2 LYS 22 -2.497 6.527 7.256
162 HG3 LYS 22 HG3 LYS 22 -3.237 8.002 6.630
163 HD2 LYS 22 HD2 LYS 22 -5.403 7.329 7.418
164 HD3 LYS 22 HD3 LYS 22 -4.807 5.720 7.836
165 HE2 LYS 22 HE2 LYS 22 -3.969 8.319 9.132
166 HE3 LYS 22 HE3 LYS 22 -5.052 7.116 9.829
167 HZ1 LYS 22 HZ1 LYS 22 -3.208 5.518 9.766
168 HZ2 LYS 22 HZ2 LYS 22 -2.845 6.866 10.720
169 HZ3 LYS 22 HZ3 LYS 22 -2.182 6.723 9.174
170 H TYR 23 H TYR 23 -0.464 7.711 5.256
171 HA TYR 23 HA TYR 23 1.198 5.475 6.123
172 HB2 TYR 23 HB2 TYR 23 2.321 7.159 4.827
173 HB3 TYR 23 HB3 TYR 23 1.741 8.441 5.885
174 HD1 TYR 23 HD1 TYR 23 3.768 5.283 6.081
175 HD2 TYR 23 HD2 TYR 23 3.207 9.271 7.482
176 HE1 TYR 23 HE1 TYR 23 5.812 5.093 7.438
177 HE2 TYR 23 HE2 TYR 23 5.251 9.087 8.835
178 HH TYR 23 HH TYR 23 7.536 6.742 8.410
179 H ASP 24 H ASP 24 1.226 4.765 8.174
180 HA ASP 24 HA ASP 24 0.323 6.552 10.323
181 HB2 ASP 24 HB2 ASP 24 -0.653 4.273 10.218
182 HB3 ASP 24 HB3 ASP 24 0.957 3.587 10.438
183 H GLU 25 H GLU 25 1.902 7.804 11.106
184 HA GLU 25 HA GLU 25 4.663 7.201 10.792
185 HB2 GLU 25 HB2 GLU 25 3.589 9.490 10.832
186 HB3 GLU 25 HB3 GLU 25 3.465 9.323 12.579
187 HG2 GLU 25 HG2 GLU 25 5.865 9.209 12.787
188 HG3 GLU 25 HG3 GLU 25 6.052 9.204 11.033
189 H GLU 26 H GLU 26 2.392 6.476 13.274
190 HA GLU 26 HA GLU 26 4.165 6.325 15.492
191 HB2 GLU 26 HB2 GLU 26 1.567 4.823 15.112
192 HB3 GLU 26 HB3 GLU 26 2.368 5.176 16.636
193 HG2 GLU 26 HG2 GLU 26 1.066 7.147 14.769
194 HG3 GLU 26 HG3 GLU 26 0.488 6.638 16.353
195 H SER 27 H SER 27 2.906 3.856 13.256
196 HA SER 27 HA SER 27 4.707 1.850 14.443
197 HB2 SER 27 HB2 SER 27 3.361 0.185 13.264
198 HB3 SER 27 HB3 SER 27 2.314 1.255 14.194
199 HG SER 27 HG SER 27 1.575 2.157 12.379
200 H GLY 28 H GLY 28 4.207 3.680 11.515
201 HA2 GLY 28 HA2 GLY 28 5.829 4.030 9.846
202 HA3 GLY 28 HA3 GLY 28 6.699 2.614 10.412
203 H PHE 29 H PHE 29 3.423 1.925 10.075
204 HA PHE 29 HA PHE 29 3.930 0.478 7.574
205 HB2 PHE 29 HB2 PHE 29 1.617 0.287 9.526
206 HB3 PHE 29 HB3 PHE 29 1.814 -0.715 8.095
207 HD1 PHE 29 HD1 PHE 29 4.258 -1.881 8.007
208 HD2 PHE 29 HD2 PHE 29 2.187 -0.687 11.529
209 HE1 PHE 29 HE1 PHE 29 5.546 -3.518 9.314
210 HE2 PHE 29 HE2 PHE 29 3.475 -2.316 12.844
211 HZ PHE 29 HZ PHE 29 5.160 -3.732 11.738
212 H TYR 30 H TYR 30 2.486 0.557 5.795
213 HA TYR 30 HA TYR 30 0.843 2.990 5.602
214 HB2 TYR 30 HB2 TYR 30 2.100 1.183 3.551
215 HB3 TYR 30 HB3 TYR 30 0.742 2.213 3.106
216 HD1 TYR 30 HD1 TYR 30 4.231 2.254 4.385
217 HD2 TYR 30 HD2 TYR 30 1.042 4.532 2.723
218 HE1 TYR 30 HE1 TYR 30 5.765 4.146 4.037
219 HE2 TYR 30 HE2 TYR 30 2.570 6.424 2.367
220 HH TYR 30 HH TYR 30 4.655 7.288 3.200
221 H GLU 31 H GLU 31 -1.306 2.920 5.535
222 HA GLU 31 HA GLU 31 -2.664 0.320 5.648
223 HB2 GLU 31 HB2 GLU 31 -3.727 3.102 6.244
224 HB3 GLU 31 HB3 GLU 31 -4.574 1.591 6.534
225 HG2 GLU 31 HG2 GLU 31 -2.972 0.964 8.227
226 HG3 GLU 31 HG3 GLU 31 -1.997 2.390 7.878
227 H PHE 32 H PHE 32 -3.570 -0.430 3.810
228 HA PHE 32 HA PHE 32 -4.985 1.447 2.075
229 HB2 PHE 32 HB2 PHE 32 -3.979 0.402 0.026
230 HB3 PHE 32 HB3 PHE 32 -2.866 1.375 0.977
231 HD1 PHE 32 HD1 PHE 32 -1.221 0.198 2.496
232 HD2 PHE 32 HD2 PHE 32 -3.512 -1.849 -0.460
233 HE1 PHE 32 HE1 PHE 32 0.377 -1.669 2.552
234 HE2 PHE 32 HE2 PHE 32 -1.919 -3.719 -0.398
235 HZ PHE 32 HZ PHE 32 0.029 -3.631 1.105
236 H LYS 33 H LYS 33 -6.706 0.620 0.963
237 HA LYS 33 HA LYS 33 -7.708 -1.937 1.974
238 HB2 LYS 33 HB2 LYS 33 -9.106 0.068 2.215
239 HB3 LYS 33 HB3 LYS 33 -9.090 0.303 0.475
240 HG2 LYS 33 HG2 LYS 33 -10.287 -1.828 0.188
241 HG3 LYS 33 HG3 LYS 33 -10.331 -2.024 1.941
242 HD2 LYS 33 HD2 LYS 33 -11.581 0.256 0.389
243 HD3 LYS 33 HD3 LYS 33 -12.449 -1.130 1.052
244 HE2 LYS 33 HE2 LYS 33 -11.767 -0.465 3.319
245 HE3 LYS 33 HE3 LYS 33 -10.902 0.919 2.652
246 HZ1 LYS 33 HZ1 LYS 33 -13.048 1.705 1.759
247 HZ2 LYS 33 HZ2 LYS 33 -13.014 1.637 3.449
248 HZ3 LYS 33 HZ3 LYS 33 -13.829 0.444 2.568
249 H GLN 34 H GLN 34 -7.246 -3.676 0.756
250 HA GLN 34 HA GLN 34 -6.574 -3.633 -1.985
251 HB2 GLN 34 HB2 GLN 34 -7.501 -5.949 -0.271
252 HB3 GLN 34 HB3 GLN 34 -6.755 -6.102 -1.857
253 HG2 GLN 34 HG2 GLN 34 -4.699 -5.118 -1.011
254 HG3 GLN 34 HG3 GLN 34 -5.440 -4.884 0.571
255 HE21 GLN 34 HE21 GLN 34 -5.828 -6.692 1.874
256 HE22 GLN 34 HE22 GLN 34 -5.041 -8.203 1.596
257 H LEU 35 H LEU 35 -7.747 -5.208 -3.550
258 HA LEU 35 HA LEU 35 -9.988 -3.988 -4.538
259 HB2 LEU 35 HB2 LEU 35 -9.214 -6.886 -4.880
260 HB3 LEU 35 HB3 LEU 35 -10.309 -5.999 -5.926
261 HG LEU 35 HG LEU 35 -7.368 -5.403 -5.545
262 HD11 LEU 35 HD11 LEU 35 -7.126 -6.189 -7.852
263 HD12 LEU 35 HD12 LEU 35 -8.834 -6.629 -7.881
264 HD13 LEU 35 HD13 LEU 35 -7.727 -7.462 -6.788
265 HD21 LEU 35 HD21 LEU 35 -9.397 -4.132 -7.393
266 HD22 LEU 35 HD22 LEU 35 -7.659 -3.826 -7.411
267 HD23 LEU 35 HD23 LEU 35 -8.619 -3.367 -6.007
268 H ASP 36 H ASP 36 -9.967 -6.892 -2.474
269 HA ASP 36 HA ASP 36 -12.835 -7.162 -2.524
270 HB2 ASP 36 HB2 ASP 36 -10.797 -8.539 -0.757
271 HB3 ASP 36 HB3 ASP 36 -12.472 -9.034 -0.992
272 H GLY 37 H GLY 37 -11.410 -4.707 -1.220
273 HA2 GLY 37 HA2 GLY 37 -11.994 -3.268 0.502
274 HA3 GLY 37 HA3 GLY 37 -13.206 -4.430 1.021
275 H LYS 38 H LYS 38 -10.142 -5.797 0.653
276 HA LYS 38 HA LYS 38 -9.934 -6.310 3.489
277 HB2 LYS 38 HB2 LYS 38 -8.194 -7.169 1.164
278 HB3 LYS 38 HB3 LYS 38 -7.988 -7.715 2.823
279 HG2 LYS 38 HG2 LYS 38 -10.213 -8.738 2.766
280 HG3 LYS 38 HG3 LYS 38 -10.415 -8.194 1.098
281 HD2 LYS 38 HD2 LYS 38 -9.732 -10.560 1.229
282 HD3 LYS 38 HD3 LYS 38 -8.545 -9.568 0.384
283 HE2 LYS 38 HE2 LYS 38 -7.495 -11.177 1.928
284 HE3 LYS 38 HE3 LYS 38 -7.136 -9.506 2.363
285 HZ1 LYS 38 HZ1 LYS 38 -9.260 -11.146 3.633
286 HZ2 LYS 38 HZ2 LYS 38 -8.751 -9.607 4.116
287 HZ3 LYS 38 HZ3 LYS 38 -7.713 -10.934 4.277
288 H GLN 39 H GLN 39 -9.173 -4.615 4.685
289 HA GLN 39 HA GLN 39 -7.050 -2.911 3.798
290 HB2 GLN 39 HB2 GLN 39 -8.679 -2.060 5.380
291 HB3 GLN 39 HB3 GLN 39 -8.264 -3.314 6.543
292 HG2 GLN 39 HG2 GLN 39 -6.022 -2.364 6.772
293 HG3 GLN 39 HG3 GLN 39 -6.431 -1.111 5.601
294 HE21 GLN 39 HE21 GLN 39 -7.797 0.552 6.214
295 HE22 GLN 39 HE22 GLN 39 -8.174 0.874 7.870
296 H THR 40 H THR 40 -4.936 -3.340 3.806
297 HA THR 40 HA THR 40 -3.834 -5.094 5.903
298 HB THR 40 HB THR 40 -3.981 -6.476 3.883
299 HG1 THR 40 HG1 THR 40 -1.560 -6.772 3.662
300 HG21 THR 40 HG21 THR 40 -3.926 -4.729 2.174
301 HG22 THR 40 HG22 THR 40 -2.660 -5.921 1.880
302 HG23 THR 40 HG23 THR 40 -2.252 -4.358 2.586
303 H ARG 41 H ARG 41 -1.445 -4.811 6.157
304 HA ARG 41 HA ARG 41 -0.578 -2.083 5.453
305 HB2 ARG 41 HB2 ARG 41 -0.582 -3.278 8.234
306 HB3 ARG 41 HB3 ARG 41 0.239 -1.785 7.797
307 HG2 ARG 41 HG2 ARG 41 -1.868 -0.738 7.240
308 HG3 ARG 41 HG3 ARG 41 -2.731 -2.249 7.532
309 HD2 ARG 41 HD2 ARG 41 -1.170 -0.698 9.603
310 HD3 ARG 41 HD3 ARG 41 -2.926 -0.678 9.423
311 HE ARG 41 HE ARG 41 -2.512 -3.272 9.742
312 HH11 ARG 41 HH11 ARG 41 -1.172 -0.620 11.489
313 HH12 ARG 41 HH12 ARG 41 -0.986 -1.539 12.939
314 HH21 ARG 41 HH21 ARG 41 -2.278 -4.425 11.606
315 HH22 ARG 41 HH22 ARG 41 -1.614 -3.659 13.010
316 H ILE 42 H ILE 42 1.587 -1.806 5.132
317 HA ILE 42 HA ILE 42 3.448 -3.943 5.895
318 HB ILE 42 HB ILE 42 2.711 -4.350 3.529
319 HG12 ILE 42 HG12 ILE 42 5.640 -3.608 3.794
320 HG13 ILE 42 HG13 ILE 42 4.930 -5.091 4.420
321 HG21 ILE 42 HG21 ILE 42 2.405 -2.026 2.834
322 HG22 ILE 42 HG22 ILE 42 3.516 -2.867 1.752
323 HG23 ILE 42 HG23 ILE 42 4.142 -1.749 2.964
324 HD11 ILE 42 HD11 ILE 42 6.064 -5.480 2.317
325 HD12 ILE 42 HD12 ILE 42 5.047 -4.275 1.525
326 HD13 ILE 42 HD13 ILE 42 4.331 -5.762 2.149
327 H ASN 43 H ASN 43 5.718 -3.220 5.931
328 HA ASN 43 HA ASN 43 5.868 -0.736 7.263
329 HB2 ASN 43 HB2 ASN 43 7.319 -2.769 7.661
330 HB3 ASN 43 HB3 ASN 43 8.234 -2.305 6.228
331 HD21 ASN 43 HD21 ASN 43 10.119 -1.853 7.272
332 HD22 ASN 43 HD22 ASN 43 10.308 -0.547 8.390
333 H LYS 44 H LYS 44 7.198 1.108 6.803
334 HA LYS 44 HA LYS 44 6.611 2.207 4.267
335 HB2 LYS 44 HB2 LYS 44 7.726 4.211 5.062
336 HB3 LYS 44 HB3 LYS 44 6.710 3.532 6.328
337 HG2 LYS 44 HG2 LYS 44 8.687 2.566 7.402
338 HG3 LYS 44 HG3 LYS 44 9.710 3.240 6.130
339 HD2 LYS 44 HD2 LYS 44 8.919 5.514 6.778
340 HD3 LYS 44 HD3 LYS 44 8.039 4.784 8.121
341 HE2 LYS 44 HE2 LYS 44 10.145 5.654 8.924
342 HE3 LYS 44 HE3 LYS 44 10.180 3.893 8.993
343 HZ1 LYS 44 HZ1 LYS 44 11.429 5.583 6.895
344 HZ2 LYS 44 HZ2 LYS 44 11.427 3.890 6.909
345 HZ3 LYS 44 HZ3 LYS 44 12.241 4.744 8.118
346 H ASP 45 H ASP 45 9.317 0.321 5.210
347 HA ASP 45 HA ASP 45 11.127 1.514 3.270
348 HB2 ASP 45 HB2 ASP 45 12.733 -0.187 3.993
349 HB3 ASP 45 HB3 ASP 45 12.044 0.655 5.373
350 H GLN 46 H GLN 46 8.625 -0.729 3.170
351 HA GLN 46 HA GLN 46 9.760 -2.335 1.018
352 HB2 GLN 46 HB2 GLN 46 7.001 -2.432 2.257
353 HB3 GLN 46 HB3 GLN 46 7.676 -3.610 1.137
354 HG2 GLN 46 HG2 GLN 46 8.670 -3.010 3.916
355 HG3 GLN 46 HG3 GLN 46 7.767 -4.436 3.411
356 HE21 GLN 46 HE21 GLN 46 10.418 -4.150 4.618
357 HE22 GLN 46 HE22 GLN 46 11.500 -4.974 3.556
358 H VAL 47 H VAL 47 7.549 0.364 1.376
359 HA VAL 47 HA VAL 47 6.299 0.065 -1.170
360 HB VAL 47 HB VAL 47 5.176 1.359 0.524
361 HG11 VAL 47 HG11 VAL 47 7.123 2.225 1.721
362 HG12 VAL 47 HG12 VAL 47 5.995 3.520 1.316
363 HG13 VAL 47 HG13 VAL 47 7.474 3.313 0.375
364 HG21 VAL 47 HG21 VAL 47 6.038 3.116 -1.779
365 HG22 VAL 47 HG22 VAL 47 4.634 3.402 -0.749
366 HG23 VAL 47 HG23 VAL 47 4.696 1.972 -1.780
367 H ARG 48 H ARG 48 7.377 0.138 -3.014
368 HA ARG 48 HA ARG 48 9.780 1.706 -3.376
369 HB2 ARG 48 HB2 ARG 48 9.564 -0.546 -4.356
370 HB3 ARG 48 HB3 ARG 48 8.220 0.009 -5.344
371 HG2 ARG 48 HG2 ARG 48 9.736 1.584 -6.486
372 HG3 ARG 48 HG3 ARG 48 11.076 0.965 -5.518
373 HD2 ARG 48 HD2 ARG 48 9.394 -0.639 -7.450
374 HD3 ARG 48 HD3 ARG 48 11.026 -0.046 -7.752
375 HE ARG 48 HE ARG 48 10.336 -2.084 -5.724
376 HH11 ARG 48 HH11 ARG 48 12.587 -0.651 -7.915
377 HH12 ARG 48 HH12 ARG 48 13.730 -1.944 -7.750
378 HH21 ARG 48 HH21 ARG 48 11.853 -3.708 -5.501
379 HH22 ARG 48 HH22 ARG 48 13.332 -3.622 -6.394
380 H THR 49 H THR 49 6.692 1.555 -5.196
381 HA THR 49 HA THR 49 6.765 4.472 -5.549
382 HB THR 49 HB THR 49 6.166 4.240 -7.961
383 HG1 THR 49 HG1 THR 49 6.518 2.202 -8.947
384 HG21 THR 49 HG21 THR 49 8.487 4.739 -7.356
385 HG22 THR 49 HG22 THR 49 8.422 3.707 -8.783
386 HG23 THR 49 HG23 THR 49 8.832 3.016 -7.215
387 H VAL 50 H VAL 50 4.817 5.425 -5.448
388 HA VAL 50 HA VAL 50 2.407 3.728 -5.298
389 HB VAL 50 HB VAL 50 2.848 6.574 -4.339
390 HG11 VAL 50 HG11 VAL 50 0.468 4.749 -3.966
391 HG12 VAL 50 HG12 VAL 50 0.520 6.208 -4.955
392 HG13 VAL 50 HG13 VAL 50 0.682 6.325 -3.204
393 HG21 VAL 50 HG21 VAL 50 4.106 4.984 -3.000
394 HG22 VAL 50 HG22 VAL 50 2.664 3.990 -2.782
395 HG23 VAL 50 HG23 VAL 50 2.737 5.605 -2.077
396 H LYS 51 H LYS 51 0.983 3.771 -6.951
397 HA LYS 51 HA LYS 51 0.633 6.220 -8.541
398 HB2 LYS 51 HB2 LYS 51 1.196 3.486 -9.721
399 HB3 LYS 51 HB3 LYS 51 0.601 4.856 -10.647
400 HG2 LYS 51 HG2 LYS 51 2.650 6.098 -10.129
401 HG3 LYS 51 HG3 LYS 51 3.243 4.722 -9.193
402 HD2 LYS 51 HD2 LYS 51 3.223 3.325 -11.197
403 HD3 LYS 51 HD3 LYS 51 2.564 4.660 -12.142
404 HE2 LYS 51 HE2 LYS 51 4.599 5.960 -11.728
405 HE3 LYS 51 HE3 LYS 51 5.254 4.634 -10.767
406 HZ1 LYS 51 HZ1 LYS 51 6.117 4.637 -13.033
407 HZ2 LYS 51 HZ2 LYS 51 4.553 4.471 -13.650
408 HZ3 LYS 51 HZ3 LYS 51 5.236 3.234 -12.719
409 H ASP 52 H ASP 52 -1.456 6.524 -9.327
410 HA ASP 52 HA ASP 52 -3.514 4.724 -8.337
411 HB2 ASP 52 HB2 ASP 52 -3.683 7.354 -9.825
412 HB3 ASP 52 HB3 ASP 52 -5.089 6.430 -9.308
413 H LEU 53 H LEU 53 -4.895 3.481 -9.564
414 HA LEU 53 HA LEU 53 -4.027 2.539 -12.096
415 HB2 LEU 53 HB2 LEU 53 -6.680 2.175 -10.687
416 HB3 LEU 53 HB3 LEU 53 -6.164 1.271 -12.099
417 HG LEU 53 HG LEU 53 -4.828 1.199 -9.383
418 HD11 LEU 53 HD11 LEU 53 -6.515 -0.870 -10.798
419 HD12 LEU 53 HD12 LEU 53 -6.988 0.068 -9.381
420 HD13 LEU 53 HD13 LEU 53 -5.669 -1.096 -9.268
421 HD21 LEU 53 HD21 LEU 53 -3.483 -0.622 -10.320
422 HD22 LEU 53 HD22 LEU 53 -3.218 0.891 -11.188
423 HD23 LEU 53 HD23 LEU 53 -4.233 -0.366 -11.897
424 H LEU 54 H LEU 54 -6.046 5.175 -11.186
425 HA LEU 54 HA LEU 54 -7.416 5.410 -13.716
426 HB2 LEU 54 HB2 LEU 54 -7.154 7.360 -11.420
427 HB3 LEU 54 HB3 LEU 54 -8.208 7.576 -12.808
428 HG LEU 54 HG LEU 54 -8.430 5.370 -10.749
429 HD11 LEU 54 HD11 LEU 54 -10.501 6.487 -10.091
430 HD12 LEU 54 HD12 LEU 54 -10.177 7.782 -11.244
431 HD13 LEU 54 HD13 LEU 54 -9.103 7.536 -9.866
432 HD21 LEU 54 HD21 LEU 54 -9.133 4.600 -12.954
433 HD22 LEU 54 HD22 LEU 54 -10.192 6.001 -13.122
434 HD23 LEU 54 HD23 LEU 54 -10.521 4.790 -11.886
435 H GLU 55 H GLU 55 -4.280 5.976 -12.844
436 HA GLU 55 HA GLU 55 -3.794 8.408 -14.314
437 HB2 GLU 55 HB2 GLU 55 -1.906 6.334 -13.173
438 HB3 GLU 55 HB3 GLU 55 -1.382 7.828 -13.935
439 HG2 GLU 55 HG2 GLU 55 -3.119 7.660 -11.475
440 HG3 GLU 55 HG3 GLU 55 -1.379 7.943 -11.476
Start of MODEL 16
1 H1 MET 1 H1 MET 1 -12.376 9.931 0.017
2 H2 MET 1 H2 MET 1 -13.227 11.219 -0.666
3 H3 MET 1 H3 MET 1 -11.636 10.910 -1.146
4 HA MET 1 HA MET 1 -13.959 9.126 -1.591
5 HB2 MET 1 HB2 MET 1 -12.407 10.892 -3.501
6 HB3 MET 1 HB3 MET 1 -13.570 9.676 -4.010
7 HG2 MET 1 HG2 MET 1 -14.532 11.920 -4.016
8 HG3 MET 1 HG3 MET 1 -15.351 10.861 -2.866
9 HE1 MET 1 HE1 MET 1 -16.465 13.021 -1.716
10 HE2 MET 1 HE2 MET 1 -15.626 14.057 -2.871
11 HE3 MET 1 HE3 MET 1 -15.526 14.401 -1.146
12 H ALA 2 H ALA 2 -13.520 7.193 -2.727
13 HA ALA 2 HA ALA 2 -10.887 6.098 -2.256
14 HB1 ALA 2 HB1 ALA 2 -11.846 3.987 -2.997
15 HB2 ALA 2 HB2 ALA 2 -13.297 4.821 -3.558
16 HB3 ALA 2 HB3 ALA 2 -12.916 4.773 -1.837
17 H SER 3 H SER 3 -9.725 4.882 -3.970
18 HA SER 3 HA SER 3 -10.060 5.670 -6.719
19 HB2 SER 3 HB2 SER 3 -9.091 7.746 -5.885
20 HB3 SER 3 HB3 SER 3 -7.781 6.864 -5.106
21 HG SER 3 HG SER 3 -6.990 6.298 -7.144
22 HA PRO 4 HA PRO 4 -7.991 1.637 -6.820
23 HB2 PRO 4 HB2 PRO 4 -7.611 1.743 -9.596
24 HB3 PRO 4 HB3 PRO 4 -9.009 1.049 -8.772
25 HG2 PRO 4 HG2 PRO 4 -8.689 3.751 -10.010
26 HG3 PRO 4 HG3 PRO 4 -10.103 2.680 -9.996
27 HD2 PRO 4 HD2 PRO 4 -9.976 4.818 -8.391
28 HD3 PRO 4 HD3 PRO 4 -10.706 3.298 -7.831
29 H THR 5 H THR 5 -5.933 1.539 -6.161
30 HA THR 5 HA THR 5 -3.869 3.147 -7.539
