Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
12853 | 1tot RC | 6238 | cing | 1-original | 4 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 1H GLY 1 H1 GLY 1 3.549 -3.787 -10.384
2 2H GLY 1 H2 GLY 1 3.666 -2.205 -9.941
3 3H GLY 1 H3 GLY 1 4.829 -3.279 -9.481
4 1HA GLY 1 HA2 GLY 1 3.047 -4.518 -8.251
5 2HA GLY 1 HA3 GLY 1 3.514 -2.923 -7.601
6 H GLN 2 H GLN 2 0.841 -4.368 -7.362
7 HA GLN 2 HA GLN 2 -0.775 -2.036 -8.018
8 1HB GLN 2 HB2 GLN 2 -0.731 -3.250 -10.133
9 2HB GLN 2 HB3 GLN 2 -1.278 -4.728 -9.366
10 1HG GLN 2 HG2 GLN 2 -3.457 -3.825 -8.918
11 2HG GLN 2 HG3 GLN 2 -2.901 -2.160 -9.166
12 1HE2 GLN 2 2HE2 GLN 2 -5.221 -3.153 -10.303
13 2HE2 GLN 2 1HE2 GLN 2 -4.970 -3.191 -12.042
14 H ASP 3 H ASP 3 -2.828 -2.121 -7.182
15 HA ASP 3 HA ASP 3 -3.783 -3.996 -5.131
16 1HB ASP 3 HB2 ASP 3 -2.525 -2.241 -3.897
17 2HB ASP 3 HB3 ASP 3 -3.239 -1.014 -4.966
18 H ARG 4 H ARG 4 -6.235 -3.294 -4.876
19 HA ARG 4 HA ARG 4 -7.354 -3.078 -7.484
20 1HB ARG 4 HB2 ARG 4 -9.544 -2.542 -6.168
21 2HB ARG 4 HB3 ARG 4 -8.821 -4.146 -6.218
22 1HG ARG 4 HG2 ARG 4 -9.669 -3.657 -4.008
23 2HG ARG 4 HG3 ARG 4 -7.931 -3.910 -3.984
24 1HD ARG 4 HD2 ARG 4 -8.167 -1.144 -4.274
25 2HD ARG 4 HD3 ARG 4 -9.547 -1.530 -3.225
26 HE ARG 4 HE ARG 4 -6.683 -1.686 -2.783
27 1HH1 ARG 4 2HH1 ARG 4 -9.728 -2.518 -1.300
28 2HH1 ARG 4 1HH1 ARG 4 -9.041 -3.218 0.135
29 1HH2 ARG 4 1HH2 ARG 4 -5.742 -2.672 -1.119
30 2HH2 ARG 4 2HH2 ARG 4 -6.571 -3.310 0.273
31 H PHE 5 H PHE 5 -6.238 -0.419 -5.453
32 HA PHE 5 HA PHE 5 -6.960 1.345 -7.654
33 1HB PHE 5 HB2 PHE 5 -7.913 3.068 -6.115
34 2HB PHE 5 HB3 PHE 5 -8.916 1.716 -6.565
35 HD1 PHE 5 HD1 PHE 5 -10.523 1.768 -4.872
36 HD2 PHE 5 HD2 PHE 5 -6.355 1.729 -3.802
37 HE1 PHE 5 HE1 PHE 5 -11.120 1.393 -2.497
38 HE2 PHE 5 HE2 PHE 5 -6.942 1.362 -1.453
39 HZ PHE 5 HZ PHE 5 -9.312 1.207 -0.773
40 H VAL 6 H VAL 6 -4.563 0.217 -5.954
41 HA VAL 6 HA VAL 6 -3.028 2.732 -6.014
42 HB VAL 6 HB VAL 6 -3.506 0.863 -3.730
43 1HG1 VAL 6 1HG1 VAL 6 -0.683 1.903 -4.190
44 2HG1 VAL 6 2HG1 VAL 6 -1.332 1.155 -2.713
45 3HG1 VAL 6 3HG1 VAL 6 -1.214 0.216 -4.201
46 1HG2 VAL 6 1HG2 VAL 6 -2.645 3.759 -3.984
47 2HG2 VAL 6 2HG2 VAL 6 -4.286 3.166 -3.698
48 3HG2 VAL 6 3HG2 VAL 6 -3.058 2.925 -2.453
49 H TYR 7 H TYR 7 -0.816 2.367 -6.424
50 HA TYR 7 HA TYR 7 0.064 -0.061 -7.841
51 1HB TYR 7 HB2 TYR 7 -0.213 2.745 -9.001
52 2HB TYR 7 HB3 TYR 7 0.455 1.355 -9.833
53 HD1 TYR 7 HD1 TYR 7 -1.262 -0.442 -10.668
54 HD2 TYR 7 HD2 TYR 7 -2.552 3.107 -8.574
55 HE1 TYR 7 HE1 TYR 7 -3.538 -0.740 -11.543
56 HE2 TYR 7 HE2 TYR 7 -4.869 2.536 -9.100
57 HH TYR 7 HH TYR 7 -6.278 1.295 -10.468
58 H THR 8 H THR 8 2.357 1.022 -8.913
59 HA THR 8 HA THR 8 3.649 2.770 -6.901
60 HB THR 8 HB THR 8 5.722 1.166 -7.565
61 HG1 THR 8 HG1 THR 8 4.849 -0.376 -8.733
62 1HG2 THR 8 1HG2 THR 8 5.120 -0.251 -5.521
63 2HG2 THR 8 2HG2 THR 8 5.350 1.477 -5.332
64 3HG2 THR 8 3HG2 THR 8 3.685 0.796 -5.389
65 H CYS 9 H CYS 9 5.781 3.540 -7.826
66 HA CYS 9 HA CYS 9 5.860 3.767 -10.800
67 1HB CYS 9 HB2 CYS 9 5.555 6.071 -9.823
68 2HB CYS 9 HB3 CYS 9 6.850 5.739 -8.678
69 H ASN 10 H ASN 10 7.378 2.054 -11.104
70 HA ASN 10 HA ASN 10 9.183 1.312 -9.024
71 1HB ASN 10 HB2 ASN 10 8.343 -0.247 -10.755
72 2HB ASN 10 HB3 ASN 10 9.406 0.561 -11.939
73 1HD2 ASN 10 2HD2 ASN 10 11.042 -0.933 -12.267
74 2HD2 ASN 10 1HD2 ASN 10 11.966 -1.707 -10.964
75 H GLU 11 H GLU 11 9.212 4.131 -10.804
76 HA GLU 11 HA GLU 11 12.136 4.218 -10.758
77 1HB GLU 11 HB2 GLU 11 10.190 5.678 -12.366
78 2HB GLU 11 HB3 GLU 11 11.336 6.734 -11.586
79 1HG GLU 11 HG2 GLU 11 12.198 4.226 -13.147
80 2HG GLU 11 HG3 GLU 11 12.202 5.832 -13.835
81 H CYS 12 H CYS 12 9.369 5.302 -8.996
82 HA CYS 12 HA CYS 12 11.103 6.995 -7.236
83 1HB CYS 12 HB2 CYS 12 8.101 6.565 -7.118
84 2HB CYS 12 HB3 CYS 12 9.055 7.752 -6.205
85 H LYS 13 H LYS 13 9.499 3.970 -7.494
86 HA LYS 13 HA LYS 13 8.956 2.237 -6.201
87 1HB LYS 13 HB2 LYS 13 11.723 2.842 -5.023
88 2HB LYS 13 HB3 LYS 13 10.753 1.460 -4.540
89 1HG LYS 13 HG2 LYS 13 11.604 0.322 -6.247
90 2HG LYS 13 HG3 LYS 13 10.645 1.298 -7.331
91 1HD LYS 13 HD2 LYS 13 13.554 1.575 -6.609
92 2HD LYS 13 HD3 LYS 13 12.787 1.194 -8.178
93 1HE LYS 13 HE2 LYS 13 11.759 3.548 -8.018
94 2HE LYS 13 HE3 LYS 13 12.999 3.905 -6.822
95 1HZ LYS 13 HZ1 LYS 13 14.653 3.280 -8.594
96 2HZ LYS 13 HZ2 LYS 13 13.396 3.065 -9.637
97 3HZ LYS 13 HZ3 LYS 13 13.693 4.520 -9.062
98 H HIS 14 H HIS 14 7.682 4.337 -5.828
99 HA HIS 14 HA HIS 14 6.787 4.068 -3.029
100 1HB HIS 14 HB2 HIS 14 7.934 6.214 -3.150
101 2HB HIS 14 HB3 HIS 14 6.952 6.687 -4.559
102 HD2 HIS 14 HD2 HIS 14 4.915 8.085 -3.993
103 HE1 HIS 14 HE1 HIS 14 3.727 6.277 -0.338
104 HE2 HIS 14 HE2 HIS 14 3.072 7.944 -2.123
105 H HIS 15 H HIS 15 4.519 4.790 -2.990
106 HA HIS 15 HA HIS 15 2.962 3.333 -4.906
107 1HB HIS 15 HB2 HIS 15 1.721 3.078 -3.068
108 2HB HIS 15 HB3 HIS 15 2.698 4.215 -2.177
109 HD2 HIS 15 HD2 HIS 15 -0.406 4.095 -4.422
110 HE1 HIS 15 HE1 HIS 15 -0.633 7.789 -2.309
111 HE2 HIS 15 HE2 HIS 15 -1.858 6.239 -3.911
112 H VAL 16 H VAL 16 1.258 4.087 -6.157
113 HA VAL 16 HA VAL 16 0.816 6.942 -6.537
114 HB VAL 16 HB VAL 16 1.176 6.962 -8.897
115 1HG1 VAL 16 1HG1 VAL 16 3.565 5.511 -7.735
116 2HG1 VAL 16 2HG1 VAL 16 3.499 6.327 -9.279
117 3HG1 VAL 16 3HG1 VAL 16 3.282 7.263 -7.755
118 1HG2 VAL 16 1HG2 VAL 16 1.954 5.011 -10.223
119 2HG2 VAL 16 2HG2 VAL 16 1.672 3.964 -8.823
120 3HG2 VAL 16 3HG2 VAL 16 0.316 4.820 -9.583
121 H GLU 17 H GLU 17 -1.336 7.235 -7.711
122 HA GLU 17 HA GLU 17 -3.178 4.927 -7.194
123 1HB GLU 17 HB2 GLU 17 -4.891 6.806 -7.620
124 2HB GLU 17 HB3 GLU 17 -4.077 6.667 -6.052
125 1HG GLU 17 HG2 GLU 17 -4.316 9.017 -6.803
126 2HG GLU 17 HG3 GLU 17 -2.624 8.539 -6.549
127 H THR 18 H THR 18 -1.600 6.710 -9.644
128 HA THR 18 HA THR 18 -2.991 5.126 -11.711
129 HB THR 18 HB THR 18 -2.378 8.119 -11.696
130 HG1 THR 18 HG1 THR 18 -4.159 8.017 -10.658
131 1HG2 THR 18 1HG2 THR 18 -4.245 7.311 -13.791
132 2HG2 THR 18 2HG2 THR 18 -2.700 8.118 -13.978
133 3HG2 THR 18 3HG2 THR 18 -2.756 6.351 -13.975
134 H ARG 19 H ARG 19 -1.527 4.096 -13.005
135 HA ARG 19 HA ARG 19 1.253 5.149 -13.138
136 1HB ARG 19 HB2 ARG 19 2.324 3.073 -12.773
137 2HB ARG 19 HB3 ARG 19 1.209 3.247 -11.425
138 1HG ARG 19 HG2 ARG 19 -0.366 1.668 -12.477
139 2HG ARG 19 HG3 ARG 19 0.678 1.552 -13.903
140 1HD ARG 19 HD2 ARG 19 2.319 0.346 -12.890
141 2HD ARG 19 HD3 ARG 19 1.769 0.647 -11.248
142 HE ARG 19 HE ARG 19 -0.362 -0.695 -12.251
143 1HH1 ARG 19 1HH2 ARG 19 3.077 -1.641 -12.349
144 2HH1 ARG 19 2HH2 ARG 19 2.701 -3.247 -12.861
145 1HH2 ARG 19 1HH1 ARG 19 -0.708 -3.058 -12.447
146 2HH2 ARG 19 2HH1 ARG 19 0.708 -3.999 -12.757
147 H TRP 20 H TRP 20 2.522 4.117 -14.774
148 HA TRP 20 HA TRP 20 1.153 3.190 -17.275
149 1HB TRP 20 HB2 TRP 20 3.793 4.600 -16.769
150 2HB TRP 20 HB3 TRP 20 3.184 4.038 -18.333
151 HD1 TRP 20 HD1 TRP 20 2.529 6.787 -15.732
152 HE1 TRP 20 HE1 TRP 20 0.965 8.535 -16.662
153 HE3 TRP 20 HE3 TRP 20 1.447 4.576 -20.200
154 HZ2 TRP 20 HZ2 TRP 20 -0.577 8.996 -19.082
155 HZ3 TRP 20 HZ3 TRP 20 -0.148 5.654 -21.767
156 HH2 TRP 20 HH2 TRP 20 -1.175 7.851 -21.202
157 H HIS 21 H HIS 21 1.791 1.044 -17.685
158 HA HIS 21 HA HIS 21 3.713 -0.209 -15.757
159 1HB HIS 21 HB2 HIS 21 1.704 -0.700 -14.804
160 2HB HIS 21 HB3 HIS 21 0.804 -0.702 -16.289
161 HD2 HIS 21 HD2 HIS 21 3.836 -3.056 -16.108
162 HE1 HIS 21 HE1 HIS 21 0.419 -5.524 -15.649
163 HE2 HIS 21 HE2 HIS 21 2.950 -5.504 -15.973
164 H CYS 22 H CYS 22 5.238 -1.254 -16.791
165 HA CYS 22 HA CYS 22 5.269 -1.819 -19.625
166 1HB CYS 22 HB2 CYS 22 7.065 -1.765 -17.276
167 2HB CYS 22 HB3 CYS 22 7.403 -3.121 -18.326
168 H THR 23 H THR 23 4.504 -3.489 -20.605
169 HA THR 23 HA THR 23 3.934 -5.940 -19.066
170 HB THR 23 HB THR 23 2.291 -6.542 -20.897
171 HG1 THR 23 HG1 THR 23 3.356 -4.333 -22.012
172 1HG2 THR 23 1HG2 THR 23 1.953 -3.895 -19.551
173 2HG2 THR 23 2HG2 THR 23 0.621 -5.024 -20.014
174 3HG2 THR 23 3HG2 THR 23 1.728 -5.477 -18.732
175 H VAL 24 H VAL 24 6.379 -4.917 -20.386
176 HA VAL 24 HA VAL 24 7.442 -7.092 -22.017
177 HB VAL 24 HB VAL 24 7.611 -4.893 -22.892
178 1HG1 VAL 24 1HG1 VAL 24 7.156 -3.128 -21.751
179 2HG1 VAL 24 2HG1 VAL 24 7.542 -3.840 -20.211
180 3HG1 VAL 24 3HG1 VAL 24 8.841 -3.139 -21.154
181 1HG2 VAL 24 1HG2 VAL 24 10.230 -5.186 -21.369
182 2HG2 VAL 24 2HG2 VAL 24 9.840 -6.075 -22.851
183 3HG2 VAL 24 3HG2 VAL 24 9.995 -4.288 -22.871
184 H CYS 25 H CYS 25 8.418 -4.884 -19.393
185 HA CYS 25 HA CYS 25 10.229 -6.597 -18.020
186 1HB CYS 25 HB2 CYS 25 8.807 -4.173 -16.949
187 2HB CYS 25 HB3 CYS 25 10.424 -4.740 -16.528
188 H GLU 26 H GLU 26 9.896 -7.122 -15.651
189 HA GLU 26 HA GLU 26 7.414 -8.519 -15.171
190 1HB GLU 26 HB2 GLU 26 10.077 -8.321 -13.807
191 2HB GLU 26 HB3 GLU 26 8.667 -8.720 -12.793
192 1HG GLU 26 HG2 GLU 26 8.038 -10.549 -14.256
193 2HG GLU 26 HG3 GLU 26 9.434 -10.229 -15.299
194 H ASP 27 H ASP 27 5.863 -6.887 -15.266
195 HA ASP 27 HA ASP 27 4.461 -5.333 -14.525
196 1HB ASP 27 HB2 ASP 27 4.076 -7.306 -13.056
197 2HB ASP 27 HB3 ASP 27 5.089 -6.580 -11.822
198 H TYR 28 H TYR 28 7.042 -4.385 -14.829
199 HA TYR 28 HA TYR 28 7.852 -2.514 -12.829
200 1HB TYR 28 HB2 TYR 28 9.281 -3.366 -14.677
201 2HB TYR 28 HB3 TYR 28 8.277 -2.513 -15.837
202 HD1 TYR 28 HD1 TYR 28 11.257 -2.340 -13.969
203 HD2 TYR 28 HD2 TYR 28 8.168 0.070 -15.743
204 HE1 TYR 28 HE1 TYR 28 12.750 -0.352 -13.845
205 HE2 TYR 28 HE2 TYR 28 9.622 2.014 -15.702
206 HH TYR 28 HH TYR 28 12.984 1.927 -14.397
207 H ASP 29 H ASP 29 7.439 -0.268 -12.699
208 HA ASP 29 HA ASP 29 4.996 0.669 -14.134
209 1HB ASP 29 HB2 ASP 29 5.513 1.712 -11.387
210 2HB ASP 29 HB3 ASP 29 4.010 1.319 -12.131
211 H LEU 30 H LEU 30 4.713 2.965 -14.096
212 HA LEU 30 HA LEU 30 6.833 4.655 -12.980
213 1HB LEU 30 HB2 LEU 30 5.859 4.735 -15.856
214 2HB LEU 30 HB3 LEU 30 6.667 6.042 -15.017
215 HG LEU 30 HG LEU 30 7.808 3.265 -15.644
216 1HD1 LEU 30 1HD1 LEU 30 8.662 6.000 -16.696
217 2HD1 LEU 30 2HD1 LEU 30 9.316 4.421 -17.138
218 3HD1 LEU 30 3HD1 LEU 30 7.623 4.835 -17.555
219 1HD2 LEU 30 1HD2 LEU 30 10.010 4.080 -14.850
220 2HD2 LEU 30 2HD2 LEU 30 9.285 5.634 -14.394
221 3HD2 LEU 30 3HD2 LEU 30 8.864 4.156 -13.525
222 H CYS 31 H CYS 31 5.953 6.468 -12.020
223 HA CYS 31 HA CYS 31 3.114 7.046 -12.149
224 1HB CYS 31 HB2 CYS 31 3.708 9.097 -11.047
225 2HB CYS 31 HB3 CYS 31 4.479 7.799 -10.157
226 H ILE 32 H ILE 32 2.451 9.188 -12.963
227 HA ILE 32 HA ILE 32 2.748 9.361 -15.678
228 HB ILE 32 HB ILE 32 2.008 11.691 -13.881
229 1HG1 ILE 32 2HG1 ILE 32 0.711 10.022 -12.879
230 2HG1 ILE 32 3HG1 ILE 32 -0.378 10.844 -13.953
231 1HG2 ILE 32 1HG2 ILE 32 1.201 10.832 -16.677
232 2HG2 ILE 32 2HG2 ILE 32 0.469 12.189 -15.780
233 3HG2 ILE 32 3HG2 ILE 32 2.195 12.235 -16.181
234 1HD1 ILE 32 1HD1 ILE 32 -0.428 8.983 -15.483
235 2HD1 ILE 32 2HD1 ILE 32 0.905 8.148 -14.622
236 3HD1 ILE 32 3HD1 ILE 32 -0.638 8.381 -13.825
237 H ASN 33 H ASN 33 4.433 11.327 -13.256
238 HA ASN 33 HA ASN 33 5.719 13.058 -15.140
239 1HB ASN 33 HB2 ASN 33 5.626 13.903 -12.921
240 2HB ASN 33 HB3 ASN 33 6.075 12.360 -12.214
241 1HD2 ASN 33 2HD2 ASN 33 8.374 11.786 -12.051
242 2HD2 ASN 33 1HD2 ASN 33 9.576 13.025 -12.309
243 H CYS 34 H CYS 34 6.767 10.023 -13.528
244 HA CYS 34 HA CYS 34 9.357 10.120 -14.716
245 1HB CYS 34 HB2 CYS 34 7.737 7.919 -13.373
246 2HB CYS 34 HB3 CYS 34 9.314 7.615 -14.109
247 H TYR 35 H TYR 35 6.297 8.480 -15.700
248 HA TYR 35 HA TYR 35 7.336 7.224 -17.997
249 1HB TYR 35 HB2 TYR 35 5.071 6.780 -17.134
250 2HB TYR 35 HB3 TYR 35 4.564 8.416 -17.534
251 HD1 TYR 35 HD1 TYR 35 6.179 5.435 -19.264
252 HD2 TYR 35 HD2 TYR 35 3.422 8.784 -19.536
253 HE1 TYR 35 HE1 TYR 35 5.526 4.705 -21.523
254 HE2 TYR 35 HE2 TYR 35 2.767 8.020 -21.813
255 HH TYR 35 HH TYR 35 4.165 5.078 -23.302
256 H ASN 36 H ASN 36 6.109 10.533 -17.541
257 HA ASN 36 HA ASN 36 6.364 11.502 -20.171
258 1HB ASN 36 HB2 ASN 36 5.988 12.655 -17.437
259 2HB ASN 36 HB3 ASN 36 6.624 13.760 -18.579
260 1HD2 ASN 36 2HD2 ASN 36 3.870 11.659 -17.939
261 2HD2 ASN 36 1HD2 ASN 36 2.738 12.504 -19.024
262 H THR 37 H THR 37 8.975 10.787 -17.981
263 HA THR 37 HA THR 37 10.754 12.587 -19.597
264 HB THR 37 HB THR 37 11.988 12.989 -17.443
265 HG1 THR 37 HG1 THR 37 9.699 12.097 -16.106
266 1HG2 THR 37 1HG2 THR 37 10.471 14.615 -16.497
267 2HG2 THR 37 2HG2 THR 37 10.338 14.651 -18.266
268 3HG2 THR 37 3HG2 THR 37 9.071 13.882 -17.285
269 H LYS 38 H LYS 38 10.667 9.726 -17.506
270 HA LYS 38 HA LYS 38 13.273 8.768 -18.175
271 1HB LYS 38 HB2 LYS 38 10.926 7.135 -17.162
272 2HB LYS 38 HB3 LYS 38 12.625 6.765 -16.957
273 1HG LYS 38 HG2 LYS 38 11.233 9.184 -15.709
274 2HG LYS 38 HG3 LYS 38 11.415 7.636 -14.900
275 1HD LYS 38 HD2 LYS 38 13.894 7.926 -14.910
276 2HD LYS 38 HD3 LYS 38 13.711 9.394 -15.849
277 1HE LYS 38 HE2 LYS 38 14.061 9.992 -13.553
278 2HE LYS 38 HE3 LYS 38 12.414 10.443 -14.008
279 1HZ LYS 38 HZ1 LYS 38 11.623 8.554 -12.764
280 2HZ LYS 38 HZ2 LYS 38 13.161 8.011 -12.506
281 3HZ LYS 38 HZ3 LYS 38 12.645 9.367 -11.791
282 H SER 39 H SER 39 10.630 9.052 -20.175
283 HA SER 39 HA SER 39 9.943 8.134 -22.124
284 1HB SER 39 HB2 SER 39 12.942 8.114 -22.496
285 2HB SER 39 HB3 SER 39 11.711 8.323 -23.765
286 HG SER 39 HG SER 39 12.267 10.093 -21.587
287 H HIS 40 H HIS 40 9.677 5.987 -20.439
288 HA HIS 40 HA HIS 40 11.028 3.637 -21.339
289 1HB HIS 40 HB2 HIS 40 9.114 4.348 -19.331
290 2HB HIS 40 HB3 HIS 40 8.352 3.113 -20.338
291 HD1 HIS 40 HD1 HIS 40 11.366 3.479 -17.938
292 HD2 HIS 40 HD2 HIS 40 9.388 0.704 -20.365
293 HE1 HIS 40 HE1 HIS 40 12.224 1.204 -17.242
294 H THR 41 H THR 41 10.924 2.970 -23.347
295 HA THR 41 HA THR 41 8.698 3.797 -24.995
296 HB THR 41 HB THR 41 10.964 2.357 -26.237
297 HG1 THR 41 HG1 THR 41 11.608 4.599 -24.637
298 1HG2 THR 41 1HG2 THR 41 10.021 5.213 -26.548
299 2HG2 THR 41 2HG2 THR 41 11.128 4.319 -27.634
300 3HG2 THR 41 3HG2 THR 41 9.430 3.805 -27.458
301 H HIS 42 H HIS 42 8.885 1.060 -23.113
302 HA HIS 42 HA HIS 42 8.712 -0.937 -25.211
303 1HB HIS 42 HB2 HIS 42 8.228 -1.115 -22.244
304 2HB HIS 42 HB3 HIS 42 8.612 -2.429 -23.379
305 HD2 HIS 42 HD2 HIS 42 11.271 -0.914 -24.691
306 HE1 HIS 42 HE1 HIS 42 12.703 -1.007 -20.680
307 HE2 HIS 42 HE2 HIS 42 13.365 -0.682 -23.128
308 H LYS 43 H LYS 43 6.962 -2.654 -24.848
309 HA LYS 43 HA LYS 43 4.430 -1.453 -25.364
310 1HB LYS 43 HB2 LYS 43 5.453 -3.594 -26.312
311 2HB LYS 43 HB3 LYS 43 4.964 -4.437 -24.854
312 1HG LYS 43 HG2 LYS 43 2.993 -2.792 -26.473
313 2HG LYS 43 HG3 LYS 43 3.479 -4.381 -27.045
314 1HD LYS 43 HD2 LYS 43 1.711 -5.119 -25.898
315 2HD LYS 43 HD3 LYS 43 2.810 -5.049 -24.502
316 1HE LYS 43 HE2 LYS 43 1.984 -2.622 -24.190
317 2HE LYS 43 HE3 LYS 43 0.781 -2.959 -25.442
318 1HZ LYS 43 HZ1 LYS 43 -0.171 -4.592 -23.968
319 2HZ LYS 43 HZ2 LYS 43 1.060 -4.401 -22.897
320 3HZ LYS 43 HZ3 LYS 43 0.049 -3.154 -23.153
321 H MET 44 H MET 44 3.557 -0.376 -23.721
322 HA MET 44 HA MET 44 3.330 -1.582 -20.995
323 1HB MET 44 HB2 MET 44 3.514 1.275 -22.065
324 2HB MET 44 HB3 MET 44 2.808 0.946 -20.462
325 1HG MET 44 HG2 MET 44 4.643 0.142 -19.561
326 2HG MET 44 HG3 MET 44 5.516 -0.101 -21.084
327 1HE MET 44 HE1 MET 44 6.068 1.184 -18.037
328 2HE MET 44 HE2 MET 44 6.139 2.964 -17.986
329 3HE MET 44 HE3 MET 44 4.573 2.126 -18.046
330 H VAL 45 H VAL 45 1.405 -0.505 -19.792
331 HA VAL 45 HA VAL 45 -1.107 -0.252 -21.233
332 HB VAL 45 HB VAL 45 -2.098 -1.506 -19.332
333 1HG1 VAL 45 1HG1 VAL 45 -1.943 -3.692 -20.335
334 2HG1 VAL 45 2HG1 VAL 45 -1.833 -2.496 -21.650
335 3HG1 VAL 45 3HG1 VAL 45 -0.362 -3.330 -21.045
336 1HG2 VAL 45 1HG2 VAL 45 -0.768 -3.293 -18.227
337 2HG2 VAL 45 2HG2 VAL 45 0.692 -2.494 -18.793
338 3HG2 VAL 45 3HG2 VAL 45 -0.428 -1.613 -17.747
339 H LYS 46 H LYS 46 -2.590 0.637 -19.112
340 HA LYS 46 HA LYS 46 -1.028 2.319 -17.328
341 1HB LYS 46 HB2 LYS 46 -1.293 3.577 -19.527
342 2HB LYS 46 HB3 LYS 46 -3.026 3.548 -19.292
343 1HG LYS 46 HG2 LYS 46 -1.087 4.823 -17.300
344 2HG LYS 46 HG3 LYS 46 -1.747 5.630 -18.705
345 1HD LYS 46 HD2 LYS 46 -4.104 5.191 -17.742
346 2HD LYS 46 HD3 LYS 46 -3.292 4.652 -16.266
347 1HE LYS 46 HE2 LYS 46 -3.773 6.942 -15.962
348 2HE LYS 46 HE3 LYS 46 -2.027 6.842 -16.271
349 1HZ LYS 46 HZ1 LYS 46 -4.162 7.678 -18.138
350 2HZ LYS 46 HZ2 LYS 46 -3.106 8.630 -17.476
351 3HZ LYS 46 HZ3 LYS 46 -2.565 7.557 -18.600
352 H TRP 47 H TRP 47 -2.210 2.465 -15.499
353 HA TRP 47 HA TRP 47 -5.069 1.648 -15.500
354 1HB TRP 47 HB2 TRP 47 -3.022 0.814 -13.438
355 2HB TRP 47 HB3 TRP 47 -4.697 0.297 -13.534
356 HD1 TRP 47 HD1 TRP 47 -1.290 -0.774 -14.411
357 HE1 TRP 47 HE1 TRP 47 -1.211 -2.674 -16.046
358 HE3 TRP 47 HE3 TRP 47 -6.129 -0.601 -16.083
359 HZ2 TRP 47 HZ2 TRP 47 -2.918 -3.831 -18.073
360 HZ3 TRP 47 HZ3 TRP 47 -6.806 -2.028 -18.024
361 HH2 TRP 47 HH2 TRP 47 -5.229 -3.649 -18.993
362 H GLY 48 H GLY 48 -6.243 3.207 -14.332
363 1HA GLY 48 HA2 GLY 48 -4.720 5.201 -12.789
364 2HA GLY 48 HA3 GLY 48 -5.578 5.709 -14.251
365 H LEU 49 H LEU 49 -5.909 6.332 -11.419
366 HA LEU 49 HA LEU 49 -8.786 5.757 -11.169
367 1HB LEU 49 HB2 LEU 49 -6.801 4.272 -9.762
368 2HB LEU 49 HB3 LEU 49 -7.480 5.333 -8.573
369 HG LEU 49 HG LEU 49 -8.524 3.190 -8.653
370 1HD1 LEU 49 1HD1 LEU 49 -9.952 5.080 -7.972
371 2HD1 LEU 49 2HD1 LEU 49 -10.531 5.272 -9.636
372 3HD1 LEU 49 3HD1 LEU 49 -10.921 3.804 -8.729
373 1HD2 LEU 49 1HD2 LEU 49 -9.637 3.694 -11.426
374 2HD2 LEU 49 2HD2 LEU 49 -8.258 2.631 -11.060
375 3HD2 LEU 49 3HD2 LEU 49 -9.864 2.277 -10.404
376 H GLY 50 H GLY 50 -6.439 8.191 -11.072
377 1HA GLY 50 HA2 GLY 50 -8.313 9.924 -9.644
378 2HA GLY 50 HA3 GLY 50 -6.716 9.673 -8.872
379 H LEU 51 H LEU 51 -4.986 9.755 -11.032
380 HA LEU 51 HA LEU 51 -5.408 12.419 -12.285
381 1HB LEU 51 HB2 LEU 51 -2.918 11.292 -10.941
382 2HB LEU 51 HB3 LEU 51 -2.960 12.786 -11.861
383 HG LEU 51 HG LEU 51 -4.551 12.284 -9.297
384 1HD1 LEU 51 1HD1 LEU 51 -2.186 12.147 -8.831
385 2HD1 LEU 51 2HD1 LEU 51 -1.879 13.683 -9.649
386 3HD1 LEU 51 3HD1 LEU 51 -2.850 13.639 -8.152
387 1HD2 LEU 51 1HD2 LEU 51 -5.539 14.098 -10.632
388 2HD2 LEU 51 2HD2 LEU 51 -4.730 14.782 -9.236
389 3HD2 LEU 51 3HD2 LEU 51 -3.941 14.848 -10.836
390 H ASP 52 H ASP 52 -6.200 10.923 -14.049
391 HA ASP 52 HA ASP 52 -4.426 8.992 -15.181
392 1HB ASP 52 HB2 ASP 52 -7.009 9.163 -15.365
393 2HB ASP 52 HB3 ASP 52 -6.709 10.216 -16.737
Start of MODEL 2
1 1H GLY 1 H1 GLY 1 3.970 -3.706 -10.451
2 2H GLY 1 H2 GLY 1 4.273 -2.158 -10.034
3 3H GLY 1 H3 GLY 1 5.307 -3.332 -9.577
4 1HA GLY 1 HA2 GLY 1 3.529 -4.326 -8.190
5 2HA GLY 1 HA3 GLY 1 3.996 -2.664 -7.708
6 H GLN 2 H GLN 2 1.322 -4.337 -7.540
7 HA GLN 2 HA GLN 2 -0.405 -2.130 -8.378
8 1HB GLN 2 HB2 GLN 2 -1.901 -3.982 -9.522
9 2HB GLN 2 HB3 GLN 2 -0.649 -3.151 -10.398
10 1HG GLN 2 HG2 GLN 2 0.878 -5.070 -10.160
11 2HG GLN 2 HG3 GLN 2 -0.365 -5.944 -9.229
12 1HE2 GLN 2 2HE2 GLN 2 0.943 -5.630 -12.337
13 2HE2 GLN 2 1HE2 GLN 2 -0.460 -6.240 -13.210
14 H ASP 3 H ASP 3 -2.499 -2.264 -7.707
15 HA ASP 3 HA ASP 3 -3.556 -4.100 -5.720
16 1HB ASP 3 HB2 ASP 3 -2.405 -2.519 -4.264
17 2HB ASP 3 HB3 ASP 3 -2.989 -1.131 -5.175
18 H ARG 4 H ARG 4 -6.026 -3.457 -5.609
19 HA ARG 4 HA ARG 4 -6.915 -3.062 -8.268
20 1HB ARG 4 HB2 ARG 4 -9.266 -2.715 -7.071
21 2HB ARG 4 HB3 ARG 4 -8.493 -4.261 -7.246
22 1HG ARG 4 HG2 ARG 4 -9.428 -4.084 -5.021
23 2HG ARG 4 HG3 ARG 4 -7.704 -4.201 -4.915
24 1HD ARG 4 HD2 ARG 4 -8.109 -1.452 -4.975
25 2HD ARG 4 HD3 ARG 4 -9.504 -2.024 -4.024
26 HE ARG 4 HE ARG 4 -6.626 -2.056 -3.477
27 1HH1 ARG 4 1HH2 ARG 4 -9.734 -3.056 -2.240
28 2HH1 ARG 4 2HH2 ARG 4 -9.116 -3.726 -0.743
29 1HH2 ARG 4 1HH1 ARG 4 -5.772 -3.037 -1.780
30 2HH2 ARG 4 2HH1 ARG 4 -6.652 -3.624 -0.405
31 H PHE 5 H PHE 5 -6.126 -0.555 -5.950
32 HA PHE 5 HA PHE 5 -6.773 1.368 -8.083
33 1HB PHE 5 HB2 PHE 5 -7.868 2.931 -6.439
34 2HB PHE 5 HB3 PHE 5 -8.783 1.593 -7.039
35 HD1 PHE 5 HD1 PHE 5 -10.450 1.307 -5.431
36 HD2 PHE 5 HD2 PHE 5 -6.363 1.540 -4.125
37 HE1 PHE 5 HE1 PHE 5 -11.153 0.657 -3.157
38 HE2 PHE 5 HE2 PHE 5 -7.059 0.854 -1.858
39 HZ PHE 5 HZ PHE 5 -9.446 0.430 -1.342
40 H VAL 6 H VAL 6 -4.454 0.172 -6.236
41 HA VAL 6 HA VAL 6 -3.002 2.735 -6.183
42 HB VAL 6 HB VAL 6 -3.548 0.778 -3.962
43 1HG1 VAL 6 1HG1 VAL 6 -0.851 2.145 -4.166
44 2HG1 VAL 6 2HG1 VAL 6 -1.512 1.271 -2.751
45 3HG1 VAL 6 3HG1 VAL 6 -1.142 0.393 -4.247
46 1HG2 VAL 6 1HG2 VAL 6 -4.395 3.160 -4.137
47 2HG2 VAL 6 2HG2 VAL 6 -3.444 2.816 -2.658
48 3HG2 VAL 6 3HG2 VAL 6 -2.705 3.702 -4.011
49 H TYR 7 H TYR 7 -0.742 2.421 -6.510
50 HA TYR 7 HA TYR 7 0.200 -0.085 -7.757
51 1HB TYR 7 HB2 TYR 7 -0.195 2.666 -9.039
52 2HB TYR 7 HB3 TYR 7 0.695 1.388 -9.799
53 HD1 TYR 7 HD1 TYR 7 -0.688 -0.874 -10.168
54 HD2 TYR 7 HD2 TYR 7 -2.575 2.805 -9.047
55 HE1 TYR 7 HE1 TYR 7 -2.905 -1.755 -10.980
56 HE2 TYR 7 HE2 TYR 7 -4.736 1.863 -9.545
57 HH TYR 7 HH TYR 7 -5.920 -0.002 -10.414
58 H THR 8 H THR 8 2.565 0.758 -8.786
59 HA THR 8 HA THR 8 3.707 2.714 -6.838
60 HB THR 8 HB THR 8 5.851 1.210 -7.477
61 HG1 THR 8 HG1 THR 8 4.989 -0.369 -8.647
62 1HG2 THR 8 1HG2 THR 8 5.528 -0.109 -5.415
63 2HG2 THR 8 2HG2 THR 8 5.183 1.608 -5.196
64 3HG2 THR 8 3HG2 THR 8 3.826 0.462 -5.346
65 H CYS 9 H CYS 9 5.746 3.663 -7.763
66 HA CYS 9 HA CYS 9 5.713 3.825 -10.754
67 1HB CYS 9 HB2 CYS 9 5.483 6.117 -9.854
68 2HB CYS 9 HB3 CYS 9 6.786 5.832 -8.676
69 H ASN 10 H ASN 10 7.315 2.164 -11.187
70 HA ASN 10 HA ASN 10 9.070 1.337 -9.094
71 1HB ASN 10 HB2 ASN 10 8.207 -0.153 -10.947
72 2HB ASN 10 HB3 ASN 10 9.391 0.640 -12.019
73 1HD2 ASN 10 2HD2 ASN 10 11.078 -0.848 -12.227
74 2HD2 ASN 10 1HD2 ASN 10 11.821 -1.707 -10.886
75 H GLU 11 H GLU 11 9.177 4.203 -10.749
76 HA GLU 11 HA GLU 11 12.101 4.241 -10.633
77 1HB GLU 11 HB2 GLU 11 10.188 5.694 -12.287
78 2HB GLU 11 HB3 GLU 11 11.342 6.748 -11.473
79 1HG GLU 11 HG2 GLU 11 12.184 4.216 -13.014
80 2HG GLU 11 HG3 GLU 11 12.238 5.829 -13.704
81 H CYS 12 H CYS 12 9.236 5.353 -8.961
82 HA CYS 12 HA CYS 12 10.940 7.068 -7.205
83 1HB CYS 12 HB2 CYS 12 7.937 6.615 -7.062
84 2HB CYS 12 HB3 CYS 12 8.923 7.797 -6.180
85 H LYS 13 H LYS 13 9.395 3.996 -7.469
86 HA LYS 13 HA LYS 13 8.940 2.230 -6.152
87 1HB LYS 13 HB2 LYS 13 11.686 2.965 -5.037
88 2HB LYS 13 HB3 LYS 13 10.768 1.597 -4.457
89 1HG LYS 13 HG2 LYS 13 11.591 0.361 -6.100
90 2HG LYS 13 HG3 LYS 13 10.569 1.238 -7.217
91 1HD LYS 13 HD2 LYS 13 13.500 1.578 -6.649
92 2HD LYS 13 HD3 LYS 13 12.627 1.197 -8.155
93 1HE LYS 13 HE2 LYS 13 11.655 3.534 -8.010
94 2HE LYS 13 HE3 LYS 13 12.867 3.898 -6.786
95 1HZ LYS 13 HZ1 LYS 13 13.558 4.515 -9.016
96 2HZ LYS 13 HZ2 LYS 13 14.577 3.328 -8.510
97 3HZ LYS 13 HZ3 LYS 13 13.321 3.040 -9.578
98 H HIS 14 H HIS 14 7.545 4.317 -5.765
99 HA HIS 14 HA HIS 14 6.701 4.060 -2.962
100 1HB HIS 14 HB2 HIS 14 7.875 6.228 -3.099
101 2HB HIS 14 HB3 HIS 14 6.937 6.665 -4.531
102 HD2 HIS 14 HD2 HIS 14 4.920 8.185 -4.048
103 HE1 HIS 14 HE1 HIS 14 3.725 6.658 -0.272
104 HE2 HIS 14 HE2 HIS 14 3.185 8.332 -2.124
105 H HIS 15 H HIS 15 4.443 4.683 -2.815
106 HA HIS 15 HA HIS 15 2.897 3.350 -4.846
107 1HB HIS 15 HB2 HIS 15 2.153 4.620 -2.184
108 2HB HIS 15 HB3 HIS 15 0.954 4.031 -3.329
109 HD2 HIS 15 HD2 HIS 15 1.286 1.344 -4.106
110 HE1 HIS 15 HE1 HIS 15 2.640 0.272 -0.212
111 HE2 HIS 15 HE2 HIS 15 1.706 -0.637 -2.418
112 H VAL 16 H VAL 16 1.272 4.121 -6.074
113 HA VAL 16 HA VAL 16 0.780 7.006 -6.361
114 HB VAL 16 HB VAL 16 1.264 6.968 -8.734
115 1HG1 VAL 16 1HG1 VAL 16 3.660 6.473 -8.868
116 2HG1 VAL 16 2HG1 VAL 16 3.283 7.333 -7.358
117 3HG1 VAL 16 3HG1 VAL 16 3.639 5.575 -7.391
118 1HG2 VAL 16 1HG2 VAL 16 0.548 4.760 -9.405
119 2HG2 VAL 16 2HG2 VAL 16 2.208 4.989 -9.921
120 3HG2 VAL 16 3HG2 VAL 16 1.849 3.963 -8.517
121 H GLU 17 H GLU 17 -1.373 7.283 -7.539
122 HA GLU 17 HA GLU 17 -3.113 4.907 -7.100
123 1HB GLU 17 HB2 GLU 17 -4.897 6.686 -7.676
124 2HB GLU 17 HB3 GLU 17 -4.184 6.608 -6.056
125 1HG GLU 17 HG2 GLU 17 -4.465 8.928 -6.865
126 2HG GLU 17 HG3 GLU 17 -2.757 8.540 -6.555
127 H THR 18 H THR 18 -1.646 6.774 -9.607
128 HA THR 18 HA THR 18 -2.906 5.032 -11.647
129 HB THR 18 HB THR 18 -2.412 8.043 -11.666
130 HG1 THR 18 HG1 THR 18 -4.193 7.886 -10.694
131 1HG2 THR 18 1HG2 THR 18 -2.185 7.515 -13.966
132 2HG2 THR 18 2HG2 THR 18 -3.147 6.060 -13.859
133 3HG2 THR 18 3HG2 THR 18 -3.968 7.631 -13.845
134 H ARG 19 H ARG 19 -1.453 4.178 -13.109
135 HA ARG 19 HA ARG 19 1.294 5.303 -13.266
136 1HB ARG 19 HB2 ARG 19 2.401 3.202 -12.830
137 2HB ARG 19 HB3 ARG 19 1.324 3.475 -11.480
138 1HG ARG 19 HG2 ARG 19 -0.284 1.906 -12.375
139 2HG ARG 19 HG3 ARG 19 0.644 1.724 -13.902
140 1HD ARG 19 HD2 ARG 19 2.292 0.411 -12.970
141 2HD ARG 19 HD3 ARG 19 1.810 0.748 -11.326
142 HE ARG 19 HE ARG 19 -0.481 -0.271 -12.233
143 1HH1 ARG 19 1HH2 ARG 19 2.717 -1.774 -12.212
144 2HH1 ARG 19 2HH2 ARG 19 2.158 -3.305 -12.750
145 1HH2 ARG 19 2HH1 ARG 19 -1.222 -2.364 -12.984
146 2HH2 ARG 19 1HH1 ARG 19 -0.050 -3.632 -13.097
147 H TRP 20 H TRP 20 2.570 4.168 -14.863
148 HA TRP 20 HA TRP 20 1.159 3.144 -17.285
149 1HB TRP 20 HB2 TRP 20 3.852 4.490 -16.866
150 2HB TRP 20 HB3 TRP 20 3.217 3.884 -18.406
151 HD1 TRP 20 HD1 TRP 20 2.702 6.723 -15.887
152 HE1 TRP 20 HE1 TRP 20 1.190 8.514 -16.854
153 HE3 TRP 20 HE3 TRP 20 1.479 4.447 -20.277
154 HZ2 TRP 20 HZ2 TRP 20 -0.527 8.859 -19.127
155 HZ3 TRP 20 HZ3 TRP 20 -0.165 5.508 -21.827
156 HH2 TRP 20 HH2 TRP 20 -1.163 7.721 -21.267
157 H HIS 21 H HIS 21 1.851 0.965 -17.742
158 HA HIS 21 HA HIS 21 3.801 -0.218 -15.821
159 1HB HIS 21 HB2 HIS 21 1.866 -0.719 -14.756
160 2HB HIS 21 HB3 HIS 21 0.877 -0.766 -16.201
161 HD2 HIS 21 HD2 HIS 21 3.940 -3.056 -16.080
162 HE1 HIS 21 HE1 HIS 21 0.533 -5.556 -15.741
163 HE2 HIS 21 HE2 HIS 21 3.067 -5.503 -16.020
164 H CYS 22 H CYS 22 5.287 -1.273 -16.841
165 HA CYS 22 HA CYS 22 5.299 -1.848 -19.678
166 1HB CYS 22 HB2 CYS 22 7.100 -1.761 -17.339
167 2HB CYS 22 HB3 CYS 22 7.448 -3.119 -18.386
168 H THR 23 H THR 23 4.523 -3.541 -20.617
169 HA THR 23 HA THR 23 3.978 -6.006 -19.062
170 HB THR 23 HB THR 23 2.292 -6.597 -20.861
171 HG1 THR 23 HG1 THR 23 3.306 -4.361 -21.954
172 1HG2 THR 23 1HG2 THR 23 1.964 -3.931 -19.482
173 2HG2 THR 23 2HG2 THR 23 0.647 -5.057 -19.949
174 3HG2 THR 23 3HG2 THR 23 1.762 -5.490 -18.659
175 H VAL 24 H VAL 24 6.374 -4.979 -20.387
176 HA VAL 24 HA VAL 24 7.463 -7.126 -22.051
177 HB VAL 24 HB VAL 24 7.527 -4.909 -22.932
178 1HG1 VAL 24 1HG1 VAL 24 7.061 -3.166 -21.822
179 2HG1 VAL 24 2HG1 VAL 24 7.499 -3.842 -20.267
180 3HG1 VAL 24 3HG1 VAL 24 8.751 -3.137 -21.236
181 1HG2 VAL 24 1HG2 VAL 24 9.864 -4.285 -23.046
182 2HG2 VAL 24 2HG2 VAL 24 10.206 -5.145 -21.512
183 3HG2 VAL 24 3HG2 VAL 24 9.770 -6.062 -22.970
184 H CYS 25 H CYS 25 8.400 -4.883 -19.470
185 HA CYS 25 HA CYS 25 10.334 -6.533 -18.159
186 1HB CYS 25 HB2 CYS 25 8.792 -4.177 -16.995
187 2HB CYS 25 HB3 CYS 25 10.401 -4.712 -16.541
188 H GLU 26 H GLU 26 9.993 -6.923 -15.682
189 HA GLU 26 HA GLU 26 7.586 -8.524 -15.256
190 1HB GLU 26 HB2 GLU 26 10.279 -8.247 -13.963
191 2HB GLU 26 HB3 GLU 26 8.941 -8.631 -12.884
192 1HG GLU 26 HG2 GLU 26 8.244 -10.499 -14.272
193 2HG GLU 26 HG3 GLU 26 9.579 -10.212 -15.377
194 H ASP 27 H ASP 27 6.005 -6.902 -15.302
195 HA ASP 27 HA ASP 27 4.588 -5.330 -14.521
196 1HB ASP 27 HB2 ASP 27 4.226 -7.285 -13.019
197 2HB ASP 27 HB3 ASP 27 5.310 -6.549 -11.849
198 H TYR 28 H TYR 28 7.118 -4.326 -14.949
199 HA TYR 28 HA TYR 28 7.936 -2.494 -12.900
200 1HB TYR 28 HB2 TYR 28 9.382 -3.314 -14.765