31 HB THR 5 HB THR 5 -4.133 2.841 -4.532
32 HG1 THR 5 HG1 THR 5 -5.618 4.350 -5.142
33 HG21 THR 5 HG21 THR 5 -2.294 4.481 -4.428
34 HG22 THR 5 HG22 THR 5 -2.156 4.429 -6.185
35 HG23 THR 5 HG23 THR 5 -1.794 2.991 -5.228
36 H VAL 6 H VAL 6 -1.869 2.159 -7.762
37 HA VAL 6 HA VAL 6 -1.712 -0.631 -6.824
38 HB VAL 6 HB VAL 6 -1.584 -0.450 -9.245
39 HG11 VAL 6 HG11 VAL 6 0.845 1.296 -8.822
40 HG12 VAL 6 HG12 VAL 6 -0.717 1.820 -9.454
41 HG13 VAL 6 HG13 VAL 6 0.271 0.683 -10.374
42 HG21 VAL 6 HG21 VAL 6 0.522 -1.661 -9.616
43 HG22 VAL 6 HG22 VAL 6 -0.312 -2.228 -8.168
44 HG23 VAL 6 HG23 VAL 6 1.088 -1.163 -8.021
45 H ILE 7 H ILE 7 -0.488 -0.980 -5.119
46 HA ILE 7 HA ILE 7 1.726 0.821 -4.473
47 HB ILE 7 HB ILE 7 0.608 -1.514 -2.899
48 HG12 ILE 7 HG12 ILE 7 0.215 1.475 -2.551
49 HG13 ILE 7 HG13 ILE 7 -0.998 0.343 -3.138
50 HG21 ILE 7 HG21 ILE 7 1.909 -0.615 -1.017
51 HG22 ILE 7 HG22 ILE 7 2.590 0.618 -2.077
52 HG23 ILE 7 HG23 ILE 7 2.957 -1.085 -2.356
53 HD11 ILE 7 HD11 ILE 7 -1.406 0.901 -0.831
54 HD12 ILE 7 HD12 ILE 7 0.221 0.385 -0.388
55 HD13 ILE 7 HD13 ILE 7 -0.953 -0.798 -0.967
56 H THR 8 H THR 8 3.488 0.375 -5.648
57 HA THR 8 HA THR 8 4.253 -2.352 -6.297
58 HB THR 8 HB THR 8 5.684 0.262 -6.861
59 HG1 THR 8 HG1 THR 8 4.449 -1.253 -8.868
60 HG21 THR 8 HG21 THR 8 7.237 -1.621 -6.888
61 HG22 THR 8 HG22 THR 8 6.950 -1.041 -8.529
62 HG23 THR 8 HG23 THR 8 6.161 -2.514 -7.964
63 H LEU 9 H LEU 9 5.407 -3.569 -4.915
64 HA LEU 9 HA LEU 9 6.876 -2.387 -2.722
65 HB2 LEU 9 HB2 LEU 9 6.682 -5.290 -3.550
66 HB3 LEU 9 HB3 LEU 9 7.326 -4.685 -2.031
67 HG LEU 9 HG LEU 9 4.450 -4.505 -2.950
68 HD11 LEU 9 HD11 LEU 9 5.099 -6.745 -2.243
69 HD12 LEU 9 HD12 LEU 9 4.001 -6.010 -1.076
70 HD13 LEU 9 HD13 LEU 9 5.727 -6.098 -0.726
71 HD21 LEU 9 HD21 LEU 9 4.000 -3.565 -0.722
72 HD22 LEU 9 HD22 LEU 9 5.048 -2.519 -1.682
73 HD23 LEU 9 HD23 LEU 9 5.734 -3.516 -0.400
74 H ASN 10 H ASN 10 9.141 -2.946 -2.262
75 HA ASN 10 HA ASN 10 10.780 -2.045 -4.359
76 HB2 ASN 10 HB2 ASN 10 11.269 -1.679 -1.969
77 HB3 ASN 10 HB3 ASN 10 11.607 -3.396 -1.778
78 HD21 ASN 10 HD21 ASN 10 12.711 -0.401 -3.181
79 HD22 ASN 10 HD22 ASN 10 14.336 -0.916 -3.464
80 H ASP 11 H ASP 11 10.187 -5.323 -3.165
81 HA ASP 11 HA ASP 11 12.200 -6.547 -4.785
82 HB2 ASP 11 HB2 ASP 11 9.804 -7.688 -3.346
83 HB3 ASP 11 HB3 ASP 11 10.995 -8.672 -4.192
84 H GLY 12 H GLY 12 9.212 -5.210 -5.628
85 HA2 GLY 12 HA2 GLY 12 8.997 -5.031 -8.092
86 HA3 GLY 12 HA3 GLY 12 9.242 -6.764 -8.152
87 H ARG 13 H ARG 13 7.425 -7.270 -5.843
88 HA ARG 13 HA ARG 13 5.127 -7.863 -7.285
89 HB2 ARG 13 HB2 ARG 13 5.610 -8.988 -5.183
90 HB3 ARG 13 HB3 ARG 13 5.390 -7.486 -4.290
91 HG2 ARG 13 HG2 ARG 13 3.029 -7.429 -4.973
92 HG3 ARG 13 HG3 ARG 13 3.253 -8.940 -5.849
93 HD2 ARG 13 HD2 ARG 13 3.816 -10.063 -3.723
94 HD3 ARG 13 HD3 ARG 13 3.527 -8.544 -2.867
95 HE ARG 13 HE ARG 13 1.265 -9.175 -4.405
96 HH11 ARG 13 HH11 ARG 13 2.900 -10.268 -1.578
97 HH12 ARG 13 HH12 ARG 13 1.464 -10.929 -0.879
98 HH21 ARG 13 HH21 ARG 13 -0.561 -10.028 -3.500
99 HH22 ARG 13 HH22 ARG 13 -0.470 -10.804 -1.956
100 H GLU 14 H GLU 14 3.263 -6.852 -7.789
101 HA GLU 14 HA GLU 14 2.870 -4.089 -6.844
102 HB2 GLU 14 HB2 GLU 14 1.687 -5.518 -9.246
103 HB3 GLU 14 HB3 GLU 14 1.405 -3.834 -8.821
104 HG2 GLU 14 HG2 GLU 14 3.733 -3.297 -9.197
105 HG3 GLU 14 HG3 GLU 14 4.112 -4.995 -9.472
106 H ILE 15 H ILE 15 1.178 -3.617 -5.547
107 HA ILE 15 HA ILE 15 -0.855 -5.713 -5.083
108 HB ILE 15 HB ILE 15 0.033 -3.503 -3.206
109 HG12 ILE 15 HG12 ILE 15 0.512 -6.501 -3.095
110 HG13 ILE 15 HG13 ILE 15 1.725 -5.281 -3.468
111 HG21 ILE 15 HG21 ILE 15 -1.389 -4.603 -1.536
112 HG22 ILE 15 HG22 ILE 15 -1.917 -5.770 -2.748
113 HG23 ILE 15 HG23 ILE 15 -2.336 -4.066 -2.924
114 HD11 ILE 15 HD11 ILE 15 1.927 -6.075 -1.183
115 HD12 ILE 15 HD12 ILE 15 0.269 -5.574 -0.847
116 HD13 ILE 15 HD13 ILE 15 1.501 -4.365 -1.219
117 H GLN 16 H GLN 16 -2.951 -5.272 -5.482
118 HA GLN 16 HA GLN 16 -3.628 -2.614 -6.527
119 HB2 GLN 16 HB2 GLN 16 -5.076 -5.265 -6.695
120 HB3 GLN 16 HB3 GLN 16 -5.665 -3.766 -7.401
121 HG2 GLN 16 HG2 GLN 16 -3.773 -3.671 -8.896
122 HG3 GLN 16 HG3 GLN 16 -3.046 -5.078 -8.122
123 HE21 GLN 16 HE21 GLN 16 -5.626 -3.963 -10.186
124 HE22 GLN 16 HE22 GLN 16 -6.034 -5.511 -10.834
125 H ALA 17 H ALA 17 -4.630 -1.191 -5.256
126 HA ALA 17 HA ALA 17 -6.475 -2.161 -3.155
127 HB1 ALA 17 HB1 ALA 17 -5.833 -0.220 -1.807
128 HB2 ALA 17 HB2 ALA 17 -4.701 0.284 -3.063
129 HB3 ALA 17 HB3 ALA 17 -4.435 -1.223 -2.189
130 H VAL 18 H VAL 18 -8.326 -0.852 -2.710
131 HA VAL 18 HA VAL 18 -9.361 0.515 -5.057
132 HB VAL 18 HB VAL 18 -11.510 0.567 -3.864
133 HG11 VAL 18 HG11 VAL 18 -10.162 -2.132 -3.743
134 HG12 VAL 18 HG12 VAL 18 -10.932 -1.419 -5.161
135 HG13 VAL 18 HG13 VAL 18 -11.903 -1.851 -3.752
136 HG21 VAL 18 HG21 VAL 18 -9.992 -0.712 -1.585
137 HG22 VAL 18 HG22 VAL 18 -11.745 -0.531 -1.668
138 HG23 VAL 18 HG23 VAL 18 -10.713 0.897 -1.587
139 H ASP 19 H ASP 19 -7.751 1.433 -2.224
140 HA ASP 19 HA ASP 19 -8.278 4.234 -2.837
141 HB2 ASP 19 HB2 ASP 19 -8.332 4.668 -0.273
142 HB3 ASP 19 HB3 ASP 19 -9.797 4.121 -1.082
143 H THR 20 H THR 20 -6.718 5.705 -1.612
144 HA THR 20 HA THR 20 -4.059 4.697 -2.105
145 HB THR 20 HB THR 20 -3.351 7.052 -1.526
146 HG1 THR 20 HG1 THR 20 -5.284 7.436 -0.188
147 HG21 THR 20 HG21 THR 20 -5.500 6.763 -3.638
148 HG22 THR 20 HG22 THR 20 -3.788 6.382 -3.846
149 HG23 THR 20 HG23 THR 20 -4.295 8.047 -3.560
150 HA PRO 21 HA PRO 21 -3.152 3.536 2.043
151 HB2 PRO 21 HB2 PRO 21 -0.450 3.424 1.935
152 HB3 PRO 21 HB3 PRO 21 -1.485 2.254 1.107
153 HG2 PRO 21 HG2 PRO 21 -0.106 4.677 -0.002
154 HG3 PRO 21 HG3 PRO 21 -0.206 3.041 -0.682
155 HD2 PRO 21 HD2 PRO 21 -1.808 5.069 -1.518
156 HD3 PRO 21 HD3 PRO 21 -2.344 3.376 -1.500
157 H LYS 22 H LYS 22 -3.263 4.728 3.847
158 HA LYS 22 HA LYS 22 -2.033 7.365 4.030
159 HB2 LYS 22 HB2 LYS 22 -4.318 6.811 4.968
160 HB3 LYS 22 HB3 LYS 22 -3.515 5.819 6.179
161 HG2 LYS 22 HG2 LYS 22 -2.220 7.938 6.800
162 HG3 LYS 22 HG3 LYS 22 -3.411 8.803 5.832
163 HD2 LYS 22 HD2 LYS 22 -3.874 7.179 8.334
164 HD3 LYS 22 HD3 LYS 22 -4.129 8.906 8.099
165 HE2 LYS 22 HE2 LYS 22 -6.289 8.062 8.019
166 HE3 LYS 22 HE3 LYS 22 -5.864 8.168 6.312
167 HZ1 LYS 22 HZ1 LYS 22 -6.961 6.060 7.022
168 HZ2 LYS 22 HZ2 LYS 22 -5.572 5.688 7.911
169 HZ3 LYS 22 HZ3 LYS 22 -5.483 5.846 6.231
170 H TYR 23 H TYR 23 -0.264 7.892 5.358
171 HA TYR 23 HA TYR 23 1.261 5.602 6.387
172 HB2 TYR 23 HB2 TYR 23 2.461 7.045 4.830
173 HB3 TYR 23 HB3 TYR 23 2.134 8.451 5.837
174 HD1 TYR 23 HD1 TYR 23 3.607 5.024 6.260
175 HD2 TYR 23 HD2 TYR 23 3.915 9.182 7.134
176 HE1 TYR 23 HE1 TYR 23 5.690 4.603 7.494
177 HE2 TYR 23 HE2 TYR 23 6.000 8.771 8.371
178 HH TYR 23 HH TYR 23 7.170 6.989 9.484
179 H ASP 24 H ASP 24 1.488 5.215 8.485
180 HA ASP 24 HA ASP 24 0.875 7.340 10.443
181 HB2 ASP 24 HB2 ASP 24 -0.517 5.301 10.623
182 HB3 ASP 24 HB3 ASP 24 0.939 4.327 10.810
183 H GLU 25 H GLU 25 2.688 8.321 11.208
184 HA GLU 25 HA GLU 25 5.289 7.335 10.744
185 HB2 GLU 25 HB2 GLU 25 4.812 9.722 10.997
186 HB3 GLU 25 HB3 GLU 25 4.397 9.474 12.688
187 HG2 GLU 25 HG2 GLU 25 6.697 8.775 13.154
188 HG3 GLU 25 HG3 GLU 25 7.113 9.012 11.458
189 H GLU 26 H GLU 26 3.207 7.064 13.572
190 HA GLU 26 HA GLU 26 5.192 6.320 15.446
191 HB2 GLU 26 HB2 GLU 26 2.272 5.527 15.493
192 HB3 GLU 26 HB3 GLU 26 3.368 5.616 16.867
193 HG2 GLU 26 HG2 GLU 26 3.559 8.055 16.511
194 HG3 GLU 26 HG3 GLU 26 2.381 7.929 15.203
195 H SER 27 H SER 27 2.895 4.299 13.609
196 HA SER 27 HA SER 27 4.180 1.851 14.503
197 HB2 SER 27 HB2 SER 27 1.932 2.177 12.497
198 HB3 SER 27 HB3 SER 27 2.400 0.696 13.334
199 HG SER 27 HG SER 27 1.040 2.947 14.296
200 H GLY 28 H GLY 28 4.213 3.896 11.687
201 HA2 GLY 28 HA2 GLY 28 5.764 3.914 9.961
202 HA3 GLY 28 HA3 GLY 28 6.415 2.399 10.558
203 H PHE 29 H PHE 29 3.055 2.249 10.145
204 HA PHE 29 HA PHE 29 3.438 0.637 7.711
205 HB2 PHE 29 HB2 PHE 29 1.194 0.601 9.746
206 HB3 PHE 29 HB3 PHE 29 1.263 -0.413 8.310
207 HD1 PHE 29 HD1 PHE 29 3.339 -1.947 8.084
208 HD2 PHE 29 HD2 PHE 29 2.091 -0.170 11.744
209 HE1 PHE 29 HE1 PHE 29 4.589 -3.656 9.337
210 HE2 PHE 29 HE2 PHE 29 3.343 -1.870 13.001
211 HZ PHE 29 HZ PHE 29 4.596 -3.617 11.797
212 H TYR 30 H TYR 30 1.940 0.737 5.995
213 HA TYR 30 HA TYR 30 0.417 3.235 5.746
214 HB2 TYR 30 HB2 TYR 30 1.407 1.228 3.715
215 HB3 TYR 30 HB3 TYR 30 0.215 2.457 3.306
216 HD1 TYR 30 HD1 TYR 30 3.726 1.910 4.339
217 HD2 TYR 30 HD2 TYR 30 0.848 4.737 2.969
218 HE1 TYR 30 HE1 TYR 30 5.526 3.517 3.874
219 HE2 TYR 30 HE2 TYR 30 2.645 6.347 2.504
220 HH TYR 30 HH TYR 30 4.945 6.797 3.224
221 H GLU 31 H GLU 31 -1.782 3.243 5.619
222 HA GLU 31 HA GLU 31 -3.191 0.684 5.955
223 HB2 GLU 31 HB2 GLU 31 -4.270 3.502 6.214
224 HB3 GLU 31 HB3 GLU 31 -5.087 2.021 6.686
225 HG2 GLU 31 HG2 GLU 31 -3.484 1.653 8.459
226 HG3 GLU 31 HG3 GLU 31 -2.561 3.071 7.950
227 H PHE 32 H PHE 32 -4.073 -0.228 4.176
228 HA PHE 32 HA PHE 32 -5.492 1.457 2.260
229 HB2 PHE 32 HB2 PHE 32 -4.394 0.448 0.309
230 HB3 PHE 32 HB3 PHE 32 -3.244 1.325 1.308
231 HD1 PHE 32 HD1 PHE 32 -1.713 0.019 2.836
232 HD2 PHE 32 HD2 PHE 32 -4.099 -1.843 -0.167
233 HE1 PHE 32 HE1 PHE 32 -0.282 -1.977 2.931
234 HE2 PHE 32 HE2 PHE 32 -2.666 -3.838 -0.072
235 HZ PHE 32 HZ PHE 32 -0.753 -3.906 1.478
236 H LYS 33 H LYS 33 -6.997 0.338 0.946
237 HA LYS 33 HA LYS 33 -7.851 -2.238 2.113
238 HB2 LYS 33 HB2 LYS 33 -9.325 -0.191 2.259
239 HB3 LYS 33 HB3 LYS 33 -9.495 -0.271 0.513
240 HG2 LYS 33 HG2 LYS 33 -10.491 -2.515 0.743
241 HG3 LYS 33 HG3 LYS 33 -10.377 -2.363 2.497
242 HD2 LYS 33 HD2 LYS 33 -11.961 -0.552 0.661
243 HD3 LYS 33 HD3 LYS 33 -12.632 -1.823 1.679
244 HE2 LYS 33 HE2 LYS 33 -12.998 0.233 2.817
245 HE3 LYS 33 HE3 LYS 33 -11.692 -0.587 3.667
246 HZ1 LYS 33 HZ1 LYS 33 -10.111 0.878 2.759
247 HZ2 LYS 33 HZ2 LYS 33 -11.393 1.862 3.244
248 HZ3 LYS 33 HZ3 LYS 33 -11.183 1.486 1.607
249 H GLN 34 H GLN 34 -7.289 -3.949 0.886
250 HA GLN 34 HA GLN 34 -6.588 -3.820 -1.848
251 HB2 GLN 34 HB2 GLN 34 -7.352 -6.213 -0.157
252 HB3 GLN 34 HB3 GLN 34 -6.629 -6.310 -1.757
253 HG2 GLN 34 HG2 GLN 34 -4.634 -5.144 -0.918
254 HG3 GLN 34 HG3 GLN 34 -5.358 -5.081 0.688
255 HE21 GLN 34 HE21 GLN 34 -5.465 -6.975 1.917
256 HE22 GLN 34 HE22 GLN 34 -4.571 -8.394 1.498
257 H LEU 35 H LEU 35 -7.645 -5.171 -3.593
258 HA LEU 35 HA LEU 35 -10.111 -4.108 -4.273
259 HB2 LEU 35 HB2 LEU 35 -8.879 -6.677 -5.261
260 HB3 LEU 35 HB3 LEU 35 -10.225 -5.858 -6.029
261 HG LEU 35 HG LEU 35 -7.404 -4.802 -5.760
262 HD11 LEU 35 HD11 LEU 35 -7.632 -6.556 -7.433
263 HD12 LEU 35 HD12 LEU 35 -7.365 -4.988 -8.198
264 HD13 LEU 35 HD13 LEU 35 -8.982 -5.694 -8.174
265 HD21 LEU 35 HD21 LEU 35 -8.168 -2.916 -7.129
266 HD22 LEU 35 HD22 LEU 35 -9.006 -2.973 -5.579
267 HD23 LEU 35 HD23 LEU 35 -9.823 -3.520 -7.042
268 H ASP 36 H ASP 36 -9.510 -7.026 -2.433
269 HA ASP 36 HA ASP 36 -12.167 -8.090 -2.709
270 HB2 ASP 36 HB2 ASP 36 -10.157 -9.494 -2.291
271 HB3 ASP 36 HB3 ASP 36 -10.014 -8.776 -0.689
272 H GLY 37 H GLY 37 -10.938 -5.521 -0.924
273 HA2 GLY 37 HA2 GLY 37 -12.287 -4.183 0.536
274 HA3 GLY 37 HA3 GLY 37 -13.153 -5.632 1.021
275 H LYS 38 H LYS 38 -10.102 -6.634 0.966
276 HA LYS 38 HA LYS 38 -9.819 -6.732 3.793
277 HB2 LYS 38 HB2 LYS 38 -7.813 -7.400 1.620
278 HB3 LYS 38 HB3 LYS 38 -7.700 -7.885 3.308
279 HG2 LYS 38 HG2 LYS 38 -9.599 -9.314 3.109
280 HG3 LYS 38 HG3 LYS 38 -9.975 -8.690 1.502
281 HD2 LYS 38 HD2 LYS 38 -8.918 -10.881 1.346
282 HD3 LYS 38 HD3 LYS 38 -7.875 -9.641 0.647
283 HE2 LYS 38 HE2 LYS 38 -6.517 -9.609 2.666
284 HE3 LYS 38 HE3 LYS 38 -7.590 -10.781 3.433
285 HZ1 LYS 38 HZ1 LYS 38 -6.979 -12.391 1.746
286 HZ2 LYS 38 HZ2 LYS 38 -5.603 -11.825 2.553
287 HZ3 LYS 38 HZ3 LYS 38 -5.960 -11.266 1.001
288 H GLN 39 H GLN 39 -9.478 -4.779 4.800
289 HA GLN 39 HA GLN 39 -7.519 -2.884 3.812
290 HB2 GLN 39 HB2 GLN 39 -9.584 -2.122 4.943
291 HB3 GLN 39 HB3 GLN 39 -9.063 -2.919 6.421
292 HG2 GLN 39 HG2 GLN 39 -7.097 -1.425 6.499
293 HG3 GLN 39 HG3 GLN 39 -7.696 -0.597 5.062
294 HE21 GLN 39 HE21 GLN 39 -7.920 1.364 6.115
295 HE22 GLN 39 HE22 GLN 39 -9.149 1.653 7.291
296 H THR 40 H THR 40 -5.410 -3.391 4.026
297 HA THR 40 HA THR 40 -4.506 -4.614 6.566
298 HB THR 40 HB THR 40 -4.420 -6.293 4.782
299 HG1 THR 40 HG1 THR 40 -2.818 -6.648 6.204
300 HG21 THR 40 HG21 THR 40 -4.144 -4.836 2.840
301 HG22 THR 40 HG22 THR 40 -2.858 -6.041 2.897
302 HG23 THR 40 HG23 THR 40 -2.533 -4.380 3.392
303 H ARG 41 H ARG 41 -2.130 -4.334 6.946
304 HA ARG 41 HA ARG 41 -1.250 -1.638 6.108
305 HB2 ARG 41 HB2 ARG 41 -1.125 -2.895 8.861
306 HB3 ARG 41 HB3 ARG 41 -0.357 -1.372 8.431
307 HG2 ARG 41 HG2 ARG 41 -2.426 -0.283 8.132
308 HG3 ARG 41 HG3 ARG 41 -3.315 -1.808 8.093
309 HD2 ARG 41 HD2 ARG 41 -1.850 -0.731 10.511
310 HD3 ARG 41 HD3 ARG 41 -3.584 -0.561 10.230
311 HE ARG 41 HE ARG 41 -3.509 -3.127 10.141
312 HH11 ARG 41 HH11 ARG 41 -1.559 -1.170 12.209
313 HH12 ARG 41 HH12 ARG 41 -1.349 -2.426 13.375
314 HH21 ARG 41 HH21 ARG 41 -3.239 -4.717 11.662
315 HH22 ARG 41 HH22 ARG 41 -2.265 -4.409 13.060
316 H ILE 42 H ILE 42 0.824 -1.459 5.418
317 HA ILE 42 HA ILE 42 2.720 -3.650 6.000
318 HB ILE 42 HB ILE 42 1.777 -3.887 3.706
319 HG12 ILE 42 HG12 ILE 42 4.720 -3.167 3.714
320 HG13 ILE 42 HG13 ILE 42 4.067 -4.691 4.309
321 HG21 ILE 42 HG21 ILE 42 1.433 -1.514 3.213
322 HG22 ILE 42 HG22 ILE 42 2.397 -2.296 1.960
323 HG23 ILE 42 HG23 ILE 42 3.179 -1.267 3.162
324 HD11 ILE 42 HD11 ILE 42 3.226 -5.196 2.072
325 HD12 ILE 42 HD12 ILE 42 4.971 -4.936 2.076
326 HD13 ILE 42 HD13 ILE 42 3.893 -3.673 1.481
327 H ASN 43 H ASN 43 4.944 -3.051 6.102
328 HA ASN 43 HA ASN 43 5.301 -0.462 7.252
329 HB2 ASN 43 HB2 ASN 43 6.450 -2.499 8.077
330 HB3 ASN 43 HB3 ASN 43 7.416 -2.528 6.604
331 HD21 ASN 43 HD21 ASN 43 9.354 -2.251 7.682
332 HD22 ASN 43 HD22 ASN 43 9.797 -0.765 8.438
333 H LYS 44 H LYS 44 6.806 1.160 6.670
334 HA LYS 44 HA LYS 44 6.575 2.071 4.049
335 HB2 LYS 44 HB2 LYS 44 8.179 3.824 4.687
336 HB3 LYS 44 HB3 LYS 44 6.957 3.568 5.925
337 HG2 LYS 44 HG2 LYS 44 8.507 2.343 7.296
338 HG3 LYS 44 HG3 LYS 44 9.723 2.373 6.019
339 HD2 LYS 44 HD2 LYS 44 9.862 4.816 6.205
340 HD3 LYS 44 HD3 LYS 44 8.632 4.793 7.472
341 HE2 LYS 44 HE2 LYS 44 10.925 4.982 8.375