201 2HB TYR 28 HB3 TYR 28 8.406 -2.440 -15.897
202 HD1 TYR 28 HD1 TYR 28 11.334 -2.281 -13.954
203 HD2 TYR 28 HD2 TYR 28 8.269 0.139 -15.731
204 HE1 TYR 28 HE1 TYR 28 12.843 -0.309 -13.826
205 HE2 TYR 28 HE2 TYR 28 9.763 2.114 -15.640
206 HH TYR 28 HH TYR 28 13.041 1.988 -14.209
207 H ASP 29 H ASP 29 7.462 -0.248 -12.742
208 HA ASP 29 HA ASP 29 4.996 0.635 -14.183
209 1HB ASP 29 HB2 ASP 29 5.548 1.642 -11.411
210 2HB ASP 29 HB3 ASP 29 4.038 1.322 -12.184
211 H LEU 30 H LEU 30 4.691 2.988 -14.129
212 HA LEU 30 HA LEU 30 6.807 4.641 -13.002
213 1HB LEU 30 HB2 LEU 30 5.929 4.735 -15.915
214 2HB LEU 30 HB3 LEU 30 6.735 6.048 -15.067
215 HG LEU 30 HG LEU 30 7.892 3.287 -15.640
216 1HD1 LEU 30 1HD1 LEU 30 7.771 4.802 -17.581
217 2HD1 LEU 30 2HD1 LEU 30 8.662 6.050 -16.663
218 3HD1 LEU 30 3HD1 LEU 30 9.451 4.529 -17.087
219 1HD2 LEU 30 1HD2 LEU 30 8.825 4.236 -13.459
220 2HD2 LEU 30 2HD2 LEU 30 10.036 4.135 -14.744
221 3HD2 LEU 30 3HD2 LEU 30 9.284 5.687 -14.359
222 H CYS 31 H CYS 31 5.864 6.475 -12.051
223 HA CYS 31 HA CYS 31 3.034 7.030 -12.302
224 1HB CYS 31 HB2 CYS 31 3.616 9.087 -11.110
225 2HB CYS 31 HB3 CYS 31 4.339 7.732 -10.285
226 H ILE 32 H ILE 32 2.354 9.208 -13.052
227 HA ILE 32 HA ILE 32 2.718 9.369 -15.766
228 HB ILE 32 HB ILE 32 1.880 11.664 -13.947
229 1HG1 ILE 32 2HG1 ILE 32 0.420 9.792 -13.344
230 2HG1 ILE 32 3HG1 ILE 32 -0.427 11.015 -14.241
231 1HG2 ILE 32 1HG2 ILE 32 0.485 12.191 -16.028
232 2HG2 ILE 32 2HG2 ILE 32 2.238 12.469 -16.134
233 3HG2 ILE 32 3HG2 ILE 32 1.520 11.030 -16.894
234 1HD1 ILE 32 1HD1 ILE 32 -0.127 9.502 -16.337
235 2HD1 ILE 32 2HD1 ILE 32 0.286 8.224 -15.133
236 3HD1 ILE 32 3HD1 ILE 32 -1.279 9.036 -15.112
237 H ASN 33 H ASN 33 4.374 11.320 -13.270
238 HA ASN 33 HA ASN 33 5.744 13.056 -15.082
239 1HB ASN 33 HB2 ASN 33 5.547 13.858 -12.884
240 2HB ASN 33 HB3 ASN 33 5.973 12.324 -12.139
241 1HD2 ASN 33 2HD2 ASN 33 8.181 11.817 -11.715
242 2HD2 ASN 33 1HD2 ASN 33 9.440 12.988 -12.002
243 H CYS 34 H CYS 34 6.769 10.009 -13.494
244 HA CYS 34 HA CYS 34 9.419 10.111 -14.642
245 1HB CYS 34 HB2 CYS 34 7.760 7.922 -13.333
246 2HB CYS 34 HB3 CYS 34 9.366 7.657 -14.031
247 H TYR 35 H TYR 35 6.347 8.491 -15.657
248 HA TYR 35 HA TYR 35 7.424 7.258 -17.949
249 1HB TYR 35 HB2 TYR 35 5.196 6.766 -17.159
250 2HB TYR 35 HB3 TYR 35 4.637 8.404 -17.521
251 HD1 TYR 35 HD1 TYR 35 6.283 5.478 -19.237
252 HD2 TYR 35 HD2 TYR 35 3.442 8.725 -19.517
253 HE1 TYR 35 HE1 TYR 35 5.649 4.718 -21.496
254 HE2 TYR 35 HE2 TYR 35 2.847 7.996 -21.813
255 HH TYR 35 HH TYR 35 4.290 5.081 -23.297
256 H ASN 36 H ASN 36 6.177 10.555 -17.513
257 HA ASN 36 HA ASN 36 6.436 11.497 -20.134
258 1HB ASN 36 HB2 ASN 36 6.057 12.669 -17.417
259 2HB ASN 36 HB3 ASN 36 6.757 13.776 -18.534
260 1HD2 ASN 36 2HD2 ASN 36 3.959 11.750 -17.912
261 2HD2 ASN 36 1HD2 ASN 36 2.856 12.606 -19.008
262 H THR 37 H THR 37 9.043 10.782 -17.974
263 HA THR 37 HA THR 37 10.888 12.574 -19.523
264 HB THR 37 HB THR 37 12.178 12.781 -17.382
265 HG1 THR 37 HG1 THR 37 9.793 12.066 -16.050
266 1HG2 THR 37 1HG2 THR 37 10.733 14.554 -16.430
267 2HG2 THR 37 2HG2 THR 37 10.681 14.593 -18.200
268 3HG2 THR 37 3HG2 THR 37 9.337 13.896 -17.284
269 H LYS 38 H LYS 38 10.734 9.644 -17.559
270 HA LYS 38 HA LYS 38 13.287 8.641 -18.231
271 1HB LYS 38 HB2 LYS 38 10.856 7.077 -17.262
272 2HB LYS 38 HB3 LYS 38 12.535 6.593 -17.121
273 1HG LYS 38 HG2 LYS 38 11.325 9.048 -15.741
274 2HG LYS 38 HG3 LYS 38 11.433 7.453 -15.012
275 1HD LYS 38 HD2 LYS 38 13.863 7.594 -14.943
276 2HD LYS 38 HD3 LYS 38 13.863 9.025 -15.969
277 1HE LYS 38 HE2 LYS 38 14.218 9.730 -13.675
278 2HE LYS 38 HE3 LYS 38 12.626 10.298 -14.217
279 1HZ LYS 38 HZ1 LYS 38 12.628 9.349 -11.957
280 2HZ LYS 38 HZ2 LYS 38 11.634 8.508 -12.911
281 3HZ LYS 38 HZ3 LYS 38 13.142 7.941 -12.536
282 H SER 39 H SER 39 10.742 8.997 -20.346
283 HA SER 39 HA SER 39 10.039 8.057 -22.229
284 1HB SER 39 HB2 SER 39 13.055 7.993 -22.645
285 2HB SER 39 HB3 SER 39 11.821 8.089 -23.917
286 HG SER 39 HG SER 39 12.387 10.038 -21.909
287 H HIS 40 H HIS 40 9.671 5.990 -20.539
288 HA HIS 40 HA HIS 40 10.997 3.557 -21.376
289 1HB HIS 40 HB2 HIS 40 9.208 4.352 -19.325
290 2HB HIS 40 HB3 HIS 40 8.347 3.139 -20.263
291 HD1 HIS 40 HD1 HIS 40 11.372 3.468 -17.946
292 HD2 HIS 40 HD2 HIS 40 9.435 0.682 -20.406
293 HE1 HIS 40 HE1 HIS 40 12.241 1.161 -17.244
294 H THR 41 H THR 41 10.883 2.948 -23.361
295 HA THR 41 HA THR 41 8.664 3.771 -25.022
296 HB THR 41 HB THR 41 10.865 2.295 -26.298
297 HG1 THR 41 HG1 THR 41 11.689 4.442 -24.684
298 1HG2 THR 41 1HG2 THR 41 9.424 4.015 -27.401
299 2HG2 THR 41 2HG2 THR 41 10.160 5.272 -26.395
300 3HG2 THR 41 3HG2 THR 41 11.150 4.351 -27.563
301 H HIS 42 H HIS 42 8.828 1.053 -23.135
302 HA HIS 42 HA HIS 42 8.573 -0.931 -25.250
303 1HB HIS 42 HB2 HIS 42 8.194 -1.162 -22.273
304 2HB HIS 42 HB3 HIS 42 8.538 -2.451 -23.458
305 HD2 HIS 42 HD2 HIS 42 11.132 -0.911 -24.800
306 HE1 HIS 42 HE1 HIS 42 12.693 -0.982 -20.828
307 HE2 HIS 42 HE2 HIS 42 13.303 -0.731 -23.307
308 H LYS 43 H LYS 43 6.872 -2.638 -24.888
309 HA LYS 43 HA LYS 43 4.313 -1.451 -25.325
310 1HB LYS 43 HB2 LYS 43 5.338 -3.569 -26.298
311 2HB LYS 43 HB3 LYS 43 4.847 -4.415 -24.826
312 1HG LYS 43 HG2 LYS 43 2.873 -2.787 -26.415
313 2HG LYS 43 HG3 LYS 43 3.380 -4.364 -27.018
314 1HD LYS 43 HD2 LYS 43 1.609 -5.162 -25.859
315 2HD LYS 43 HD3 LYS 43 2.717 -5.106 -24.492
316 1HE LYS 43 HE2 LYS 43 1.934 -2.680 -24.133
317 2HE LYS 43 HE3 LYS 43 0.702 -2.954 -25.339
318 1HZ LYS 43 HZ1 LYS 43 -0.021 -3.213 -23.081
319 2HZ LYS 43 HZ2 LYS 43 -0.255 -4.647 -23.895
320 3HZ LYS 43 HZ3 LYS 43 0.984 -4.468 -22.828
321 H MET 44 H MET 44 3.489 -0.367 -23.672
322 HA MET 44 HA MET 44 3.302 -1.586 -20.956
323 1HB MET 44 HB2 MET 44 3.370 1.257 -22.012
324 2HB MET 44 HB3 MET 44 2.756 0.907 -20.390
325 1HG MET 44 HG2 MET 44 4.645 0.094 -19.569
326 2HG MET 44 HG3 MET 44 5.472 -0.115 -21.124
327 1HE MET 44 HE1 MET 44 6.168 2.960 -18.066
328 2HE MET 44 HE2 MET 44 4.633 2.090 -18.019
329 3HE MET 44 HE3 MET 44 6.131 1.173 -18.121
330 H VAL 45 H VAL 45 1.342 -0.509 -19.759
331 HA VAL 45 HA VAL 45 -1.175 -0.274 -21.178
332 HB VAL 45 HB VAL 45 -2.121 -1.516 -19.238
333 1HG1 VAL 45 1HG1 VAL 45 -1.926 -3.698 -20.177
334 2HG1 VAL 45 2HG1 VAL 45 -1.883 -2.544 -21.523
335 3HG1 VAL 45 3HG1 VAL 45 -0.364 -3.329 -20.952
336 1HG2 VAL 45 1HG2 VAL 45 0.692 -2.513 -18.784
337 2HG2 VAL 45 2HG2 VAL 45 -0.329 -1.544 -17.717
338 3HG2 VAL 45 3HG2 VAL 45 -0.745 -3.248 -18.082
339 H LYS 46 H LYS 46 -2.643 0.711 -19.182
340 HA LYS 46 HA LYS 46 -1.052 2.317 -17.322
341 1HB LYS 46 HB2 LYS 46 -1.313 3.591 -19.539
342 2HB LYS 46 HB3 LYS 46 -3.042 3.606 -19.254
343 1HG LYS 46 HG2 LYS 46 -0.991 4.872 -17.368
344 2HG LYS 46 HG3 LYS 46 -1.716 5.675 -18.729
345 1HD LYS 46 HD2 LYS 46 -4.027 5.263 -17.622
346 2HD LYS 46 HD3 LYS 46 -3.120 4.823 -16.176
347 1HE LYS 46 HE2 LYS 46 -3.558 7.117 -15.984
348 2HE LYS 46 HE3 LYS 46 -1.838 6.990 -16.401
349 1HZ LYS 46 HZ1 LYS 46 -4.101 7.715 -18.171
350 2HZ LYS 46 HZ2 LYS 46 -3.012 8.709 -17.629
351 3HZ LYS 46 HZ3 LYS 46 -2.532 7.579 -18.719
352 H TRP 47 H TRP 47 -2.231 2.599 -15.491
353 HA TRP 47 HA TRP 47 -5.053 1.691 -15.465
354 1HB TRP 47 HB2 TRP 47 -2.987 0.942 -13.349
355 2HB TRP 47 HB3 TRP 47 -4.653 0.376 -13.488
356 HD1 TRP 47 HD1 TRP 47 -1.166 -0.382 -14.488
357 HE1 TRP 47 HE1 TRP 47 -1.023 -2.463 -15.989
358 HE3 TRP 47 HE3 TRP 47 -6.064 -0.737 -15.845
359 HZ2 TRP 47 HZ2 TRP 47 -2.734 -3.808 -17.858
360 HZ3 TRP 47 HZ3 TRP 47 -6.728 -2.331 -17.665
361 HH2 TRP 47 HH2 TRP 47 -5.099 -3.879 -18.613
362 H GLY 48 H GLY 48 -6.229 3.321 -14.379
363 1HA GLY 48 HA2 GLY 48 -4.794 5.145 -12.625
364 2HA GLY 48 HA3 GLY 48 -5.420 5.833 -14.141
365 H LEU 49 H LEU 49 -5.978 6.339 -11.425
366 HA LEU 49 HA LEU 49 -8.884 5.897 -11.412
367 1HB LEU 49 HB2 LEU 49 -6.885 5.116 -9.266
368 2HB LEU 49 HB3 LEU 49 -8.487 5.591 -8.790
369 HG LEU 49 HG LEU 49 -8.578 3.379 -8.794
370 1HD1 LEU 49 1HD1 LEU 49 -9.793 3.866 -11.515
371 2HD1 LEU 49 2HD1 LEU 49 -10.263 2.664 -10.296
372 3HD1 LEU 49 3HD1 LEU 49 -10.539 4.386 -9.997
373 1HD2 LEU 49 1HD2 LEU 49 -7.786 1.753 -10.159
374 2HD2 LEU 49 2HD2 LEU 49 -7.625 2.780 -11.571
375 3HD2 LEU 49 3HD2 LEU 49 -6.480 2.981 -10.214
376 H GLY 50 H GLY 50 -6.398 8.243 -11.313
377 1HA GLY 50 HA2 GLY 50 -8.392 10.181 -10.379
378 2HA GLY 50 HA3 GLY 50 -7.001 9.999 -9.300
379 H LEU 51 H LEU 51 -4.824 9.931 -10.734
380 HA LEU 51 HA LEU 51 -4.777 12.480 -12.261
381 1HB LEU 51 HB2 LEU 51 -2.653 10.842 -10.810
382 2HB LEU 51 HB3 LEU 51 -2.264 12.123 -11.925
383 HG LEU 51 HG LEU 51 -3.382 13.803 -10.551
384 1HD1 LEU 51 1HD1 LEU 51 -3.938 11.472 -8.661
385 2HD1 LEU 51 2HD1 LEU 51 -3.989 13.180 -8.137
386 3HD1 LEU 51 3HD1 LEU 51 -5.121 12.612 -9.359
387 1HD2 LEU 51 1HD2 LEU 51 -1.437 12.058 -8.986
388 2HD2 LEU 51 2HD2 LEU 51 -0.983 13.265 -10.219
389 3HD2 LEU 51 3HD2 LEU 51 -1.735 13.800 -8.722
390 H ASP 52 H ASP 52 -5.894 11.129 -14.053
391 HA ASP 52 HA ASP 52 -4.224 9.080 -15.299
392 1HB ASP 52 HB2 ASP 52 -6.834 9.203 -15.236
393 2HB ASP 52 HB3 ASP 52 -6.644 10.216 -16.670
Start of MODEL 3
1 1H GLY 1 H1 GLY 1 5.049 -3.263 -9.410
2 2H GLY 1 H2 GLY 1 3.738 -3.638 -10.337
3 3H GLY 1 H3 GLY 1 4.004 -2.089 -9.909
4 1HA GLY 1 HA2 GLY 1 3.269 -4.290 -8.127
5 2HA GLY 1 HA3 GLY 1 3.651 -2.644 -7.568
6 H GLN 2 H GLN 2 0.972 -4.306 -7.499
7 HA GLN 2 HA GLN 2 -0.655 -2.062 -8.368
8 1HB GLN 2 HB2 GLN 2 -2.130 -3.716 -9.735
9 2HB GLN 2 HB3 GLN 2 -0.672 -3.057 -10.458
10 1HG GLN 2 HG2 GLN 2 0.525 -5.198 -10.047
11 2HG GLN 2 HG3 GLN 2 -0.954 -5.871 -9.362
12 1HE2 GLN 2 2HE2 GLN 2 0.844 -5.701 -12.227
13 2HE2 GLN 2 1HE2 GLN 2 -0.461 -6.093 -13.339
14 H ASP 3 H ASP 3 -2.732 -2.101 -7.795
15 HA ASP 3 HA ASP 3 -3.993 -3.956 -5.918
16 1HB ASP 3 HB2 ASP 3 -3.006 -2.380 -4.340
17 2HB ASP 3 HB3 ASP 3 -3.394 -1.000 -5.367
18 H ARG 4 H ARG 4 -6.397 -3.108 -5.857
19 HA ARG 4 HA ARG 4 -7.298 -2.851 -8.533
20 1HB ARG 4 HB2 ARG 4 -9.564 -2.466 -7.503
21 2HB ARG 4 HB3 ARG 4 -8.734 -3.964 -7.135
22 1HG ARG 4 HG2 ARG 4 -9.900 -3.168 -5.205
23 2HG ARG 4 HG3 ARG 4 -8.166 -3.228 -4.889
24 1HD ARG 4 HD2 ARG 4 -8.023 -0.800 -4.994
25 2HD ARG 4 HD3 ARG 4 -9.674 -0.678 -5.634
26 HE ARG 4 HE ARG 4 -10.530 -0.836 -3.543
27 1HH1 ARG 4 1HH2 ARG 4 -7.044 -1.625 -3.264
28 2HH1 ARG 4 2HH2 ARG 4 -7.007 -1.605 -1.589
29 1HH2 ARG 4 1HH1 ARG 4 -10.496 -0.757 -1.277
30 2HH2 ARG 4 2HH1 ARG 4 -9.010 -0.993 -0.413
31 H PHE 5 H PHE 5 -6.453 -0.232 -6.268
32 HA PHE 5 HA PHE 5 -6.817 1.571 -8.529
33 1HB PHE 5 HB2 PHE 5 -8.052 3.262 -7.333
34 2HB PHE 5 HB3 PHE 5 -8.966 1.814 -7.662
35 HD1 PHE 5 HD1 PHE 5 -10.692 2.480 -6.136
36 HD2 PHE 5 HD2 PHE 5 -6.675 1.911 -4.660
37 HE1 PHE 5 HE1 PHE 5 -11.540 2.519 -3.805
38 HE2 PHE 5 HE2 PHE 5 -7.501 2.019 -2.368
39 HZ PHE 5 HZ PHE 5 -9.941 2.318 -1.911
40 H VAL 6 H VAL 6 -4.650 0.385 -6.717
41 HA VAL 6 HA VAL 6 -3.149 2.887 -6.404
42 HB VAL 6 HB VAL 6 -3.955 1.034 -4.189
43 1HG1 VAL 6 1HG1 VAL 6 -1.632 0.357 -4.296
44 2HG1 VAL 6 2HG1 VAL 6 -1.113 2.057 -4.304
45 3HG1 VAL 6 3HG1 VAL 6 -1.934 1.355 -2.871
46 1HG2 VAL 6 1HG2 VAL 6 -4.676 3.335 -4.392
47 2HG2 VAL 6 2HG2 VAL 6 -3.656 3.111 -2.946
48 3HG2 VAL 6 3HG2 VAL 6 -3.020 3.901 -4.451
49 H TYR 7 H TYR 7 -0.993 2.576 -6.692
50 HA TYR 7 HA TYR 7 -0.010 0.047 -7.850
51 1HB TYR 7 HB2 TYR 7 -0.455 2.751 -9.216
52 2HB TYR 7 HB3 TYR 7 0.493 1.474 -9.921
53 HD1 TYR 7 HD1 TYR 7 -0.849 -0.849 -10.227
54 HD2 TYR 7 HD2 TYR 7 -2.826 2.868 -9.350
55 HE1 TYR 7 HE1 TYR 7 -2.986 -1.775 -11.105
56 HE2 TYR 7 HE2 TYR 7 -4.950 1.900 -9.896
57 HH TYR 7 HH TYR 7 -6.073 -0.035 -10.811
58 H THR 8 H THR 8 2.333 0.998 -8.881
59 HA THR 8 HA THR 8 3.596 2.853 -6.933
60 HB THR 8 HB THR 8 5.665 1.212 -7.535
61 HG1 THR 8 HG1 THR 8 4.788 -0.339 -8.685
62 1HG2 THR 8 1HG2 THR 8 5.231 1.590 -5.294
63 2HG2 THR 8 2HG2 THR 8 3.609 0.800 -5.374
64 3HG2 THR 8 3HG2 THR 8 5.114 -0.149 -5.476
65 H CYS 9 H CYS 9 5.706 3.601 -7.851
66 HA CYS 9 HA CYS 9 5.764 3.788 -10.846
67 1HB CYS 9 HB2 CYS 9 5.513 6.086 -9.901
68 2HB CYS 9 HB3 CYS 9 6.813 5.769 -8.740
69 H ASN 10 H ASN 10 7.345 2.133 -11.219
70 HA ASN 10 HA ASN 10 9.107 1.318 -9.107
71 1HB ASN 10 HB2 ASN 10 8.214 -0.220 -10.916
72 2HB ASN 10 HB3 ASN 10 9.338 0.584 -12.036
73 1HD2 ASN 10 2HD2 ASN 10 11.048 -0.905 -12.286
74 2HD2 ASN 10 1HD2 ASN 10 11.821 -1.741 -10.949
75 H GLU 11 H GLU 11 9.172 4.160 -10.814
76 HA GLU 11 HA GLU 11 12.091 4.205 -10.746
77 1HB GLU 11 HB2 GLU 11 10.178 5.720 -12.352
78 2HB GLU 11 HB3 GLU 11 11.360 6.739 -11.533
79 1HG GLU 11 HG2 GLU 11 12.158 4.265 -13.111
80 2HG GLU 11 HG3 GLU 11 12.173 5.883 -13.786
81 H CYS 12 H CYS 12 9.271 5.333 -9.012
82 HA CYS 12 HA CYS 12 10.959 7.039 -7.231
83 1HB CYS 12 HB2 CYS 12 7.958 6.573 -7.154
84 2HB CYS 12 HB3 CYS 12 8.898 7.783 -6.260
85 H LYS 13 H LYS 13 9.423 3.955 -7.526
86 HA LYS 13 HA LYS 13 8.887 2.202 -6.183
87 1HB LYS 13 HB2 LYS 13 11.668 2.913 -5.115
88 2HB LYS 13 HB3 LYS 13 10.731 1.535 -4.540
89 1HG LYS 13 HG2 LYS 13 11.483 0.306 -6.244
90 2HG LYS 13 HG3 LYS 13 10.546 1.298 -7.342
91 1HD LYS 13 HD2 LYS 13 13.507 1.505 -6.698
92 2HD LYS 13 HD3 LYS 13 12.667 1.115 -8.208
93 1HE LYS 13 HE2 LYS 13 11.688 3.489 -8.073
94 2HE LYS 13 HE3 LYS 13 12.965 3.833 -6.900
95 1HZ LYS 13 HZ1 LYS 13 14.563 3.194 -8.729
96 2HZ LYS 13 HZ2 LYS 13 13.260 2.950 -9.719
97 3HZ LYS 13 HZ3 LYS 13 13.578 4.419 -9.168
98 H HIS 14 H HIS 14 7.554 4.338 -5.795
99 HA HIS 14 HA HIS 14 6.658 3.942 -3.041
100 1HB HIS 14 HB2 HIS 14 7.799 6.129 -2.961
101 2HB HIS 14 HB3 HIS 14 6.890 6.682 -4.362
102 HD2 HIS 14 HD2 HIS 14 4.751 7.990 -3.849
103 HE1 HIS 14 HE1 HIS 14 3.601 6.170 -0.181
104 HE2 HIS 14 HE2 HIS 14 2.925 7.828 -1.997