342 HE3 LYS 44 HE3 LYS 44 10.100 3.524 8.925
343 HZ1 LYS 44 HZ1 LYS 44 12.056 3.628 6.691
344 HZ2 LYS 44 HZ2 LYS 44 11.319 2.240 7.312
345 HZ3 LYS 44 HZ3 LYS 44 12.409 3.121 8.260
346 H ASP 45 H ASP 45 9.139 0.076 5.428
347 HA ASP 45 HA ASP 45 11.113 0.748 3.486
348 HB2 ASP 45 HB2 ASP 45 12.384 -1.142 4.369
349 HB3 ASP 45 HB3 ASP 45 11.728 -0.157 5.668
350 H GLN 46 H GLN 46 8.333 -1.133 3.226
351 HA GLN 46 HA GLN 46 9.372 -2.968 1.223
352 HB2 GLN 46 HB2 GLN 46 6.568 -2.524 2.268
353 HB3 GLN 46 HB3 GLN 46 7.026 -3.790 1.138
354 HG2 GLN 46 HG2 GLN 46 8.230 -3.523 3.882
355 HG3 GLN 46 HG3 GLN 46 6.789 -4.480 3.548
356 HE21 GLN 46 HE21 GLN 46 7.774 -6.393 4.153
357 HE22 GLN 46 HE22 GLN 46 8.992 -7.157 3.195
358 H VAL 47 H VAL 47 7.713 0.121 1.249
359 HA VAL 47 HA VAL 47 6.508 -0.252 -1.337
360 HB VAL 47 HB VAL 47 5.381 1.153 0.301
361 HG11 VAL 47 HG11 VAL 47 7.702 3.060 -0.012
362 HG12 VAL 47 HG12 VAL 47 7.300 2.133 1.432
363 HG13 VAL 47 HG13 VAL 47 6.207 3.394 0.864
364 HG21 VAL 47 HG21 VAL 47 6.259 2.705 -2.138
365 HG22 VAL 47 HG22 VAL 47 4.820 3.028 -1.171
366 HG23 VAL 47 HG23 VAL 47 4.953 1.520 -2.077
367 H ARG 48 H ARG 48 7.500 -0.142 -3.177
368 HA ARG 48 HA ARG 48 10.020 1.198 -3.599
369 HB2 ARG 48 HB2 ARG 48 9.389 -0.976 -4.658
370 HB3 ARG 48 HB3 ARG 48 8.162 -0.136 -5.588
371 HG2 ARG 48 HG2 ARG 48 9.919 1.181 -6.694
372 HG3 ARG 48 HG3 ARG 48 11.140 0.306 -5.766
373 HD2 ARG 48 HD2 ARG 48 10.347 -1.811 -6.771
374 HD3 ARG 48 HD3 ARG 48 9.192 -0.896 -7.740
375 HE ARG 48 HE ARG 48 12.008 -0.208 -8.020
376 HH11 ARG 48 HH11 ARG 48 9.247 -1.814 -9.322
377 HH12 ARG 48 HH12 ARG 48 9.946 -1.971 -10.891
378 HH21 ARG 48 HH21 ARG 48 12.893 -0.441 -10.036
379 HH22 ARG 48 HH22 ARG 48 11.977 -1.208 -11.289
380 H THR 49 H THR 49 6.791 1.465 -5.102
381 HA THR 49 HA THR 49 7.055 4.369 -5.338
382 HB THR 49 HB THR 49 6.346 4.332 -7.743
383 HG1 THR 49 HG1 THR 49 5.596 2.119 -7.743
384 HG21 THR 49 HG21 THR 49 8.701 4.724 -7.178
385 HG22 THR 49 HG22 THR 49 8.546 3.833 -8.692
386 HG23 THR 49 HG23 THR 49 9.003 2.987 -7.213
387 H VAL 50 H VAL 50 5.122 5.378 -5.058
388 HA VAL 50 HA VAL 50 2.676 3.726 -5.016
389 HB VAL 50 HB VAL 50 3.107 6.492 -3.854
390 HG11 VAL 50 HG11 VAL 50 0.774 6.086 -4.469
391 HG12 VAL 50 HG12 VAL 50 0.965 6.130 -2.718
392 HG13 VAL 50 HG13 VAL 50 0.783 4.582 -3.542
393 HG21 VAL 50 HG21 VAL 50 4.431 4.825 -2.661
394 HG22 VAL 50 HG22 VAL 50 3.003 3.809 -2.466
395 HG23 VAL 50 HG23 VAL 50 3.085 5.377 -1.663
396 H LYS 51 H LYS 51 1.567 3.768 -6.878
397 HA LYS 51 HA LYS 51 1.113 6.366 -8.197
398 HB2 LYS 51 HB2 LYS 51 1.914 3.776 -9.532
399 HB3 LYS 51 HB3 LYS 51 1.184 5.114 -10.409
400 HG2 LYS 51 HG2 LYS 51 3.050 6.556 -9.814
401 HG3 LYS 51 HG3 LYS 51 3.778 5.250 -8.873
402 HD2 LYS 51 HD2 LYS 51 4.179 3.948 -10.821
403 HD3 LYS 51 HD3 LYS 51 3.159 4.994 -11.813
404 HE2 LYS 51 HE2 LYS 51 5.745 5.840 -10.499
405 HE3 LYS 51 HE3 LYS 51 5.582 5.361 -12.187
406 HZ1 LYS 51 HZ1 LYS 51 4.301 7.701 -10.877
407 HZ2 LYS 51 HZ2 LYS 51 3.979 7.201 -12.462
408 HZ3 LYS 51 HZ3 LYS 51 5.525 7.733 -12.044
409 H ASP 52 H ASP 52 -0.925 6.724 -8.977
410 HA ASP 52 HA ASP 52 -3.059 4.984 -8.206
411 HB2 ASP 52 HB2 ASP 52 -3.153 7.301 -10.162
412 HB3 ASP 52 HB3 ASP 52 -4.521 6.583 -9.318
413 H LEU 53 H LEU 53 -4.547 3.885 -9.643
414 HA LEU 53 HA LEU 53 -3.329 2.836 -12.068
415 HB2 LEU 53 HB2 LEU 53 -5.962 2.271 -10.698
416 HB3 LEU 53 HB3 LEU 53 -5.472 1.501 -12.196
417 HG LEU 53 HG LEU 53 -3.960 1.290 -9.582
418 HD11 LEU 53 HD11 LEU 53 -4.801 -1.015 -9.507
419 HD12 LEU 53 HD12 LEU 53 -5.808 -0.688 -10.917
420 HD13 LEU 53 HD13 LEU 53 -6.103 0.170 -9.405
421 HD21 LEU 53 HD21 LEU 53 -2.702 -0.476 -10.711
422 HD22 LEU 53 HD22 LEU 53 -2.532 1.063 -11.557
423 HD23 LEU 53 HD23 LEU 53 -3.604 -0.184 -12.198
424 H LEU 54 H LEU 54 -5.093 5.530 -11.296
425 HA LEU 54 HA LEU 54 -6.372 5.729 -13.943
426 HB2 LEU 54 HB2 LEU 54 -6.811 7.406 -11.462
427 HB3 LEU 54 HB3 LEU 54 -7.703 7.544 -12.967
428 HG LEU 54 HG LEU 54 -7.751 5.183 -11.075
429 HD11 LEU 54 HD11 LEU 54 -10.083 5.830 -10.710
430 HD12 LEU 54 HD12 LEU 54 -9.858 7.237 -11.751
431 HD13 LEU 54 HD13 LEU 54 -8.971 7.113 -10.230
432 HD21 LEU 54 HD21 LEU 54 -7.954 4.441 -13.394
433 HD22 LEU 54 HD22 LEU 54 -9.246 5.611 -13.667
434 HD23 LEU 54 HD23 LEU 54 -9.489 4.272 -12.545
435 H GLU 55 H GLU 55 -3.574 6.057 -13.865
436 HA GLU 55 HA GLU 55 -2.894 8.851 -13.713
437 HB2 GLU 55 HB2 GLU 55 -1.355 6.519 -14.883
438 HB3 GLU 55 HB3 GLU 55 -0.717 8.145 -14.702
439 HG2 GLU 55 HG2 GLU 55 -1.053 7.949 -12.248
440 HG3 GLU 55 HG3 GLU 55 -1.538 6.271 -12.489
Start of MODEL 17
1 H1 MET 1 H1 MET 1 -12.482 11.841 -1.263
2 H2 MET 1 H2 MET 1 -10.908 11.259 -1.469
3 H3 MET 1 H3 MET 1 -12.016 10.392 -0.525
4 HA MET 1 HA MET 1 -13.376 9.934 -2.445
5 HB2 MET 1 HB2 MET 1 -11.209 11.427 -3.959
6 HB3 MET 1 HB3 MET 1 -12.515 10.517 -4.709
7 HG2 MET 1 HG2 MET 1 -12.829 12.954 -2.965
8 HG3 MET 1 HG3 MET 1 -12.973 12.907 -4.721
9 HE1 MET 1 HE1 MET 1 -14.521 10.218 -5.250
10 HE2 MET 1 HE2 MET 1 -14.963 11.740 -6.024
11 HE3 MET 1 HE3 MET 1 -16.199 10.760 -5.236
12 H ALA 2 H ALA 2 -13.079 7.779 -2.427
13 HA ALA 2 HA ALA 2 -10.537 6.525 -2.202
14 HB1 ALA 2 HB1 ALA 2 -11.758 4.423 -2.452
15 HB2 ALA 2 HB2 ALA 2 -13.191 5.309 -2.980
16 HB3 ALA 2 HB3 ALA 2 -12.586 5.507 -1.334
17 H SER 3 H SER 3 -9.117 6.824 -3.834
18 HA SER 3 HA SER 3 -9.977 6.263 -6.595
19 HB2 SER 3 HB2 SER 3 -7.876 7.414 -7.279
20 HB3 SER 3 HB3 SER 3 -8.941 8.454 -6.337
21 HG SER 3 HG SER 3 -6.421 7.493 -5.747
22 HA PRO 4 HA PRO 4 -8.091 2.211 -6.143
23 HB2 PRO 4 HB2 PRO 4 -7.771 1.875 -8.922
24 HB3 PRO 4 HB3 PRO 4 -9.168 1.378 -7.964
25 HG2 PRO 4 HG2 PRO 4 -8.769 3.848 -9.598
26 HG3 PRO 4 HG3 PRO 4 -10.231 2.867 -9.383
27 HD2 PRO 4 HD2 PRO 4 -9.961 5.203 -8.123
28 HD3 PRO 4 HD3 PRO 4 -10.704 3.815 -7.294
29 H THR 5 H THR 5 -6.022 1.925 -5.594
30 HA THR 5 HA THR 5 -3.900 3.321 -7.119
31 HB THR 5 HB THR 5 -4.004 2.922 -4.113
32 HG1 THR 5 HG1 THR 5 -5.400 4.607 -4.918
33 HG21 THR 5 HG21 THR 5 -1.958 4.329 -5.843
34 HG22 THR 5 HG22 THR 5 -1.715 2.827 -4.950
35 HG23 THR 5 HG23 THR 5 -1.983 4.338 -4.079
36 H VAL 6 H VAL 6 -2.206 2.054 -7.765
37 HA VAL 6 HA VAL 6 -2.000 -0.658 -6.643
38 HB VAL 6 HB VAL 6 -2.118 -0.505 -9.104
39 HG11 VAL 6 HG11 VAL 6 -1.009 1.631 -9.459
40 HG12 VAL 6 HG12 VAL 6 -0.221 0.362 -10.397
41 HG13 VAL 6 HG13 VAL 6 0.523 0.947 -8.910
42 HG21 VAL 6 HG21 VAL 6 -0.234 -1.994 -9.592
43 HG22 VAL 6 HG22 VAL 6 -0.987 -2.400 -8.049
44 HG23 VAL 6 HG23 VAL 6 0.541 -1.518 -8.080
45 H ILE 7 H ILE 7 -0.474 -1.122 -5.209
46 HA ILE 7 HA ILE 7 1.740 0.774 -4.810
47 HB ILE 7 HB ILE 7 0.711 -1.392 -2.961
48 HG12 ILE 7 HG12 ILE 7 0.429 1.626 -2.849
49 HG13 ILE 7 HG13 ILE 7 -0.860 0.482 -3.205
50 HG21 ILE 7 HG21 ILE 7 2.195 -0.386 -1.275
51 HG22 ILE 7 HG22 ILE 7 2.826 0.718 -2.495
52 HG23 ILE 7 HG23 ILE 7 3.103 -1.016 -2.651
53 HD11 ILE 7 HD11 ILE 7 -0.632 -0.448 -0.949
54 HD12 ILE 7 HD12 ILE 7 -1.025 1.271 -0.933
55 HD13 ILE 7 HD13 ILE 7 0.623 0.740 -0.600
56 H THR 8 H THR 8 3.653 0.256 -5.604
57 HA THR 8 HA THR 8 4.315 -2.555 -6.163
58 HB THR 8 HB THR 8 5.744 -0.036 -7.077
59 HG1 THR 8 HG1 THR 8 3.809 -1.729 -8.304
60 HG21 THR 8 HG21 THR 8 7.233 -1.997 -6.954
61 HG22 THR 8 HG22 THR 8 6.929 -1.523 -8.626
62 HG23 THR 8 HG23 THR 8 6.095 -2.917 -7.941
63 H LEU 9 H LEU 9 5.505 -3.608 -4.714
64 HA LEU 9 HA LEU 9 6.983 -2.215 -2.648
65 HB2 LEU 9 HB2 LEU 9 6.704 -5.182 -3.168
66 HB3 LEU 9 HB3 LEU 9 7.362 -4.448 -1.715
67 HG LEU 9 HG LEU 9 4.497 -4.233 -2.665
68 HD11 LEU 9 HD11 LEU 9 5.049 -6.446 -1.807
69 HD12 LEU 9 HD12 LEU 9 3.969 -5.591 -0.708
70 HD13 LEU 9 HD13 LEU 9 5.687 -5.726 -0.328
71 HD21 LEU 9 HD21 LEU 9 4.072 -3.111 -0.527
72 HD22 LEU 9 HD22 LEU 9 5.200 -2.192 -1.522
73 HD23 LEU 9 HD23 LEU 9 5.797 -3.144 -0.161
74 H ASN 10 H ASN 10 9.222 -3.097 -2.055
75 HA ASN 10 HA ASN 10 10.998 -2.450 -4.156
76 HB2 ASN 10 HB2 ASN 10 11.461 -2.112 -1.726
77 HB3 ASN 10 HB3 ASN 10 11.665 -3.849 -1.552
78 HD21 ASN 10 HD21 ASN 10 12.994 -0.929 -2.898
79 HD22 ASN 10 HD22 ASN 10 14.576 -1.555 -3.194
80 H ASP 11 H ASP 11 9.796 -5.529 -2.985
81 HA ASP 11 HA ASP 11 11.585 -7.266 -4.300
82 HB2 ASP 11 HB2 ASP 11 8.639 -7.651 -3.687
83 HB3 ASP 11 HB3 ASP 11 9.745 -8.935 -4.158
84 H GLY 12 H GLY 12 9.358 -5.082 -5.646
85 HA2 GLY 12 HA2 GLY 12 8.812 -4.770 -7.913
86 HA3 GLY 12 HA3 GLY 12 9.408 -6.387 -8.265
87 H ARG 13 H ARG 13 7.510 -6.515 -5.572
88 HA ARG 13 HA ARG 13 5.348 -7.882 -6.876
89 HB2 ARG 13 HB2 ARG 13 6.188 -8.679 -4.752
90 HB3 ARG 13 HB3 ARG 13 5.881 -7.121 -3.997
91 HG2 ARG 13 HG2 ARG 13 3.470 -7.459 -4.296
92 HG3 ARG 13 HG3 ARG 13 3.790 -9.035 -5.028
93 HD2 ARG 13 HD2 ARG 13 4.833 -9.797 -2.958
94 HD3 ARG 13 HD3 ARG 13 4.570 -8.212 -2.228
95 HE ARG 13 HE ARG 13 2.117 -9.308 -3.116
96 HH11 ARG 13 HH11 ARG 13 4.486 -9.640 -0.642
97 HH12 ARG 13 HH12 ARG 13 3.359 -10.275 0.504
98 HH21 ARG 13 HH21 ARG 13 0.676 -10.110 -1.646
99 HH22 ARG 13 HH22 ARG 13 1.208 -10.520 -0.054
100 H GLU 14 H GLU 14 3.276 -7.143 -7.262
101 HA GLU 14 HA GLU 14 2.707 -4.337 -6.511
102 HB2 GLU 14 HB2 GLU 14 1.843 -5.853 -8.986
103 HB3 GLU 14 HB3 GLU 14 1.303 -4.231 -8.568
104 HG2 GLU 14 HG2 GLU 14 3.560 -3.387 -8.751
105 HG3 GLU 14 HG3 GLU 14 4.173 -5.013 -9.045
106 H ILE 15 H ILE 15 0.956 -3.950 -5.330
107 HA ILE 15 HA ILE 15 -1.204 -5.975 -5.228
108 HB ILE 15 HB ILE 15 -0.337 -4.150 -2.965
109 HG12 ILE 15 HG12 ILE 15 0.028 -7.147 -3.294
110 HG13 ILE 15 HG13 ILE 15 1.309 -5.946 -3.404
111 HG21 ILE 15 HG21 ILE 15 -2.388 -6.372 -3.026
112 HG22 ILE 15 HG22 ILE 15 -2.737 -4.645 -2.948
113 HG23 ILE 15 HG23 ILE 15 -1.918 -5.440 -1.604
114 HD11 ILE 15 HD11 ILE 15 -0.325 -6.580 -0.956
115 HD12 ILE 15 HD12 ILE 15 0.942 -5.355 -1.057
116 HD13 ILE 15 HD13 ILE 15 1.345 -7.061 -1.259
117 H GLN 16 H GLN 16 -3.227 -5.249 -5.697
118 HA GLN 16 HA GLN 16 -3.515 -2.409 -6.369
119 HB2 GLN 16 HB2 GLN 16 -5.260 -4.795 -7.019
120 HB3 GLN 16 HB3 GLN 16 -5.596 -3.144 -7.527
121 HG2 GLN 16 HG2 GLN 16 -3.491 -3.113 -8.793
122 HG3 GLN 16 HG3 GLN 16 -3.181 -4.779 -8.300
123 HE21 GLN 16 HE21 GLN 16 -5.134 -2.702 -10.291
124 HE22 GLN 16 HE22 GLN 16 -5.803 -3.950 -11.278
125 H ALA 17 H ALA 17 -4.674 -1.018 -5.211
126 HA ALA 17 HA ALA 17 -6.533 -2.027 -3.147
127 HB1 ALA 17 HB1 ALA 17 -5.879 -0.128 -1.740
128 HB2 ALA 17 HB2 ALA 17 -4.726 0.391 -2.973
129 HB3 ALA 17 HB3 ALA 17 -4.490 -1.142 -2.133
130 H VAL 18 H VAL 18 -8.189 -0.380 -2.477
131 HA VAL 18 HA VAL 18 -9.334 0.852 -4.874
132 HB VAL 18 HB VAL 18 -11.432 0.991 -3.613
133 HG11 VAL 18 HG11 VAL 18 -10.151 -1.738 -3.421
134 HG12 VAL 18 HG12 VAL 18 -10.937 -1.059 -4.846
135 HG13 VAL 18 HG13 VAL 18 -11.883 -1.404 -3.398
136 HG21 VAL 18 HG21 VAL 18 -9.880 -0.247 -1.329
137 HG22 VAL 18 HG22 VAL 18 -11.627 0.003 -1.367
138 HG23 VAL 18 HG23 VAL 18 -10.538 1.390 -1.375
139 H ASP 19 H ASP 19 -7.748 1.804 -1.969
140 HA ASP 19 HA ASP 19 -8.559 4.603 -2.441
141 HB2 ASP 19 HB2 ASP 19 -8.497 5.019 -0.043
142 HB3 ASP 19 HB3 ASP 19 -9.622 3.712 -0.393
143 H THR 20 H THR 20 -6.999 6.165 -1.346
144 HA THR 20 HA THR 20 -4.289 5.591 -2.156
145 HB THR 20 HB THR 20 -5.428 8.027 -0.750
146 HG1 THR 20 HG1 THR 20 -4.993 7.362 -3.479
147 HG21 THR 20 HG21 THR 20 -3.369 9.168 -1.495
148 HG22 THR 20 HG22 THR 20 -2.746 7.630 -2.092
149 HG23 THR 20 HG23 THR 20 -3.021 7.859 -0.365
150 HA PRO 21 HA PRO 21 -3.233 3.511 1.637
151 HB2 PRO 21 HB2 PRO 21 -0.468 3.981 1.424
152 HB3 PRO 21 HB3 PRO 21 -1.348 2.597 0.772
153 HG2 PRO 21 HG2 PRO 21 -0.492 5.115 -0.589
154 HG3 PRO 21 HG3 PRO 21 -0.530 3.455 -1.215
155 HD2 PRO 21 HD2 PRO 21 -2.395 5.227 -1.927
156 HD3 PRO 21 HD3 PRO 21 -2.832 3.531 -1.616
157 H LYS 22 H LYS 22 -3.193 4.131 3.679
158 HA LYS 22 HA LYS 22 -2.637 6.878 4.418
159 HB2 LYS 22 HB2 LYS 22 -4.563 5.944 5.455
160 HB3 LYS 22 HB3 LYS 22 -3.715 4.466 5.883
161 HG2 LYS 22 HG2 LYS 22 -2.325 5.803 7.479
162 HG3 LYS 22 HG3 LYS 22 -3.354 7.193 7.123
163 HD2 LYS 22 HD2 LYS 22 -5.281 6.092 8.017
164 HD3 LYS 22 HD3 LYS 22 -4.419 4.558 8.149
165 HE2 LYS 22 HE2 LYS 22 -4.628 5.615 10.333
166 HE3 LYS 22 HE3 LYS 22 -2.937 5.540 9.840
167 HZ1 LYS 22 HZ1 LYS 22 -4.687 7.928 9.635
168 HZ2 LYS 22 HZ2 LYS 22 -3.056 7.859 9.194
169 HZ3 LYS 22 HZ3 LYS 22 -3.504 7.678 10.815
170 H TYR 23 H TYR 23 -0.723 7.566 5.164
171 HA TYR 23 HA TYR 23 1.278 5.587 6.018
172 HB2 TYR 23 HB2 TYR 23 2.059 7.061 4.273
173 HB3 TYR 23 HB3 TYR 23 1.556 8.483 5.183
174 HD1 TYR 23 HD1 TYR 23 3.716 5.460 5.749
175 HD2 TYR 23 HD2 TYR 23 3.264 9.675 6.189
176 HE1 TYR 23 HE1 TYR 23 5.950 5.592 6.768
177 HE2 TYR 23 HE2 TYR 23 5.494 9.810 7.211
178 HH TYR 23 HH TYR 23 7.126 8.509 8.261
179 H ASP 24 H ASP 24 1.174 5.176 8.149
180 HA ASP 24 HA ASP 24 0.673 7.384 10.016
181 HB2 ASP 24 HB2 ASP 24 -0.642 5.286 10.260
182 HB3 ASP 24 HB3 ASP 24 0.854 4.412 10.577
183 H GLU 25 H GLU 25 2.414 8.454 10.663
184 HA GLU 25 HA GLU 25 5.075 7.547 10.365
185 HB2 GLU 25 HB2 GLU 25 4.649 9.889 10.288
186 HB3 GLU 25 HB3 GLU 25 3.857 9.871 11.857
187 HG2 GLU 25 HG2 GLU 25 5.956 9.440 12.965
188 HG3 GLU 25 HG3 GLU 25 6.781 9.296 11.414
189 H GLU 26 H GLU 26 2.898 7.616 13.138
190 HA GLU 26 HA GLU 26 4.826 7.161 15.142
191 HB2 GLU 26 HB2 GLU 26 1.913 6.360 15.197
192 HB3 GLU 26 HB3 GLU 26 2.960 6.610 16.588
193 HG2 GLU 26 HG2 GLU 26 3.204 8.991 15.885
194 HG3 GLU 26 HG3 GLU 26 1.989 8.693 14.643
195 H SER 27 H SER 27 2.811 4.866 13.306
196 HA SER 27 HA SER 27 4.064 2.596 14.659
197 HB2 SER 27 HB2 SER 27 1.973 2.577 12.465
198 HB3 SER 27 HB3 SER 27 2.445 1.216 13.484
199 HG SER 27 HG SER 27 0.946 3.510 14.123
200 H GLY 28 H GLY 28 4.232 4.256 11.579
201 HA2 GLY 28 HA2 GLY 28 5.987 4.120 10.041
202 HA3 GLY 28 HA3 GLY 28 6.582 2.695 10.874
203 H PHE 29 H PHE 29 3.256 2.518 10.103
204 HA PHE 29 HA PHE 29 3.879 0.656 7.895
205 HB2 PHE 29 HB2 PHE 29 1.521 0.688 9.797
206 HB3 PHE 29 HB3 PHE 29 1.703 -0.433 8.454
207 HD1 PHE 29 HD1 PHE 29 3.625 -2.059 8.477
208 HD2 PHE 29 HD2 PHE 29 2.558 0.274 11.876
209 HE1 PHE 29 HE1 PHE 29 4.857 -3.615 9.927
210 HE2 PHE 29 HE2 PHE 29 3.792 -1.279 13.330
211 HZ PHE 29 HZ PHE 29 4.944 -3.228 12.356
212 H TYR 30 H TYR 30 2.544 0.559 6.064
213 HA TYR 30 HA TYR 30 0.830 2.891 5.538
214 HB2 TYR 30 HB2 TYR 30 2.184 0.877 3.748
215 HB3 TYR 30 HB3 TYR 30 0.828 1.828 3.156
216 HD1 TYR 30 HD1 TYR 30 4.351 1.941 4.209
217 HD2 TYR 30 HD2 TYR 30 1.051 4.211 2.752
218 HE1 TYR 30 HE1 TYR 30 5.876 3.776 3.622
219 HE2 TYR 30 HE2 TYR 30 2.572 6.052 2.168
220 HH TYR 30 HH TYR 30 5.935 5.697 2.066
221 H GLU 31 H GLU 31 -1.334 2.690 5.476
222 HA GLU 31 HA GLU 31 -2.503 -0.018 5.639
223 HB2 GLU 31 HB2 GLU 31 -3.733 2.623 6.470
224 HB3 GLU 31 HB3 GLU 31 -4.431 1.026 6.717
225 HG2 GLU 31 HG2 GLU 31 -2.448 0.478 8.150
226 HG3 GLU 31 HG3 GLU 31 -1.963 2.167 8.014
227 H PHE 32 H PHE 32 -3.584 -0.746 3.888
228 HA PHE 32 HA PHE 32 -5.100 1.141 2.235
229 HB2 PHE 32 HB2 PHE 32 -4.119 0.240 0.138
230 HB3 PHE 32 HB3 PHE 32 -2.945 1.104 1.122
231 HD1 PHE 32 HD1 PHE 32 -1.301 -0.229 2.508
232 HD2 PHE 32 HD2 PHE 32 -3.776 -2.011 -0.471
233 HE1 PHE 32 HE1 PHE 32 0.198 -2.179 2.429
234 HE2 PHE 32 HE2 PHE 32 -2.278 -3.958 -0.550
235 HZ PHE 32 HZ PHE 32 -0.288 -4.045 0.901
236 H LYS 33 H LYS 33 -6.859 0.255 1.160
237 HA LYS 33 HA LYS 33 -7.573 -2.475 1.988
238 HB2 LYS 33 HB2 LYS 33 -9.135 -0.643 2.538
239 HB3 LYS 33 HB3 LYS 33 -9.299 -0.275 0.827
240 HG2 LYS 33 HG2 LYS 33 -10.320 -2.442 0.427
241 HG3 LYS 33 HG3 LYS 33 -10.093 -2.884 2.121
242 HD2 LYS 33 HD2 LYS 33 -11.827 -0.638 1.071
243 HD3 LYS 33 HD3 LYS 33 -12.392 -2.176 1.728
244 HE2 LYS 33 HE2 LYS 33 -11.363 -1.596 3.901
245 HE3 LYS 33 HE3 LYS 33 -10.871 -0.040 3.234
246 HZ1 LYS 33 HZ1 LYS 33 -13.252 0.428 2.835
247 HZ2 LYS 33 HZ2 LYS 33 -12.870 0.245 4.473
248 HZ3 LYS 33 HZ3 LYS 33 -13.647 -1.005 3.642
249 H GLN 34 H GLN 34 -7.158 -4.042 0.579
250 HA GLN 34 HA GLN 34 -6.554 -3.729 -2.140
251 HB2 GLN 34 HB2 GLN 34 -7.591 -6.202 -0.729
252 HB3 GLN 34 HB3 GLN 34 -6.770 -6.176 -2.283
253 HG2 GLN 34 HG2 GLN 34 -4.733 -5.390 -1.234
254 HG3 GLN 34 HG3 GLN 34 -5.543 -5.301 0.328
255 HE21 GLN 34 HE21 GLN 34 -4.139 -6.754 1.289
256 HE22 GLN 34 HE22 GLN 34 -4.136 -8.440 0.921
257 H LEU 35 H LEU 35 -7.764 -4.764 -3.987
258 HA LEU 35 HA LEU 35 -10.272 -3.579 -4.384
259 HB2 LEU 35 HB2 LEU 35 -9.116 -5.983 -5.809
260 HB3 LEU 35 HB3 LEU 35 -10.457 -5.011 -6.384
261 HG LEU 35 HG LEU 35 -7.602 -4.062 -6.052
262 HD11 LEU 35 HD11 LEU 35 -7.595 -3.947 -8.497
263 HD12 LEU 35 HD12 LEU 35 -9.218 -4.637 -8.538
264 HD13 LEU 35 HD13 LEU 35 -7.867 -5.593 -7.927
265 HD21 LEU 35 HD21 LEU 35 -10.036 -2.614 -7.115
266 HD22 LEU 35 HD22 LEU 35 -8.378 -2.016 -7.185
267 HD23 LEU 35 HD23 LEU 35 -9.166 -2.247 -5.626
268 H ASP 36 H ASP 36 -9.447 -6.652 -2.980
269 HA ASP 36 HA ASP 36 -12.023 -7.870 -3.156
270 HB2 ASP 36 HB2 ASP 36 -9.705 -8.433 -1.291
271 HB3 ASP 36 HB3 ASP 36 -11.113 -9.472 -1.497
272 H GLY 37 H GLY 37 -11.086 -5.220 -1.367
273 HA2 GLY 37 HA2 GLY 37 -12.274 -4.073 0.279
274 HA3 GLY 37 HA3 GLY 37 -13.318 -5.472 0.475
275 H LYS 38 H LYS 38 -9.873 -5.865 0.597
276 HA LYS 38 HA LYS 38 -10.046 -6.354 3.504
277 HB2 LYS 38 HB2 LYS 38 -8.200 -7.635 1.472
278 HB3 LYS 38 HB3 LYS 38 -8.193 -7.962 3.201
279 HG2 LYS 38 HG2 LYS 38 -10.557 -8.751 2.990
280 HG3 LYS 38 HG3 LYS 38 -10.410 -8.570 1.242
281 HD2 LYS 38 HD2 LYS 38 -8.750 -10.388 2.999
282 HD3 LYS 38 HD3 LYS 38 -10.049 -10.889 1.916
283 HE2 LYS 38 HE2 LYS 38 -8.742 -10.013 0.005
284 HE3 LYS 38 HE3 LYS 38 -7.426 -9.620 1.113
285 HZ1 LYS 38 HZ1 LYS 38 -8.490 -12.321 0.495
286 HZ2 LYS 38 HZ2 LYS 38 -7.353 -12.007 1.706
287 HZ3 LYS 38 HZ3 LYS 38 -6.964 -11.709 0.092
288 H GLN 39 H GLN 39 -9.119 -4.782 4.651
289 HA GLN 39 HA GLN 39 -7.005 -3.139 3.482
290 HB2 GLN 39 HB2 GLN 39 -8.886 -2.047 4.647
291 HB3 GLN 39 HB3 GLN 39 -8.444 -2.870 6.136
292 HG2 GLN 39 HG2 GLN 39 -6.309 -1.682 6.174
293 HG3 GLN 39 HG3 GLN 39 -6.725 -0.870 4.665
294 HE21 GLN 39 HE21 GLN 39 -6.118 0.267 7.278
295 HE22 GLN 39 HE22 GLN 39 -7.488 1.218 7.711
296 H THR 40 H THR 40 -4.974 -3.854 3.659
297 HA THR 40 HA THR 40 -4.180 -5.289 6.125
298 HB THR 40 HB THR 40 -4.011 -6.705 4.133
299 HG1 THR 40 HG1 THR 40 -2.382 -6.798 5.872
300 HG21 THR 40 HG21 THR 40 -2.414 -6.197 2.346
301 HG22 THR 40 HG22 THR 40 -2.052 -4.645 3.103
302 HG23 THR 40 HG23 THR 40 -3.662 -4.954 2.451
303 H ARG 41 H ARG 41 -1.836 -5.055 6.714
304 HA ARG 41 HA ARG 41 -0.928 -2.274 6.283
305 HB2 ARG 41 HB2 ARG 41 -0.930 -3.876 8.855
306 HB3 ARG 41 HB3 ARG 41 -0.173 -2.297 8.662
307 HG2 ARG 41 HG2 ARG 41 -2.315 -1.278 8.204
308 HG3 ARG 41 HG3 ARG 41 -3.109 -2.851 8.247
309 HD2 ARG 41 HD2 ARG 41 -2.703 -3.079 10.588
310 HD3 ARG 41 HD3 ARG 41 -1.634 -1.673 10.601
311 HE ARG 41 HE ARG 41 -3.666 -0.356 10.008
312 HH11 ARG 41 HH11 ARG 41 -4.028 -3.366 11.657
313 HH12 ARG 41 HH12 ARG 41 -5.534 -2.897 12.369
314 HH21 ARG 41 HH21 ARG 41 -5.584 0.201 10.906
315 HH22 ARG 41 HH22 ARG 41 -6.401 -0.912 11.955
316 H ILE 42 H ILE 42 1.151 -1.999 5.729
317 HA ILE 42 HA ILE 42 3.070 -4.194 6.181
318 HB ILE 42 HB ILE 42 2.215 -4.331 3.853
319 HG12 ILE 42 HG12 ILE 42 5.117 -3.460 4.009
320 HG13 ILE 42 HG13 ILE 42 4.524 -5.063 4.425
321 HG21 ILE 42 HG21 ILE 42 1.729 -1.967 3.488
322 HG22 ILE 42 HG22 ILE 42 2.789 -2.594 2.224
323 HG23 ILE 42 HG23 ILE 42 3.454 -1.597 3.518
324 HD11 ILE 42 HD11 ILE 42 5.516 -5.047 2.221
325 HD12 ILE 42 HD12 ILE 42 4.403 -3.780 1.705
326 HD13 ILE 42 HD13 ILE 42 3.788 -5.382 2.115
327 H ASN 43 H ASN 43 5.310 -3.525 6.234
328 HA ASN 43 HA ASN 43 5.685 -1.087 7.635
329 HB2 ASN 43 HB2 ASN 43 7.009 -3.245 7.889
330 HB3 ASN 43 HB3 ASN 43 7.874 -2.789 6.426
331 HD21 ASN 43 HD21 ASN 43 8.898 -3.174 9.098
332 HD22 ASN 43 HD22 ASN 43 9.642 -1.685 9.552
333 H LYS 44 H LYS 44 6.854 0.781 7.075
334 HA LYS 44 HA LYS 44 6.350 1.791 4.487
335 HB2 LYS 44 HB2 LYS 44 7.571 3.795 5.237
336 HB3 LYS 44 HB3 LYS 44 6.401 3.249 6.428
337 HG2 LYS 44 HG2 LYS 44 8.124 2.311 7.804
338 HG3 LYS 44 HG3 LYS 44 9.345 2.604 6.565
339 HD2 LYS 44 HD2 LYS 44 7.770 4.767 7.980
340 HD3 LYS 44 HD3 LYS 44 9.400 4.260 8.422
341 HE2 LYS 44 HE2 LYS 44 10.200 4.914 6.192
342 HE3 LYS 44 HE3 LYS 44 8.569 5.429 5.763
343 HZ1 LYS 44 HZ1 LYS 44 8.669 7.114 7.465
344 HZ2 LYS 44 HZ2 LYS 44 9.994 7.278 6.430
345 HZ3 LYS 44 HZ3 LYS 44 10.196 6.590 7.962
346 H ASP 45 H ASP 45 9.064 0.020 5.674
347 HA ASP 45 HA ASP 45 10.992 1.166 3.873
348 HB2 ASP 45 HB2 ASP 45 12.478 -0.663 4.651
349 HB3 ASP 45 HB3 ASP 45 11.769 0.262 5.969
350 H GLN 46 H GLN 46 8.474 -0.991 3.382
351 HA GLN 46 HA GLN 46 9.832 -2.612 1.374
352 HB2 GLN 46 HB2 GLN 46 6.933 -2.652 2.244
353 HB3 GLN 46 HB3 GLN 46 7.739 -3.862 1.250
354 HG2 GLN 46 HG2 GLN 46 8.399 -3.213 4.122
355 HG3 GLN 46 HG3 GLN 46 7.474 -4.605 3.562
356 HE21 GLN 46 HE21 GLN 46 10.069 -4.316 5.017
357 HE22 GLN 46 HE22 GLN 46 11.181 -5.284 4.113
358 H VAL 47 H VAL 47 8.021 0.306 1.389
359 HA VAL 47 HA VAL 47 6.667 -0.105 -1.109
360 HB VAL 47 HB VAL 47 5.698 1.382 0.560
361 HG11 VAL 47 HG11 VAL 47 7.751 2.295 1.523
362 HG12 VAL 47 HG12 VAL 47 6.643 3.581 1.050
363 HG13 VAL 47 HG13 VAL 47 8.047 3.212 0.047
364 HG21 VAL 47 HG21 VAL 47 6.465 2.835 -1.979
365 HG22 VAL 47 HG22 VAL 47 5.135 3.271 -0.906
366 HG23 VAL 47 HG23 VAL 47 5.098 1.737 -1.772
367 H ARG 48 H ARG 48 7.617 -0.115 -3.030
368 HA ARG 48 HA ARG 48 10.040 1.382 -3.591
369 HB2 ARG 48 HB2 ARG 48 9.635 -0.852 -4.596
370 HB3 ARG 48 HB3 ARG 48 8.256 -0.195 -5.467
371 HG2 ARG 48 HG2 ARG 48 9.822 1.394 -6.601
372 HG3 ARG 48 HG3 ARG 48 11.159 0.539 -5.829
373 HD2 ARG 48 HD2 ARG 48 10.360 -1.558 -6.909
374 HD3 ARG 48 HD3 ARG 48 9.151 -0.610 -7.773
375 HE ARG 48 HE ARG 48 11.992 -0.733 -8.294
376 HH11 ARG 48 HH11 ARG 48 9.056 0.989 -8.859
377 HH12 ARG 48 HH12 ARG 48 9.658 1.752 -10.287
378 HH21 ARG 48 HH21 ARG 48 12.732 0.207 -10.134
379 HH22 ARG 48 HH22 ARG 48 11.710 1.279 -11.033
380 H THR 49 H THR 49 6.794 1.310 -5.069
381 HA THR 49 HA THR 49 6.751 4.228 -5.291
382 HB THR 49 HB THR 49 6.009 4.095 -7.705
383 HG1 THR 49 HG1 THR 49 5.602 2.073 -8.266
384 HG21 THR 49 HG21 THR 49 8.277 4.832 -7.130
385 HG22 THR 49 HG22 THR 49 8.266 3.921 -8.642
386 HG23 THR 49 HG23 THR 49 8.830 3.156 -7.156
387 H VAL 50 H VAL 50 4.669 5.111 -5.565
388 HA VAL 50 HA VAL 50 2.394 3.224 -5.371
389 HB VAL 50 HB VAL 50 2.704 5.848 -3.879
390 HG11 VAL 50 HG11 VAL 50 0.403 3.890 -3.878
391 HG12 VAL 50 HG12 VAL 50 0.392 5.513 -4.570
392 HG13 VAL 50 HG13 VAL 50 0.553 5.297 -2.827
393 HG21 VAL 50 HG21 VAL 50 4.026 4.072 -2.872
394 HG22 VAL 50 HG22 VAL 50 2.619 3.007 -2.854
395 HG23 VAL 50 HG23 VAL 50 2.642 4.459 -1.851
396 H LYS 51 H LYS 51 1.035 3.468 -7.068
397 HA LYS 51 HA LYS 51 0.773 6.151 -8.297
398 HB2 LYS 51 HB2 LYS 51 1.022 3.524 -9.782
399 HB3 LYS 51 HB3 LYS 51 0.720 5.088 -10.527
400 HG2 LYS 51 HG2 LYS 51 2.901 5.883 -9.778
401 HG3 LYS 51 HG3 LYS 51 3.200 4.336 -8.981
402 HD2 LYS 51 HD2 LYS 51 3.033 3.204 -11.175
403 HD3 LYS 51 HD3 LYS 51 2.809 4.774 -11.948
404 HE2 LYS 51 HE2 LYS 51 5.017 5.479 -11.170
405 HE3 LYS 51 HE3 LYS 51 5.238 3.924 -10.366
406 HZ1 LYS 51 HZ1 LYS 51 4.828 4.261 -13.285
407 HZ2 LYS 51 HZ2 LYS 51 5.190 2.821 -12.480
408 HZ3 LYS 51 HZ3 LYS 51 6.334 4.062 -12.551
409 H ASP 52 H ASP 52 -1.257 6.808 -8.748
410 HA ASP 52 HA ASP 52 -3.561 5.273 -8.107
411 HB2 ASP 52 HB2 ASP 52 -3.256 7.791 -9.773
412 HB3 ASP 52 HB3 ASP 52 -4.804 7.118 -9.270
413 H LEU 53 H LEU 53 -4.631 3.786 -9.315
414 HA LEU 53 HA LEU 53 -3.736 2.842 -11.796
415 HB2 LEU 53 HB2 LEU 53 -6.403 2.528 -10.414
416 HB3 LEU 53 HB3 LEU 53 -5.996 1.689 -11.901
417 HG LEU 53 HG LEU 53 -4.520 1.388 -9.274
418 HD11 LEU 53 HD11 LEU 53 -5.514 -0.852 -9.206
419 HD12 LEU 53 HD12 LEU 53 -6.454 -0.479 -10.652
420 HD13 LEU 53 HD13 LEU 53 -6.744 0.409 -9.155
421 HD21 LEU 53 HD21 LEU 53 -3.398 -0.495 -10.399
422 HD22 LEU 53 HD22 LEU 53 -3.046 1.050 -11.174
423 HD23 LEU 53 HD23 LEU 53 -4.203 -0.060 -11.908
424 H LEU 54 H LEU 54 -5.685 5.560 -11.087
425 HA LEU 54 HA LEU 54 -6.807 5.782 -13.756
426 HB2 LEU 54 HB2 LEU 54 -6.847 7.742 -11.450
427 HB3 LEU 54 HB3 LEU 54 -7.762 7.896 -12.940
428 HG LEU 54 HG LEU 54 -8.133 5.698 -10.892
429 HD11 LEU 54 HD11 LEU 54 -9.858 8.102 -11.494
430 HD12 LEU 54 HD12 LEU 54 -8.877 7.867 -10.046
431 HD13 LEU 54 HD13 LEU 54 -10.245 6.800 -10.366
432 HD21 LEU 54 HD21 LEU 54 -8.663 4.951 -13.150
433 HD22 LEU 54 HD22 LEU 54 -9.703 6.357 -13.387
434 HD23 LEU 54 HD23 LEU 54 -10.134 5.130 -12.193
435 H GLU 55 H GLU 55 -4.887 5.840 -14.986
436 HA GLU 55 HA GLU 55 -3.295 8.317 -14.736
437 HB2 GLU 55 HB2 GLU 55 -1.446 7.019 -15.864
438 HB3 GLU 55 HB3 GLU 55 -1.851 6.498 -14.236
439 HG2 GLU 55 HG2 GLU 55 -3.132 4.621 -15.150
440 HG3 GLU 55 HG3 GLU 55 -2.736 5.145 -16.784
Start of MODEL 18
1 H1 MET 1 H1 MET 1 -15.465 8.204 -0.389
2 H2 MET 1 H2 MET 1 -15.504 8.239 -2.076
3 H3 MET 1 H3 MET 1 -15.819 9.647 -1.195
4 HA MET 1 HA MET 1 -13.618 9.739 -2.123
5 HB2 MET 1 HB2 MET 1 -13.627 9.311 0.880
6 HB3 MET 1 HB3 MET 1 -12.331 10.090 -0.018
7 HG2 MET 1 HG2 MET 1 -13.847 11.856 -0.713
8 HG3 MET 1 HG3 MET 1 -15.175 11.066 0.131
9 HE1 MET 1 HE1 MET 1 -14.510 14.275 2.282
10 HE2 MET 1 HE2 MET 1 -15.712 13.353 1.378
11 HE3 MET 1 HE3 MET 1 -14.373 14.128 0.530
12 H ALA 2 H ALA 2 -13.312 7.789 -3.351
13 HA ALA 2 HA ALA 2 -11.139 6.185 -2.327
14 HB1 ALA 2 HB1 ALA 2 -12.211 4.014 -2.707
15 HB2 ALA 2 HB2 ALA 2 -13.731 4.825 -3.087
16 HB3 ALA 2 HB3 ALA 2 -13.057 4.930 -1.460
17 H SER 3 H SER 3 -9.935 5.191 -3.974
18 HA SER 3 HA SER 3 -10.833 5.218 -6.720
19 HB2 SER 3 HB2 SER 3 -8.578 7.064 -5.859
20 HB3 SER 3 HB3 SER 3 -8.957 6.664 -7.534
21 HG SER 3 HG SER 3 -11.216 7.447 -6.453
22 HA PRO 4 HA PRO 4 -8.181 1.685 -6.767
23 HB2 PRO 4 HB2 PRO 4 -7.616 1.533 -9.453
24 HB3 PRO 4 HB3 PRO 4 -9.151 1.028 -8.739
25 HG2 PRO 4 HG2 PRO 4 -8.449 3.607 -10.102
26 HG3 PRO 4 HG3 PRO 4 -9.906 2.608 -10.280
27 HD2 PRO 4 HD2 PRO 4 -9.900 4.827 -8.765
28 HD3 PRO 4 HD3 PRO 4 -10.837 3.392 -8.298
29 H THR 5 H THR 5 -6.180 1.757 -5.938
30 HA THR 5 HA THR 5 -4.053 3.180 -7.413
31 HB THR 5 HB THR 5 -4.472 3.229 -4.409
32 HG1 THR 5 HG1 THR 5 -4.176 5.606 -5.782
33 HG21 THR 5 HG21 THR 5 -2.090 3.052 -4.907
34 HG22 THR 5 HG22 THR 5 -2.475 4.676 -4.339
35 HG23 THR 5 HG23 THR 5 -2.211 4.383 -6.059
36 H VAL 6 H VAL 6 -2.165 2.074 -7.648
37 HA VAL 6 HA VAL 6 -1.997 -0.582 -6.364
38 HB VAL 6 HB VAL 6 -2.204 -0.740 -8.784
39 HG11 VAL 6 HG11 VAL 6 -1.320 1.430 -9.432
40 HG12 VAL 6 HG12 VAL 6 -0.475 0.141 -10.292
41 HG13 VAL 6 HG13 VAL 6 0.299 0.946 -8.927
42 HG21 VAL 6 HG21 VAL 6 -0.240 -2.111 -9.265
43 HG22 VAL 6 HG22 VAL 6 -0.826 -2.404 -7.628
44 HG23 VAL 6 HG23 VAL 6 0.604 -1.405 -7.886
45 H ILE 7 H ILE 7 -0.396 -0.945 -4.969
46 HA ILE 7 HA ILE 7 1.780 1.015 -4.736
47 HB ILE 7 HB ILE 7 0.940 -1.173 -2.816
48 HG12 ILE 7 HG12 ILE 7 0.478 1.825 -2.711
49 HG13 ILE 7 HG13 ILE 7 -0.752 0.613 -3.043
50 HG21 ILE 7 HG21 ILE 7 2.415 -0.056 -1.204
51 HG22 ILE 7 HG22 ILE 7 2.918 1.086 -2.449
52 HG23 ILE 7 HG23 ILE 7 3.315 -0.625 -2.609
53 HD11 ILE 7 HD11 ILE 7 -0.453 -0.303 -0.795
54 HD12 ILE 7 HD12 ILE 7 -0.899 1.403 -0.759
55 HD13 ILE 7 HD13 ILE 7 0.772 0.925 -0.463
56 H THR 8 H THR 8 3.641 0.554 -5.716
57 HA THR 8 HA THR 8 4.435 -2.199 -6.268
58 HB THR 8 HB THR 8 5.861 0.399 -6.937
59 HG1 THR 8 HG1 THR 8 3.805 -0.991 -8.154
60 HG21 THR 8 HG21 THR 8 7.417 -1.489 -6.851
61 HG22 THR 8 HG22 THR 8 7.160 -0.973 -8.519
62 HG23 THR 8 HG23 THR 8 6.360 -2.423 -7.911
63 H LEU 9 H LEU 9 5.759 -3.344 -4.975
64 HA LEU 9 HA LEU 9 6.980 -2.019 -2.675
65 HB2 LEU 9 HB2 LEU 9 6.813 -4.970 -3.296
66 HB3 LEU 9 HB3 LEU 9 7.270 -4.248 -1.759
67 HG LEU 9 HG LEU 9 4.532 -4.072 -3.043
68 HD11 LEU 9 HD11 LEU 9 5.000 -6.306 -2.229
69 HD12 LEU 9 HD12 LEU 9 3.826 -5.509 -1.181
70 HD13 LEU 9 HD13 LEU 9 5.508 -5.658 -0.667
71 HD21 LEU 9 HD21 LEU 9 3.840 -3.059 -0.908
72 HD22 LEU 9 HD22 LEU 9 5.027 -2.067 -1.757
73 HD23 LEU 9 HD23 LEU 9 5.522 -3.045 -0.375
74 H ASN 10 H ASN 10 9.140 -2.744 -1.942
75 HA ASN 10 HA ASN 10 11.182 -2.122 -3.709
76 HB2 ASN 10 HB2 ASN 10 11.358 -2.029 -1.245
77 HB3 ASN 10 HB3 ASN 10 11.334 -3.788 -1.176
78 HD21 ASN 10 HD21 ASN 10 13.068 -1.797 -3.521
79 HD22 ASN 10 HD22 ASN 10 14.642 -2.280 -3.013
80 H ASP 11 H ASP 11 9.779 -5.234 -2.922
81 HA ASP 11 HA ASP 11 11.754 -6.853 -4.200
82 HB2 ASP 11 HB2 ASP 11 10.318 -7.675 -2.384