105 H HIS 15 H HIS 15 4.389 4.675 -2.942
106 HA HIS 15 HA HIS 15 2.853 3.360 -4.956
107 1HB HIS 15 HB2 HIS 15 1.594 3.051 -3.132
108 2HB HIS 15 HB3 HIS 15 2.527 4.223 -2.220
109 HD2 HIS 15 HD2 HIS 15 -0.571 4.098 -4.534
110 HE1 HIS 15 HE1 HIS 15 -0.856 7.680 -2.291
111 HE2 HIS 15 HE2 HIS 15 -2.059 6.157 -3.941
112 H VAL 16 H VAL 16 1.122 4.250 -6.177
113 HA VAL 16 HA VAL 16 0.786 7.105 -6.517
114 HB VAL 16 HB VAL 16 1.217 7.084 -8.909
115 1HG1 VAL 16 1HG1 VAL 16 3.303 7.325 -7.704
116 2HG1 VAL 16 2HG1 VAL 16 3.554 5.563 -7.675
117 3HG1 VAL 16 3HG1 VAL 16 3.531 6.405 -9.208
118 1HG2 VAL 16 1HG2 VAL 16 0.290 4.907 -9.582
119 2HG2 VAL 16 2HG2 VAL 16 1.921 5.106 -10.197
120 3HG2 VAL 16 3HG2 VAL 16 1.625 4.064 -8.787
121 H GLU 17 H GLU 17 -1.398 7.492 -7.556
122 HA GLU 17 HA GLU 17 -3.207 5.194 -7.170
123 1HB GLU 17 HB2 GLU 17 -4.903 6.704 -7.110
124 2HB GLU 17 HB3 GLU 17 -3.597 7.598 -6.359
125 1HG GLU 17 HG2 GLU 17 -4.734 7.973 -9.138
126 2HG GLU 17 HG3 GLU 17 -4.874 9.084 -7.811
127 H THR 18 H THR 18 -1.588 7.008 -9.754
128 HA THR 18 HA THR 18 -2.878 5.192 -11.747
129 HB THR 18 HB THR 18 -2.207 8.142 -12.139
130 HG1 THR 18 HG1 THR 18 -3.770 8.354 -10.972
131 1HG2 THR 18 1HG2 THR 18 -4.088 6.499 -13.906
132 2HG2 THR 18 2HG2 THR 18 -3.291 8.040 -14.240
133 3HG2 THR 18 3HG2 THR 18 -2.344 6.566 -14.228
134 H ARG 19 H ARG 19 -1.482 4.199 -13.188
135 HA ARG 19 HA ARG 19 1.286 5.236 -13.328
136 1HB ARG 19 HB2 ARG 19 2.353 3.165 -12.843
137 2HB ARG 19 HB3 ARG 19 1.204 3.383 -11.533
138 1HG ARG 19 HG2 ARG 19 -0.397 1.872 -12.608
139 2HG ARG 19 HG3 ARG 19 0.686 1.658 -13.988
140 1HD ARG 19 HD2 ARG 19 2.195 0.329 -12.918
141 2HD ARG 19 HD3 ARG 19 1.644 0.712 -11.306
142 HE ARG 19 HE ARG 19 -0.627 -0.300 -12.336
143 1HH1 ARG 19 1HH2 ARG 19 2.609 -1.749 -12.212
144 2HH1 ARG 19 2HH2 ARG 19 2.093 -3.296 -12.737
145 1HH2 ARG 19 2HH1 ARG 19 -1.315 -2.439 -13.053
146 2HH2 ARG 19 1HH1 ARG 19 -0.103 -3.649 -13.201
147 H TRP 20 H TRP 20 2.564 4.145 -14.902
148 HA TRP 20 HA TRP 20 1.207 3.134 -17.366
149 1HB TRP 20 HB2 TRP 20 3.870 4.508 -16.863
150 2HB TRP 20 HB3 TRP 20 3.295 3.878 -18.412
151 HD1 TRP 20 HD1 TRP 20 2.611 6.728 -15.919
152 HE1 TRP 20 HE1 TRP 20 0.941 8.374 -16.879
153 HE3 TRP 20 HE3 TRP 20 1.742 4.432 -20.389
154 HZ2 TRP 20 HZ2 TRP 20 -0.558 8.729 -19.322
155 HZ3 TRP 20 HZ3 TRP 20 0.177 5.445 -22.020
156 HH2 TRP 20 HH2 TRP 20 -0.995 7.602 -21.500
157 H HIS 21 H HIS 21 1.823 0.939 -17.747
158 HA HIS 21 HA HIS 21 3.694 -0.273 -15.769
159 1HB HIS 21 HB2 HIS 21 1.659 -0.741 -14.806
160 2HB HIS 21 HB3 HIS 21 0.800 -0.775 -16.305
161 HD2 HIS 21 HD2 HIS 21 3.805 -3.131 -15.970
162 HE1 HIS 21 HE1 HIS 21 0.306 -5.519 -15.750
163 HE2 HIS 21 HE2 HIS 21 2.850 -5.570 -15.872
164 H CYS 22 H CYS 22 5.236 -1.316 -16.787
165 HA CYS 22 HA CYS 22 5.282 -1.954 -19.606
166 1HB CYS 22 HB2 CYS 22 7.007 -1.903 -17.208
167 2HB CYS 22 HB3 CYS 22 7.372 -3.220 -18.326
168 H THR 23 H THR 23 4.485 -3.582 -20.569
169 HA THR 23 HA THR 23 4.015 -6.079 -19.000
170 HB THR 23 HB THR 23 2.287 -6.747 -20.629
171 HG1 THR 23 HG1 THR 23 3.196 -4.512 -21.887
172 1HG2 THR 23 1HG2 THR 23 2.018 -4.018 -19.398
173 2HG2 THR 23 2HG2 THR 23 0.658 -5.123 -19.787
174 3HG2 THR 23 3HG2 THR 23 1.817 -5.553 -18.520
175 H VAL 24 H VAL 24 6.353 -5.005 -20.348
176 HA VAL 24 HA VAL 24 7.426 -7.105 -22.065
177 HB VAL 24 HB VAL 24 7.508 -4.884 -22.908
178 1HG1 VAL 24 1HG1 VAL 24 6.989 -3.171 -21.799
179 2HG1 VAL 24 2HG1 VAL 24 7.427 -3.847 -20.252
180 3HG1 VAL 24 3HG1 VAL 24 8.675 -3.099 -21.176
181 1HG2 VAL 24 1HG2 VAL 24 9.875 -4.232 -22.946
182 2HG2 VAL 24 2HG2 VAL 24 10.167 -5.099 -21.434
183 3HG2 VAL 24 3HG2 VAL 24 9.806 -6.016 -22.921
184 H CYS 25 H CYS 25 8.299 -4.903 -19.406
185 HA CYS 25 HA CYS 25 10.227 -6.623 -18.157
186 1HB CYS 25 HB2 CYS 25 8.757 -4.267 -16.949
187 2HB CYS 25 HB3 CYS 25 10.381 -4.820 -16.554
188 H GLU 26 H GLU 26 9.870 -7.010 -15.656
189 HA GLU 26 HA GLU 26 7.375 -8.491 -15.278
190 1HB GLU 26 HB2 GLU 26 10.074 -8.437 -14.024
191 2HB GLU 26 HB3 GLU 26 8.743 -8.744 -12.921
192 1HG GLU 26 HG2 GLU 26 7.902 -10.562 -14.378
193 2HG GLU 26 HG3 GLU 26 9.267 -10.330 -15.462
194 H ASP 27 H ASP 27 5.796 -6.990 -15.114
195 HA ASP 27 HA ASP 27 4.473 -5.346 -14.338
196 1HB ASP 27 HB2 ASP 27 4.165 -7.268 -12.821
197 2HB ASP 27 HB3 ASP 27 5.245 -6.511 -11.657
198 H TYR 28 H TYR 28 7.034 -4.363 -14.822
199 HA TYR 28 HA TYR 28 7.907 -2.488 -12.839
200 1HB TYR 28 HB2 TYR 28 9.292 -3.406 -14.699
201 2HB TYR 28 HB3 TYR 28 8.308 -2.529 -15.854
202 HD1 TYR 28 HD1 TYR 28 11.381 -2.409 -14.061
203 HD2 TYR 28 HD2 TYR 28 8.190 0.055 -15.605
204 HE1 TYR 28 HE1 TYR 28 12.823 -0.404 -13.868
205 HE2 TYR 28 HE2 TYR 28 9.664 2.040 -15.486
206 HH TYR 28 HH TYR 28 11.623 2.855 -14.686
207 H ASP 29 H ASP 29 7.432 -0.234 -12.692
208 HA ASP 29 HA ASP 29 4.957 0.628 -14.124
209 1HB ASP 29 HB2 ASP 29 5.481 1.618 -11.355
210 2HB ASP 29 HB3 ASP 29 3.980 1.319 -12.187
211 H LEU 30 H LEU 30 4.645 2.950 -14.122
212 HA LEU 30 HA LEU 30 6.775 4.617 -13.027
213 1HB LEU 30 HB2 LEU 30 5.888 4.715 -15.941
214 2HB LEU 30 HB3 LEU 30 6.686 6.019 -15.103
215 HG LEU 30 HG LEU 30 7.799 3.242 -15.612
216 1HD1 LEU 30 1HD1 LEU 30 8.713 5.936 -16.735
217 2HD1 LEU 30 2HD1 LEU 30 9.345 4.317 -17.139
218 3HD1 LEU 30 3HD1 LEU 30 7.692 4.759 -17.597
219 1HD2 LEU 30 1HD2 LEU 30 9.999 4.105 -14.774
220 2HD2 LEU 30 2HD2 LEU 30 9.232 5.672 -14.427
221 3HD2 LEU 30 3HD2 LEU 30 8.796 4.214 -13.508
222 H CYS 31 H CYS 31 5.897 6.448 -12.072
223 HA CYS 31 HA CYS 31 3.072 6.987 -12.178
224 1HB CYS 31 HB2 CYS 31 3.653 9.084 -11.113
225 2HB CYS 31 HB3 CYS 31 4.463 7.797 -10.249
226 H ILE 32 H ILE 32 2.377 9.218 -12.972
227 HA ILE 32 HA ILE 32 2.697 9.310 -15.737
228 HB ILE 32 HB ILE 32 1.847 11.654 -13.977
229 1HG1 ILE 32 2HG1 ILE 32 0.522 9.865 -13.154
230 2HG1 ILE 32 3HG1 ILE 32 -0.465 10.878 -14.210
231 1HG2 ILE 32 1HG2 ILE 32 2.187 12.268 -16.267
232 2HG2 ILE 32 2HG2 ILE 32 1.333 10.840 -16.870
233 3HG2 ILE 32 3HG2 ILE 32 0.421 12.115 -16.014
234 1HD1 ILE 32 1HD1 ILE 32 -0.318 9.177 -15.991
235 2HD1 ILE 32 2HD1 ILE 32 0.638 8.134 -14.912
236 3HD1 ILE 32 3HD1 ILE 32 -1.032 8.563 -14.512
237 H ASN 33 H ASN 33 4.302 11.345 -13.273
238 HA ASN 33 HA ASN 33 5.651 13.033 -15.143
239 1HB ASN 33 HB2 ASN 33 5.508 13.825 -12.887
240 2HB ASN 33 HB3 ASN 33 6.066 12.291 -12.206
241 1HD2 ASN 33 2HD2 ASN 33 8.289 11.784 -12.071
242 2HD2 ASN 33 1HD2 ASN 33 9.495 13.040 -12.319
243 H CYS 34 H CYS 34 6.714 10.031 -13.524
244 HA CYS 34 HA CYS 34 9.348 10.132 -14.668
245 1HB CYS 34 HB2 CYS 34 7.720 7.942 -13.315
246 2HB CYS 34 HB3 CYS 34 9.294 7.638 -14.092
247 H TYR 35 H TYR 35 6.256 8.537 -15.703
248 HA TYR 35 HA TYR 35 7.367 7.196 -17.921
249 1HB TYR 35 HB2 TYR 35 5.089 6.796 -17.143
250 2HB TYR 35 HB3 TYR 35 4.606 8.436 -17.592
251 HD1 TYR 35 HD1 TYR 35 6.297 5.450 -19.184
252 HD2 TYR 35 HD2 TYR 35 3.394 8.611 -19.588
253 HE1 TYR 35 HE1 TYR 35 5.797 4.655 -21.460
254 HE2 TYR 35 HE2 TYR 35 2.880 7.811 -21.902
255 HH TYR 35 HH TYR 35 4.479 4.954 -23.311
256 H ASN 36 H ASN 36 6.098 10.514 -17.576
257 HA ASN 36 HA ASN 36 6.411 11.430 -20.195
258 1HB ASN 36 HB2 ASN 36 5.956 12.581 -17.453
259 2HB ASN 36 HB3 ASN 36 6.586 13.709 -18.592
260 1HD2 ASN 36 2HD2 ASN 36 3.895 11.516 -17.926
261 2HD2 ASN 36 1HD2 ASN 36 2.757 12.297 -19.036
262 H THR 37 H THR 37 8.977 10.765 -17.984
263 HA THR 37 HA THR 37 10.776 12.598 -19.547
264 HB THR 37 HB THR 37 12.064 12.843 -17.406
265 HG1 THR 37 HG1 THR 37 9.708 12.081 -16.087
266 1HG2 THR 37 1HG2 THR 37 10.627 14.571 -16.456
267 2HG2 THR 37 2HG2 THR 37 10.549 14.618 -18.224
268 3HG2 THR 37 3HG2 THR 37 9.205 13.912 -17.299
269 H LYS 38 H LYS 38 10.653 9.672 -17.553
270 HA LYS 38 HA LYS 38 13.283 8.783 -18.151
271 1HB LYS 38 HB2 LYS 38 10.934 7.128 -17.150
272 2HB LYS 38 HB3 LYS 38 12.636 6.769 -16.933
273 1HG LYS 38 HG2 LYS 38 11.261 9.213 -15.698
274 2HG LYS 38 HG3 LYS 38 11.423 7.657 -14.915
275 1HD LYS 38 HD2 LYS 38 13.867 7.896 -14.864
276 2HD LYS 38 HD3 LYS 38 13.750 9.367 -15.843
277 1HE LYS 38 HE2 LYS 38 14.022 10.084 -13.568
278 2HE LYS 38 HE3 LYS 38 12.356 10.423 -14.048
279 1HZ LYS 38 HZ1 LYS 38 12.604 9.435 -11.810
280 2HZ LYS 38 HZ2 LYS 38 11.631 8.563 -12.769
281 3HZ LYS 38 HZ3 LYS 38 13.179 8.073 -12.497
282 H SER 39 H SER 39 10.809 9.036 -20.266
283 HA SER 39 HA SER 39 10.130 8.040 -22.157
284 1HB SER 39 HB2 SER 39 13.144 7.976 -22.523
285 2HB SER 39 HB3 SER 39 11.937 8.142 -23.798
286 HG SER 39 HG SER 39 12.565 9.994 -21.742
287 H HIS 40 H HIS 40 9.759 5.989 -20.501
288 HA HIS 40 HA HIS 40 11.121 3.568 -21.300
289 1HB HIS 40 HB2 HIS 40 9.273 4.368 -19.290
290 2HB HIS 40 HB3 HIS 40 8.419 3.168 -20.244
291 HD1 HIS 40 HD1 HIS 40 11.503 3.431 -17.960
292 HD2 HIS 40 HD2 HIS 40 9.349 0.719 -20.300
293 HE1 HIS 40 HE1 HIS 40 12.259 1.111 -17.205
294 H THR 41 H THR 41 11.064 3.019 -23.310
295 HA THR 41 HA THR 41 8.925 3.843 -25.049
296 HB THR 41 HB THR 41 11.116 2.191 -26.156
297 HG1 THR 41 HG1 THR 41 11.863 4.445 -24.645
298 1HG2 THR 41 1HG2 THR 41 9.742 3.778 -27.486
299 2HG2 THR 41 2HG2 THR 41 10.438 5.132 -26.587
300 3HG2 THR 41 3HG2 THR 41 11.488 4.130 -27.602
301 H HIS 42 H HIS 42 9.041 1.030 -23.155
302 HA HIS 42 HA HIS 42 8.599 -0.897 -25.244
303 1HB HIS 42 HB2 HIS 42 8.071 -1.105 -22.300
304 2HB HIS 42 HB3 HIS 42 8.421 -2.403 -23.445
305 HD2 HIS 42 HD2 HIS 42 11.147 -1.104 -24.727
306 HE1 HIS 42 HE1 HIS 42 12.546 -1.202 -20.686
307 HE2 HIS 42 HE2 HIS 42 13.257 -1.064 -23.161
308 H LYS 43 H LYS 43 6.693 -2.505 -24.959
309 HA LYS 43 HA LYS 43 4.257 -0.980 -25.267
310 1HB LYS 43 HB2 LYS 43 4.859 -3.025 -26.667
311 2HB LYS 43 HB3 LYS 43 4.454 -3.992 -25.268
312 1HG LYS 43 HG2 LYS 43 2.268 -2.180 -25.504
313 2HG LYS 43 HG3 LYS 43 2.723 -2.483 -27.170
314 1HD LYS 43 HD2 LYS 43 0.972 -4.009 -26.597
315 2HD LYS 43 HD3 LYS 43 2.465 -4.940 -26.760
316 1HE LYS 43 HE2 LYS 43 1.317 -5.728 -24.757
317 2HE LYS 43 HE3 LYS 43 2.761 -4.818 -24.266
318 1HZ LYS 43 HZ1 LYS 43 1.057 -4.198 -22.895
319 2HZ LYS 43 HZ2 LYS 43 1.262 -2.908 -23.855
320 3HZ LYS 43 HZ3 LYS 43 -0.039 -3.881 -24.076
321 H MET 44 H MET 44 4.061 -0.060 -23.267
322 HA MET 44 HA MET 44 3.487 -1.613 -20.862
323 1HB MET 44 HB2 MET 44 3.454 1.337 -21.770
324 2HB MET 44 HB3 MET 44 2.859 0.873 -20.156
325 1HG MET 44 HG2 MET 44 4.807 0.110 -19.393
326 2HG MET 44 HG3 MET 44 5.543 -0.115 -20.970
327 1HE MET 44 HE1 MET 44 6.200 1.161 -17.933
328 2HE MET 44 HE2 MET 44 6.251 2.953 -17.903
329 3HE MET 44 HE3 MET 44 4.704 2.100 -17.923
330 H VAL 45 H VAL 45 1.425 -0.544 -19.789
331 HA VAL 45 HA VAL 45 -0.999 -0.307 -21.338
332 HB VAL 45 HB VAL 45 -2.075 -1.601 -19.507
333 1HG1 VAL 45 1HG1 VAL 45 -0.146 -3.395 -21.088
334 2HG1 VAL 45 2HG1 VAL 45 -1.768 -3.795 -20.492
335 3HG1 VAL 45 3HG1 VAL 45 -1.585 -2.645 -21.823
336 1HG2 VAL 45 1HG2 VAL 45 0.682 -2.624 -18.848
337 2HG2 VAL 45 2HG2 VAL 45 -0.364 -1.592 -17.850
338 3HG2 VAL 45 3HG2 VAL 45 -0.812 -3.288 -18.227
339 H LYS 46 H LYS 46 -2.577 0.718 -19.371
340 HA LYS 46 HA LYS 46 -0.991 2.355 -17.519
341 1HB LYS 46 HB2 LYS 46 -0.825 3.721 -19.397
342 2HB LYS 46 HB3 LYS 46 -2.454 3.381 -19.980
343 1HG LYS 46 HG2 LYS 46 -2.167 4.820 -17.328
344 2HG LYS 46 HG3 LYS 46 -1.772 5.679 -18.801
345 1HD LYS 46 HD2 LYS 46 -4.044 5.054 -19.734
346 2HD LYS 46 HD3 LYS 46 -4.471 4.418 -18.131
347 1HE LYS 46 HE2 LYS 46 -4.294 6.523 -17.103
348 2HE LYS 46 HE3 LYS 46 -3.362 7.224 -18.428
349 1HZ LYS 46 HZ1 LYS 46 -6.194 6.576 -18.440
350 2HZ LYS 46 HZ2 LYS 46 -5.518 8.022 -18.523
351 3HZ LYS 46 HZ3 LYS 46 -5.389 7.063 -19.831
352 H TRP 47 H TRP 47 -2.244 2.818 -15.715
353 HA TRP 47 HA TRP 47 -5.133 2.225 -15.761
354 1HB TRP 47 HB2 TRP 47 -3.281 0.970 -13.719
355 2HB TRP 47 HB3 TRP 47 -4.933 0.530 -14.094
356 HD1 TRP 47 HD1 TRP 47 -1.449 -0.477 -14.623
357 HE1 TRP 47 HE1 TRP 47 -1.251 -2.472 -16.171
358 HE3 TRP 47 HE3 TRP 47 -6.112 -0.294 -16.735
359 HZ2 TRP 47 HZ2 TRP 47 -2.917 -3.819 -18.165
360 HZ3 TRP 47 HZ3 TRP 47 -6.725 -1.882 -18.536
361 HH2 TRP 47 HH2 TRP 47 -5.162 -3.684 -19.218
362 H GLY 48 H GLY 48 -6.018 2.762 -13.486
363 1HA GLY 48 HA2 GLY 48 -4.503 3.705 -11.464
364 2HA GLY 48 HA3 GLY 48 -4.768 5.164 -12.473
365 H LEU 49 H LEU 49 -7.008 5.353 -13.306
366 HA LEU 49 HA LEU 49 -9.225 5.655 -13.032
367 1HB LEU 49 HB2 LEU 49 -9.258 4.217 -10.398
368 2HB LEU 49 HB3 LEU 49 -10.588 4.560 -11.494
369 HG LEU 49 HG LEU 49 -8.307 2.563 -11.916
370 1HD1 LEU 49 1HD1 LEU 49 -11.335 2.231 -11.680
371 2HD1 LEU 49 2HD1 LEU 49 -10.130 0.926 -11.892
372 3HD1 LEU 49 3HD1 LEU 49 -10.143 1.897 -10.415
373 1HD2 LEU 49 1HD2 LEU 49 -8.795 3.606 -14.105
374 2HD2 LEU 49 2HD2 LEU 49 -9.492 1.973 -14.050
375 3HD2 LEU 49 3HD2 LEU 49 -10.527 3.394 -13.854
376 H GLY 50 H GLY 50 -6.848 7.208 -11.514
377 1HA GLY 50 HA2 GLY 50 -8.672 8.979 -9.944
378 2HA GLY 50 HA3 GLY 50 -6.998 8.641 -9.495
379 H LEU 51 H LEU 51 -5.626 8.968 -11.916
380 HA LEU 51 HA LEU 51 -6.273 11.671 -12.951
381 1HB LEU 51 HB2 LEU 51 -3.614 10.745 -11.839
382 2HB LEU 51 HB3 LEU 51 -3.810 12.193 -12.809
383 HG LEU 51 HG LEU 51 -5.062 11.748 -10.059
384 1HD1 LEU 51 1HD1 LEU 51 -2.702 13.453 -10.922
385 2HD1 LEU 51 2HD1 LEU 51 -3.405 13.399 -9.278
386 3HD1 LEU 51 3HD1 LEU 51 -2.626 11.975 -9.963
387 1HD2 LEU 51 1HD2 LEU 51 -4.973 14.240 -11.830
388 2HD2 LEU 51 2HD2 LEU 51 -6.427 13.312 -11.403
389 3HD2 LEU 51 3HD2 LEU 51 -5.559 14.197 -10.138
390 H ASP 52 H ASP 52 -6.959 9.292 -13.925
391 HA ASP 52 HA ASP 52 -5.136 7.861 -15.464
392 1HB ASP 52 HB2 ASP 52 -7.570 7.383 -14.484
393 2HB ASP 52 HB3 ASP 52 -8.121 7.823 -16.080
Start of MODEL 4
1 1H GLY 1 H1 GLY 1 4.175 -2.125 -9.812
2 2H GLY 1 H2 GLY 1 5.313 -3.266 -9.524
3 3H GLY 1 H3 GLY 1 3.926 -3.659 -10.307
4 1HA GLY 1 HA2 GLY 1 3.732 -4.488 -8.123
5 2HA GLY 1 HA3 GLY 1 4.145 -2.867 -7.495
6 H GLN 2 H GLN 2 1.560 -4.557 -7.182
7 HA GLN 2 HA GLN 2 -0.352 -2.445 -7.976
8 1HB GLN 2 HB2 GLN 2 -0.878 -5.401 -8.462
9 2HB GLN 2 HB3 GLN 2 -1.906 -4.056 -8.903
10 1HG GLN 2 HG2 GLN 2 0.108 -3.294 -10.410
11 2HG GLN 2 HG3 GLN 2 0.680 -4.929 -10.180
12 1HE2 GLN 2 2HE2 GLN 2 0.403 -5.674 -12.288
13 2HE2 GLN 2 1HE2 GLN 2 -1.203 -5.842 -13.015
14 H ASP 3 H ASP 3 -2.451 -2.782 -6.972
15 HA ASP 3 HA ASP 3 -2.725 -4.365 -4.537
16 1HB ASP 3 HB2 ASP 3 -1.423 -2.232 -3.957
17 2HB ASP 3 HB3 ASP 3 -2.888 -1.344 -4.417
18 H ARG 4 H ARG 4 -5.065 -2.800 -3.698
19 HA ARG 4 HA ARG 4 -6.974 -3.845 -5.591
20 1HB ARG 4 HB2 ARG 4 -7.336 -1.889 -3.273
21 2HB ARG 4 HB3 ARG 4 -8.640 -2.701 -4.151
22 1HG ARG 4 HG2 ARG 4 -8.626 -4.187 -2.558
23 2HG ARG 4 HG3 ARG 4 -7.227 -4.891 -3.326
24 1HD ARG 4 HD2 ARG 4 -6.705 -2.666 -1.342
25 2HD ARG 4 HD3 ARG 4 -7.384 -4.134 -0.664
26 HE ARG 4 HE ARG 4 -4.720 -3.662 -1.613
27 1HH1 ARG 4 1HH1 ARG 4 -7.036 -6.295 -1.036
28 2HH1 ARG 4 2HH1 ARG 4 -5.804 -7.502 -0.825
29 1HH2 ARG 4 1HH2 ARG 4 -3.187 -5.199 -1.434
30 2HH2 ARG 4 2HH2 ARG 4 -3.491 -6.865 -1.076
31 H PHE 5 H PHE 5 -5.797 -0.594 -4.874
32 HA PHE 5 HA PHE 5 -6.604 0.413 -7.488
33 1HB PHE 5 HB2 PHE 5 -7.797 2.420 -6.396
34 2HB PHE 5 HB3 PHE 5 -8.670 0.909 -6.418
35 HD1 PHE 5 HD1 PHE 5 -9.461 -0.150 -4.480
36 HD2 PHE 5 HD2 PHE 5 -6.623 3.079 -4.118
37 HE1 PHE 5 HE1 PHE 5 -9.779 -0.146 -2.027
38 HE2 PHE 5 HE2 PHE 5 -6.926 3.060 -1.662
39 HZ PHE 5 HZ PHE 5 -8.518 1.460 -0.611
40 H VAL 6 H VAL 6 -4.174 -0.148 -5.799
41 HA VAL 6 HA VAL 6 -2.869 2.479 -5.951
42 HB VAL 6 HB VAL 6 -3.246 0.651 -3.576
43 1HG1 VAL 6 1HG1 VAL 6 -1.165 1.307 -2.503
44 2HG1 VAL 6 2HG1 VAL 6 -0.812 0.405 -3.979
45 3HG1 VAL 6 3HG1 VAL 6 -0.645 2.186 -3.942
46 1HG2 VAL 6 1HG2 VAL 6 -4.269 2.915 -3.771
47 2HG2 VAL 6 2HG2 VAL 6 -3.183 2.743 -2.364
48 3HG2 VAL 6 3HG2 VAL 6 -2.626 3.620 -3.801
49 H TYR 7 H TYR 7 -0.696 2.234 -6.387
50 HA TYR 7 HA TYR 7 0.350 -0.298 -7.500
51 1HB TYR 7 HB2 TYR 7 -0.156 2.344 -8.955
52 2HB TYR 7 HB3 TYR 7 0.750 1.034 -9.626
53 HD1 TYR 7 HD1 TYR 7 -0.639 -1.306 -9.868
54 HD2 TYR 7 HD2 TYR 7 -2.474 2.494 -8.989
55 HE1 TYR 7 HE1 TYR 7 -2.893 -2.332 -10.109
56 HE2 TYR 7 HE2 TYR 7 -4.691 1.443 -9.026
57 HH TYR 7 HH TYR 7 -5.192 -2.034 -9.585
58 H THR 8 H THR 8 2.647 0.670 -8.653
59 HA THR 8 HA THR 8 3.857 2.617 -6.745
60 HB THR 8 HB THR 8 5.976 1.158 -7.451
61 HG1 THR 8 HG1 THR 8 5.042 -0.401 -8.663
62 1HG2 THR 8 1HG2 THR 8 4.043 0.395 -5.253
63 2HG2 THR 8 2HG2 THR 8 5.707 -0.234 -5.424
64 3HG2 THR 8 3HG2 THR 8 5.468 1.483 -5.165
65 H CYS 9 H CYS 9 5.837 3.640 -7.725
66 HA CYS 9 HA CYS 9 5.760 3.843 -10.713
67 1HB CYS 9 HB2 CYS 9 5.519 6.131 -9.745
68 2HB CYS 9 HB3 CYS 9 6.859 5.833 -8.645
69 H ASN 10 H ASN 10 7.333 2.167 -11.160
70 HA ASN 10 HA ASN 10 9.158 1.424 -9.109
71 1HB ASN 10 HB2 ASN 10 8.280 -0.144 -10.922
72 2HB ASN 10 HB3 ASN 10 9.473 0.616 -12.000
73 1HD2 ASN 10 2HD2 ASN 10 11.042 -0.958 -12.176
74 2HD2 ASN 10 1HD2 ASN 10 11.852 -1.731 -10.796
75 H GLU 11 H GLU 11 9.226 4.221 -10.793
76 HA GLU 11 HA GLU 11 12.157 4.233 -10.797
77 1HB GLU 11 HB2 GLU 11 10.223 5.657 -12.441
78 2HB GLU 11 HB3 GLU 11 11.368 6.720 -11.665
79 1HG GLU 11 HG2 GLU 11 12.207 4.155 -13.126
80 2HG GLU 11 HG3 GLU 11 12.220 5.751 -13.896
81 H CYS 12 H CYS 12 9.374 5.396 -9.033
82 HA CYS 12 HA CYS 12 11.153 7.126 -7.386
83 1HB CYS 12 HB2 CYS 12 8.157 6.735 -7.226
84 2HB CYS 12 HB3 CYS 12 9.134 7.927 -6.346
85 H LYS 13 H LYS 13 9.597 4.093 -7.555
86 HA LYS 13 HA LYS 13 9.071 2.377 -6.182
87 1HB LYS 13 HB2 LYS 13 11.850 3.058 -5.110
88 2HB LYS 13 HB3 LYS 13 10.901 1.699 -4.538
89 1HG LYS 13 HG2 LYS 13 11.605 0.447 -6.215
90 2HG LYS 13 HG3 LYS 13 10.637 1.406 -7.285
91 1HD LYS 13 HD2 LYS 13 13.603 1.625 -6.725
92 2HD LYS 13 HD3 LYS 13 12.740 1.192 -8.238
93 1HE LYS 13 HE2 LYS 13 11.768 3.568 -8.115
94 2HE LYS 13 HE3 LYS 13 13.044 3.940 -6.950
95 1HZ LYS 13 HZ1 LYS 13 13.664 4.506 -9.203
96 2HZ LYS 13 HZ2 LYS 13 14.644 3.274 -8.747
97 3HZ LYS 13 HZ3 LYS 13 13.344 3.027 -9.734
98 H HIS 14 H HIS 14 7.706 4.546 -5.794
99 HA HIS 14 HA HIS 14 6.917 4.210 -2.988
100 1HB HIS 14 HB2 HIS 14 6.435 6.475 -2.683
101 2HB HIS 14 HB3 HIS 14 8.086 6.398 -3.270
102 HD2 HIS 14 HD2 HIS 14 7.947 8.959 -3.990
103 HE1 HIS 14 HE1 HIS 14 5.521 8.344 -7.416
104 HE2 HIS 14 HE2 HIS 14 7.062 9.965 -6.275
105 H HIS 15 H HIS 15 4.601 4.912 -2.823
106 HA HIS 15 HA HIS 15 3.146 3.355 -4.797
107 1HB HIS 15 HB2 HIS 15 2.352 4.659 -2.152
108 2HB HIS 15 HB3 HIS 15 1.161 3.982 -3.226
109 HD2 HIS 15 HD2 HIS 15 1.441 1.316 -3.884
110 HE1 HIS 15 HE1 HIS 15 3.549 0.324 -0.318
111 HE2 HIS 15 HE2 HIS 15 2.284 -0.632 -2.306
112 H VAL 16 H VAL 16 1.401 4.002 -5.968
113 HA VAL 16 HA VAL 16 0.762 6.854 -6.344
114 HB VAL 16 HB VAL 16 1.200 6.776 -8.714
115 1HG1 VAL 16 1HG1 VAL 16 3.555 6.351 -8.920
116 2HG1 VAL 16 2HG1 VAL 16 3.212 7.220 -7.378
117 3HG1 VAL 16 3HG1 VAL 16 3.649 5.506 -7.408
118 1HG2 VAL 16 1HG2 VAL 16 0.476 4.549 -9.357
119 2HG2 VAL 16 2HG2 VAL 16 2.147 4.796 -9.861
120 3HG2 VAL 16 3HG2 VAL 16 1.771 3.793 -8.442
121 H GLU 17 H GLU 17 -1.376 7.028 -7.569
122 HA GLU 17 HA GLU 17 -3.106 4.629 -7.061
123 1HB GLU 17 HB2 GLU 17 -4.913 6.438 -7.544
124 2HB GLU 17 HB3 GLU 17 -4.136 6.321 -5.960
125 1HG GLU 17 HG2 GLU 17 -4.460 8.648 -6.699
126 2HG GLU 17 HG3 GLU 17 -2.744 8.256 -6.418
127 H THR 18 H THR 18 -1.670 6.570 -9.547
128 HA THR 18 HA THR 18 -3.005 4.904 -11.629
129 HB THR 18 HB THR 18 -2.526 7.932 -11.578
130 HG1 THR 18 HG1 THR 18 -4.300 7.667 -10.571
131 1HG2 THR 18 1HG2 THR 18 -4.177 7.454 -13.715
132 2HG2 THR 18 2HG2 THR 18 -2.411 7.712 -13.852
133 3HG2 THR 18 3HG2 THR 18 -3.088 6.080 -13.881
134 H ARG 19 H ARG 19 -1.520 4.102 -13.151
135 HA ARG 19 HA ARG 19 1.180 5.319 -13.279
136 1HB ARG 19 HB2 ARG 19 2.353 3.209 -12.894
137 2HB ARG 19 HB3 ARG 19 1.336 3.498 -11.490
138 1HG ARG 19 HG2 ARG 19 -0.318 1.904 -12.252
139 2HG ARG 19 HG3 ARG 19 0.496 1.705 -13.821
140 1HD ARG 19 HD2 ARG 19 2.235 0.465 -12.975
141 2HD ARG 19 HD3 ARG 19 1.859 0.833 -11.302
142 HE ARG 19 HE ARG 19 -0.452 -0.282 -12.033
143 1HH1 ARG 19 1HH2 ARG 19 2.776 -1.671 -12.076
144 2HH1 ARG 19 2HH2 ARG 19 2.292 -3.172 -12.780
145 1HH2 ARG 19 1HH1 ARG 19 -1.093 -2.351 -13.009
146 2HH2 ARG 19 2HH1 ARG 19 0.151 -3.499 -13.354
147 H TRP 20 H TRP 20 2.498 4.249 -14.883
148 HA TRP 20 HA TRP 20 1.151 3.201 -17.320
149 1HB TRP 20 HB2 TRP 20 3.799 4.548 -16.782
150 2HB TRP 20 HB3 TRP 20 3.250 3.972 -18.391
151 HD1 TRP 20 HD1 TRP 20 2.670 6.756 -15.871
152 HE1 TRP 20 HE1 TRP 20 1.057 8.504 -16.798
153 HE3 TRP 20 HE3 TRP 20 1.526 4.516 -20.294
154 HZ2 TRP 20 HZ2 TRP 20 -0.610 8.854 -19.093
155 HZ3 TRP 20 HZ3 TRP 20 -0.107 5.560 -21.847
156 HH2 TRP 20 HH2 TRP 20 -1.211 7.728 -21.271
157 H HIS 21 H HIS 21 1.849 1.053 -17.757
158 HA HIS 21 HA HIS 21 3.742 -0.157 -15.794
159 1HB HIS 21 HB2 HIS 21 1.767 -0.680 -14.795
160 2HB HIS 21 HB3 HIS 21 0.837 -0.691 -16.257
161 HD2 HIS 21 HD2 HIS 21 3.893 -3.001 -16.071
162 HE1 HIS 21 HE1 HIS 21 0.454 -5.486 -15.864
163 HE2 HIS 21 HE2 HIS 21 2.993 -5.463 -16.080
164 H CYS 22 H CYS 22 5.251 -1.243 -16.778
165 HA CYS 22 HA CYS 22 5.346 -1.787 -19.608
166 1HB CYS 22 HB2 CYS 22 7.058 -1.786 -17.202
167 2HB CYS 22 HB3 CYS 22 7.362 -3.173 -18.251
168 H THR 23 H THR 23 4.523 -3.445 -20.615
169 HA THR 23 HA THR 23 3.929 -5.949 -19.104
170 HB THR 23 HB THR 23 2.322 -6.478 -21.000
171 HG1 THR 23 HG1 THR 23 3.405 -4.240 -21.973
172 1HG2 THR 23 1HG2 THR 23 1.949 -3.882 -19.523
173 2HG2 THR 23 2HG2 THR 23 0.635 -4.986 -20.081
174 3HG2 THR 23 3HG2 THR 23 1.720 -5.480 -18.768
175 H VAL 24 H VAL 24 6.406 -5.002 -20.178
176 HA VAL 24 HA VAL 24 7.507 -7.152 -21.855
177 HB VAL 24 HB VAL 24 7.530 -4.943 -22.763
178 1HG1 VAL 24 1HG1 VAL 24 7.125 -3.157 -21.663
179 2HG1 VAL 24 2HG1 VAL 24 7.492 -3.848 -20.135
180 3HG1 VAL 24 3HG1 VAL 24 8.822 -3.169 -21.046
181 1HG2 VAL 24 1HG2 VAL 24 10.223 -5.187 -21.369
182 2HG2 VAL 24 2HG2 VAL 24 9.774 -6.123 -22.804
183 3HG2 VAL 24 3HG2 VAL 24 9.907 -4.338 -22.891
184 H CYS 25 H CYS 25 8.569 -4.802 -19.391
185 HA CYS 25 HA CYS 25 10.271 -6.560 -17.932
186 1HB CYS 25 HB2 CYS 25 8.903 -4.052 -16.941
187 2HB CYS 25 HB3 CYS 25 10.477 -4.696 -16.422
188 H GLU 26 H GLU 26 9.719 -7.484 -15.755
189 HA GLU 26 HA GLU 26 6.976 -8.327 -15.574
190 1HB GLU 26 HB2 GLU 26 9.465 -8.839 -13.957
191 2HB GLU 26 HB3 GLU 26 7.854 -9.240 -13.307
192 1HG GLU 26 HG2 GLU 26 7.319 -10.537 -15.289
193 2HG GLU 26 HG3 GLU 26 8.905 -10.179 -16.002
194 H ASP 27 H ASP 27 5.606 -6.908 -15.208
195 HA ASP 27 HA ASP 27 4.360 -5.209 -14.399
196 1HB ASP 27 HB2 ASP 27 3.889 -7.214 -12.981
197 2HB ASP 27 HB3 ASP 27 4.940 -6.549 -11.746
198 H TYR 28 H TYR 28 6.916 -4.338 -14.830
199 HA TYR 28 HA TYR 28 7.840 -2.524 -12.776
200 1HB TYR 28 HB2 TYR 28 9.272 -3.408 -14.586
201 2HB TYR 28 HB3 TYR 28 8.269 -2.576 -15.761
202 HD1 TYR 28 HD1 TYR 28 11.249 -2.358 -13.879
203 HD2 TYR 28 HD2 TYR 28 8.170 0.001 -15.701
204 HE1 TYR 28 HE1 TYR 28 12.745 -0.373 -13.805
205 HE2 TYR 28 HE2 TYR 28 9.651 1.980 -15.696
206 HH TYR 28 HH TYR 28 12.994 1.871 -14.381
207 H ASP 29 H ASP 29 7.416 -0.271 -12.676
208 HA ASP 29 HA ASP 29 4.954 0.642 -14.137
209 1HB ASP 29 HB2 ASP 29 5.492 1.686 -11.399
210 2HB ASP 29 HB3 ASP 29 3.996 1.357 -12.193
211 H LEU 30 H LEU 30 4.658 2.993 -14.064
212 HA LEU 30 HA LEU 30 6.814 4.655 -13.031
213 1HB LEU 30 HB2 LEU 30 5.839 4.670 -15.916
214 2HB LEU 30 HB3 LEU 30 6.642 6.019 -15.149
215 HG LEU 30 HG LEU 30 7.805 3.247 -15.679
216 1HD1 LEU 30 1HD1 LEU 30 7.671 4.779 -17.636
217 2HD1 LEU 30 2HD1 LEU 30 8.637 5.976 -16.745
218 3HD1 LEU 30 3HD1 LEU 30 9.351 4.407 -17.156
219 1HD2 LEU 30 1HD2 LEU 30 9.959 4.080 -14.813
220 2HD2 LEU 30 2HD2 LEU 30 9.195 5.660 -14.446
221 3HD2 LEU 30 3HD2 LEU 30 8.768 4.218 -13.527
222 H CYS 31 H CYS 31 5.873 6.444 -12.024
223 HA CYS 31 HA CYS 31 3.065 6.950 -12.235
224 1HB CYS 31 HB2 CYS 31 3.577 9.022 -11.036
225 2HB CYS 31 HB3 CYS 31 4.347 7.703 -10.217
226 H ILE 32 H ILE 32 2.304 9.103 -12.988
227 HA ILE 32 HA ILE 32 2.614 9.324 -15.716
228 HB ILE 32 HB ILE 32 1.777 11.581 -13.831
229 1HG1 ILE 32 2HG1 ILE 32 0.364 9.660 -13.234
230 2HG1 ILE 32 3HG1 ILE 32 -0.534 10.896 -14.057
231 1HG2 ILE 32 1HG2 ILE 32 0.334 12.181 -15.868
232 2HG2 ILE 32 2HG2 ILE 32 2.088 12.422 -16.023
233 3HG2 ILE 32 3HG2 ILE 32 1.314 11.007 -16.760
234 1HD1 ILE 32 1HD1 ILE 32 0.222 8.161 -15.060
235 2HD1 ILE 32 2HD1 ILE 32 -1.364 8.998 -15.050
236 3HD1 ILE 32 3HD1 ILE 32 -0.204 9.463 -16.231
237 H ASN 33 H ASN 33 4.329 11.225 -13.221
238 HA ASN 33 HA ASN 33 5.657 12.987 -15.083
239 1HB ASN 33 HB2 ASN 33 5.483 13.692 -12.767
240 2HB ASN 33 HB3 ASN 33 6.100 12.167 -12.170
241 1HD2 ASN 33 2HD2 ASN 33 8.409 11.762 -12.134
242 2HD2 ASN 33 1HD2 ASN 33 9.504 13.107 -12.362
243 H CYS 34 H CYS 34 6.716 9.944 -13.515
244 HA CYS 34 HA CYS 34 9.311 10.098 -14.718
245 1HB CYS 34 HB2 CYS 34 7.731 7.874 -13.357
246 2HB CYS 34 HB3 CYS 34 9.292 7.611 -14.169
247 H TYR 35 H TYR 35 6.260 8.471 -15.702
248 HA TYR 35 HA TYR 35 7.329 7.179 -17.983
249 1HB TYR 35 HB2 TYR 35 5.129 6.680 -17.239
250 2HB TYR 35 HB3 TYR 35 4.612 8.352 -17.401
251 HD1 TYR 35 HD1 TYR 35 5.767 5.381 -19.386
252 HD2 TYR 35 HD2 TYR 35 3.683 9.139 -19.455
253 HE1 TYR 35 HE1 TYR 35 5.058 4.928 -21.731
254 HE2 TYR 35 HE2 TYR 35 3.026 8.744 -21.791
255 HH TYR 35 HH TYR 35 3.182 7.313 -23.615
256 H ASN 36 H ASN 36 6.089 10.490 -17.557
257 HA ASN 36 HA ASN 36 6.374 11.438 -20.169
258 1HB ASN 36 HB2 ASN 36 5.906 12.582 -17.452
259 2HB ASN 36 HB3 ASN 36 6.608 13.699 -18.556
260 1HD2 ASN 36 2HD2 ASN 36 3.809 11.724 -17.898
261 2HD2 ASN 36 1HD2 ASN 36 2.740 12.486 -19.083
262 H THR 37 H THR 37 8.969 10.750 -17.941
263 HA THR 37 HA THR 37 10.742 12.541 -19.566
264 HB THR 37 HB THR 37 12.075 12.730 -17.429
265 HG1 THR 37 HG1 THR 37 9.675 12.072 -16.136
266 1HG2 THR 37 1HG2 THR 37 10.760 14.536 -16.472
267 2HG2 THR 37 2HG2 THR 37 10.692 14.599 -18.224
268 3HG2 THR 37 3HG2 THR 37 9.296 13.976 -17.327
269 H LYS 38 H LYS 38 10.647 9.604 -17.558
270 HA LYS 38 HA LYS 38 13.268 8.704 -18.223
271 1HB LYS 38 HB2 LYS 38 10.915 7.033 -17.261
272 2HB LYS 38 HB3 LYS 38 12.621 6.650 -17.068
273 1HG LYS 38 HG2 LYS 38 11.247 9.061 -15.779
274 2HG LYS 38 HG3 LYS 38 11.484 7.512 -14.981
275 1HD LYS 38 HD2 LYS 38 13.911 7.840 -15.001
276 2HD LYS 38 HD3 LYS 38 13.735 9.279 -16.000
277 1HE LYS 38 HE2 LYS 38 14.075 9.979 -13.717
278 2HE LYS 38 HE3 LYS 38 12.411 10.379 -14.188
279 1HZ LYS 38 HZ1 LYS 38 12.658 9.374 -11.951
280 2HZ LYS 38 HZ2 LYS 38 11.664 8.519 -12.904
281 3HZ LYS 38 HZ3 LYS 38 13.200 7.995 -12.648
282 H SER 39 H SER 39 10.655 8.909 -20.283
283 HA SER 39 HA SER 39 10.113 8.003 -22.266
284 1HB SER 39 HB2 SER 39 13.133 7.970 -22.509
285 2HB SER 39 HB3 SER 39 11.960 8.090 -23.839
286 HG SER 39 HG SER 39 12.428 9.981 -21.763
287 H HIS 40 H HIS 40 9.805 5.937 -20.523
288 HA HIS 40 HA HIS 40 11.168 3.517 -21.333
289 1HB HIS 40 HB2 HIS 40 9.282 4.335 -19.341
290 2HB HIS 40 HB3 HIS 40 8.479 3.083 -20.293
291 HD1 HIS 40 HD1 HIS 40 11.451 3.446 -17.894
292 HD2 HIS 40 HD2 HIS 40 9.506 0.650 -20.310
293 HE1 HIS 40 HE1 HIS 40 12.330 1.149 -17.168
294 H THR 41 H THR 41 11.055 2.855 -23.334
295 HA THR 41 HA THR 41 8.883 3.719 -25.025
296 HB THR 41 HB THR 41 11.120 2.155 -26.196
297 HG1 THR 41 HG1 THR 41 11.785 4.430 -24.669
298 1HG2 THR 41 1HG2 THR 41 10.272 5.061 -26.595
299 2HG2 THR 41 2HG2 THR 41 11.397 4.123 -27.613
300 3HG2 THR 41 3HG2 THR 41 9.686 3.676 -27.534
301 H HIS 42 H HIS 42 9.154 0.948 -23.126