83 HB3 ASP 11 HB3 ASP 11 8.895 -7.456 -3.393
84 H GLY 12 H GLY 12 9.324 -4.868 -5.460
85 HA2 GLY 12 HA2 GLY 12 9.029 -4.535 -7.806
86 HA3 GLY 12 HA3 GLY 12 9.446 -6.221 -8.075
87 H ARG 13 H ARG 13 7.627 -6.992 -5.802
88 HA ARG 13 HA ARG 13 5.313 -7.594 -7.281
89 HB2 ARG 13 HB2 ARG 13 6.068 -8.948 -5.392
90 HB3 ARG 13 HB3 ARG 13 5.760 -7.615 -4.285
91 HG2 ARG 13 HG2 ARG 13 3.370 -7.757 -4.761
92 HG3 ARG 13 HG3 ARG 13 3.668 -9.061 -5.914
93 HD2 ARG 13 HD2 ARG 13 4.528 -10.473 -4.116
94 HD3 ARG 13 HD3 ARG 13 4.286 -9.168 -2.953
95 HE ARG 13 HE ARG 13 1.840 -9.647 -4.175
96 HH11 ARG 13 HH11 ARG 13 4.053 -11.359 -2.162
97 HH12 ARG 13 HH12 ARG 13 2.803 -12.292 -1.416
98 HH21 ARG 13 HH21 ARG 13 0.263 -10.847 -3.208
99 HH22 ARG 13 HH22 ARG 13 0.692 -12.011 -2.002
100 H GLU 14 H GLU 14 3.349 -6.624 -7.486
101 HA GLU 14 HA GLU 14 2.972 -4.009 -6.161
102 HB2 GLU 14 HB2 GLU 14 1.802 -5.043 -8.755
103 HB3 GLU 14 HB3 GLU 14 1.492 -3.458 -8.059
104 HG2 GLU 14 HG2 GLU 14 3.833 -2.858 -8.324
105 HG3 GLU 14 HG3 GLU 14 4.185 -4.461 -8.970
106 H ILE 15 H ILE 15 0.960 -3.478 -5.265
107 HA ILE 15 HA ILE 15 -1.029 -5.663 -5.065
108 HB ILE 15 HB ILE 15 -0.280 -3.725 -2.854
109 HG12 ILE 15 HG12 ILE 15 0.174 -6.721 -3.075
110 HG13 ILE 15 HG13 ILE 15 1.423 -5.489 -3.214
111 HG21 ILE 15 HG21 ILE 15 -2.279 -5.992 -2.879
112 HG22 ILE 15 HG22 ILE 15 -2.655 -4.271 -2.814
113 HG23 ILE 15 HG23 ILE 15 -1.823 -5.043 -1.464
114 HD11 ILE 15 HD11 ILE 15 -0.212 -6.107 -0.760
115 HD12 ILE 15 HD12 ILE 15 0.988 -4.821 -0.888
116 HD13 ILE 15 HD13 ILE 15 1.485 -6.505 -1.028
117 H GLN 16 H GLN 16 -3.057 -5.103 -5.674
118 HA GLN 16 HA GLN 16 -3.574 -2.306 -6.359
119 HB2 GLN 16 HB2 GLN 16 -5.200 -4.787 -6.969
120 HB3 GLN 16 HB3 GLN 16 -5.512 -3.173 -7.598
121 HG2 GLN 16 HG2 GLN 16 -3.357 -3.216 -8.769
122 HG3 GLN 16 HG3 GLN 16 -3.051 -4.835 -8.140
123 HE21 GLN 16 HE21 GLN 16 -4.888 -2.939 -10.386
124 HE22 GLN 16 HE22 GLN 16 -5.489 -4.259 -11.320
125 H ALA 17 H ALA 17 -4.730 -1.002 -5.113
126 HA ALA 17 HA ALA 17 -6.635 -2.137 -3.157
127 HB1 ALA 17 HB1 ALA 17 -4.696 -1.066 -2.106
128 HB2 ALA 17 HB2 ALA 17 -6.186 -0.192 -1.750
129 HB3 ALA 17 HB3 ALA 17 -5.061 0.436 -2.955
130 H VAL 18 H VAL 18 -8.567 -0.866 -2.706
131 HA VAL 18 HA VAL 18 -9.613 0.438 -5.098
132 HB VAL 18 HB VAL 18 -11.801 0.397 -3.937
133 HG11 VAL 18 HG11 VAL 18 -12.118 -2.026 -3.994
134 HG12 VAL 18 HG12 VAL 18 -10.371 -2.261 -3.954
135 HG13 VAL 18 HG13 VAL 18 -11.123 -1.480 -5.344
136 HG21 VAL 18 HG21 VAL 18 -10.307 -1.019 -1.721
137 HG22 VAL 18 HG22 VAL 18 -12.053 -0.789 -1.817
138 HG23 VAL 18 HG23 VAL 18 -10.991 0.605 -1.630
139 H ASP 19 H ASP 19 -8.137 1.422 -2.241
140 HA ASP 19 HA ASP 19 -8.881 4.191 -2.799
141 HB2 ASP 19 HB2 ASP 19 -8.894 4.559 -0.228
142 HB3 ASP 19 HB3 ASP 19 -10.327 3.896 -0.999
143 H THR 20 H THR 20 -7.411 5.749 -1.586
144 HA THR 20 HA THR 20 -4.705 4.990 -2.238
145 HB THR 20 HB THR 20 -4.123 7.332 -1.739
146 HG1 THR 20 HG1 THR 20 -5.361 8.218 -0.251
147 HG21 THR 20 HG21 THR 20 -5.002 6.803 -3.963
148 HG22 THR 20 HG22 THR 20 -5.517 8.412 -3.454
149 HG23 THR 20 HG23 THR 20 -6.649 7.061 -3.385
150 HA PRO 21 HA PRO 21 -3.482 3.727 1.784
151 HB2 PRO 21 HB2 PRO 21 -0.788 3.973 1.601
152 HB3 PRO 21 HB3 PRO 21 -1.696 2.734 0.728
153 HG2 PRO 21 HG2 PRO 21 -0.665 5.371 -0.261
154 HG3 PRO 21 HG3 PRO 21 -0.604 3.781 -1.047
155 HD2 PRO 21 HD2 PRO 21 -2.458 5.658 -1.687
156 HD3 PRO 21 HD3 PRO 21 -2.786 3.915 -1.782
157 H LYS 22 H LYS 22 -2.981 4.466 3.801
158 HA LYS 22 HA LYS 22 -2.313 7.323 4.120
159 HB2 LYS 22 HB2 LYS 22 -4.419 6.444 5.172
160 HB3 LYS 22 HB3 LYS 22 -3.428 5.389 6.171
161 HG2 LYS 22 HG2 LYS 22 -2.301 7.473 7.048
162 HG3 LYS 22 HG3 LYS 22 -3.551 8.398 6.216
163 HD2 LYS 22 HD2 LYS 22 -4.013 6.319 8.367
164 HD3 LYS 22 HD3 LYS 22 -4.089 8.065 8.590
165 HE2 LYS 22 HE2 LYS 22 -6.328 7.319 8.406
166 HE3 LYS 22 HE3 LYS 22 -5.946 8.086 6.866
167 HZ1 LYS 22 HZ1 LYS 22 -5.778 5.156 7.306
168 HZ2 LYS 22 HZ2 LYS 22 -5.741 5.980 5.828
169 HZ3 LYS 22 HZ3 LYS 22 -7.170 5.923 6.725
170 H TYR 23 H TYR 23 -0.429 7.928 5.132
171 HA TYR 23 HA TYR 23 1.484 5.829 5.753
172 HB2 TYR 23 HB2 TYR 23 2.195 7.788 4.427
173 HB3 TYR 23 HB3 TYR 23 1.841 8.838 5.795
174 HD1 TYR 23 HD1 TYR 23 3.885 5.821 4.940
175 HD2 TYR 23 HD2 TYR 23 3.604 9.391 7.251
176 HE1 TYR 23 HE1 TYR 23 6.161 5.448 5.786
177 HE2 TYR 23 HE2 TYR 23 5.883 9.021 8.098
178 HH TYR 23 HH TYR 23 7.995 6.694 6.741
179 H ASP 24 H ASP 24 1.800 5.044 7.713
180 HA ASP 24 HA ASP 24 0.818 6.489 10.069
181 HB2 ASP 24 HB2 ASP 24 0.017 4.231 9.903
182 HB3 ASP 24 HB3 ASP 24 1.640 3.616 9.607
183 H GLU 25 H GLU 25 2.297 7.823 10.954
184 HA GLU 25 HA GLU 25 5.138 7.304 10.724
185 HB2 GLU 25 HB2 GLU 25 4.112 9.591 10.519
186 HB3 GLU 25 HB3 GLU 25 3.760 9.532 12.240
187 HG2 GLU 25 HG2 GLU 25 6.143 9.381 12.738
188 HG3 GLU 25 HG3 GLU 25 6.515 9.382 11.015
189 H GLU 26 H GLU 26 2.704 6.523 12.981
190 HA GLU 26 HA GLU 26 4.136 6.579 15.409
191 HB2 GLU 26 HB2 GLU 26 1.869 4.765 14.547
192 HB3 GLU 26 HB3 GLU 26 2.464 4.899 16.195
193 HG2 GLU 26 HG2 GLU 26 1.198 7.113 14.584
194 HG3 GLU 26 HG3 GLU 26 0.425 6.191 15.869
195 H SER 27 H SER 27 3.579 3.841 13.170
196 HA SER 27 HA SER 27 5.981 2.551 14.318
197 HB2 SER 27 HB2 SER 27 3.916 1.302 14.825
198 HB3 SER 27 HB3 SER 27 3.580 1.165 13.097
199 HG SER 27 HG SER 27 5.904 0.216 13.165
200 H GLY 28 H GLY 28 4.341 3.503 11.352
201 HA2 GLY 28 HA2 GLY 28 5.872 4.098 9.524
202 HA3 GLY 28 HA3 GLY 28 6.780 2.644 9.887
203 H PHE 29 H PHE 29 3.368 2.193 9.961
204 HA PHE 29 HA PHE 29 3.609 0.544 7.556
205 HB2 PHE 29 HB2 PHE 29 1.417 0.720 9.633
206 HB3 PHE 29 HB3 PHE 29 1.379 -0.358 8.241
207 HD1 PHE 29 HD1 PHE 29 3.286 -2.054 8.010
208 HD2 PHE 29 HD2 PHE 29 2.437 0.043 11.616
209 HE1 PHE 29 HE1 PHE 29 4.506 -3.766 9.289
210 HE2 PHE 29 HE2 PHE 29 3.657 -1.665 12.898
211 HZ PHE 29 HZ PHE 29 4.694 -3.572 11.736
212 H TYR 30 H TYR 30 1.914 0.480 5.945
213 HA TYR 30 HA TYR 30 0.535 3.059 5.508
214 HB2 TYR 30 HB2 TYR 30 1.434 0.909 3.576
215 HB3 TYR 30 HB3 TYR 30 0.323 2.191 3.113
216 HD1 TYR 30 HD1 TYR 30 3.740 1.640 4.516
217 HD2 TYR 30 HD2 TYR 30 1.154 4.235 2.342
218 HE1 TYR 30 HE1 TYR 30 5.647 3.096 3.984
219 HE2 TYR 30 HE2 TYR 30 3.060 5.695 1.808
220 HH TYR 30 HH TYR 30 5.272 6.219 2.621
221 H GLU 31 H GLU 31 -1.672 3.108 5.498
222 HA GLU 31 HA GLU 31 -3.115 0.555 5.793
223 HB2 GLU 31 HB2 GLU 31 -4.158 3.376 6.165
224 HB3 GLU 31 HB3 GLU 31 -4.998 1.888 6.581
225 HG2 GLU 31 HG2 GLU 31 -3.232 1.418 8.259
226 HG3 GLU 31 HG3 GLU 31 -2.510 2.984 7.885
227 H PHE 32 H PHE 32 -4.053 -0.305 4.020
228 HA PHE 32 HA PHE 32 -5.552 1.416 2.215
229 HB2 PHE 32 HB2 PHE 32 -4.476 0.471 0.177
230 HB3 PHE 32 HB3 PHE 32 -3.385 1.459 1.139
231 HD1 PHE 32 HD1 PHE 32 -1.700 0.305 2.630
232 HD2 PHE 32 HD2 PHE 32 -3.954 -1.770 -0.332
233 HE1 PHE 32 HE1 PHE 32 -0.062 -1.528 2.671
234 HE2 PHE 32 HE2 PHE 32 -2.321 -3.607 -0.287
235 HZ PHE 32 HZ PHE 32 -0.370 -3.489 1.211
236 H LYS 33 H LYS 33 -7.210 0.372 1.107
237 HA LYS 33 HA LYS 33 -7.831 -2.322 2.116
238 HB2 LYS 33 HB2 LYS 33 -9.487 -0.477 2.408
239 HB3 LYS 33 HB3 LYS 33 -9.625 -0.367 0.659
240 HG2 LYS 33 HG2 LYS 33 -10.310 -2.828 0.721
241 HG3 LYS 33 HG3 LYS 33 -10.488 -2.611 2.462
242 HD2 LYS 33 HD2 LYS 33 -11.936 -1.018 0.335
243 HD3 LYS 33 HD3 LYS 33 -12.623 -2.355 1.253
244 HE2 LYS 33 HE2 LYS 33 -13.416 -0.392 2.292
245 HE3 LYS 33 HE3 LYS 33 -12.132 -0.990 3.341
246 HZ1 LYS 33 HZ1 LYS 33 -11.685 1.101 1.290
247 HZ2 LYS 33 HZ2 LYS 33 -10.670 0.666 2.567
248 HZ3 LYS 33 HZ3 LYS 33 -12.126 1.457 2.883
249 H GLN 34 H GLN 34 -7.193 -3.955 0.828
250 HA GLN 34 HA GLN 34 -6.647 -3.790 -1.923
251 HB2 GLN 34 HB2 GLN 34 -7.321 -6.205 -0.224
252 HB3 GLN 34 HB3 GLN 34 -6.702 -6.292 -1.869
253 HG2 GLN 34 HG2 GLN 34 -4.658 -5.138 -1.152
254 HG3 GLN 34 HG3 GLN 34 -5.275 -5.087 0.499
255 HE21 GLN 34 HE21 GLN 34 -5.347 -6.994 1.699
256 HE22 GLN 34 HE22 GLN 34 -4.476 -8.408 1.230
257 H LEU 35 H LEU 35 -7.734 -5.022 -3.662
258 HA LEU 35 HA LEU 35 -10.217 -4.033 -4.270
259 HB2 LEU 35 HB2 LEU 35 -9.048 -6.637 -5.259
260 HB3 LEU 35 HB3 LEU 35 -10.334 -5.732 -6.040
261 HG LEU 35 HG LEU 35 -7.488 -4.768 -5.675
262 HD11 LEU 35 HD11 LEU 35 -7.303 -5.057 -8.101
263 HD12 LEU 35 HD12 LEU 35 -8.921 -5.759 -8.141
264 HD13 LEU 35 HD13 LEU 35 -7.622 -6.587 -7.283
265 HD21 LEU 35 HD21 LEU 35 -9.799 -3.523 -7.175
266 HD22 LEU 35 HD22 LEU 35 -8.138 -2.929 -7.150
267 HD23 LEU 35 HD23 LEU 35 -9.096 -2.925 -5.671
268 H ASP 36 H ASP 36 -9.531 -7.122 -2.686
269 HA ASP 36 HA ASP 36 -12.209 -8.104 -2.782
270 HB2 ASP 36 HB2 ASP 36 -9.913 -8.928 -0.987
271 HB3 ASP 36 HB3 ASP 36 -11.379 -9.860 -1.282
272 H GLY 37 H GLY 37 -11.363 -5.444 -1.230
273 HA2 GLY 37 HA2 GLY 37 -12.339 -4.260 0.493
274 HA3 GLY 37 HA3 GLY 37 -13.430 -5.615 0.743
275 H LYS 38 H LYS 38 -9.886 -5.371 0.941
276 HA LYS 38 HA LYS 38 -10.040 -6.278 3.753
277 HB2 LYS 38 HB2 LYS 38 -7.941 -7.094 1.725
278 HB3 LYS 38 HB3 LYS 38 -8.049 -7.642 3.394
279 HG2 LYS 38 HG2 LYS 38 -10.162 -8.768 2.894
280 HG3 LYS 38 HG3 LYS 38 -10.067 -8.209 1.222
281 HD2 LYS 38 HD2 LYS 38 -9.305 -10.510 1.364
282 HD3 LYS 38 HD3 LYS 38 -7.948 -9.459 0.953
283 HE2 LYS 38 HE2 LYS 38 -7.253 -9.469 3.322
284 HE3 LYS 38 HE3 LYS 38 -8.588 -10.561 3.693
285 HZ1 LYS 38 HZ1 LYS 38 -6.303 -11.139 1.889
286 HZ2 LYS 38 HZ2 LYS 38 -7.595 -12.190 2.186
287 HZ3 LYS 38 HZ3 LYS 38 -6.539 -11.774 3.437
288 H GLN 39 H GLN 39 -9.500 -4.456 4.883
289 HA GLN 39 HA GLN 39 -7.497 -2.606 3.959
290 HB2 GLN 39 HB2 GLN 39 -9.413 -1.881 5.362
291 HB3 GLN 39 HB3 GLN 39 -8.773 -2.827 6.699
292 HG2 GLN 39 HG2 GLN 39 -6.736 -1.425 6.685
293 HG3 GLN 39 HG3 GLN 39 -7.444 -0.447 5.399
294 HE21 GLN 39 HE21 GLN 39 -7.429 1.425 6.650
295 HE22 GLN 39 HE22 GLN 39 -8.497 1.654 7.985
296 H THR 40 H THR 40 -5.484 -3.430 3.807
297 HA THR 40 HA THR 40 -4.372 -4.844 6.157
298 HB THR 40 HB THR 40 -4.467 -6.279 4.165
299 HG1 THR 40 HG1 THR 40 -2.734 -7.029 5.109
300 HG21 THR 40 HG21 THR 40 -2.618 -4.237 2.910
301 HG22 THR 40 HG22 THR 40 -4.281 -4.561 2.426
302 HG23 THR 40 HG23 THR 40 -3.046 -5.802 2.221
303 H ARG 41 H ARG 41 -1.943 -4.628 6.346
304 HA ARG 41 HA ARG 41 -1.088 -1.877 5.703
305 HB2 ARG 41 HB2 ARG 41 -0.760 -3.257 8.378
306 HB3 ARG 41 HB3 ARG 41 -0.130 -1.667 7.967
307 HG2 ARG 41 HG2 ARG 41 -2.378 -0.798 7.725
308 HG3 ARG 41 HG3 ARG 41 -3.057 -2.402 8.008
309 HD2 ARG 41 HD2 ARG 41 -1.455 -0.765 9.980
310 HD3 ARG 41 HD3 ARG 41 -3.198 -1.032 10.021
311 HE ARG 41 HE ARG 41 -1.299 -3.276 10.256
312 HH11 ARG 41 HH11 ARG 41 -3.984 -1.483 11.479
313 HH12 ARG 41 HH12 ARG 41 -4.272 -2.603 12.763
314 HH21 ARG 41 HH21 ARG 41 -1.699 -4.698 11.912
315 HH22 ARG 41 HH22 ARG 41 -3.011 -4.391 13.000
316 H ILE 42 H ILE 42 1.078 -1.579 5.289
317 HA ILE 42 HA ILE 42 2.922 -3.831 5.676
318 HB ILE 42 HB ILE 42 2.052 -3.909 3.333
319 HG12 ILE 42 HG12 ILE 42 5.005 -3.250 3.500
320 HG13 ILE 42 HG13 ILE 42 4.303 -4.787 3.999
321 HG21 ILE 42 HG21 ILE 42 1.753 -1.526 2.940
322 HG22 ILE 42 HG22 ILE 42 2.816 -2.218 1.715
323 HG23 ILE 42 HG23 ILE 42 3.494 -1.271 3.039
324 HD11 ILE 42 HD11 ILE 42 4.284 -3.629 1.225
325 HD12 ILE 42 HD12 ILE 42 3.531 -5.152 1.702
326 HD13 ILE 42 HD13 ILE 42 5.281 -4.962 1.804
327 H ASN 43 H ASN 43 5.184 -3.205 5.755
328 HA ASN 43 HA ASN 43 5.413 -0.716 7.185
329 HB2 ASN 43 HB2 ASN 43 6.467 -2.891 7.905
330 HB3 ASN 43 HB3 ASN 43 7.623 -2.692 6.591
331 HD21 ASN 43 HD21 ASN 43 9.345 -2.576 8.030
332 HD22 ASN 43 HD22 ASN 43 9.631 -1.182 9.009
333 H LYS 44 H LYS 44 7.023 0.884 6.864
334 HA LYS 44 HA LYS 44 6.973 2.029 4.331
335 HB2 LYS 44 HB2 LYS 44 8.521 3.701 5.248
336 HB3 LYS 44 HB3 LYS 44 7.228 3.320 6.380
337 HG2 LYS 44 HG2 LYS 44 8.767 1.813 7.596
338 HG3 LYS 44 HG3 LYS 44 10.062 2.283 6.491
339 HD2 LYS 44 HD2 LYS 44 9.787 4.636 7.226
340 HD3 LYS 44 HD3 LYS 44 8.563 4.106 8.383
341 HE2 LYS 44 HE2 LYS 44 11.460 3.249 8.338
342 HE3 LYS 44 HE3 LYS 44 10.729 4.384 9.471
343 HZ1 LYS 44 HZ1 LYS 44 9.303 2.588 10.264
344 HZ2 LYS 44 HZ2 LYS 44 10.938 2.220 10.461
345 HZ3 LYS 44 HZ3 LYS 44 10.063 1.503 9.210
346 H ASP 45 H ASP 45 9.339 -0.206 5.609
347 HA ASP 45 HA ASP 45 11.382 0.555 3.715
348 HB2 ASP 45 HB2 ASP 45 12.552 -1.518 4.604
349 HB3 ASP 45 HB3 ASP 45 12.210 -0.251 5.773
350 H GLN 46 H GLN 46 8.596 -1.314 3.485
351 HA GLN 46 HA GLN 46 9.649 -3.117 1.436
352 HB2 GLN 46 HB2 GLN 46 6.864 -2.886 2.593
353 HB3 GLN 46 HB3 GLN 46 7.414 -4.139 1.489
354 HG2 GLN 46 HG2 GLN 46 8.605 -3.684 4.209
355 HG3 GLN 46 HG3 GLN 46 7.274 -4.793 3.905
356 HE21 GLN 46 HE21 GLN 46 8.447 -6.585 4.553
357 HE22 GLN 46 HE22 GLN 46 9.751 -7.234 3.623
358 H VAL 47 H VAL 47 8.045 -0.073 1.578
359 HA VAL 47 HA VAL 47 6.674 -0.398 -0.958
360 HB VAL 47 HB VAL 47 5.576 0.921 0.755
361 HG11 VAL 47 HG11 VAL 47 7.920 2.814 0.543
362 HG12 VAL 47 HG12 VAL 47 7.517 1.798 1.928
363 HG13 VAL 47 HG13 VAL 47 6.440 3.114 1.456
364 HG21 VAL 47 HG21 VAL 47 6.438 2.633 -1.583
365 HG22 VAL 47 HG22 VAL 47 5.022 2.913 -0.567
366 HG23 VAL 47 HG23 VAL 47 5.111 1.471 -1.579
367 H ARG 48 H ARG 48 7.628 -0.154 -2.864
368 HA ARG 48 HA ARG 48 10.075 1.370 -3.194
369 HB2 ARG 48 HB2 ARG 48 9.801 -0.688 -4.475
370 HB3 ARG 48 HB3 ARG 48 8.325 -0.076 -5.202
371 HG2 ARG 48 HG2 ARG 48 10.029 0.104 -6.838
372 HG3 ARG 48 HG3 ARG 48 9.711 1.740 -6.263
373 HD2 ARG 48 HD2 ARG 48 11.955 0.010 -5.235
374 HD3 ARG 48 HD3 ARG 48 12.135 1.141 -6.571
375 HE ARG 48 HE ARG 48 11.122 2.634 -4.500
376 HH11 ARG 48 HH11 ARG 48 13.908 0.664 -4.985
377 HH12 ARG 48 HH12 ARG 48 14.894 1.609 -3.925
378 HH21 ARG 48 HH21 ARG 48 12.396 3.825 -3.112
379 HH22 ARG 48 HH22 ARG 48 14.051 3.373 -2.877
380 H THR 49 H THR 49 6.953 1.480 -4.925
381 HA THR 49 HA THR 49 6.859 4.394 -4.702
382 HB THR 49 HB THR 49 6.379 4.653 -7.154
383 HG1 THR 49 HG1 THR 49 7.488 2.772 -8.362
384 HG21 THR 49 HG21 THR 49 8.581 5.262 -6.272
385 HG22 THR 49 HG22 THR 49 8.714 4.591 -7.898
386 HG23 THR 49 HG23 THR 49 9.138 3.602 -6.499
387 H VAL 50 H VAL 50 4.807 5.185 -4.606
388 HA VAL 50 HA VAL 50 2.598 3.260 -4.810
389 HB VAL 50 HB VAL 50 2.565 6.092 -3.727
390 HG11 VAL 50 HG11 VAL 50 0.498 3.891 -3.548
391 HG12 VAL 50 HG12 VAL 50 0.368 5.367 -4.504