302 HA HIS 42 HA HIS 42 8.777 -1.014 -25.185
303 1HB HIS 42 HB2 HIS 42 8.265 -1.241 -22.217
304 2HB HIS 42 HB3 HIS 42 8.649 -2.531 -23.374
305 HD2 HIS 42 HD2 HIS 42 11.322 -1.066 -24.663
306 HE1 HIS 42 HE1 HIS 42 12.738 -1.044 -20.642
307 HE2 HIS 42 HE2 HIS 42 13.411 -0.772 -23.087
308 H LYS 43 H LYS 43 6.816 -2.605 -24.962
309 HA LYS 43 HA LYS 43 4.481 -0.970 -25.291
310 1HB LYS 43 HB2 LYS 43 5.178 -3.137 -26.525
311 2HB LYS 43 HB3 LYS 43 4.433 -3.998 -25.193
312 1HG LYS 43 HG2 LYS 43 3.179 -1.833 -26.951
313 2HG LYS 43 HG3 LYS 43 2.950 -3.564 -27.202
314 1HD LYS 43 HD2 LYS 43 1.858 -1.805 -25.009
315 2HD LYS 43 HD3 LYS 43 0.964 -2.670 -26.267
316 1HE LYS 43 HE2 LYS 43 1.470 -4.841 -25.269
317 2HE LYS 43 HE3 LYS 43 2.593 -4.108 -24.130
318 1HZ LYS 43 HZ1 LYS 43 0.839 -4.270 -22.848
319 2HZ LYS 43 HZ2 LYS 43 0.616 -2.774 -23.390
320 3HZ LYS 43 HZ3 LYS 43 -0.311 -3.989 -24.028
321 H MET 44 H MET 44 3.494 -0.135 -23.642
322 HA MET 44 HA MET 44 3.334 -1.472 -20.976
323 1HB MET 44 HB2 MET 44 3.464 1.407 -21.972
324 2HB MET 44 HB3 MET 44 2.809 1.009 -20.363
325 1HG MET 44 HG2 MET 44 4.684 0.184 -19.540
326 2HG MET 44 HG3 MET 44 5.509 -0.026 -21.084
327 1HE MET 44 HE1 MET 44 6.097 1.219 -18.028
328 2HE MET 44 HE2 MET 44 6.132 3.004 -17.956
329 3HE MET 44 HE3 MET 44 4.582 2.164 -18.017
330 H VAL 45 H VAL 45 1.376 -0.432 -19.816
331 HA VAL 45 HA VAL 45 -1.119 -0.169 -21.260
332 HB VAL 45 HB VAL 45 -2.097 -1.473 -19.338
333 1HG1 VAL 45 1HG1 VAL 45 -1.800 -3.677 -20.344
334 2HG1 VAL 45 2HG1 VAL 45 -1.833 -2.498 -21.662
335 3HG1 VAL 45 3HG1 VAL 45 -0.284 -3.214 -21.093
336 1HG2 VAL 45 1HG2 VAL 45 -0.664 -3.175 -18.199
337 2HG2 VAL 45 2HG2 VAL 45 0.741 -2.387 -18.879
338 3HG2 VAL 45 3HG2 VAL 45 -0.297 -1.470 -17.811
339 H LYS 46 H LYS 46 -2.629 0.800 -19.236
340 HA LYS 46 HA LYS 46 -1.061 2.391 -17.369
341 1HB LYS 46 HB2 LYS 46 -1.224 3.674 -19.539
342 2HB LYS 46 HB3 LYS 46 -2.955 3.683 -19.390
343 1HG LYS 46 HG2 LYS 46 -1.097 4.932 -17.298
344 2HG LYS 46 HG3 LYS 46 -1.722 5.796 -18.678
345 1HD LYS 46 HD2 LYS 46 -4.105 5.261 -17.760
346 2HD LYS 46 HD3 LYS 46 -3.256 4.759 -16.293
347 1HE LYS 46 HE2 LYS 46 -3.814 7.014 -15.960
348 2HE LYS 46 HE3 LYS 46 -2.078 6.997 -16.277
349 1HZ LYS 46 HZ1 LYS 46 -3.218 8.730 -17.438
350 2HZ LYS 46 HZ2 LYS 46 -2.614 7.707 -18.586
351 3HZ LYS 46 HZ3 LYS 46 -4.227 7.760 -18.121
352 H TRP 47 H TRP 47 -2.274 2.532 -15.539
353 HA TRP 47 HA TRP 47 -5.126 1.731 -15.646
354 1HB TRP 47 HB2 TRP 47 -3.162 0.902 -13.469
355 2HB TRP 47 HB3 TRP 47 -4.802 0.336 -13.684
356 HD1 TRP 47 HD1 TRP 47 -1.304 -0.454 -14.521
357 HE1 TRP 47 HE1 TRP 47 -1.092 -2.461 -16.076
358 HE3 TRP 47 HE3 TRP 47 -6.131 -0.662 -16.149
359 HZ2 TRP 47 HZ2 TRP 47 -2.762 -3.798 -18.056
360 HZ3 TRP 47 HZ3 TRP 47 -6.731 -2.179 -18.031
361 HH2 TRP 47 HH2 TRP 47 -5.071 -3.770 -18.950
362 H GLY 48 H GLY 48 -6.227 3.441 -14.858
363 1HA GLY 48 HA2 GLY 48 -4.828 5.226 -12.935
364 2HA GLY 48 HA3 GLY 48 -5.657 5.851 -14.385
365 H LEU 49 H LEU 49 -5.986 6.090 -11.437
366 HA LEU 49 HA LEU 49 -8.881 5.602 -11.298
367 1HB LEU 49 HB2 LEU 49 -6.855 4.543 -9.300
368 2HB LEU 49 HB3 LEU 49 -8.549 4.688 -8.920
369 HG LEU 49 HG LEU 49 -7.463 2.988 -11.212
370 1HD1 LEU 49 1HD1 LEU 49 -6.861 2.195 -9.004
371 2HD1 LEU 49 2HD1 LEU 49 -8.579 2.218 -8.519
372 3HD1 LEU 49 3HD1 LEU 49 -8.040 1.106 -9.792
373 1HD2 LEU 49 1HD2 LEU 49 -9.800 3.673 -11.727
374 2HD2 LEU 49 2HD2 LEU 49 -9.758 1.995 -11.234
375 3HD2 LEU 49 3HD2 LEU 49 -10.308 3.226 -10.085
376 H GLY 50 H GLY 50 -6.527 7.963 -11.075
377 1HA GLY 50 HA2 GLY 50 -8.341 9.608 -9.443
378 2HA GLY 50 HA3 GLY 50 -6.754 9.287 -8.741
379 H LEU 51 H LEU 51 -5.016 9.486 -10.830
380 HA LEU 51 HA LEU 51 -5.428 12.197 -12.028
381 1HB LEU 51 HB2 LEU 51 -2.932 11.044 -10.715
382 2HB LEU 51 HB3 LEU 51 -3.014 12.603 -11.527
383 HG LEU 51 HG LEU 51 -4.594 11.945 -9.010
384 1HD1 LEU 51 1HD1 LEU 51 -1.967 13.447 -9.328
385 2HD1 LEU 51 2HD1 LEU 51 -2.935 13.387 -7.855
386 3HD1 LEU 51 3HD1 LEU 51 -2.214 11.884 -8.517
387 1HD2 LEU 51 1HD2 LEU 51 -4.059 14.595 -10.421
388 2HD2 LEU 51 2HD2 LEU 51 -5.633 13.767 -10.271
389 3HD2 LEU 51 3HD2 LEU 51 -4.871 14.419 -8.841
390 H ASP 52 H ASP 52 -6.231 10.890 -13.820
391 HA ASP 52 HA ASP 52 -4.449 8.991 -15.101
392 1HB ASP 52 HB2 ASP 52 -7.055 9.040 -15.161
393 2HB ASP 52 HB3 ASP 52 -6.866 10.248 -16.446
Start of MODEL 5
1 1H GLY 1 H1 GLY 1 3.866 -3.653 -10.396
2 2H GLY 1 H2 GLY 1 4.023 -2.121 -9.853
3 3H GLY 1 H3 GLY 1 5.134 -3.241 -9.410
4 1HA GLY 1 HA2 GLY 1 3.336 -4.473 -8.239
5 2HA GLY 1 HA3 GLY 1 3.722 -2.855 -7.591
6 H GLN 2 H GLN 2 1.061 -4.489 -7.591
7 HA GLN 2 HA GLN 2 -0.624 -2.240 -8.371
8 1HB GLN 2 HB2 GLN 2 -2.141 -3.858 -9.692
9 2HB GLN 2 HB3 GLN 2 -0.718 -3.175 -10.472
10 1HG GLN 2 HG2 GLN 2 0.520 -5.283 -10.176
11 2HG GLN 2 HG3 GLN 2 -0.883 -6.000 -9.374
12 1HE2 GLN 2 2HE2 GLN 2 0.648 -5.724 -12.424
13 2HE2 GLN 2 1HE2 GLN 2 -0.756 -6.157 -13.384
14 H ASP 3 H ASP 3 -2.678 -2.253 -7.628
15 HA ASP 3 HA ASP 3 -3.661 -4.150 -5.637
16 1HB ASP 3 HB2 ASP 3 -2.103 -2.413 -4.545
17 2HB ASP 3 HB3 ASP 3 -3.237 -1.186 -5.139
18 H ARG 4 H ARG 4 -5.906 -3.046 -4.946
19 HA ARG 4 HA ARG 4 -7.601 -2.997 -7.159
20 1HB ARG 4 HB2 ARG 4 -9.387 -2.327 -5.662
21 2HB ARG 4 HB3 ARG 4 -8.402 -3.582 -4.967
22 1HG ARG 4 HG2 ARG 4 -7.491 -0.880 -4.171
23 2HG ARG 4 HG3 ARG 4 -9.186 -1.149 -3.782
24 1HD ARG 4 HD2 ARG 4 -8.667 -2.461 -2.001
25 2HD ARG 4 HD3 ARG 4 -7.497 -3.396 -2.940
26 HE ARG 4 HE ARG 4 -5.799 -2.063 -2.403
27 1HH1 ARG 4 1HH1 ARG 4 -8.649 -0.770 -0.785
28 2HH1 ARG 4 2HH1 ARG 4 -7.747 0.323 0.226
29 1HH2 ARG 4 1HH2 ARG 4 -4.698 -0.600 -1.344
30 2HH2 ARG 4 2HH2 ARG 4 -5.320 0.480 -0.129
31 H PHE 5 H PHE 5 -6.058 -0.170 -5.716
32 HA PHE 5 HA PHE 5 -6.594 1.419 -8.063
33 1HB PHE 5 HB2 PHE 5 -7.735 3.283 -6.796
34 2HB PHE 5 HB3 PHE 5 -8.727 1.884 -7.087
35 HD1 PHE 5 HD1 PHE 5 -9.965 0.958 -5.296
36 HD2 PHE 5 HD2 PHE 5 -6.648 3.566 -4.397
37 HE1 PHE 5 HE1 PHE 5 -10.644 1.013 -2.923
38 HE2 PHE 5 HE2 PHE 5 -7.267 3.543 -2.034
39 HZ PHE 5 HZ PHE 5 -9.276 2.301 -1.263
40 H VAL 6 H VAL 6 -4.385 0.287 -6.513
41 HA VAL 6 HA VAL 6 -2.797 2.712 -6.058
42 HB VAL 6 HB VAL 6 -3.688 0.726 -3.994
43 1HG1 VAL 6 1HG1 VAL 6 -0.792 1.672 -3.999
44 2HG1 VAL 6 2HG1 VAL 6 -1.657 0.865 -2.658
45 3HG1 VAL 6 3HG1 VAL 6 -1.394 -0.004 -4.161
46 1HG2 VAL 6 1HG2 VAL 6 -3.241 2.699 -2.539
47 2HG2 VAL 6 2HG2 VAL 6 -2.763 3.604 -3.999
48 3HG2 VAL 6 3HG2 VAL 6 -4.402 2.983 -3.865
49 H TYR 7 H TYR 7 -0.652 2.328 -6.382
50 HA TYR 7 HA TYR 7 0.298 -0.148 -7.614
51 1HB TYR 7 HB2 TYR 7 -0.014 2.580 -8.978
52 2HB TYR 7 HB3 TYR 7 0.811 1.214 -9.691
53 HD1 TYR 7 HD1 TYR 7 -0.759 -0.947 -10.049
54 HD2 TYR 7 HD2 TYR 7 -2.261 2.962 -9.097
55 HE1 TYR 7 HE1 TYR 7 -3.079 -1.712 -10.596
56 HE2 TYR 7 HE2 TYR 7 -4.552 2.194 -9.476
57 HH TYR 7 HH TYR 7 -5.347 -1.181 -10.167
58 H THR 8 H THR 8 2.553 0.896 -8.727
59 HA THR 8 HA THR 8 3.798 2.705 -6.753
60 HB THR 8 HB THR 8 5.901 1.118 -7.473
61 HG1 THR 8 HG1 THR 8 4.956 -0.449 -8.555
62 1HG2 THR 8 1HG2 THR 8 5.514 -0.204 -5.356
63 2HG2 THR 8 2HG2 THR 8 5.487 1.544 -5.184
64 3HG2 THR 8 3HG2 THR 8 3.940 0.645 -5.214
65 H CYS 9 H CYS 9 5.902 3.570 -7.772
66 HA CYS 9 HA CYS 9 5.810 3.758 -10.739
67 1HB CYS 9 HB2 CYS 9 5.546 6.090 -9.798
68 2HB CYS 9 HB3 CYS 9 6.883 5.820 -8.692
69 H ASN 10 H ASN 10 7.403 2.163 -11.162
70 HA ASN 10 HA ASN 10 9.232 1.342 -9.121
71 1HB ASN 10 HB2 ASN 10 8.284 -0.145 -10.896
72 2HB ASN 10 HB3 ASN 10 9.392 0.631 -12.041
73 1HD2 ASN 10 2HD2 ASN 10 11.037 -0.952 -12.319
74 2HD2 ASN 10 1HD2 ASN 10 11.902 -1.690 -10.989
75 H GLU 11 H GLU 11 9.228 4.189 -10.817
76 HA GLU 11 HA GLU 11 12.150 4.247 -10.827
77 1HB GLU 11 HB2 GLU 11 10.197 5.714 -12.403
78 2HB GLU 11 HB3 GLU 11 11.358 6.763 -11.627
79 1HG GLU 11 HG2 GLU 11 12.190 4.273 -13.190
80 2HG GLU 11 HG3 GLU 11 12.162 5.891 -13.878
81 H CYS 12 H CYS 12 9.361 5.344 -9.036
82 HA CYS 12 HA CYS 12 11.101 7.071 -7.332
83 1HB CYS 12 HB2 CYS 12 8.088 6.614 -7.129
84 2HB CYS 12 HB3 CYS 12 9.060 7.836 -6.289
85 H LYS 13 H LYS 13 9.519 4.007 -7.512
86 HA LYS 13 HA LYS 13 9.097 2.267 -6.170
87 1HB LYS 13 HB2 LYS 13 11.875 2.989 -5.118
88 2HB LYS 13 HB3 LYS 13 10.954 1.596 -4.546
89 1HG LYS 13 HG2 LYS 13 11.730 0.392 -6.244
90 2HG LYS 13 HG3 LYS 13 10.708 1.338 -7.304
91 1HD LYS 13 HD2 LYS 13 13.690 1.646 -6.805
92 2HD LYS 13 HD3 LYS 13 12.800 1.228 -8.268
93 1HE LYS 13 HE2 LYS 13 11.783 3.572 -8.132
94 2HE LYS 13 HE3 LYS 13 13.065 3.976 -6.982
95 1HZ LYS 13 HZ1 LYS 13 13.376 3.067 -9.778
96 2HZ LYS 13 HZ2 LYS 13 13.639 4.548 -9.238
97 3HZ LYS 13 HZ3 LYS 13 14.669 3.364 -8.776
98 H HIS 14 H HIS 14 7.779 4.385 -5.809
99 HA HIS 14 HA HIS 14 6.933 4.191 -3.005
100 1HB HIS 14 HB2 HIS 14 7.260 6.720 -4.710
101 2HB HIS 14 HB3 HIS 14 6.139 6.641 -3.335
102 HD2 HIS 14 HD2 HIS 14 9.548 7.652 -4.039
103 HE1 HIS 14 HE1 HIS 14 9.823 6.156 -0.056
104 HE2 HIS 14 HE2 HIS 14 11.036 7.438 -1.902
105 H HIS 15 H HIS 15 4.644 4.865 -2.871
106 HA HIS 15 HA HIS 15 3.083 3.317 -4.720
107 1HB HIS 15 HB2 HIS 15 1.982 3.043 -2.827
108 2HB HIS 15 HB3 HIS 15 2.819 4.376 -2.048
109 HD2 HIS 15 HD2 HIS 15 -0.335 3.791 -4.242
110 HE1 HIS 15 HE1 HIS 15 -0.778 7.571 -2.356
111 HE2 HIS 15 HE2 HIS 15 -1.904 5.876 -3.873
112 H VAL 16 H VAL 16 1.325 4.060 -5.952
113 HA VAL 16 HA VAL 16 0.844 6.881 -6.378
114 HB VAL 16 HB VAL 16 1.219 6.874 -8.796
115 1HG1 VAL 16 1HG1 VAL 16 3.556 6.416 -9.102
116 2HG1 VAL 16 2HG1 VAL 16 3.301 7.280 -7.559
117 3HG1 VAL 16 3HG1 VAL 16 3.667 5.516 -7.619
118 1HG2 VAL 16 1HG2 VAL 16 2.077 4.922 -10.034
119 2HG2 VAL 16 2HG2 VAL 16 1.838 3.912 -8.585
120 3HG2 VAL 16 3HG2 VAL 16 0.458 4.674 -9.406
121 H GLU 17 H GLU 17 -1.303 7.055 -7.756
122 HA GLU 17 HA GLU 17 -3.041 4.717 -7.127
123 1HB GLU 17 HB2 GLU 17 -4.847 6.525 -7.431
124 2HB GLU 17 HB3 GLU 17 -3.937 6.455 -5.928
125 1HG GLU 17 HG2 GLU 17 -4.308 8.771 -6.732
126 2HG GLU 17 HG3 GLU 17 -2.596 8.390 -6.563
127 H THR 18 H THR 18 -1.645 6.552 -9.646
128 HA THR 18 HA THR 18 -3.084 4.987 -11.707
129 HB THR 18 HB THR 18 -2.422 7.957 -11.575
130 HG1 THR 18 HG1 THR 18 -4.276 7.776 -10.606
131 1HG2 THR 18 1HG2 THR 18 -2.744 8.267 -13.769
132 2HG2 THR 18 2HG2 THR 18 -2.514 6.535 -13.983
133 3HG2 THR 18 3HG2 THR 18 -4.144 7.228 -13.820
134 H ARG 19 H ARG 19 -1.572 4.159 -13.236
135 HA ARG 19 HA ARG 19 1.152 5.245 -13.275
136 1HB ARG 19 HB2 ARG 19 2.334 3.196 -12.823
137 2HB ARG 19 HB3 ARG 19 1.198 3.389 -11.486
138 1HG ARG 19 HG2 ARG 19 -0.330 1.780 -12.534
139 2HG ARG 19 HG3 ARG 19 0.726 1.622 -13.941
140 1HD ARG 19 HD2 ARG 19 2.293 0.355 -12.939
141 2HD ARG 19 HD3 ARG 19 1.820 0.742 -11.298
142 HE ARG 19 HE ARG 19 -0.472 -0.342 -12.140
143 1HH1 ARG 19 2HH2 ARG 19 2.737 -1.803 -12.145
144 2HH1 ARG 19 1HH2 ARG 19 2.198 -3.317 -12.772
145 1HH2 ARG 19 1HH1 ARG 19 -1.178 -2.387 -13.022
146 2HH2 ARG 19 2HH1 ARG 19 0.029 -3.629 -13.219
147 H TRP 20 H TRP 20 2.515 4.151 -14.858
148 HA TRP 20 HA TRP 20 1.175 3.039 -17.285
149 1HB TRP 20 HB2 TRP 20 3.810 4.477 -16.791
150 2HB TRP 20 HB3 TRP 20 3.308 3.790 -18.346
151 HD1 TRP 20 HD1 TRP 20 2.437 6.651 -15.980
152 HE1 TRP 20 HE1 TRP 20 0.626 8.099 -16.961
153 HE3 TRP 20 HE3 TRP 20 1.674 4.139 -20.366
154 HZ2 TRP 20 HZ2 TRP 20 -0.908 8.284 -19.387
155 HZ3 TRP 20 HZ3 TRP 20 -0.010 4.988 -22.013
156 HH2 TRP 20 HH2 TRP 20 -1.315 7.025 -21.510
157 H HIS 21 H HIS 21 1.809 0.950 -17.682
158 HA HIS 21 HA HIS 21 3.764 -0.236 -15.771
159 1HB HIS 21 HB2 HIS 21 1.834 -0.766 -14.723
160 2HB HIS 21 HB3 HIS 21 0.853 -0.776 -16.168
161 HD2 HIS 21 HD2 HIS 21 3.943 -3.095 -16.011
162 HE1 HIS 21 HE1 HIS 21 0.503 -5.577 -15.743
163 HE2 HIS 21 HE2 HIS 21 3.041 -5.527 -16.030
164 H CYS 22 H CYS 22 5.272 -1.298 -16.782
165 HA CYS 22 HA CYS 22 5.331 -1.878 -19.605
166 1HB CYS 22 HB2 CYS 22 7.080 -1.760 -17.236
167 2HB CYS 22 HB3 CYS 22 7.454 -3.122 -18.278
168 H THR 23 H THR 23 4.582 -3.483 -20.586
169 HA THR 23 HA THR 23 4.007 -6.024 -19.149
170 HB THR 23 HB THR 23 2.263 -6.548 -20.837
171 HG1 THR 23 HG1 THR 23 3.277 -4.168 -21.814
172 1HG2 THR 23 1HG2 THR 23 1.979 -3.830 -19.588
173 2HG2 THR 23 2HG2 THR 23 0.646 -4.965 -20.010
174 3HG2 THR 23 3HG2 THR 23 1.761 -5.342 -18.673
175 H VAL 24 H VAL 24 6.411 -5.128 -20.184
176 HA VAL 24 HA VAL 24 7.495 -7.108 -22.032
177 HB VAL 24 HB VAL 24 7.508 -4.866 -22.822
178 1HG1 VAL 24 1HG1 VAL 24 7.123 -3.122 -21.686
179 2HG1 VAL 24 2HG1 VAL 24 7.442 -3.884 -20.162
180 3HG1 VAL 24 3HG1 VAL 24 8.778 -3.150 -21.015
181 1HG2 VAL 24 1HG2 VAL 24 9.786 -6.043 -22.856
182 2HG2 VAL 24 2HG2 VAL 24 9.899 -4.250 -22.899
183 3HG2 VAL 24 3HG2 VAL 24 10.213 -5.110 -21.405
184 H CYS 25 H CYS 25 8.398 -4.890 -19.382
185 HA CYS 25 HA CYS 25 10.237 -6.634 -18.066
186 1HB CYS 25 HB2 CYS 25 8.791 -4.230 -16.913
187 2HB CYS 25 HB3 CYS 25 10.404 -4.773 -16.494
188 H GLU 26 H GLU 26 9.843 -7.134 -15.607
189 HA GLU 26 HA GLU 26 7.284 -8.493 -15.259
190 1HB GLU 26 HB2 GLU 26 9.926 -8.397 -13.846
191 2HB GLU 26 HB3 GLU 26 8.511 -8.756 -12.863
192 1HG GLU 26 HG2 GLU 26 7.865 -10.588 -14.340
193 2HG GLU 26 HG3 GLU 26 9.317 -10.315 -15.347
194 H ASP 27 H ASP 27 5.704 -7.032 -15.077
195 HA ASP 27 HA ASP 27 4.431 -5.334 -14.370
196 1HB ASP 27 HB2 ASP 27 4.020 -7.290 -12.902
197 2HB ASP 27 HB3 ASP 27 5.030 -6.556 -11.664
198 H TYR 28 H TYR 28 6.962 -4.380 -14.811
199 HA TYR 28 HA TYR 28 7.845 -2.534 -12.806
200 1HB TYR 28 HB2 TYR 28 9.254 -3.439 -14.659
201 2HB TYR 28 HB3 TYR 28 8.235 -2.583 -15.813
202 HD1 TYR 28 HD1 TYR 28 11.288 -2.409 -14.091
203 HD2 TYR 28 HD2 TYR 28 8.096 0.034 -15.631
204 HE1 TYR 28 HE1 TYR 28 12.760 -0.392 -13.965
205 HE2 TYR 28 HE2 TYR 28 9.553 2.000 -15.542
206 HH TYR 28 HH TYR 28 11.577 2.856 -14.805
207 H ASP 29 H ASP 29 7.394 -0.316 -12.611
208 HA ASP 29 HA ASP 29 4.911 0.613 -14.017
209 1HB ASP 29 HB2 ASP 29 5.545 1.628 -11.269
210 2HB ASP 29 HB3 ASP 29 4.011 1.349 -12.072
211 H LEU 30 H LEU 30 4.621 2.965 -14.053
212 HA LEU 30 HA LEU 30 6.781 4.608 -12.967
213 1HB LEU 30 HB2 LEU 30 5.848 4.687 -15.873
214 2HB LEU 30 HB3 LEU 30 6.681 6.001 -15.075
215 HG LEU 30 HG LEU 30 7.774 3.202 -15.589
216 1HD1 LEU 30 1HD1 LEU 30 8.620 5.875 -16.761
217 2HD1 LEU 30 2HD1 LEU 30 9.296 4.283 -17.139
218 3HD1 LEU 30 3HD1 LEU 30 7.591 4.664 -17.568
219 1HD2 LEU 30 1HD2 LEU 30 9.977 4.165 -14.864
220 2HD2 LEU 30 2HD2 LEU 30 9.155 5.669 -14.382
221 3HD2 LEU 30 3HD2 LEU 30 8.826 4.175 -13.517
222 H CYS 31 H CYS 31 5.904 6.441 -11.987
223 HA CYS 31 HA CYS 31 3.100 7.023 -12.149
224 1HB CYS 31 HB2 CYS 31 3.660 9.053 -11.034
225 2HB CYS 31 HB3 CYS 31 4.481 7.766 -10.180
226 H ILE 32 H ILE 32 2.425 9.153 -12.988
227 HA ILE 32 HA ILE 32 2.762 9.254 -15.727
228 HB ILE 32 HB ILE 32 1.856 11.563 -13.952
229 1HG1 ILE 32 2HG1 ILE 32 0.627 9.730 -13.063
230 2HG1 ILE 32 3HG1 ILE 32 -0.458 10.563 -14.151
231 1HG2 ILE 32 1HG2 ILE 32 1.200 10.750 -16.812
232 2HG2 ILE 32 2HG2 ILE 32 0.392 12.054 -15.923
233 3HG2 ILE 32 3HG2 ILE 32 2.137 12.160 -16.251
234 1HD1 ILE 32 1HD1 ILE 32 -0.138 8.876 -15.838
235 2HD1 ILE 32 2HD1 ILE 32 1.002 7.948 -14.796
236 3HD1 ILE 32 3HD1 ILE 32 -0.676 8.121 -14.325
237 H ASN 33 H ASN 33 4.313 11.274 -13.264
238 HA ASN 33 HA ASN 33 5.631 13.039 -15.101
239 1HB ASN 33 HB2 ASN 33 5.395 13.853 -12.875
240 2HB ASN 33 HB3 ASN 33 5.913 12.339 -12.137
241 1HD2 ASN 33 2HD2 ASN 33 8.242 11.811 -12.084
242 2HD2 ASN 33 1HD2 ASN 33 9.370 13.140 -12.216
243 H CYS 34 H CYS 34 6.684 10.018 -13.512
244 HA CYS 34 HA CYS 34 9.316 10.182 -14.661
245 1HB CYS 34 HB2 CYS 34 7.740 7.950 -13.323
246 2HB CYS 34 HB3 CYS 34 9.319 7.675 -14.099
247 H TYR 35 H TYR 35 6.276 8.509 -15.658
248 HA TYR 35 HA TYR 35 7.418 7.264 -17.908
249 1HB TYR 35 HB2 TYR 35 5.125 6.791 -17.102
250 2HB TYR 35 HB3 TYR 35 4.588 8.394 -17.595
251 HD1 TYR 35 HD1 TYR 35 6.527 5.569 -19.240
252 HD2 TYR 35 HD2 TYR 35 3.272 8.409 -19.528
253 HE1 TYR 35 HE1 TYR 35 6.056 4.770 -21.508
254 HE2 TYR 35 HE2 TYR 35 2.816 7.606 -21.847
255 HH TYR 35 HH TYR 35 4.732 4.954 -23.343
256 H ASN 36 H ASN 36 6.099 10.514 -17.500
257 HA ASN 36 HA ASN 36 6.357 11.466 -20.138
258 1HB ASN 36 HB2 ASN 36 5.913 12.653 -17.403
259 2HB ASN 36 HB3 ASN 36 6.523 13.773 -18.564
260 1HD2 ASN 36 2HD2 ASN 36 3.894 11.419 -18.158
261 2HD2 ASN 36 1HD2 ASN 36 2.754 12.285 -19.209
262 H THR 37 H THR 37 8.923 10.842 -17.921
263 HA THR 37 HA THR 37 10.709 12.636 -19.530
264 HB THR 37 HB THR 37 12.060 12.845 -17.392
265 HG1 THR 37 HG1 THR 37 9.666 12.149 -16.076
266 1HG2 THR 37 1HG2 THR 37 10.612 14.679 -18.174
267 2HG2 THR 37 2HG2 THR 37 9.252 14.014 -17.244
268 3HG2 THR 37 3HG2 THR 37 10.709 14.577 -16.391
269 H LYS 38 H LYS 38 10.594 9.695 -17.574
270 HA LYS 38 HA LYS 38 13.227 8.755 -18.237
271 1HB LYS 38 HB2 LYS 38 10.869 7.147 -17.233
272 2HB LYS 38 HB3 LYS 38 12.575 6.746 -17.070
273 1HG LYS 38 HG2 LYS 38 11.218 9.153 -15.718
274 2HG LYS 38 HG3 LYS 38 11.476 7.599 -14.973
275 1HD LYS 38 HD2 LYS 38 13.882 7.925 -15.056
276 2HD LYS 38 HD3 LYS 38 13.692 9.409 -16.015
277 1HE LYS 38 HE2 LYS 38 14.103 10.003 -13.724
278 2HE LYS 38 HE3 LYS 38 12.455 10.496 -14.193
279 1HZ LYS 38 HZ1 LYS 38 12.621 9.424 -11.969
280 2HZ LYS 38 HZ2 LYS 38 11.613 8.619 -12.952
281 3HZ LYS 38 HZ3 LYS 38 13.146 8.062 -12.677
282 H SER 39 H SER 39 10.660 9.043 -20.308
283 HA SER 39 HA SER 39 10.019 8.050 -22.223
284 1HB SER 39 HB2 SER 39 13.047 8.045 -22.544
285 2HB SER 39 HB3 SER 39 11.850 8.168 -23.838
286 HG SER 39 HG SER 39 12.452 10.061 -21.810
287 H HIS 40 H HIS 40 9.680 6.023 -20.538
288 HA HIS 40 HA HIS 40 11.079 3.594 -21.282
289 1HB HIS 40 HB2 HIS 40 9.233 4.411 -19.291
290 2HB HIS 40 HB3 HIS 40 8.398 3.195 -20.251
291 HD1 HIS 40 HD1 HIS 40 11.455 3.471 -17.908
292 HD2 HIS 40 HD2 HIS 40 9.391 0.719 -20.293
293 HE1 HIS 40 HE1 HIS 40 12.256 1.142 -17.192
294 H THR 41 H THR 41 10.998 2.911 -23.285
295 HA THR 41 HA THR 41 8.846 3.748 -25.031
296 HB THR 41 HB THR 41 11.073 2.167 -26.123
297 HG1 THR 41 HG1 THR 41 11.795 4.450 -24.641
298 1HG2 THR 41 1HG2 THR 41 10.307 5.078 -26.570
299 2HG2 THR 41 2HG2 THR 41 11.379 4.097 -27.598
300 3HG2 THR 41 3HG2 THR 41 9.653 3.689 -27.467
301 H HIS 42 H HIS 42 8.978 1.001 -23.097
302 HA HIS 42 HA HIS 42 8.657 -0.960 -25.195
303 1HB HIS 42 HB2 HIS 42 8.171 -1.200 -22.245
304 2HB HIS 42 HB3 HIS 42 8.613 -2.493 -23.422
305 HD2 HIS 42 HD2 HIS 42 11.258 -1.095 -24.647
306 HE1 HIS 42 HE1 HIS 42 12.594 -1.014 -20.590
307 HE2 HIS 42 HE2 HIS 42 13.326 -0.828 -23.046
308 H LYS 43 H LYS 43 6.827 -2.606 -24.900
309 HA LYS 43 HA LYS 43 4.285 -1.291 -25.231
310 1HB LYS 43 HB2 LYS 43 4.874 -3.472 -26.309
311 2HB LYS 43 HB3 LYS 43 4.804 -4.244 -24.706
312 1HG LYS 43 HG2 LYS 43 2.373 -3.231 -24.570
313 2HG LYS 43 HG3 LYS 43 2.590 -2.829 -26.255
314 1HD LYS 43 HD2 LYS 43 1.427 -4.771 -26.373
315 2HD LYS 43 HD3 LYS 43 3.063 -5.376 -26.604
316 1HE LYS 43 HE2 LYS 43 1.602 -5.291 -23.910
317 2HE LYS 43 HE3 LYS 43 1.467 -6.669 -24.997
318 1HZ LYS 43 HZ1 LYS 43 3.114 -7.017 -23.303
319 2HZ LYS 43 HZ2 LYS 43 3.888 -6.972 -24.761
320 3HZ LYS 43 HZ3 LYS 43 3.915 -5.708 -23.678
321 H MET 44 H MET 44 3.552 -0.156 -23.518
322 HA MET 44 HA MET 44 3.330 -1.481 -20.856
323 1HB MET 44 HB2 MET 44 3.436 1.392 -21.842
324 2HB MET 44 HB3 MET 44 2.797 0.976 -20.226
325 1HG MET 44 HG2 MET 44 4.713 0.111 -19.465
326 2HG MET 44 HG3 MET 44 5.528 -0.018 -20.998
327 1HE MET 44 HE1 MET 44 4.646 1.909 -17.836
328 2HE MET 44 HE2 MET 44 6.241 1.166 -17.932
329 3HE MET 44 HE3 MET 44 6.117 2.931 -17.795
330 H VAL 45 H VAL 45 1.377 -0.560 -19.697
331 HA VAL 45 HA VAL 45 -1.097 -0.291 -21.234
332 HB VAL 45 HB VAL 45 -2.117 -1.492 -19.281
333 1HG1 VAL 45 1HG1 VAL 45 -1.962 -2.552 -21.542
334 2HG1 VAL 45 2HG1 VAL 45 -0.370 -3.239 -21.092
335 3HG1 VAL 45 3HG1 VAL 45 -1.836 -3.753 -20.262
336 1HG2 VAL 45 1HG2 VAL 45 0.699 -2.489 -18.807
337 2HG2 VAL 45 2HG2 VAL 45 -0.342 -1.555 -17.722
338 3HG2 VAL 45 3HG2 VAL 45 -0.737 -3.259 -18.157
339 H LYS 46 H LYS 46 -2.673 0.694 -19.301
340 HA LYS 46 HA LYS 46 -1.184 2.509 -17.506
341 1HB LYS 46 HB2 LYS 46 -1.402 3.830 -19.499
342 2HB LYS 46 HB3 LYS 46 -3.083 3.383 -19.731
343 1HG LYS 46 HG2 LYS 46 -2.085 4.993 -17.323
344 2HG LYS 46 HG3 LYS 46 -2.498 5.743 -18.865
345 1HD LYS 46 HD2 LYS 46 -4.861 4.666 -18.598
346 2HD LYS 46 HD3 LYS 46 -4.375 4.333 -16.933
347 1HE LYS 46 HE2 LYS 46 -5.630 6.331 -16.907
348 2HE LYS 46 HE3 LYS 46 -3.971 6.706 -16.500
349 1HZ LYS 46 HZ1 LYS 46 -4.975 7.152 -19.271
350 2HZ LYS 46 HZ2 LYS 46 -5.070 8.248 -18.037
351 3HZ LYS 46 HZ3 LYS 46 -3.670 7.802 -18.463
352 H TRP 47 H TRP 47 -2.274 2.627 -15.642
353 HA TRP 47 HA TRP 47 -5.083 1.651 -15.559
354 1HB TRP 47 HB2 TRP 47 -2.986 1.096 -13.419
355 2HB TRP 47 HB3 TRP 47 -4.625 0.463 -13.501
356 HD1 TRP 47 HD1 TRP 47 -1.155 -0.272 -14.519
357 HE1 TRP 47 HE1 TRP 47 -0.995 -2.361 -16.002
358 HE3 TRP 47 HE3 TRP 47 -6.069 -0.732 -15.819
359 HZ2 TRP 47 HZ2 TRP 47 -2.713 -3.799 -17.847
360 HZ3 TRP 47 HZ3 TRP 47 -6.704 -2.305 -17.639
361 HH2 TRP 47 HH2 TRP 47 -5.056 -3.850 -18.601
362 H GLY 48 H GLY 48 -6.315 3.367 -14.804
363 1HA GLY 48 HA2 GLY 48 -4.897 5.339 -13.156
364 2HA GLY 48 HA3 GLY 48 -5.574 5.898 -14.724
365 H LEU 49 H LEU 49 -5.988 6.404 -11.871
366 HA LEU 49 HA LEU 49 -8.918 5.965 -11.614
367 1HB LEU 49 HB2 LEU 49 -6.718 5.480 -9.581
368 2HB LEU 49 HB3 LEU 49 -8.373 5.757 -9.108
369 HG LEU 49 HG LEU 49 -8.048 3.514 -9.039
370 1HD1 LEU 49 1HD1 LEU 49 -9.640 3.873 -11.592
371 2HD1 LEU 49 2HD1 LEU 49 -9.795 2.583 -10.374
372 3HD1 LEU 49 3HD1 LEU 49 -10.235 4.251 -9.961
373 1HD2 LEU 49 1HD2 LEU 49 -7.102 2.026 -10.543
374 2HD2 LEU 49 2HD2 LEU 49 -7.374 3.075 -11.939
375 3HD2 LEU 49 3HD2 LEU 49 -6.085 3.453 -10.773
376 H GLY 50 H GLY 50 -6.370 8.321 -11.725
377 1HA GLY 50 HA2 GLY 50 -8.244 10.394 -11.083
378 2HA GLY 50 HA3 GLY 50 -7.218 10.089 -9.695
379 H LEU 51 H LEU 51 -4.700 9.643 -11.085
380 HA LEU 51 HA LEU 51 -4.061 12.437 -11.466
381 1HB LEU 51 HB2 LEU 51 -2.846 10.666 -10.139
382 2HB LEU 51 HB3 LEU 51 -2.230 10.023 -11.668
383 HG LEU 51 HG LEU 51 -0.979 12.105 -12.059
384 1HD1 LEU 51 1HD1 LEU 51 -2.400 13.750 -10.823
385 2HD1 LEU 51 2HD1 LEU 51 -2.060 12.909 -9.302
386 3HD1 LEU 51 3HD1 LEU 51 -0.755 13.749 -10.176
387 1HD2 LEU 51 1HD2 LEU 51 -0.579 10.807 -9.313
388 2HD2 LEU 51 2HD2 LEU 51 0.036 10.191 -10.850
389 3HD2 LEU 51 3HD2 LEU 51 0.658 11.719 -10.191
390 H ASP 52 H ASP 52 -4.792 9.910 -13.731
391 HA ASP 52 HA ASP 52 -4.508 11.488 -16.080
392 1HB ASP 52 HB2 ASP 52 -2.256 11.165 -16.337
393 2HB ASP 52 HB3 ASP 52 -2.229 9.784 -15.250
Start of MODEL 6
1 1H GLY 1 H1 GLY 1 3.867 -3.769 -10.298
2 2H GLY 1 H2 GLY 1 4.157 -2.218 -9.897
3 3H GLY 1 H3 GLY 1 5.234 -3.393 -9.480
4 1HA GLY 1 HA2 GLY 1 3.479 -4.437 -8.110
5 2HA GLY 1 HA3 GLY 1 3.989 -2.840 -7.509
6 H GLN 2 H GLN 2 1.264 -4.315 -7.244
7 HA GLN 2 HA GLN 2 -0.389 -2.029 -7.977
8 1HB GLN 2 HB2 GLN 2 -1.971 -3.343 -9.246
9 2HB GLN 2 HB3 GLN 2 -0.400 -3.464 -10.033
10 1HG GLN 2 HG2 GLN 2 -1.634 -5.610 -8.246
11 2HG GLN 2 HG3 GLN 2 -1.625 -5.641 -10.001
12 1HE2 GLN 2 2HE2 GLN 2 0.590 -5.586 -11.088
13 2HE2 GLN 2 1HE2 GLN 2 1.919 -6.308 -10.254
14 H ASP 3 H ASP 3 -2.545 -2.335 -7.395
15 HA ASP 3 HA ASP 3 -3.546 -4.094 -5.339
16 1HB ASP 3 HB2 ASP 3 -2.621 -2.446 -3.823
17 2HB ASP 3 HB3 ASP 3 -3.076 -1.102 -4.893
18 H ARG 4 H ARG 4 -5.966 -3.303 -5.227
19 HA ARG 4 HA ARG 4 -6.965 -3.086 -7.904
20 1HB ARG 4 HB2 ARG 4 -9.216 -2.793 -6.815
21 2HB ARG 4 HB3 ARG 4 -8.346 -4.280 -6.449
22 1HG ARG 4 HG2 ARG 4 -9.488 -3.502 -4.505
23 2HG ARG 4 HG3 ARG 4 -7.750 -3.484 -4.244
24 1HD ARG 4 HD2 ARG 4 -7.653 -1.089 -4.379
25 2HD ARG 4 HD3 ARG 4 -9.300 -0.994 -5.035
26 HE ARG 4 HE ARG 4 -10.146 -0.987 -2.963
27 1HH1 ARG 4 1HH2 ARG 4 -6.722 -1.955 -2.692
28 2HH1 ARG 4 2HH2 ARG 4 -6.676 -1.944 -1.013
29 1HH2 ARG 4 1HH1 ARG 4 -10.145 -1.015 -0.693
30 2HH2 ARG 4 2HH1 ARG 4 -8.689 -1.338 0.195
31 H PHE 5 H PHE 5 -6.119 -0.534 -5.604
32 HA PHE 5 HA PHE 5 -6.659 1.332 -7.793
33 1HB PHE 5 HB2 PHE 5 -7.902 2.949 -6.526
34 2HB PHE 5 HB3 PHE 5 -8.746 1.433 -6.701
35 HD1 PHE 5 HD1 PHE 5 -6.215 1.518 -3.946
36 HD2 PHE 5 HD2 PHE 5 -10.301 2.404 -5.027
37 HE1 PHE 5 HE1 PHE 5 -6.808 1.634 -1.581
38 HE2 PHE 5 HE2 PHE 5 -10.899 2.452 -2.616
39 HZ PHE 5 HZ PHE 5 -9.133 2.107 -0.880
40 H VAL 6 H VAL 6 -4.398 0.175 -5.956
41 HA VAL 6 HA VAL 6 -2.926 2.721 -5.926
42 HB VAL 6 HB VAL 6 -3.410 0.802 -3.657
43 1HG1 VAL 6 1HG1 VAL 6 -1.309 1.320 -2.537
44 2HG1 VAL 6 2HG1 VAL 6 -1.030 0.385 -4.020
45 3HG1 VAL 6 3HG1 VAL 6 -0.708 2.142 -3.979
46 1HG2 VAL 6 1HG2 VAL 6 -2.588 3.734 -3.792
47 2HG2 VAL 6 2HG2 VAL 6 -4.270 3.164 -3.821
48 3HG2 VAL 6 3HG2 VAL 6 -3.264 2.859 -2.381
49 H TYR 7 H TYR 7 -0.698 2.377 -6.288
50 HA TYR 7 HA TYR 7 0.231 -0.101 -7.595
51 1HB TYR 7 HB2 TYR 7 -0.187 2.640 -8.845
52 2HB TYR 7 HB3 TYR 7 0.642 1.371 -9.669
53 HD1 TYR 7 HD1 TYR 7 -0.871 -0.892 -10.007
54 HD2 TYR 7 HD2 TYR 7 -2.490 2.889 -8.831
55 HE1 TYR 7 HE1 TYR 7 -3.128 -1.640 -10.758
56 HE2 TYR 7 HE2 TYR 7 -4.749 2.052 -9.226
57 HH TYR 7 HH TYR 7 -6.055 0.326 -10.178
58 H THR 8 H THR 8 2.521 0.864 -8.682
59 HA THR 8 HA THR 8 3.730 2.805 -6.772
60 HB THR 8 HB THR 8 5.842 1.258 -7.412
61 HG1 THR 8 HG1 THR 8 4.983 -0.358 -8.532
62 1HG2 THR 8 1HG2 THR 8 3.876 0.381 -5.279
63 2HG2 THR 8 2HG2 THR 8 5.642 0.082 -5.301
64 3HG2 THR 8 3HG2 THR 8 5.028 1.730 -5.118
65 H CYS 9 H CYS 9 5.749 3.728 -7.735
66 HA CYS 9 HA CYS 9 5.726 3.845 -10.729
67 1HB CYS 9 HB2 CYS 9 5.531 6.157 -9.843
68 2HB CYS 9 HB3 CYS 9 6.844 5.827 -8.703
69 H ASN 10 H ASN 10 7.317 2.193 -11.162
70 HA ASN 10 HA ASN 10 9.059 1.340 -9.080
71 1HB ASN 10 HB2 ASN 10 8.140 -0.135 -10.912
72 2HB ASN 10 HB3 ASN 10 9.302 0.627 -12.009
73 1HD2 ASN 10 2HD2 ASN 10 10.938 -0.946 -12.277
74 2HD2 ASN 10 1HD2 ASN 10 11.686 -1.816 -10.943
75 H GLU 11 H GLU 11 9.183 4.183 -10.744
76 HA GLU 11 HA GLU 11 12.101 4.188 -10.698
77 1HB GLU 11 HB2 GLU 11 10.206 5.662 -12.345
78 2HB GLU 11 HB3 GLU 11 11.358 6.702 -11.537
79 1HG GLU 11 HG2 GLU 11 12.184 4.192 -13.086
80 2HG GLU 11 HG3 GLU 11 12.272 5.833 -13.735
81 H CYS 12 H CYS 12 9.282 5.347 -8.984
82 HA CYS 12 HA CYS 12 11.021 7.051 -7.248
83 1HB CYS 12 HB2 CYS 12 8.022 6.601 -7.150
84 2HB CYS 12 HB3 CYS 12 8.956 7.825 -6.263
85 H LYS 13 H LYS 13 9.450 4.000 -7.475
86 HA LYS 13 HA LYS 13 8.958 2.260 -6.118
87 1HB LYS 13 HB2 LYS 13 11.741 2.889 -5.040
88 2HB LYS 13 HB3 LYS 13 10.746 1.530 -4.494
89 1HG LYS 13 HG2 LYS 13 11.539 0.300 -6.128
90 2HG LYS 13 HG3 LYS 13 10.559 1.222 -7.234
91 1HD LYS 13 HD2 LYS 13 13.525 1.462 -6.750
92 2HD LYS 13 HD3 LYS 13 12.615 1.115 -8.230
93 1HE LYS 13 HE2 LYS 13 11.680 3.488 -8.050
94 2HE LYS 13 HE3 LYS 13 12.889 3.817 -6.816
95 1HZ LYS 13 HZ1 LYS 13 14.573 3.231 -8.578
96 2HZ LYS 13 HZ2 LYS 13 13.326 3.058 -9.637
97 3HZ LYS 13 HZ3 LYS 13 13.608 4.487 -8.976
98 H HIS 14 H HIS 14 7.601 4.308 -5.783
99 HA HIS 14 HA HIS 14 6.801 4.218 -2.960
100 1HB HIS 14 HB2 HIS 14 8.038 6.311 -3.211
101 2HB HIS 14 HB3 HIS 14 7.127 6.727 -4.664
102 HD2 HIS 14 HD2 HIS 14 5.147 8.272 -4.309
103 HE1 HIS 14 HE1 HIS 14 3.892 7.054 -0.443
104 HE2 HIS 14 HE2 HIS 14 3.391 8.559 -2.434
105 H HIS 15 H HIS 15 4.537 4.846 -2.802
106 HA HIS 15 HA HIS 15 2.992 3.444 -4.796
107 1HB HIS 15 HB2 HIS 15 2.258 4.794 -2.177
108 2HB HIS 15 HB3 HIS 15 1.057 4.060 -3.234
109 HD2 HIS 15 HD2 HIS 15 1.413 1.420 -3.854