392 HG13 VAL 50 HG13 VAL 50 0.400 5.459 -2.744
393 HG21 VAL 50 HG21 VAL 50 3.990 4.650 -2.369
394 HG22 VAL 50 HG22 VAL 50 2.696 3.456 -2.253
395 HG23 VAL 50 HG23 VAL 50 2.503 5.043 -1.505
396 H LYS 51 H LYS 51 1.702 3.110 -6.790
397 HA LYS 51 HA LYS 51 1.542 5.528 -8.484
398 HB2 LYS 51 HB2 LYS 51 1.540 2.600 -9.259
399 HB3 LYS 51 HB3 LYS 51 1.338 3.935 -10.389
400 HG2 LYS 51 HG2 LYS 51 3.576 4.748 -9.851
401 HG3 LYS 51 HG3 LYS 51 3.782 3.434 -8.687
402 HD2 LYS 51 HD2 LYS 51 3.604 1.789 -10.467
403 HD3 LYS 51 HD3 LYS 51 3.276 3.062 -11.646
404 HE2 LYS 51 HE2 LYS 51 5.503 3.992 -11.275
405 HE3 LYS 51 HE3 LYS 51 5.835 2.752 -10.064
406 HZ1 LYS 51 HZ1 LYS 51 6.784 2.234 -12.252
407 HZ2 LYS 51 HZ2 LYS 51 5.230 2.206 -12.918
408 HZ3 LYS 51 HZ3 LYS 51 5.670 1.066 -11.750
409 H ASP 52 H ASP 52 -0.385 6.138 -9.416
410 HA ASP 52 HA ASP 52 -2.809 4.866 -8.370
411 HB2 ASP 52 HB2 ASP 52 -2.406 7.474 -9.853
412 HB3 ASP 52 HB3 ASP 52 -3.957 6.886 -9.262
413 H LEU 53 H LEU 53 -4.599 4.357 -9.761
414 HA LEU 53 HA LEU 53 -3.724 3.374 -12.383
415 HB2 LEU 53 HB2 LEU 53 -6.184 2.752 -10.745
416 HB3 LEU 53 HB3 LEU 53 -5.873 2.089 -12.340
417 HG LEU 53 HG LEU 53 -4.195 1.614 -9.861
418 HD11 LEU 53 HD11 LEU 53 -6.035 -0.212 -11.405
419 HD12 LEU 53 HD12 LEU 53 -6.278 0.395 -9.768
420 HD13 LEU 53 HD13 LEU 53 -4.956 -0.720 -10.105
421 HD21 LEU 53 HD21 LEU 53 -2.928 0.036 -11.242
422 HD22 LEU 53 HD22 LEU 53 -2.795 1.682 -11.863
423 HD23 LEU 53 HD23 LEU 53 -3.859 0.521 -12.660
424 H LEU 54 H LEU 54 -5.186 6.103 -11.215
425 HA LEU 54 HA LEU 54 -6.738 6.513 -13.698
426 HB2 LEU 54 HB2 LEU 54 -7.000 7.951 -11.054
427 HB3 LEU 54 HB3 LEU 54 -7.977 8.247 -12.479
428 HG LEU 54 HG LEU 54 -7.948 5.686 -10.866
429 HD11 LEU 54 HD11 LEU 54 -10.020 7.870 -11.072
430 HD12 LEU 54 HD12 LEU 54 -9.022 7.502 -9.664
431 HD13 LEU 54 HD13 LEU 54 -10.225 6.340 -10.221
432 HD21 LEU 54 HD21 LEU 54 -8.387 5.213 -13.203
433 HD22 LEU 54 HD22 LEU 54 -9.605 6.487 -13.262
434 HD23 LEU 54 HD23 LEU 54 -9.877 5.052 -12.273
435 H GLU 55 H GLU 55 -4.853 7.126 -14.898
436 HA GLU 55 HA GLU 55 -4.467 9.934 -14.968
437 HB2 GLU 55 HB2 GLU 55 -2.016 9.998 -14.534
438 HB3 GLU 55 HB3 GLU 55 -2.983 9.631 -13.114
439 HG2 GLU 55 HG2 GLU 55 -2.423 7.234 -13.393
440 HG3 GLU 55 HG3 GLU 55 -1.386 7.664 -14.753
Start of MODEL 19
1 H1 MET 1 H1 MET 1 -12.698 9.677 0.691
2 H2 MET 1 H2 MET 1 -14.108 9.583 -0.244
3 H3 MET 1 H3 MET 1 -13.342 11.071 -0.020
4 HA MET 1 HA MET 1 -12.945 10.146 -2.224
5 HB2 MET 1 HB2 MET 1 -10.490 10.437 -2.212
6 HB3 MET 1 HB3 MET 1 -11.308 11.681 -1.282
7 HG2 MET 1 HG2 MET 1 -10.728 10.504 0.791
8 HG3 MET 1 HG3 MET 1 -9.897 9.270 -0.153
9 HE1 MET 1 HE1 MET 1 -6.934 11.314 -1.724
10 HE2 MET 1 HE2 MET 1 -8.507 10.970 -2.443
11 HE3 MET 1 HE3 MET 1 -7.654 9.714 -1.543
12 H ALA 2 H ALA 2 -12.477 8.424 -3.507
13 HA ALA 2 HA ALA 2 -11.125 6.083 -2.425
14 HB1 ALA 2 HB1 ALA 2 -12.939 4.529 -2.965
15 HB2 ALA 2 HB2 ALA 2 -13.972 5.884 -3.418
16 HB3 ALA 2 HB3 ALA 2 -13.445 5.700 -1.747
17 H SER 3 H SER 3 -9.555 6.284 -3.983
18 HA SER 3 HA SER 3 -10.397 5.765 -6.765
19 HB2 SER 3 HB2 SER 3 -8.442 7.113 -7.528
20 HB3 SER 3 HB3 SER 3 -9.624 8.073 -6.641
21 HG SER 3 HG SER 3 -7.170 7.033 -5.648
22 HA PRO 4 HA PRO 4 -8.028 2.036 -6.332
23 HB2 PRO 4 HB2 PRO 4 -7.406 1.717 -9.027
24 HB3 PRO 4 HB3 PRO 4 -8.893 1.173 -8.249
25 HG2 PRO 4 HG2 PRO 4 -8.374 3.664 -9.824
26 HG3 PRO 4 HG3 PRO 4 -9.800 2.606 -9.834
27 HD2 PRO 4 HD2 PRO 4 -9.835 4.940 -8.530
28 HD3 PRO 4 HD3 PRO 4 -10.632 3.505 -7.846
29 H THR 5 H THR 5 -6.029 1.992 -5.521
30 HA THR 5 HA THR 5 -3.859 3.456 -6.904
31 HB THR 5 HB THR 5 -4.076 3.144 -3.899
32 HG1 THR 5 HG1 THR 5 -5.752 4.505 -4.547
33 HG21 THR 5 HG21 THR 5 -2.332 4.901 -5.640
34 HG22 THR 5 HG22 THR 5 -1.801 3.501 -4.705
35 HG23 THR 5 HG23 THR 5 -2.383 4.946 -3.878
36 H VAL 6 H VAL 6 -2.105 2.222 -7.388
37 HA VAL 6 HA VAL 6 -1.943 -0.468 -6.185
38 HB VAL 6 HB VAL 6 -2.216 -0.529 -8.591
39 HG11 VAL 6 HG11 VAL 6 -1.299 1.671 -9.150
40 HG12 VAL 6 HG12 VAL 6 -0.571 0.400 -10.133
41 HG13 VAL 6 HG13 VAL 6 0.327 1.092 -8.779
42 HG21 VAL 6 HG21 VAL 6 -0.256 -1.885 -9.195
43 HG22 VAL 6 HG22 VAL 6 -0.845 -2.270 -7.576
44 HG23 VAL 6 HG23 VAL 6 0.598 -1.275 -7.776
45 H ILE 7 H ILE 7 -0.319 -0.942 -4.846
46 HA ILE 7 HA ILE 7 1.999 0.875 -4.694
47 HB ILE 7 HB ILE 7 0.972 -1.102 -2.637
48 HG12 ILE 7 HG12 ILE 7 0.853 1.933 -2.672
49 HG13 ILE 7 HG13 ILE 7 -0.514 0.857 -2.950
50 HG21 ILE 7 HG21 ILE 7 2.596 -0.043 -1.117
51 HG22 ILE 7 HG22 ILE 7 3.210 0.925 -2.458
52 HG23 ILE 7 HG23 ILE 7 3.385 -0.830 -2.482
53 HD11 ILE 7 HD11 ILE 7 -0.544 1.745 -0.698
54 HD12 ILE 7 HD12 ILE 7 1.066 1.094 -0.397
55 HD13 ILE 7 HD13 ILE 7 -0.291 -0.000 -0.669
56 H THR 8 H THR 8 3.714 0.138 -5.814
57 HA THR 8 HA THR 8 4.255 -2.696 -6.152
58 HB THR 8 HB THR 8 6.101 -0.395 -6.855
59 HG1 THR 8 HG1 THR 8 4.049 -1.574 -8.458
60 HG21 THR 8 HG21 THR 8 7.103 -2.644 -6.911
61 HG22 THR 8 HG22 THR 8 6.984 -1.947 -8.526
62 HG23 THR 8 HG23 THR 8 5.831 -3.180 -8.011
63 H LEU 9 H LEU 9 5.719 -3.905 -4.977
64 HA LEU 9 HA LEU 9 6.976 -2.554 -2.684
65 HB2 LEU 9 HB2 LEU 9 6.593 -5.519 -3.119
66 HB3 LEU 9 HB3 LEU 9 7.096 -4.724 -1.630
67 HG LEU 9 HG LEU 9 4.378 -4.461 -2.940
68 HD11 LEU 9 HD11 LEU 9 4.719 -6.648 -1.910
69 HD12 LEU 9 HD12 LEU 9 3.555 -5.686 -0.998
70 HD13 LEU 9 HD13 LEU 9 5.205 -5.870 -0.401
71 HD21 LEU 9 HD21 LEU 9 3.773 -3.229 -0.889
72 HD22 LEU 9 HD22 LEU 9 5.000 -2.393 -1.843
73 HD23 LEU 9 HD23 LEU 9 5.464 -3.269 -0.383
74 H ASN 10 H ASN 10 9.056 -3.634 -1.910
75 HA ASN 10 HA ASN 10 11.110 -2.969 -3.621
76 HB2 ASN 10 HB2 ASN 10 11.329 -3.170 -1.180
77 HB3 ASN 10 HB3 ASN 10 11.218 -4.922 -1.310
78 HD21 ASN 10 HD21 ASN 10 13.184 -2.131 -1.933
79 HD22 ASN 10 HD22 ASN 10 14.672 -2.981 -2.151
80 H ASP 11 H ASP 11 9.844 -6.246 -3.006
81 HA ASP 11 HA ASP 11 11.715 -7.597 -4.663
82 HB2 ASP 11 HB2 ASP 11 10.238 -9.526 -4.400
83 HB3 ASP 11 HB3 ASP 11 10.426 -8.692 -2.858
84 H GLY 12 H GLY 12 8.840 -5.815 -5.362
85 HA2 GLY 12 HA2 GLY 12 8.657 -5.134 -7.740
86 HA3 GLY 12 HA3 GLY 12 8.891 -6.824 -8.146
87 H ARG 13 H ARG 13 7.082 -7.554 -5.786
88 HA ARG 13 HA ARG 13 4.727 -7.963 -7.220
89 HB2 ARG 13 HB2 ARG 13 5.320 -9.263 -5.230
90 HB3 ARG 13 HB3 ARG 13 5.077 -7.846 -4.216
91 HG2 ARG 13 HG2 ARG 13 2.698 -7.818 -4.840
92 HG3 ARG 13 HG3 ARG 13 2.952 -9.254 -5.833
93 HD2 ARG 13 HD2 ARG 13 3.608 -10.524 -3.854
94 HD3 ARG 13 HD3 ARG 13 3.407 -9.086 -2.852
95 HE ARG 13 HE ARG 13 0.986 -9.490 -4.129
96 HH11 ARG 13 HH11 ARG 13 2.999 -11.239 -1.950
97 HH12 ARG 13 HH12 ARG 13 1.669 -12.031 -1.184
98 HH21 ARG 13 HH21 ARG 13 -0.719 -10.519 -3.134
99 HH22 ARG 13 HH22 ARG 13 -0.412 -11.627 -1.844
100 H GLU 14 H GLU 14 2.992 -6.747 -7.681
101 HA GLU 14 HA GLU 14 2.719 -4.115 -6.388
102 HB2 GLU 14 HB2 GLU 14 1.499 -5.160 -8.958
103 HB3 GLU 14 HB3 GLU 14 1.259 -3.545 -8.309
104 HG2 GLU 14 HG2 GLU 14 3.653 -3.090 -8.557
105 HG3 GLU 14 HG3 GLU 14 3.891 -4.709 -9.214
106 H ILE 15 H ILE 15 1.054 -3.696 -5.056
107 HA ILE 15 HA ILE 15 -1.193 -5.617 -4.953
108 HB ILE 15 HB ILE 15 -0.175 -3.820 -2.730
109 HG12 ILE 15 HG12 ILE 15 0.061 -6.828 -3.079
110 HG13 ILE 15 HG13 ILE 15 1.380 -5.672 -3.239
111 HG21 ILE 15 HG21 ILE 15 -1.730 -5.102 -1.301
112 HG22 ILE 15 HG22 ILE 15 -2.335 -5.933 -2.735
113 HG23 ILE 15 HG23 ILE 15 -2.568 -4.194 -2.559
114 HD11 ILE 15 HD11 ILE 15 -0.175 -6.251 -0.726
115 HD12 ILE 15 HD12 ILE 15 1.129 -5.075 -0.879
116 HD13 ILE 15 HD13 ILE 15 1.462 -6.793 -1.099
117 H GLN 16 H GLN 16 -3.105 -4.837 -5.637
118 HA GLN 16 HA GLN 16 -3.381 -1.949 -6.056
119 HB2 GLN 16 HB2 GLN 16 -5.103 -4.216 -7.081
120 HB3 GLN 16 HB3 GLN 16 -5.245 -2.526 -7.543
121 HG2 GLN 16 HG2 GLN 16 -2.939 -2.641 -8.469
122 HG3 GLN 16 HG3 GLN 16 -2.926 -4.366 -8.111
123 HE21 GLN 16 HE21 GLN 16 -4.240 -1.876 -10.138
124 HE22 GLN 16 HE22 GLN 16 -4.918 -2.919 -11.331
125 H ALA 17 H ALA 17 -4.661 -0.699 -4.869
126 HA ALA 17 HA ALA 17 -6.586 -1.945 -3.002
127 HB1 ALA 17 HB1 ALA 17 -6.199 -0.042 -1.527
128 HB2 ALA 17 HB2 ALA 17 -5.089 0.664 -2.705
129 HB3 ALA 17 HB3 ALA 17 -4.681 -0.856 -1.907
130 H VAL 18 H VAL 18 -8.564 -0.794 -2.561
131 HA VAL 18 HA VAL 18 -9.747 0.379 -4.896
132 HB VAL 18 HB VAL 18 -11.805 0.557 -3.563
133 HG11 VAL 18 HG11 VAL 18 -10.395 -2.095 -3.234
134 HG12 VAL 18 HG12 VAL 18 -11.293 -1.559 -4.654
135 HG13 VAL 18 HG13 VAL 18 -12.137 -1.834 -3.131
136 HG21 VAL 18 HG21 VAL 18 -10.118 -0.442 -1.260
137 HG22 VAL 18 HG22 VAL 18 -11.873 -0.247 -1.245
138 HG23 VAL 18 HG23 VAL 18 -10.830 1.166 -1.409
139 H ASP 19 H ASP 19 -8.422 1.643 -1.915
140 HA ASP 19 HA ASP 19 -8.958 4.368 -2.892
141 HB2 ASP 19 HB2 ASP 19 -9.313 5.152 -0.606
142 HB3 ASP 19 HB3 ASP 19 -10.475 3.897 -1.019
143 H THR 20 H THR 20 -7.514 5.977 -1.526
144 HA THR 20 HA THR 20 -4.810 5.244 -2.204
145 HB THR 20 HB THR 20 -4.226 7.550 -1.612
146 HG1 THR 20 HG1 THR 20 -5.518 8.788 -0.435
147 HG21 THR 20 HG21 THR 20 -5.178 7.154 -3.829
148 HG22 THR 20 HG22 THR 20 -5.678 8.729 -3.214
149 HG23 THR 20 HG23 THR 20 -6.805 7.373 -3.184
150 HA PRO 21 HA PRO 21 -3.574 3.768 1.748
151 HB2 PRO 21 HB2 PRO 21 -0.883 4.079 1.596
152 HB3 PRO 21 HB3 PRO 21 -1.764 2.870 0.655
153 HG2 PRO 21 HG2 PRO 21 -0.784 5.579 -0.191
154 HG3 PRO 21 HG3 PRO 21 -0.679 4.032 -1.055
155 HD2 PRO 21 HD2 PRO 21 -2.575 5.886 -1.623
156 HD3 PRO 21 HD3 PRO 21 -2.869 4.143 -1.785
157 H LYS 22 H LYS 22 -3.427 4.509 3.777
158 HA LYS 22 HA LYS 22 -2.768 7.319 4.278
159 HB2 LYS 22 HB2 LYS 22 -4.803 6.415 5.297
160 HB3 LYS 22 HB3 LYS 22 -3.873 5.148 6.085
161 HG2 LYS 22 HG2 LYS 22 -2.629 6.986 7.307
162 HG3 LYS 22 HG3 LYS 22 -3.834 8.105 6.671
163 HD2 LYS 22 HD2 LYS 22 -4.403 5.693 8.408
164 HD3 LYS 22 HD3 LYS 22 -4.381 7.370 8.951
165 HE2 LYS 22 HE2 LYS 22 -6.262 6.233 6.877
166 HE3 LYS 22 HE3 LYS 22 -6.664 6.523 8.566
167 HZ1 LYS 22 HZ1 LYS 22 -7.434 8.314 7.133
168 HZ2 LYS 22 HZ2 LYS 22 -5.854 8.614 6.616
169 HZ3 LYS 22 HZ3 LYS 22 -6.277 8.878 8.229
170 H TYR 23 H TYR 23 -0.829 7.948 5.159
171 HA TYR 23 HA TYR 23 1.079 5.868 5.913
172 HB2 TYR 23 HB2 TYR 23 1.852 7.656 4.432
173 HB3 TYR 23 HB3 TYR 23 1.427 8.863 5.642
174 HD1 TYR 23 HD1 TYR 23 3.474 5.735 5.396
175 HD2 TYR 23 HD2 TYR 23 3.175 9.698 6.932
176 HE1 TYR 23 HE1 TYR 23 5.731 5.534 6.342
177 HE2 TYR 23 HE2 TYR 23 5.431 9.500 7.887
178 HH TYR 23 HH TYR 23 7.027 7.850 8.540
179 H ASP 24 H ASP 24 1.103 5.171 7.952
180 HA ASP 24 HA ASP 24 0.360 6.980 10.142
181 HB2 ASP 24 HB2 ASP 24 -0.762 4.813 10.112
182 HB3 ASP 24 HB3 ASP 24 0.788 3.977 10.089
183 H GLU 25 H GLU 25 2.061 8.185 10.790
184 HA GLU 25 HA GLU 25 4.775 7.416 10.507
185 HB2 GLU 25 HB2 GLU 25 4.010 9.763 10.548
186 HB3 GLU 25 HB3 GLU 25 3.577 9.588 12.244
187 HG2 GLU 25 HG2 GLU 25 5.946 9.140 12.776
188 HG3 GLU 25 HG3 GLU 25 6.354 9.395 11.080
189 H GLU 26 H GLU 26 2.476 7.026 13.112
190 HA GLU 26 HA GLU 26 4.197 6.793 15.304
191 HB2 GLU 26 HB2 GLU 26 1.626 5.240 14.953
192 HB3 GLU 26 HB3 GLU 26 2.376 5.737 16.464
193 HG2 GLU 26 HG2 GLU 26 1.075 7.509 14.407
194 HG3 GLU 26 HG3 GLU 26 0.483 7.137 16.022
195 H SER 27 H SER 27 2.839 4.169 13.291
196 HA SER 27 HA SER 27 4.855 2.324 14.391
197 HB2 SER 27 HB2 SER 27 2.313 1.764 12.842
198 HB3 SER 27 HB3 SER 27 3.446 0.527 13.386
199 HG SER 27 HG SER 27 2.988 1.826 15.539
200 H GLY 28 H GLY 28 4.264 4.181 11.602
201 HA2 GLY 28 HA2 GLY 28 5.751 4.477 9.833
202 HA3 GLY 28 HA3 GLY 28 6.623 3.045 10.348
203 H PHE 29 H PHE 29 3.267 2.525 9.993
204 HA PHE 29 HA PHE 29 3.799 0.942 7.576
205 HB2 PHE 29 HB2 PHE 29 1.481 0.850 9.522
206 HB3 PHE 29 HB3 PHE 29 1.646 -0.188 8.112
207 HD1 PHE 29 HD1 PHE 29 3.985 -1.471 8.013
208 HD2 PHE 29 HD2 PHE 29 2.127 -0.020 11.559
209 HE1 PHE 29 HE1 PHE 29 5.240 -3.115 9.340
210 HE2 PHE 29 HE2 PHE 29 3.387 -1.660 12.892
211 HZ PHE 29 HZ PHE 29 4.943 -3.213 11.784
212 H TYR 30 H TYR 30 2.382 0.949 5.781
213 HA TYR 30 HA TYR 30 0.659 3.312 5.455
214 HB2 TYR 30 HB2 TYR 30 1.760 1.306 3.466
215 HB3 TYR 30 HB3 TYR 30 0.566 2.523 3.035
216 HD1 TYR 30 HD1 TYR 30 4.042 2.065 4.274
217 HD2 TYR 30 HD2 TYR 30 1.226 4.737 2.517
218 HE1 TYR 30 HE1 TYR 30 5.849 3.663 3.804
219 HE2 TYR 30 HE2 TYR 30 3.031 6.338 2.050
220 HH TYR 30 HH TYR 30 5.251 6.887 2.801
221 H GLU 31 H GLU 31 -1.506 3.110 5.577
222 HA GLU 31 HA GLU 31 -2.675 0.423 5.798
223 HB2 GLU 31 HB2 GLU 31 -3.896 3.115 6.473
224 HB3 GLU 31 HB3 GLU 31 -4.584 1.538 6.839
225 HG2 GLU 31 HG2 GLU 31 -2.663 1.065 8.317
226 HG3 GLU 31 HG3 GLU 31 -2.035 2.679 7.980
227 H PHE 32 H PHE 32 -3.708 -0.416 4.078
228 HA PHE 32 HA PHE 32 -5.255 1.338 2.315
229 HB2 PHE 32 HB2 PHE 32 -4.238 0.318 0.281
230 HB3 PHE 32 HB3 PHE 32 -3.108 1.293 1.214
231 HD1 PHE 32 HD1 PHE 32 -1.424 0.146 2.678
232 HD2 PHE 32 HD2 PHE 32 -3.823 -1.967 -0.140
233 HE1 PHE 32 HE1 PHE 32 0.147 -1.743 2.757
234 HE2 PHE 32 HE2 PHE 32 -2.255 -3.856 -0.060
235 HZ PHE 32 HZ PHE 32 -0.264 -3.746 1.385
236 H LYS 33 H LYS 33 -6.971 0.363 1.272
237 HA LYS 33 HA LYS 33 -7.638 -2.357 2.172
238 HB2 LYS 33 HB2 LYS 33 -9.232 -0.430 2.551
239 HB3 LYS 33 HB3 LYS 33 -9.445 -0.344 0.807
240 HG2 LYS 33 HG2 LYS 33 -10.215 -2.730 0.872
241 HG3 LYS 33 HG3 LYS 33 -10.180 -2.628 2.631
242 HD2 LYS 33 HD2 LYS 33 -11.933 -1.087 0.718
243 HD3 LYS 33 HD3 LYS 33 -12.430 -2.251 1.943
244 HE2 LYS 33 HE2 LYS 33 -12.927 -0.316 3.050
245 HE3 LYS 33 HE3 LYS 33 -11.249 -0.500 3.559
246 HZ1 LYS 33 HZ1 LYS 33 -11.593 1.736 2.853
247 HZ2 LYS 33 HZ2 LYS 33 -12.279 1.238 1.388
248 HZ3 LYS 33 HZ3 LYS 33 -10.634 0.984 1.680
249 H GLN 34 H GLN 34 -7.020 -3.921 0.774
250 HA GLN 34 HA GLN 34 -6.353 -3.521 -1.925
251 HB2 GLN 34 HB2 GLN 34 -7.131 -6.086 -0.514
252 HB3 GLN 34 HB3 GLN 34 -6.346 -5.999 -2.087
253 HG2 GLN 34 HG2 GLN 34 -4.389 -4.957 -1.071
254 HG3 GLN 34 HG3 GLN 34 -5.176 -4.992 0.506
255 HE21 GLN 34 HE21 GLN 34 -5.402 -6.978 1.577
256 HE22 GLN 34 HE22 GLN 34 -4.491 -8.371 1.118
257 H LEU 35 H LEU 35 -7.366 -4.503 -3.851
258 HA LEU 35 HA LEU 35 -9.976 -3.632 -4.296
259 HB2 LEU 35 HB2 LEU 35 -8.405 -5.735 -5.788
260 HB3 LEU 35 HB3 LEU 35 -9.910 -5.042 -6.363
261 HG LEU 35 HG LEU 35 -7.310 -3.551 -5.939
262 HD11 LEU 35 HD11 LEU 35 -7.326 -3.310 -8.375
263 HD12 LEU 35 HD12 LEU 35 -8.790 -4.289 -8.468
264 HD13 LEU 35 HD13 LEU 35 -7.283 -5.006 -7.898
265 HD21 LEU 35 HD21 LEU 35 -9.961 -2.541 -6.983
266 HD22 LEU 35 HD22 LEU 35 -8.452 -1.627 -6.922
267 HD23 LEU 35 HD23 LEU 35 -9.239 -2.132 -5.427
268 H ASP 36 H ASP 36 -8.894 -6.690 -3.022
269 HA ASP 36 HA ASP 36 -11.373 -8.084 -3.440
270 HB2 ASP 36 HB2 ASP 36 -9.197 -9.248 -3.336
271 HB3 ASP 36 HB3 ASP 36 -9.018 -8.758 -1.654
272 H GLY 37 H GLY 37 -10.410 -5.725 -1.226
273 HA2 GLY 37 HA2 GLY 37 -11.993 -4.843 0.366
274 HA3 GLY 37 HA3 GLY 37 -12.571 -6.477 0.646
275 H LYS 38 H LYS 38 -9.644 -7.356 0.673
276 HA LYS 38 HA LYS 38 -9.246 -7.364 3.456
277 HB2 LYS 38 HB2 LYS 38 -7.279 -7.893 1.218
278 HB3 LYS 38 HB3 LYS 38 -6.971 -8.241 2.912
279 HG2 LYS 38 HG2 LYS 38 -8.837 -9.841 2.917
280 HG3 LYS 38 HG3 LYS 38 -9.123 -9.496 1.207
281 HD2 LYS 38 HD2 LYS 38 -6.927 -10.343 0.623
282 HD3 LYS 38 HD3 LYS 38 -6.525 -10.569 2.326
283 HE2 LYS 38 HE2 LYS 38 -7.098 -12.698 1.355
284 HE3 LYS 38 HE3 LYS 38 -8.355 -12.227 2.496
285 HZ1 LYS 38 HZ1 LYS 38 -8.519 -11.892 -0.447
286 HZ2 LYS 38 HZ2 LYS 38 -9.740 -11.536 0.663
287 HZ3 LYS 38 HZ3 LYS 38 -9.250 -13.135 0.426
288 H GLN 39 H GLN 39 -8.990 -5.444 4.532
289 HA GLN 39 HA GLN 39 -7.161 -3.421 3.494
290 HB2 GLN 39 HB2 GLN 39 -9.342 -2.813 4.585
291 HB3 GLN 39 HB3 GLN 39 -8.681 -3.384 6.113
292 HG2 GLN 39 HG2 GLN 39 -6.918 -1.695 5.989
293 HG3 GLN 39 HG3 GLN 39 -7.550 -1.143 4.438
294 HE21 GLN 39 HE21 GLN 39 -8.004 0.929 5.133
295 HE22 GLN 39 HE22 GLN 39 -9.269 1.283 6.256
296 H THR 40 H THR 40 -5.045 -3.420 3.960
297 HA THR 40 HA THR 40 -4.125 -4.676 6.459
298 HB THR 40 HB THR 40 -3.855 -6.439 4.857
299 HG1 THR 40 HG1 THR 40 -1.263 -5.276 4.993
300 HG21 THR 40 HG21 THR 40 -3.983 -5.145 2.791
301 HG22 THR 40 HG22 THR 40 -2.546 -6.166 2.790
302 HG23 THR 40 HG23 THR 40 -2.399 -4.439 3.114
303 H ARG 41 H ARG 41 -1.843 -4.227 6.960
304 HA ARG 41 HA ARG 41 -0.992 -1.564 5.991
305 HB2 ARG 41 HB2 ARG 41 -0.223 -2.963 8.566
306 HB3 ARG 41 HB3 ARG 41 0.197 -1.319 8.105
307 HG2 ARG 41 HG2 ARG 41 -2.118 -0.643 8.244
308 HG3 ARG 41 HG3 ARG 41 -2.613 -2.305 8.577
309 HD2 ARG 41 HD2 ARG 41 -0.886 -0.542 10.321
310 HD3 ARG 41 HD3 ARG 41 -2.546 -1.052 10.645
311 HE ARG 41 HE ARG 41 -0.363 -3.025 10.438
312 HH11 ARG 41 HH11 ARG 41 -2.933 -1.589 12.228
313 HH12 ARG 41 HH12 ARG 41 -2.881 -2.788 13.469
314 HH21 ARG 41 HH21 ARG 41 -0.296 -4.547 12.041
315 HH22 ARG 41 HH22 ARG 41 -1.402 -4.444 13.368
316 H ILE 42 H ILE 42 1.280 -1.215 5.617
317 HA ILE 42 HA ILE 42 3.050 -3.534 5.734
318 HB ILE 42 HB ILE 42 1.992 -3.539 3.454
319 HG12 ILE 42 HG12 ILE 42 4.976 -3.034 3.385
320 HG13 ILE 42 HG13 ILE 42 4.255 -4.515 4.004
321 HG21 ILE 42 HG21 ILE 42 1.829 -1.115 3.126
322 HG22 ILE 42 HG22 ILE 42 2.705 -1.885 1.804
323 HG23 ILE 42 HG23 ILE 42 3.588 -1.003 3.051
324 HD11 ILE 42 HD11 ILE 42 5.028 -4.806 1.735
325 HD12 ILE 42 HD12 ILE 42 4.012 -3.470 1.196
326 HD13 ILE 42 HD13 ILE 42 3.273 -4.948 1.811
327 H ASN 43 H ASN 43 5.287 -2.993 5.829
328 HA ASN 43 HA ASN 43 5.684 -0.526 7.207
329 HB2 ASN 43 HB2 ASN 43 6.833 -2.722 7.714
330 HB3 ASN 43 HB3 ASN 43 7.848 -2.433 6.305
331 HD21 ASN 43 HD21 ASN 43 9.723 -2.279 7.506
332 HD22 ASN 43 HD22 ASN 43 10.058 -0.951 8.559
333 H LYS 44 H LYS 44 7.149 1.160 6.738
334 HA LYS 44 HA LYS 44 6.814 2.217 4.158
335 HB2 LYS 44 HB2 LYS 44 8.235 4.077 4.955
336 HB3 LYS 44 HB3 LYS 44 6.957 3.654 6.085
337 HG2 LYS 44 HG2 LYS 44 8.684 2.294 7.343
338 HG3 LYS 44 HG3 LYS 44 9.901 3.051 6.313
339 HD2 LYS 44 HD2 LYS 44 7.949 4.553 8.068
340 HD3 LYS 44 HD3 LYS 44 9.612 4.179 8.512
341 HE2 LYS 44 HE2 LYS 44 8.814 5.812 6.098
342 HE3 LYS 44 HE3 LYS 44 9.282 6.496 7.653
343 HZ1 LYS 44 HZ1 LYS 44 11.159 6.509 6.212
344 HZ2 LYS 44 HZ2 LYS 44 10.977 4.867 5.842
345 HZ3 LYS 44 HZ3 LYS 44 11.438 5.339 7.401
346 H ASP 45 H ASP 45 9.258 0.061 5.227
347 HA ASP 45 HA ASP 45 11.204 0.995 3.266
348 HB2 ASP 45 HB2 ASP 45 12.667 -0.754 4.152
349 HB3 ASP 45 HB3 ASP 45 12.021 0.248 5.443
350 H GLN 46 H GLN 46 8.587 -1.179 3.343
351 HA GLN 46 HA GLN 46 9.590 -3.040 1.366
352 HB2 GLN 46 HB2 GLN 46 6.711 -2.620 2.190
353 HB3 GLN 46 HB3 GLN 46 7.423 -4.058 1.472
354 HG2 GLN 46 HG2 GLN 46 8.150 -3.011 4.192
355 HG3 GLN 46 HG3 GLN 46 6.891 -4.207 3.911
356 HE21 GLN 46 HE21 GLN 46 7.903 -5.793 5.079
357 HE22 GLN 46 HE22 GLN 46 9.345 -6.582 4.546
358 H VAL 47 H VAL 47 7.812 -0.047 1.368
359 HA VAL 47 HA VAL 47 6.507 -0.416 -1.141
360 HB VAL 47 HB VAL 47 5.514 1.060 0.487
361 HG11 VAL 47 HG11 VAL 47 7.546 1.870 1.586
362 HG12 VAL 47 HG12 VAL 47 6.501 3.209 1.110
363 HG13 VAL 47 HG13 VAL 47 7.941 2.835 0.162
364 HG21 VAL 47 HG21 VAL 47 6.465 2.595 -1.937
365 HG22 VAL 47 HG22 VAL 47 5.082 3.025 -0.927
366 HG23 VAL 47 HG23 VAL 47 5.064 1.528 -1.860
367 H ARG 48 H ARG 48 7.502 -0.497 -3.000
368 HA ARG 48 HA ARG 48 9.988 0.859 -3.561
369 HB2 ARG 48 HB2 ARG 48 9.496 -1.383 -4.460
370 HB3 ARG 48 HB3 ARG 48 8.133 -0.732 -5.351
371 HG2 ARG 48 HG2 ARG 48 9.592 0.533 -6.785
372 HG3 ARG 48 HG3 ARG 48 10.999 0.098 -5.808
373 HD2 ARG 48 HD2 ARG 48 10.676 -2.259 -6.386
374 HD3 ARG 48 HD3 ARG 48 9.257 -1.840 -7.341
375 HE ARG 48 HE ARG 48 10.949 -0.451 -8.681
376 HH11 ARG 48 HH11 ARG 48 11.674 -3.449 -7.138
377 HH12 ARG 48 HH12 ARG 48 12.883 -3.880 -8.295
378 HH21 ARG 48 HH21 ARG 48 12.483 -1.038 -10.180
379 HH22 ARG 48 HH22 ARG 48 13.331 -2.534 -9.996
380 H THR 49 H THR 49 6.734 0.960 -5.082
381 HA THR 49 HA THR 49 6.940 3.870 -5.346
382 HB THR 49 HB THR 49 6.206 3.814 -7.737
383 HG1 THR 49 HG1 THR 49 5.443 1.664 -7.856
384 HG21 THR 49 HG21 THR 49 8.550 4.247 -7.219
385 HG22 THR 49 HG22 THR 49 8.407 3.308 -8.706
386 HG23 THR 49 HG23 THR 49 8.884 2.514 -7.204
387 H VAL 50 H VAL 50 5.031 4.787 -4.818
388 HA VAL 50 HA VAL 50 2.574 3.186 -4.875
389 HB VAL 50 HB VAL 50 3.018 5.981 -3.775
390 HG11 VAL 50 HG11 VAL 50 0.643 4.122 -3.527
391 HG12 VAL 50 HG12 VAL 50 0.698 5.639 -4.427
392 HG13 VAL 50 HG13 VAL 50 0.835 5.652 -2.670
393 HG21 VAL 50 HG21 VAL 50 4.270 4.309 -2.512
394 HG22 VAL 50 HG22 VAL 50 2.816 3.327 -2.337
395 HG23 VAL 50 HG23 VAL 50 2.911 4.909 -1.562
396 H LYS 51 H LYS 51 1.305 3.268 -6.621
397 HA LYS 51 HA LYS 51 1.399 5.665 -8.348
398 HB2 LYS 51 HB2 LYS 51 1.117 2.751 -9.071
399 HB3 LYS 51 HB3 LYS 51 0.753 4.049 -10.199
400 HG2 LYS 51 HG2 LYS 51 3.027 4.813 -10.152
401 HG3 LYS 51 HG3 LYS 51 3.433 3.670 -8.869
402 HD2 LYS 51 HD2 LYS 51 3.421 1.856 -10.293
403 HD3 LYS 51 HD3 LYS 51 2.277 2.603 -11.408
404 HE2 LYS 51 HE2 LYS 51 5.154 3.467 -11.082
405 HE3 LYS 51 HE3 LYS 51 4.566 2.375 -12.339
406 HZ1 LYS 51 HZ1 LYS 51 3.022 4.178 -13.016
407 HZ2 LYS 51 HZ2 LYS 51 4.655 4.551 -13.245
408 HZ3 LYS 51 HZ3 LYS 51 3.811 5.215 -11.941
409 H ASP 52 H ASP 52 -0.443 6.710 -8.713
410 HA ASP 52 HA ASP 52 -3.015 5.628 -7.926
411 HB2 ASP 52 HB2 ASP 52 -2.294 8.201 -9.372
412 HB3 ASP 52 HB3 ASP 52 -3.894 7.793 -8.764
413 H LEU 53 H LEU 53 -4.466 4.627 -9.308
414 HA LEU 53 HA LEU 53 -3.628 4.133 -12.033
415 HB2 LEU 53 HB2 LEU 53 -6.127 3.328 -10.539
416 HB3 LEU 53 HB3 LEU 53 -5.776 2.848 -12.191
417 HG LEU 53 HG LEU 53 -4.212 2.089 -9.715
418 HD11 LEU 53 HD11 LEU 53 -4.861 -0.196 -10.319
419 HD12 LEU 53 HD12 LEU 53 -5.828 0.437 -11.652
420 HD13 LEU 53 HD13 LEU 53 -6.257 0.823 -9.988
421 HD21 LEU 53 HD21 LEU 53 -2.659 2.485 -11.548
422 HD22 LEU 53 HD22 LEU 53 -3.614 1.442 -12.605
423 HD23 LEU 53 HD23 LEU 53 -2.786 0.760 -11.203
424 H LEU 54 H LEU 54 -5.105 6.711 -10.616
425 HA LEU 54 HA LEU 54 -6.498 7.461 -13.114
426 HB2 LEU 54 HB2 LEU 54 -7.142 8.379 -10.306
427 HB3 LEU 54 HB3 LEU 54 -7.981 8.868 -11.765
428 HG LEU 54 HG LEU 54 -7.944 6.077 -10.590
429 HD11 LEU 54 HD11 LEU 54 -10.164 8.117 -10.780
430 HD12 LEU 54 HD12 LEU 54 -9.311 7.644 -9.311
431 HD13 LEU 54 HD13 LEU 54 -10.319 6.472 -10.161
432 HD21 LEU 54 HD21 LEU 54 -9.371 7.131 -13.038
433 HD22 LEU 54 HD22 LEU 54 -9.583 5.529 -12.328
434 HD23 LEU 54 HD23 LEU 54 -8.030 5.984 -13.024
435 H GLU 55 H GLU 55 -3.644 7.902 -12.275
436 HA GLU 55 HA GLU 55 -3.471 10.753 -11.796
437 HB2 GLU 55 HB2 GLU 55 -0.997 10.401 -11.916
438 HB3 GLU 55 HB3 GLU 55 -1.822 9.467 -10.684
439 HG2 GLU 55 HG2 GLU 55 -0.394 7.893 -11.496
440 HG3 GLU 55 HG3 GLU 55 -1.795 7.589 -12.515
Start of MODEL 20
1 H1 MET 1 H1 MET 1 -11.091 11.578 -0.655
2 H2 MET 1 H2 MET 1 -12.269 10.608 0.074
3 H3 MET 1 H3 MET 1 -12.721 12.036 -0.713
4 HA MET 1 HA MET 1 -13.253 10.106 -2.047
5 HB2 MET 1 HB2 MET 1 -11.005 11.833 -3.118
6 HB3 MET 1 HB3 MET 1 -11.993 10.776 -4.118
7 HG2 MET 1 HG2 MET 1 -13.990 12.051 -3.479
8 HG3 MET 1 HG3 MET 1 -12.980 13.126 -2.512
9 HE1 MET 1 HE1 MET 1 -13.978 15.383 -5.570
10 HE2 MET 1 HE2 MET 1 -13.937 15.265 -3.812
11 HE3 MET 1 HE3 MET 1 -14.979 14.190 -4.742
12 H ALA 2 H ALA 2 -12.479 8.342 -3.368
13 HA ALA 2 HA ALA 2 -9.898 7.206 -2.488
14 HB1 ALA 2 HB1 ALA 2 -10.946 4.988 -2.391
15 HB2 ALA 2 HB2 ALA 2 -12.510 5.710 -2.770
16 HB3 ALA 2 HB3 ALA 2 -11.696 6.111 -1.257
17 H SER 3 H SER 3 -8.610 6.629 -4.123
18 HA SER 3 HA SER 3 -9.795 6.088 -6.779
19 HB2 SER 3 HB2 SER 3 -7.143 7.440 -6.178
20 HB3 SER 3 HB3 SER 3 -7.744 7.046 -7.788
21 HG SER 3 HG SER 3 -8.468 9.041 -7.614
22 HA PRO 4 HA PRO 4 -7.761 2.122 -6.514
23 HB2 PRO 4 HB2 PRO 4 -7.341 1.659 -9.202
24 HB3 PRO 4 HB3 PRO 4 -8.883 1.399 -8.379
25 HG2 PRO 4 HG2 PRO 4 -7.981 3.740 -10.021
26 HG3 PRO 4 HG3 PRO 4 -9.551 2.915 -10.013
27 HD2 PRO 4 HD2 PRO 4 -9.187 5.254 -8.734
28 HD3 PRO 4 HD3 PRO 4 -10.251 3.993 -8.073
29 H THR 5 H THR 5 -5.724 2.031 -5.760
30 HA THR 5 HA THR 5 -3.556 3.332 -7.310
31 HB THR 5 HB THR 5 -3.739 3.098 -4.287
32 HG1 THR 5 HG1 THR 5 -3.774 5.515 -5.780
33 HG21 THR 5 HG21 THR 5 -1.424 3.033 -5.117
34 HG22 THR 5 HG22 THR 5 -1.760 4.538 -4.260
35 HG23 THR 5 HG23 THR 5 -1.710 4.520 -6.023
36 H VAL 6 H VAL 6 -1.868 2.072 -7.849
37 HA VAL 6 HA VAL 6 -1.702 -0.636 -6.729
38 HB VAL 6 HB VAL 6 -1.779 -0.543 -9.153
39 HG11 VAL 6 HG11 VAL 6 0.749 1.111 -9.023
40 HG12 VAL 6 HG12 VAL 6 -0.847 1.699 -9.486
41 HG13 VAL 6 HG13 VAL 6 -0.024 0.507 -10.489
42 HG21 VAL 6 HG21 VAL 6 0.216 -1.860 -9.678
43 HG22 VAL 6 HG22 VAL 6 -0.455 -2.325 -8.114
44 HG23 VAL 6 HG23 VAL 6 0.984 -1.309 -8.189
45 H ILE 7 H ILE 7 -0.339 -0.997 -5.135
46 HA ILE 7 HA ILE 7 1.951 0.773 -4.679
47 HB ILE 7 HB ILE 7 0.773 -1.400 -2.922
48 HG12 ILE 7 HG12 ILE 7 0.595 1.625 -2.745
49 HG13 ILE 7 HG13 ILE 7 -0.716 0.538 -3.189
50 HG21 ILE 7 HG21 ILE 7 2.213 -0.471 -1.147
51 HG22 ILE 7 HG22 ILE 7 2.951 0.614 -2.327
52 HG23 ILE 7 HG23 ILE 7 3.154 -1.131 -2.486
53 HD11 ILE 7 HD11 ILE 7 -0.948 1.291 -0.904
54 HD12 ILE 7 HD12 ILE 7 0.652 0.663 -0.511
55 HD13 ILE 7 HD13 ILE 7 -0.648 -0.447 -0.948
56 H THR 8 H THR 8 3.684 0.158 -5.878
57 HA THR 8 HA THR 8 4.381 -2.641 -6.264
58 HB THR 8 HB THR 8 6.013 -0.200 -7.023
59 HG1 THR 8 HG1 THR 8 5.067 -0.433 -9.080
60 HG21 THR 8 HG21 THR 8 6.091 -3.046 -8.048
61 HG22 THR 8 HG22 THR 8 7.287 -2.302 -6.985
62 HG23 THR 8 HG23 THR 8 7.081 -1.709 -8.632
63 H LEU 9 H LEU 9 5.564 -3.762 -4.826
64 HA LEU 9 HA LEU 9 7.026 -2.389 -2.721
65 HB2 LEU 9 HB2 LEU 9 6.817 -5.360 -3.232
66 HB3 LEU 9 HB3 LEU 9 7.348 -4.580 -1.748
67 HG LEU 9 HG LEU 9 4.546 -4.494 -2.891
68 HD11 LEU 9 HD11 LEU 9 5.139 -6.670 -1.947
69 HD12 LEU 9 HD12 LEU 9 3.938 -5.841 -0.958
70 HD13 LEU 9 HD13 LEU 9 5.623 -5.890 -0.441
71 HD21 LEU 9 HD21 LEU 9 5.650 -3.303 -0.342
72 HD22 LEU 9 HD22 LEU 9 3.947 -3.362 -0.798
73 HD23 LEU 9 HD23 LEU 9 5.081 -2.411 -1.754
74 H ASN 10 H ASN 10 9.278 -3.272 -2.150
75 HA ASN 10 HA ASN 10 11.069 -2.492 -4.128
76 HB2 ASN 10 HB2 ASN 10 11.622 -2.491 -1.743
77 HB3 ASN 10 HB3 ASN 10 11.616 -4.252 -1.727
78 HD21 ASN 10 HD21 ASN 10 13.335 -5.365 -2.646
79 HD22 ASN 10 HD22 ASN 10 14.811 -4.585 -3.090
80 H ASP 11 H ASP 11 10.014 -5.787 -3.313
81 HA ASP 11 HA ASP 11 11.911 -7.110 -4.994
82 HB2 ASP 11 HB2 ASP 11 10.662 -9.114 -4.540
83 HB3 ASP 11 HB3 ASP 11 10.726 -8.166 -3.057
84 H GLY 12 H GLY 12 8.868 -5.582 -5.584
85 HA2 GLY 12 HA2 GLY 12 8.387 -5.031 -7.943
86 HA3 GLY 12 HA3 GLY 12 8.810 -6.690 -8.336
87 H ARG 13 H ARG 13 7.193 -7.018 -5.526
88 HA ARG 13 HA ARG 13 4.827 -8.018 -6.745
89 HB2 ARG 13 HB2 ARG 13 5.719 -8.930 -4.641
90 HB3 ARG 13 HB3 ARG 13 5.382 -7.405 -3.832
91 HG2 ARG 13 HG2 ARG 13 2.991 -7.713 -4.202
92 HG3 ARG 13 HG3 ARG 13 3.312 -9.223 -5.062
93 HD2 ARG 13 HD2 ARG 13 4.282 -10.173 -3.015
94 HD3 ARG 13 HD3 ARG 13 3.958 -8.662 -2.163
95 HE ARG 13 HE ARG 13 1.518 -9.267 -2.966
96 HH11 ARG 13 HH11 ARG 13 3.921 -11.338 -1.628
97 HH12 ARG 13 HH12 ARG 13 2.766 -12.393 -0.896
98 HH21 ARG 13 HH21 ARG 13 0.039 -10.621 -1.990
99 HH22 ARG 13 HH22 ARG 13 0.601 -12.001 -1.108
100 H GLU 14 H GLU 14 2.988 -6.996 -7.287
101 HA GLU 14 HA GLU 14 2.638 -4.203 -6.414
102 HB2 GLU 14 HB2 GLU 14 1.475 -5.718 -8.770
103 HB3 GLU 14 HB3 GLU 14 1.083 -4.048 -8.371
104 HG2 GLU 14 HG2 GLU 14 3.340 -3.348 -8.777
105 HG3 GLU 14 HG3 GLU 14 3.876 -5.017 -8.961
106 H ILE 15 H ILE 15 1.024 -3.653 -5.083
107 HA ILE 15 HA ILE 15 -1.229 -5.534 -4.704
108 HB ILE 15 HB ILE 15 -0.050 -3.697 -2.601
109 HG12 ILE 15 HG12 ILE 15 0.144 -6.713 -2.853
110 HG13 ILE 15 HG13 ILE 15 1.459 -5.585 -3.154
111 HG21 ILE 15 HG21 ILE 15 -2.206 -5.806 -2.410
112 HG22 ILE 15 HG22 ILE 15 -2.437 -4.061 -2.294
113 HG23 ILE 15 HG23 ILE 15 -1.527 -4.914 -1.048
114 HD11 ILE 15 HD11 ILE 15 1.685 -6.621 -0.982
115 HD12 ILE 15 HD12 ILE 15 0.084 -6.048 -0.515
116 HD13 ILE 15 HD13 ILE 15 1.385 -4.892 -0.805
117 H GLN 16 H GLN 16 -3.063 -4.686 -5.519
118 HA GLN 16 HA GLN 16 -3.279 -1.785 -5.838
119 HB2 GLN 16 HB2 GLN 16 -4.896 -4.057 -7.013
120 HB3 GLN 16 HB3 GLN 16 -5.184 -2.354 -7.354
121 HG2 GLN 16 HG2 GLN 16 -2.966 -2.155 -8.335
122 HG3 GLN 16 HG3 GLN 16 -2.624 -3.838 -7.945
123 HE21 GLN 16 HE21 GLN 16 -5.282 -4.772 -8.667
124 HE22 GLN 16 HE22 GLN 16 -5.348 -4.730 -10.389
125 H ALA 17 H ALA 17 -4.608 -0.536 -4.690
126 HA ALA 17 HA ALA 17 -6.627 -1.811 -2.943
127 HB1 ALA 17 HB1 ALA 17 -5.098 0.743 -2.431
128 HB2 ALA 17 HB2 ALA 17 -4.735 -0.827 -1.713
129 HB3 ALA 17 HB3 ALA 17 -6.259 -0.020 -1.343
130 H VAL 18 H VAL 18 -8.516 -0.449 -2.400
131 HA VAL 18 HA VAL 18 -9.573 0.860 -4.760
132 HB VAL 18 HB VAL 18 -11.687 1.009 -3.535
133 HG11 VAL 18 HG11 VAL 18 -11.168 -1.078 -4.687
134 HG12 VAL 18 HG12 VAL 18 -12.121 -1.381 -3.235
135 HG13 VAL 18 HG13 VAL 18 -10.388 -1.702 -3.230
136 HG21 VAL 18 HG21 VAL 18 -10.831 1.501 -1.300
137 HG22 VAL 18 HG22 VAL 18 -10.163 -0.125 -1.178
138 HG23 VAL 18 HG23 VAL 18 -11.911 0.106 -1.256
139 H ASP 19 H ASP 19 -8.210 1.809 -1.719
140 HA ASP 19 HA ASP 19 -8.760 4.643 -2.339
141 HB2 ASP 19 HB2 ASP 19 -8.698 5.093 0.094
142 HB3 ASP 19 HB3 ASP 19 -9.994 3.986 -0.340
143 H THR 20 H THR 20 -7.115 6.153 -1.366
144 HA THR 20 HA THR 20 -4.483 5.270 -2.176
145 HB THR 20 HB THR 20 -3.761 7.581 -1.757
146 HG1 THR 20 HG1 THR 20 -5.458 7.750 0.063
147 HG21 THR 20 HG21 THR 20 -6.418 7.454 -3.198
148 HG22 THR 20 HG22 THR 20 -4.847 7.068 -3.899
149 HG23 THR 20 HG23 THR 20 -5.203 8.717 -3.385
150 HA PRO 21 HA PRO 21 -3.206 3.631 1.716
151 HB2 PRO 21 HB2 PRO 21 -0.471 4.197 1.436
152 HB3 PRO 21 HB3 PRO 21 -1.297 2.746 0.864
153 HG2 PRO 21 HG2 PRO 21 -0.575 5.232 -0.632
154 HG3 PRO 21 HG3 PRO 21 -0.524 3.542 -1.171
155 HD2 PRO 21 HD2 PRO 21 -2.490 5.162 -1.960
156 HD3 PRO 21 HD3 PRO 21 -2.832 3.468 -1.544
157 H LYS 22 H LYS 22 -3.534 4.559 3.601
158 HA LYS 22 HA LYS 22 -2.737 7.296 4.185
159 HB2 LYS 22 HB2 LYS 22 -4.922 6.478 4.928
160 HB3 LYS 22 HB3 LYS 22 -4.155 5.183 5.834
161 HG2 LYS 22 HG2 LYS 22 -3.056 6.927 7.253
162 HG3 LYS 22 HG3 LYS 22 -4.033 8.138 6.417
163 HD2 LYS 22 HD2 LYS 22 -5.098 5.793 8.011
164 HD3 LYS 22 HD3 LYS 22 -5.049 7.472 8.553
165 HE2 LYS 22 HE2 LYS 22 -6.597 8.122 6.812
166 HE3 LYS 22 HE3 LYS 22 -6.560 6.498 6.125
167 HZ1 LYS 22 HZ1 LYS 22 -7.615 5.645 8.084
168 HZ2 LYS 22 HZ2 LYS 22 -8.539 6.933 7.500
169 HZ3 LYS 22 HZ3 LYS 22 -7.546 7.146 8.852
170 H TYR 23 H TYR 23 -0.915 7.857 5.345
171 HA TYR 23 HA TYR 23 0.947 5.731 5.974
172 HB2 TYR 23 HB2 TYR 23 1.790 7.741 4.877
173 HB3 TYR 23 HB3 TYR 23 1.250 8.735 6.228
174 HD1 TYR 23 HD1 TYR 23 3.444 5.777 5.534
175 HD2 TYR 23 HD2 TYR 23 2.800 9.266 7.896
176 HE1 TYR 23 HE1 TYR 23 5.597 5.410 6.654
177 HE2 TYR 23 HE2 TYR 23 4.959 8.907 9.018
178 HH TYR 23 HH TYR 23 6.465 6.862 9.487
179 H ASP 24 H ASP 24 1.483 4.953 7.889
180 HA ASP 24 HA ASP 24 0.259 6.042 10.313
181 HB2 ASP 24 HB2 ASP 24 -0.158 3.710 10.037
182 HB3 ASP 24 HB3 ASP 24 1.529 3.380 9.654
183 H GLU 25 H GLU 25 1.491 7.599 11.224
184 HA GLU 25 HA GLU 25 4.345 7.689 10.915
185 HB2 GLU 25 HB2 GLU 25 2.961 9.728 11.037
186 HB3 GLU 25 HB3 GLU 25 2.550 9.350 12.703
187 HG2 GLU 25 HG2 GLU 25 4.938 9.541 13.309
188 HG3 GLU 25 HG3 GLU 25 5.304 9.972 11.640
189 H GLU 26 H GLU 26 2.251 6.225 13.211
190 HA GLU 26 HA GLU 26 3.931 6.387 15.499
191 HB2 GLU 26 HB2 GLU 26 1.711 4.442 14.841
192 HB3 GLU 26 HB3 GLU 26 2.466 4.607 16.421
193 HG2 GLU 26 HG2 GLU 26 0.874 6.719 14.968
194 HG3 GLU 26 HG3 GLU 26 0.347 5.778 16.362
195 H SER 27 H SER 27 3.315 3.661 13.245
196 HA SER 27 HA SER 27 5.816 2.428 14.241
197 HB2 SER 27 HB2 SER 27 3.788 1.137 14.812
198 HB3 SER 27 HB3 SER 27 3.386 1.020 13.101
199 HG SER 27 HG SER 27 5.563 0.007 12.911
200 H GLY 28 H GLY 28 4.467 3.875 11.494
201 HA2 GLY 28 HA2 GLY 28 5.791 4.342 9.596
202 HA3 GLY 28 HA3 GLY 28 6.787 2.947 9.962
203 H PHE 29 H PHE 29 3.420 2.289 10.024
204 HA PHE 29 HA PHE 29 3.724 0.672 7.606
205 HB2 PHE 29 HB2 PHE 29 1.487 0.787 9.646
206 HB3 PHE 29 HB3 PHE 29 1.526 -0.305 8.270
207 HD1 PHE 29 HD1 PHE 29 3.976 -1.569 8.147
208 HD2 PHE 29 HD2 PHE 29 1.962 -0.224 11.649
209 HE1 PHE 29 HE1 PHE 29 5.176 -3.253 9.478
210 HE2 PHE 29 HE2 PHE 29 3.162 -1.900 12.987
211 HZ PHE 29 HZ PHE 29 4.772 -3.418 11.902
212 H TYR 30 H TYR 30 1.777 0.493 6.136
213 HA TYR 30 HA TYR 30 0.385 3.078 5.768
214 HB2 TYR 30 HB2 TYR 30 1.374 1.075 3.736
215 HB3 TYR 30 HB3 TYR 30 0.111 2.234 3.340
216 HD1 TYR 30 HD1 TYR 30 0.615 4.648 3.259
217 HD2 TYR 30 HD2 TYR 30 3.683 1.769 3.941
218 HE1 TYR 30 HE1 TYR 30 2.318 6.331 2.696
219 HE2 TYR 30 HE2 TYR 30 5.383 3.448 3.380
220 HH TYR 30 HH TYR 30 4.686 6.763 3.118
221 H GLU 31 H GLU 31 -1.800 3.048 5.857
222 HA GLU 31 HA GLU 31 -3.192 0.462 5.988
223 HB2 GLU 31 HB2 GLU 31 -4.172 3.250 6.666
224 HB3 GLU 31 HB3 GLU 31 -5.113 1.775 6.841
225 HG2 GLU 31 HG2 GLU 31 -3.361 0.963 8.448
226 HG3 GLU 31 HG3 GLU 31 -2.652 2.578 8.377
227 H PHE 32 H PHE 32 -4.164 -0.266 4.211
228 HA PHE 32 HA PHE 32 -5.666 1.536 2.488
229 HB2 PHE 32 HB2 PHE 32 -4.583 0.653 0.419
230 HB3 PHE 32 HB3 PHE 32 -3.496 1.614 1.415
231 HD1 PHE 32 HD1 PHE 32 -1.803 0.435 2.865
232 HD2 PHE 32 HD2 PHE 32 -4.080 -1.595 -0.113
233 HE1 PHE 32 HE1 PHE 32 -0.191 -1.424 2.895
234 HE2 PHE 32 HE2 PHE 32 -2.471 -3.451 -0.080
235 HZ PHE 32 HZ PHE 32 -0.524 -3.370 1.420
236 H LYS 33 H LYS 33 -7.415 0.544 1.510
237 HA LYS 33 HA LYS 33 -7.903 -2.243 2.279
238 HB2 LYS 33 HB2 LYS 33 -9.648 -0.568 2.746
239 HB3 LYS 33 HB3 LYS 33 -9.758 -0.202 1.029
240 HG2 LYS 33 HG2 LYS 33 -10.478 -2.537 0.614
241 HG3 LYS 33 HG3 LYS 33 -10.451 -2.825 2.355
242 HD2 LYS 33 HD2 LYS 33 -12.173 -0.782 0.933
243 HD3 LYS 33 HD3 LYS 33 -12.721 -2.353 1.523
244 HE2 LYS 33 HE2 LYS 33 -12.167 -1.681 3.817
245 HE3 LYS 33 HE3 LYS 33 -11.615 -0.111 3.226
246 HZ1 LYS 33 HZ1 LYS 33 -14.382 -1.172 2.987
247 HZ2 LYS 33 HZ2 LYS 33 -13.852 0.342 2.453
248 HZ3 LYS 33 HZ3 LYS 33 -13.869 -0.011 4.104
249 H GLN 34 H GLN 34 -7.162 -3.728 0.899
250 HA GLN 34 HA GLN 34 -6.501 -3.269 -1.799
251 HB2 GLN 34 HB2 GLN 34 -7.072 -5.906 -0.422
252 HB3 GLN 34 HB3 GLN 34 -6.208 -5.705 -1.941
253 HG2 GLN 34 HG2 GLN 34 -4.394 -4.593 -0.849
254 HG3 GLN 34 HG3 GLN 34 -5.284 -4.516 0.669
255 HE21 GLN 34 HE21 GLN 34 -5.570 -6.423 1.862
256 HE22 GLN 34 HE22 GLN 34 -4.558 -7.801 1.619
257 H LEU 35 H LEU 35 -7.439 -4.359 -3.711
258 HA LEU 35 HA LEU 35 -10.091 -3.626 -4.140
259 HB2 LEU 35 HB2 LEU 35 -8.491 -5.702 -5.643
260 HB3 LEU 35 HB3 LEU 35 -9.965 -4.948 -6.220
261 HG LEU 35 HG LEU 35 -7.321 -3.565 -5.728
262 HD11 LEU 35 HD11 LEU 35 -7.324 -4.922 -7.738
263 HD12 LEU 35 HD12 LEU 35 -7.333 -3.208 -8.151
264 HD13 LEU 35 HD13 LEU 35 -8.817 -4.155 -8.280
265 HD21 LEU 35 HD21 LEU 35 -8.381 -1.566 -6.661
266 HD22 LEU 35 HD22 LEU 35 -9.168 -2.074 -5.168
267 HD23 LEU 35 HD23 LEU 35 -9.927 -2.410 -6.724
268 H ASP 36 H ASP 36 -8.847 -6.659 -2.906
269 HA ASP 36 HA ASP 36 -11.250 -8.177 -3.293
270 HB2 ASP 36 HB2 ASP 36 -9.038 -8.746 -1.315
271 HB3 ASP 36 HB3 ASP 36 -10.156 -9.900 -2.040
272 H GLY 37 H GLY 37 -10.438 -5.745 -1.094
273 HA2 GLY 37 HA2 GLY 37 -12.172 -4.882 0.355
274 HA3 GLY 37 HA3 GLY 37 -12.664 -6.535 0.683
275 H LYS 38 H LYS 38 -9.643 -7.168 0.927
276 HA LYS 38 HA LYS 38 -9.573 -6.897 3.786
277 HB2 LYS 38 HB2 LYS 38 -7.574 -8.002 1.804
278 HB3 LYS 38 HB3 LYS 38 -7.306 -8.001 3.541
279 HG2 LYS 38 HG2 LYS 38 -9.229 -9.435 3.881
280 HG3 LYS 38 HG3 LYS 38 -9.615 -9.365 2.161
281 HD2 LYS 38 HD2 LYS 38 -8.470 -11.459 2.768
282 HD3 LYS 38 HD3 LYS 38 -7.533 -10.507 1.619
283 HE2 LYS 38 HE2 LYS 38 -6.080 -11.426 3.335
284 HE3 LYS 38 HE3 LYS 38 -6.137 -9.669 3.462
285 HZ1 LYS 38 HZ1 LYS 38 -6.282 -10.808 5.619
286 HZ2 LYS 38 HZ2 LYS 38 -7.731 -11.529 5.138
287 HZ3 LYS 38 HZ3 LYS 38 -7.637 -9.849 5.311
288 H GLN 39 H GLN 39 -9.172 -4.899 4.627
289 HA GLN 39 HA GLN 39 -7.030 -3.254 3.556
290 HB2 GLN 39 HB2 GLN 39 -8.959 -2.070 4.377
291 HB3 GLN 39 HB3 GLN 39 -8.860 -2.877 5.936
292 HG2 GLN 39 HG2 GLN 39 -6.937 -1.666 6.564
293 HG3 GLN 39 HG3 GLN 39 -6.652 -1.110 4.916
294 HE21 GLN 39 HE21 GLN 39 -6.996 0.383 7.443
295 HE22 GLN 39 HE22 GLN 39 -8.276 1.502 7.132
296 H THR 40 H THR 40 -4.972 -3.433 4.136
297 HA THR 40 HA THR 40 -4.284 -4.623 6.745
298 HB THR 40 HB THR 40 -4.129 -6.443 5.103
299 HG1 THR 40 HG1 THR 40 -1.617 -6.605 5.342
300 HG21 THR 40 HG21 THR 40 -3.718 -5.080 3.088
301 HG22 THR 40 HG22 THR 40 -2.525 -6.367 3.262
302 HG23 THR 40 HG23 THR 40 -2.097 -4.708 3.679
303 H ARG 41 H ARG 41 -1.940 -4.322 7.271
304 HA ARG 41 HA ARG 41 -1.009 -1.702 6.276
305 HB2 ARG 41 HB2 ARG 41 -0.406 -3.012 8.940
306 HB3 ARG 41 HB3 ARG 41 0.116 -1.414 8.431
307 HG2 ARG 41 HG2 ARG 41 -2.251 -0.705 8.338
308 HG3 ARG 41 HG3 ARG 41 -2.722 -2.298 8.937
309 HD2 ARG 41 HD2 ARG 41 -1.023 -0.247 10.368
310 HD3 ARG 41 HD3 ARG 41 -2.665 -0.742 10.783
311 HE ARG 41 HE ARG 41 -1.138 -3.041 10.853
312 HH11 ARG 41 HH11 ARG 41 -1.143 -0.003 12.503
313 HH12 ARG 41 HH12 ARG 41 -0.462 -0.672 13.942
314 HH21 ARG 41 HH21 ARG 41 -0.266 -3.873 12.716
315 HH22 ARG 41 HH22 ARG 41 0.013 -2.824 14.066
316 H ILE 42 H ILE 42 1.030 -1.485 5.484
317 HA ILE 42 HA ILE 42 2.962 -3.667 5.922
318 HB ILE 42 HB ILE 42 1.969 -3.885 3.640
319 HG12 ILE 42 HG12 ILE 42 4.904 -3.118 3.622
320 HG13 ILE 42 HG13 ILE 42 4.279 -4.663 4.189
321 HG21 ILE 42 HG21 ILE 42 1.583 -1.502 3.192
322 HG22 ILE 42 HG22 ILE 42 2.528 -2.256 1.908
323 HG23 ILE 42 HG23 ILE 42 3.324 -1.236 3.106
324 HD11 ILE 42 HD11 ILE 42 3.457 -5.166 1.961
325 HD12 ILE 42 HD12 ILE 42 5.182 -4.809 1.934
326 HD13 ILE 42 HD13 ILE 42 4.026 -3.598 1.384
327 H ASN 43 H ASN 43 5.153 -3.036 6.006
328 HA ASN 43 HA ASN 43 5.544 -0.484 7.177
329 HB2 ASN 43 HB2 ASN 43 6.755 -2.678 7.673
330 HB3 ASN 43 HB3 ASN 43 7.741 -2.334 6.259
331 HD21 ASN 43 HD21 ASN 43 8.462 -2.555 9.072
332 HD22 ASN 43 HD22 ASN 43 9.246 -1.070 9.471
333 H LYS 44 H LYS 44 6.765 1.270 6.522
334 HA LYS 44 HA LYS 44 6.438 2.086 3.851
335 HB2 LYS 44 HB2 LYS 44 7.764 4.079 4.536
336 HB3 LYS 44 HB3 LYS 44 6.435 3.701 5.624
337 HG2 LYS 44 HG2 LYS 44 8.002 2.662 7.193
338 HG3 LYS 44 HG3 LYS 44 9.339 3.021 6.098
339 HD2 LYS 44 HD2 LYS 44 9.001 5.397 6.385
340 HD3 LYS 44 HD3 LYS 44 7.536 5.116 7.328
341 HE2 LYS 44 HE2 LYS 44 9.456 5.680 8.757
342 HE3 LYS 44 HE3 LYS 44 8.842 4.063 9.091
343 HZ1 LYS 44 HZ1 LYS 44 11.264 4.131 9.007
344 HZ2 LYS 44 HZ2 LYS 44 11.209 4.674 7.405
345 HZ3 LYS 44 HZ3 LYS 44 10.636 3.133 7.799
346 H ASP 45 H ASP 45 9.016 0.287 5.264
347 HA ASP 45 HA ASP 45 11.024 1.202 3.389
348 HB2 ASP 45 HB2 ASP 45 12.472 -0.508 4.439
349 HB3 ASP 45 HB3 ASP 45 11.745 0.583 5.610
350 H GLN 46 H GLN 46 8.517 -1.069 3.272
351 HA GLN 46 HA GLN 46 9.804 -2.817 1.321
352 HB2 GLN 46 HB2 GLN 46 6.972 -2.819 2.392
353 HB3 GLN 46 HB3 GLN 46 7.676 -4.062 1.368
354 HG2 GLN 46 HG2 GLN 46 8.751 -3.341 4.079
355 HG3 GLN 46 HG3 GLN 46 7.549 -4.598 3.817
356 HE21 GLN 46 HE21 GLN 46 8.977 -6.135 4.671
357 HE22 GLN 46 HE22 GLN 46 10.322 -6.727 3.764
358 H VAL 47 H VAL 47 7.592 -0.110 1.360
359 HA VAL 47 HA VAL 47 6.519 -0.613 -1.259
360 HB VAL 47 HB VAL 47 5.129 0.579 0.312
361 HG11 VAL 47 HG11 VAL 47 5.659 2.848 1.089
362 HG12 VAL 47 HG12 VAL 47 7.242 2.739 0.319
363 HG13 VAL 47 HG13 VAL 47 6.837 1.665 1.658
364 HG21 VAL 47 HG21 VAL 47 5.990 2.407 -1.941
365 HG22 VAL 47 HG22 VAL 47 4.469 2.513 -1.052
366 HG23 VAL 47 HG23 VAL 47 4.808 1.101 -2.053
367 H ARG 48 H ARG 48 7.604 -0.341 -3.077
368 HA ARG 48 HA ARG 48 9.917 1.389 -3.274
369 HB2 ARG 48 HB2 ARG 48 9.881 -0.804 -4.390
370 HB3 ARG 48 HB3 ARG 48 8.518 -0.291 -5.375
371 HG2 ARG 48 HG2 ARG 48 9.936 1.461 -6.377
372 HG3 ARG 48 HG3 ARG 48 11.299 0.877 -5.424
373 HD2 ARG 48 HD2 ARG 48 11.173 -1.287 -6.541
374 HD3 ARG 48 HD3 ARG 48 9.768 -0.750 -7.461
375 HE ARG 48 HE ARG 48 11.821 1.058 -7.952
376 HH11 ARG 48 HH11 ARG 48 11.162 -2.280 -8.539
377 HH12 ARG 48 HH12 ARG 48 12.119 -2.316 -9.977
378 HH21 ARG 48 HH21 ARG 48 13.044 0.977 -9.771
379 HH22 ARG 48 HH22 ARG 48 13.176 -0.505 -10.657
380 H THR 49 H THR 49 6.930 1.157 -5.255
381 HA THR 49 HA THR 49 6.916 4.105 -5.493
382 HB THR 49 HB THR 49 6.254 3.950 -7.868
383 HG1 THR 49 HG1 THR 49 5.467 1.705 -7.642
384 HG21 THR 49 HG21 THR 49 8.637 4.266 -7.334
385 HG22 THR 49 HG22 THR 49 8.416 3.337 -8.818
386 HG23 THR 49 HG23 THR 49 8.858 2.516 -7.323
387 H VAL 50 H VAL 50 4.973 5.022 -5.195
388 HA VAL 50 HA VAL 50 2.562 3.320 -5.169
389 HB VAL 50 HB VAL 50 2.948 6.120 -4.066
390 HG11 VAL 50 HG11 VAL 50 0.611 4.223 -3.765
391 HG12 VAL 50 HG12 VAL 50 0.628 5.696 -4.735
392 HG13 VAL 50 HG13 VAL 50 0.777 5.794 -2.982
393 HG21 VAL 50 HG21 VAL 50 2.786 3.470 -2.620
394 HG22 VAL 50 HG22 VAL 50 2.869 5.056 -1.853
395 HG23 VAL 50 HG23 VAL 50 4.231 4.463 -2.805
396 H LYS 51 H LYS 51 1.484 3.322 -7.084
397 HA LYS 51 HA LYS 51 1.342 5.854 -8.618
398 HB2 LYS 51 HB2 LYS 51 1.443 3.030 -9.697
399 HB3 LYS 51 HB3 LYS 51 1.223 4.475 -10.671
400 HG2 LYS 51 HG2 LYS 51 3.446 5.257 -10.062
401 HG3 LYS 51 HG3 LYS 51 3.671 3.853 -9.015
402 HD2 LYS 51 HD2 LYS 51 3.232 3.766 -12.009
403 HD3 LYS 51 HD3 LYS 51 4.785 3.561 -11.192
404 HE2 LYS 51 HE2 LYS 51 4.080 1.530 -10.179
405 HE3 LYS 51 HE3 LYS 51 2.401 1.794 -10.646
406 HZ1 LYS 51 HZ1 LYS 51 3.577 0.147 -12.022
407 HZ2 LYS 51 HZ2 LYS 51 4.614 1.361 -12.575
408 HZ3 LYS 51 HZ3 LYS 51 2.961 1.436 -12.923
409 H ASP 52 H ASP 52 -0.629 6.413 -9.543
410 HA ASP 52 HA ASP 52 -2.962 4.933 -8.575
411 HB2 ASP 52 HB2 ASP 52 -2.824 7.600 -10.003
412 HB3 ASP 52 HB3 ASP 52 -4.249 6.898 -9.241
413 H LEU 53 H LEU 53 -4.320 3.784 -9.877
414 HA LEU 53 HA LEU 53 -3.446 3.013 -12.465
415 HB2 LEU 53 HB2 LEU 53 -6.115 2.578 -11.113
416 HB3 LEU 53 HB3 LEU 53 -5.599 1.776 -12.587
417 HG LEU 53 HG LEU 53 -4.321 1.487 -9.860
418 HD11 LEU 53 HD11 LEU 53 -5.910 -0.474 -11.515
419 HD12 LEU 53 HD12 LEU 53 -6.460 0.335 -10.047
420 HD13 LEU 53 HD13 LEU 53 -5.125 -0.813 -9.971
421 HD21 LEU 53 HD21 LEU 53 -2.921 -0.239 -10.917
422 HD22 LEU 53 HD22 LEU 53 -2.624 1.363 -11.590
423 HD23 LEU 53 HD23 LEU 53 -3.590 0.193 -12.491
424 H LEU 54 H LEU 54 -5.420 5.622 -11.417
425 HA LEU 54 HA LEU 54 -6.529 6.078 -14.094
426 HB2 LEU 54 HB2 LEU 54 -6.973 7.560 -11.493
427 HB3 LEU 54 HB3 LEU 54 -7.779 7.925 -13.007
428 HG LEU 54 HG LEU 54 -8.062 5.366 -11.421
429 HD11 LEU 54 HD11 LEU 54 -10.037 7.595 -11.907
430 HD12 LEU 54 HD12 LEU 54 -9.189 7.280 -10.393
431 HD13 LEU 54 HD13 LEU 54 -10.342 6.102 -11.020
432 HD21 LEU 54 HD21 LEU 54 -8.215 4.917 -13.811
433 HD22 LEU 54 HD22 LEU 54 -9.395 6.216 -13.997
434 HD23 LEU 54 HD23 LEU 54 -9.802 4.780 -13.058
435 H GLU 55 H GLU 55 -3.701 6.303 -13.741
436 HA GLU 55 HA GLU 55 -2.720 8.869 -13.355
437 HB2 GLU 55 HB2 GLU 55 -0.818 8.070 -14.917
438 HB3 GLU 55 HB3 GLU 55 -1.093 7.234 -13.399
439 HG2 GLU 55 HG2 GLU 55 -0.684 5.561 -14.999
440 HG3 GLU 55 HG3 GLU 55 -2.416 5.526 -14.690