110 HE1 HIS 15 HE1 HIS 15 3.377 0.530 -0.172
111 HE2 HIS 15 HE2 HIS 15 2.172 -0.473 -2.203
112 H VAL 16 H VAL 16 1.282 4.166 -6.009
113 HA VAL 16 HA VAL 16 0.728 7.033 -6.340
114 HB VAL 16 HB VAL 16 1.158 6.961 -8.687
115 1HG1 VAL 16 1HG1 VAL 16 3.246 7.334 -7.414
116 2HG1 VAL 16 2HG1 VAL 16 3.555 5.584 -7.377
117 3HG1 VAL 16 3HG1 VAL 16 3.550 6.410 -8.922
118 1HG2 VAL 16 1HG2 VAL 16 1.794 3.980 -8.478
119 2HG2 VAL 16 2HG2 VAL 16 0.382 4.725 -9.260
120 3HG2 VAL 16 3HG2 VAL 16 1.995 4.982 -9.921
121 H GLU 17 H GLU 17 -1.417 7.228 -7.647
122 HA GLU 17 HA GLU 17 -3.159 4.898 -7.062
123 1HB GLU 17 HB2 GLU 17 -4.953 6.700 -7.596
124 2HB GLU 17 HB3 GLU 17 -4.179 6.642 -6.015
125 1HG GLU 17 HG2 GLU 17 -4.490 8.947 -6.870
126 2HG GLU 17 HG3 GLU 17 -2.804 8.554 -6.531
127 H THR 18 H THR 18 -1.705 6.716 -9.606
128 HA THR 18 HA THR 18 -3.017 4.998 -11.652
129 HB THR 18 HB THR 18 -2.486 7.998 -11.644
130 HG1 THR 18 HG1 THR 18 -4.295 7.810 -10.740
131 1HG2 THR 18 1HG2 THR 18 -3.051 6.095 -13.932
132 2HG2 THR 18 2HG2 THR 18 -3.893 7.652 -13.892
133 3HG2 THR 18 3HG2 THR 18 -2.088 7.549 -13.849
134 H ARG 19 H ARG 19 -1.509 4.116 -13.136
135 HA ARG 19 HA ARG 19 1.201 5.262 -13.209
136 1HB ARG 19 HB2 ARG 19 2.370 3.218 -12.729
137 2HB ARG 19 HB3 ARG 19 1.251 3.433 -11.400
138 1HG ARG 19 HG2 ARG 19 -0.327 1.867 -12.391
139 2HG ARG 19 HG3 ARG 19 0.707 1.649 -13.825
140 1HD ARG 19 HD2 ARG 19 2.259 0.341 -12.797
141 2HD ARG 19 HD3 ARG 19 1.777 0.780 -11.169
142 HE ARG 19 HE ARG 19 -0.492 -0.287 -11.895
143 1HH1 ARG 19 1HH2 ARG 19 2.714 -1.828 -12.110
144 2HH1 ARG 19 2HH2 ARG 19 2.122 -3.313 -12.671
145 1HH2 ARG 19 1HH1 ARG 19 -1.256 -2.332 -12.817
146 2HH2 ARG 19 2HH1 ARG 19 -0.067 -3.553 -13.142
147 H TRP 20 H TRP 20 2.533 4.102 -14.785
148 HA TRP 20 HA TRP 20 1.126 3.115 -17.203
149 1HB TRP 20 HB2 TRP 20 3.824 4.428 -16.810
150 2HB TRP 20 HB3 TRP 20 3.172 3.781 -18.333
151 HD1 TRP 20 HD1 TRP 20 2.627 6.626 -15.819
152 HE1 TRP 20 HE1 TRP 20 1.066 8.391 -16.796
153 HE3 TRP 20 HE3 TRP 20 1.601 4.427 -20.267
154 HZ2 TRP 20 HZ2 TRP 20 -0.503 8.796 -19.141
155 HZ3 TRP 20 HZ3 TRP 20 0.031 5.504 -21.898
156 HH2 TRP 20 HH2 TRP 20 -1.066 7.667 -21.323
157 H HIS 21 H HIS 21 1.818 0.904 -17.616
158 HA HIS 21 HA HIS 21 3.772 -0.251 -15.695
159 1HB HIS 21 HB2 HIS 21 1.822 -0.797 -14.651
160 2HB HIS 21 HB3 HIS 21 0.861 -0.838 -16.091
161 HD2 HIS 21 HD2 HIS 21 3.951 -3.180 -16.005
162 HE1 HIS 21 HE1 HIS 21 0.536 -5.620 -15.416
163 HE2 HIS 21 HE2 HIS 21 3.048 -5.594 -15.828
164 H CYS 22 H CYS 22 5.276 -1.249 -16.783
165 HA CYS 22 HA CYS 22 5.251 -1.809 -19.609
166 1HB CYS 22 HB2 CYS 22 7.061 -1.732 -17.277
167 2HB CYS 22 HB3 CYS 22 7.374 -3.122 -18.338
168 H THR 23 H THR 23 4.357 -3.458 -20.544
169 HA THR 23 HA THR 23 3.998 -5.992 -18.992
170 HB THR 23 HB THR 23 2.265 -6.600 -20.747
171 HG1 THR 23 HG1 THR 23 3.117 -4.309 -21.813
172 1HG2 THR 23 1HG2 THR 23 1.951 -4.072 -19.134
173 2HG2 THR 23 2HG2 THR 23 0.598 -5.152 -19.627
174 3HG2 THR 23 3HG2 THR 23 1.796 -5.695 -18.442
175 H VAL 24 H VAL 24 6.315 -4.920 -20.375
176 HA VAL 24 HA VAL 24 7.330 -7.064 -22.103
177 HB VAL 24 HB VAL 24 7.381 -4.825 -22.957
178 1HG1 VAL 24 1HG1 VAL 24 7.445 -3.818 -20.276
179 2HG1 VAL 24 2HG1 VAL 24 8.673 -3.092 -21.227
180 3HG1 VAL 24 3HG1 VAL 24 6.946 -3.087 -21.790
181 1HG2 VAL 24 1HG2 VAL 24 9.742 -4.240 -23.143
182 2HG2 VAL 24 2HG2 VAL 24 10.106 -5.072 -21.630
183 3HG2 VAL 24 3HG2 VAL 24 9.624 -6.015 -23.052
184 H CYS 25 H CYS 25 8.258 -4.875 -19.452
185 HA CYS 25 HA CYS 25 10.264 -6.564 -18.261
186 1HB CYS 25 HB2 CYS 25 8.744 -4.244 -17.021
187 2HB CYS 25 HB3 CYS 25 10.397 -4.744 -16.662
188 H GLU 26 H GLU 26 10.015 -6.988 -15.823
189 HA GLU 26 HA GLU 26 7.610 -8.590 -15.289
190 1HB GLU 26 HB2 GLU 26 10.332 -8.322 -14.055
191 2HB GLU 26 HB3 GLU 26 8.995 -8.670 -12.956
192 1HG GLU 26 HG2 GLU 26 8.273 -10.550 -14.280
193 2HG GLU 26 HG3 GLU 26 9.564 -10.275 -15.446
194 H ASP 27 H ASP 27 6.005 -6.989 -15.314
195 HA ASP 27 HA ASP 27 4.652 -5.393 -14.480
196 1HB ASP 27 HB2 ASP 27 4.283 -7.343 -13.029
197 2HB ASP 27 HB3 ASP 27 5.482 -6.738 -11.901
198 H TYR 28 H TYR 28 7.071 -4.275 -15.015
199 HA TYR 28 HA TYR 28 7.979 -2.495 -12.911
200 1HB TYR 28 HB2 TYR 28 9.380 -3.322 -14.806
201 2HB TYR 28 HB3 TYR 28 8.377 -2.447 -15.930
202 HD1 TYR 28 HD1 TYR 28 11.340 -2.261 -13.963
203 HD2 TYR 28 HD2 TYR 28 8.241 0.139 -15.761
204 HE1 TYR 28 HE1 TYR 28 12.795 -0.237 -13.801
205 HE2 TYR 28 HE2 TYR 28 9.712 2.121 -15.656
206 HH TYR 28 HH TYR 28 12.975 2.022 -14.208
207 H ASP 29 H ASP 29 7.456 -0.301 -12.675
208 HA ASP 29 HA ASP 29 4.943 0.613 -14.043
209 1HB ASP 29 HB2 ASP 29 5.573 1.597 -11.295
210 2HB ASP 29 HB3 ASP 29 4.050 1.316 -12.084
211 H LEU 30 H LEU 30 4.658 2.957 -14.048
212 HA LEU 30 HA LEU 30 6.801 4.628 -12.982
213 1HB LEU 30 HB2 LEU 30 5.878 4.690 -15.890
214 2HB LEU 30 HB3 LEU 30 6.661 6.008 -15.055
215 HG LEU 30 HG LEU 30 7.853 3.284 -15.705
216 1HD1 LEU 30 1HD1 LEU 30 7.687 4.927 -17.595
217 2HD1 LEU 30 2HD1 LEU 30 8.607 6.106 -16.628
218 3HD1 LEU 30 3HD1 LEU 30 9.369 4.604 -17.159
219 1HD2 LEU 30 1HD2 LEU 30 9.268 5.657 -14.361
220 2HD2 LEU 30 2HD2 LEU 30 8.818 4.184 -13.507
221 3HD2 LEU 30 3HD2 LEU 30 10.006 4.098 -14.798
222 H CYS 31 H CYS 31 5.873 6.482 -12.063
223 HA CYS 31 HA CYS 31 3.021 7.029 -12.317
224 1HB CYS 31 HB2 CYS 31 3.560 9.047 -11.121
225 2HB CYS 31 HB3 CYS 31 4.309 7.713 -10.265
226 H ILE 32 H ILE 32 2.324 9.192 -13.027
227 HA ILE 32 HA ILE 32 2.597 9.375 -15.763
228 HB ILE 32 HB ILE 32 1.857 11.608 -13.799
229 1HG1 ILE 32 2HG1 ILE 32 0.385 9.764 -13.212
230 2HG1 ILE 32 3HG1 ILE 32 -0.499 10.961 -14.118
231 1HG2 ILE 32 1HG2 ILE 32 1.275 11.201 -16.747
232 2HG2 ILE 32 2HG2 ILE 32 0.381 12.347 -15.741
233 3HG2 ILE 32 3HG2 ILE 32 2.139 12.535 -15.962
234 1HD1 ILE 32 1HD1 ILE 32 -1.281 9.008 -15.046
235 2HD1 ILE 32 2HD1 ILE 32 -0.069 9.478 -16.196
236 3HD1 ILE 32 3HD1 ILE 32 0.316 8.204 -14.988
237 H ASN 33 H ASN 33 4.347 11.202 -13.266
238 HA ASN 33 HA ASN 33 5.664 13.017 -15.072
239 1HB ASN 33 HB2 ASN 33 5.330 13.716 -12.797
240 2HB ASN 33 HB3 ASN 33 5.992 12.239 -12.131
241 1HD2 ASN 33 2HD2 ASN 33 8.274 12.016 -11.842
242 2HD2 ASN 33 1HD2 ASN 33 9.360 13.332 -12.201
243 H CYS 34 H CYS 34 6.714 9.958 -13.504
244 HA CYS 34 HA CYS 34 9.366 10.127 -14.654
245 1HB CYS 34 HB2 CYS 34 7.772 7.897 -13.340
246 2HB CYS 34 HB3 CYS 34 9.369 7.661 -14.088
247 H TYR 35 H TYR 35 6.338 8.475 -15.648
248 HA TYR 35 HA TYR 35 7.289 7.207 -17.978
249 1HB TYR 35 HB2 TYR 35 5.084 6.805 -17.141
250 2HB TYR 35 HB3 TYR 35 4.634 8.485 -17.308
251 HD1 TYR 35 HD1 TYR 35 5.791 5.577 -19.432
252 HD2 TYR 35 HD2 TYR 35 3.362 9.128 -19.188
253 HE1 TYR 35 HE1 TYR 35 4.813 5.070 -21.651
254 HE2 TYR 35 HE2 TYR 35 2.437 8.669 -21.408
255 HH TYR 35 HH TYR 35 2.283 7.141 -23.168
256 H ASN 36 H ASN 36 6.138 10.540 -17.527
257 HA ASN 36 HA ASN 36 6.430 11.559 -20.130
258 1HB ASN 36 HB2 ASN 36 6.046 12.618 -17.392
259 2HB ASN 36 HB3 ASN 36 6.813 13.749 -18.424
260 1HD2 ASN 36 2HD2 ASN 36 3.878 12.057 -17.830
261 2HD2 ASN 36 1HD2 ASN 36 2.905 12.881 -19.061
262 H THR 37 H THR 37 9.037 10.749 -17.968
263 HA THR 37 HA THR 37 10.841 12.529 -19.580
264 HB THR 37 HB THR 37 12.182 12.745 -17.470
265 HG1 THR 37 HG1 THR 37 9.844 12.094 -16.044
266 1HG2 THR 37 1HG2 THR 37 10.810 14.589 -18.210
267 2HG2 THR 37 2HG2 THR 37 9.395 13.950 -17.372
268 3HG2 THR 37 3HG2 THR 37 10.794 14.487 -16.436
269 H LYS 38 H LYS 38 10.731 9.592 -17.577
270 HA LYS 38 HA LYS 38 13.331 8.707 -18.262
271 1HB LYS 38 HB2 LYS 38 11.001 7.009 -17.357
272 2HB LYS 38 HB3 LYS 38 12.708 6.616 -17.147
273 1HG LYS 38 HG2 LYS 38 11.325 9.007 -15.807
274 2HG LYS 38 HG3 LYS 38 11.450 7.413 -15.082
275 1HD LYS 38 HD2 LYS 38 13.911 7.640 -14.979
276 2HD LYS 38 HD3 LYS 38 13.825 9.096 -15.957
277 1HE LYS 38 HE2 LYS 38 14.119 9.836 -13.701
278 2HE LYS 38 HE3 LYS 38 12.489 10.246 -14.202
279 1HZ LYS 38 HZ1 LYS 38 12.582 9.284 -11.951
280 2HZ LYS 38 HZ2 LYS 38 11.671 8.367 -12.935
281 3HZ LYS 38 HZ3 LYS 38 13.199 7.908 -12.554
282 H SER 39 H SER 39 10.638 8.849 -20.296
283 HA SER 39 HA SER 39 10.131 7.995 -22.301
284 1HB SER 39 HB2 SER 39 13.173 7.924 -22.517
285 2HB SER 39 HB3 SER 39 12.016 8.048 -23.862
286 HG SER 39 HG SER 39 12.449 9.929 -21.742
287 H HIS 40 H HIS 40 9.755 5.968 -20.588
288 HA HIS 40 HA HIS 40 11.097 3.531 -21.334
289 1HB HIS 40 HB2 HIS 40 9.242 4.363 -19.358
290 2HB HIS 40 HB3 HIS 40 8.380 3.181 -20.338
291 HD1 HIS 40 HD1 HIS 40 11.360 3.415 -17.897
292 HD2 HIS 40 HD2 HIS 40 9.372 0.708 -20.408
293 HE1 HIS 40 HE1 HIS 40 12.204 1.116 -17.242
294 H THR 41 H THR 41 11.053 2.916 -23.321
295 HA THR 41 HA THR 41 9.005 3.769 -25.167
296 HB THR 41 HB THR 41 11.225 2.132 -26.183
297 HG1 THR 41 HG1 THR 41 11.949 4.328 -24.550
298 1HG2 THR 41 1HG2 THR 41 10.610 5.104 -26.482
299 2HG2 THR 41 2HG2 THR 41 11.705 4.111 -27.497
300 3HG2 THR 41 3HG2 THR 41 9.958 3.813 -27.511
301 H HIS 42 H HIS 42 8.899 1.069 -23.213
302 HA HIS 42 HA HIS 42 8.543 -0.924 -25.276
303 1HB HIS 42 HB2 HIS 42 8.053 -1.090 -22.312
304 2HB HIS 42 HB3 HIS 42 8.366 -2.398 -23.455
305 HD2 HIS 42 HD2 HIS 42 11.052 -1.176 -24.840
306 HE1 HIS 42 HE1 HIS 42 12.622 -1.214 -20.878
307 HE2 HIS 42 HE2 HIS 42 13.213 -1.105 -23.358
308 H LYS 43 H LYS 43 6.608 -2.542 -24.894
309 HA LYS 43 HA LYS 43 4.190 -0.980 -25.246
310 1HB LYS 43 HB2 LYS 43 4.764 -3.079 -26.590
311 2HB LYS 43 HB3 LYS 43 4.367 -4.019 -25.165
312 1HG LYS 43 HG2 LYS 43 2.182 -2.213 -25.418
313 2HG LYS 43 HG3 LYS 43 2.610 -2.547 -27.067
314 1HD LYS 43 HD2 LYS 43 0.920 -4.120 -26.458
315 2HD LYS 43 HD3 LYS 43 2.411 -5.020 -26.544
316 1HE LYS 43 HE2 LYS 43 1.301 -5.728 -24.547
317 2HE LYS 43 HE3 LYS 43 2.657 -4.724 -24.021
318 1HZ LYS 43 HZ1 LYS 43 0.849 -4.110 -22.779
319 2HZ LYS 43 HZ2 LYS 43 0.998 -2.883 -23.802
320 3HZ LYS 43 HZ3 LYS 43 -0.202 -3.983 -24.030
321 H MET 44 H MET 44 3.840 -0.001 -23.302
322 HA MET 44 HA MET 44 3.430 -1.580 -20.842
323 1HB MET 44 HB2 MET 44 3.315 1.364 -21.717
324 2HB MET 44 HB3 MET 44 2.739 0.885 -20.123
325 1HG MET 44 HG2 MET 44 4.717 0.205 -19.354
326 2HG MET 44 HG3 MET 44 5.481 0.001 -20.923
327 1HE MET 44 HE1 MET 44 6.147 1.268 -17.946
328 2HE MET 44 HE2 MET 44 6.150 3.052 -17.825
329 3HE MET 44 HE3 MET 44 4.615 2.133 -17.809
330 H VAL 45 H VAL 45 1.394 -0.612 -19.657
331 HA VAL 45 HA VAL 45 -1.105 -0.407 -21.102
332 HB VAL 45 HB VAL 45 -2.076 -1.640 -19.198
333 1HG1 VAL 45 1HG1 VAL 45 -1.728 -2.696 -21.478
334 2HG1 VAL 45 2HG1 VAL 45 -0.223 -3.426 -20.848
335 3HG1 VAL 45 3HG1 VAL 45 -1.798 -3.870 -20.140
336 1HG2 VAL 45 1HG2 VAL 45 0.712 -2.579 -18.620
337 2HG2 VAL 45 2HG2 VAL 45 -0.360 -1.618 -17.609
338 3HG2 VAL 45 3HG2 VAL 45 -0.719 -3.349 -17.974
339 H LYS 46 H LYS 46 -2.612 0.647 -19.192
340 HA LYS 46 HA LYS 46 -1.053 2.264 -17.310
341 1HB LYS 46 HB2 LYS 46 -1.151 3.497 -19.535
342 2HB LYS 46 HB3 LYS 46 -2.887 3.534 -19.406
343 1HG LYS 46 HG2 LYS 46 -1.015 4.793 -17.336
344 2HG LYS 46 HG3 LYS 46 -1.628 5.616 -18.776
345 1HD LYS 46 HD2 LYS 46 -3.969 5.275 -17.936
346 2HD LYS 46 HD3 LYS 46 -3.275 4.672 -16.419
347 1HE LYS 46 HE2 LYS 46 -3.598 7.011 -16.065
348 2HE LYS 46 HE3 LYS 46 -1.855 6.803 -16.312
349 1HZ LYS 46 HZ1 LYS 46 -2.671 8.665 -17.568
350 2HZ LYS 46 HZ2 LYS 46 -2.301 7.537 -18.684
351 3HZ LYS 46 HZ3 LYS 46 -3.855 7.838 -18.211
352 H TRP 47 H TRP 47 -2.227 2.449 -15.510
353 HA TRP 47 HA TRP 47 -5.093 1.634 -15.572
354 1HB TRP 47 HB2 TRP 47 -3.101 0.912 -13.374
355 2HB TRP 47 HB3 TRP 47 -4.748 0.350 -13.558
356 HD1 TRP 47 HD1 TRP 47 -1.255 -0.476 -14.398
357 HE1 TRP 47 HE1 TRP 47 -1.051 -2.515 -15.899
358 HE3 TRP 47 HE3 TRP 47 -6.066 -0.650 -16.077
359 HZ2 TRP 47 HZ2 TRP 47 -2.753 -3.955 -17.781
360 HZ3 TRP 47 HZ3 TRP 47 -6.678 -2.243 -17.899
361 HH2 TRP 47 HH2 TRP 47 -5.051 -3.915 -18.706
362 H GLY 48 H GLY 48 -6.183 3.482 -14.922
363 1HA GLY 48 HA2 GLY 48 -4.803 5.276 -13.005
364 2HA GLY 48 HA3 GLY 48 -5.440 5.885 -14.556
365 H LEU 49 H LEU 49 -5.959 6.260 -11.630
366 HA LEU 49 HA LEU 49 -8.886 5.994 -11.704
367 1HB LEU 49 HB2 LEU 49 -7.066 4.903 -9.529
368 2HB LEU 49 HB3 LEU 49 -8.760 5.203 -9.216
369 HG LEU 49 HG LEU 49 -7.793 3.434 -11.512
370 1HD1 LEU 49 1HD1 LEU 49 -8.221 1.535 -10.161
371 2HD1 LEU 49 2HD1 LEU 49 -6.983 2.590 -9.442
372 3HD1 LEU 49 3HD1 LEU 49 -8.667 2.583 -8.778
373 1HD2 LEU 49 1HD2 LEU 49 -10.490 3.677 -10.119
374 2HD2 LEU 49 2HD2 LEU 49 -10.130 4.221 -11.775
375 3HD2 LEU 49 3HD2 LEU 49 -10.096 2.493 -11.401
376 H GLY 50 H GLY 50 -6.428 8.243 -11.452
377 1HA GLY 50 HA2 GLY 50 -8.318 10.113 -10.295
378 2HA GLY 50 HA3 GLY 50 -6.934 9.805 -9.239
379 H LEU 51 H LEU 51 -4.771 9.777 -10.964
380 HA LEU 51 HA LEU 51 -4.830 12.444 -12.315
381 1HB LEU 51 HB2 LEU 51 -2.625 11.074 -10.730
382 2HB LEU 51 HB3 LEU 51 -2.430 12.583 -11.622
383 HG LEU 51 HG LEU 51 -4.309 12.191 -9.253
384 1HD1 LEU 51 1HD1 LEU 51 -1.666 13.685 -9.365
385 2HD1 LEU 51 2HD1 LEU 51 -2.752 13.499 -7.956
386 3HD1 LEU 51 3HD1 LEU 51 -1.930 12.087 -8.648
387 1HD2 LEU 51 1HD2 LEU 51 -4.452 14.689 -9.247
388 2HD2 LEU 51 2HD2 LEU 51 -3.573 14.712 -10.794
389 3HD2 LEU 51 3HD2 LEU 51 -5.195 13.980 -10.678
390 H ASP 52 H ASP 52 -5.431 11.416 -14.250
391 HA ASP 52 HA ASP 52 -3.928 9.231 -15.361
392 1HB ASP 52 HB2 ASP 52 -6.434 10.079 -15.718
393 2HB ASP 52 HB3 ASP 52 -5.723 10.934 -17.071
Start of MODEL 7
1 1H GLY 1 H1 GLY 1 4.076 -3.709 -10.387
2 2H GLY 1 H2 GLY 1 4.330 -2.130 -10.024
3 3H GLY 1 H3 GLY 1 5.421 -3.264 -9.560
4 1HA GLY 1 HA2 GLY 1 3.705 -4.309 -8.151
5 2HA GLY 1 HA3 GLY 1 4.126 -2.649 -7.658
6 H GLN 2 H GLN 2 1.490 -4.393 -7.533
7 HA GLN 2 HA GLN 2 -0.259 -2.171 -8.369
8 1HB GLN 2 HB2 GLN 2 -1.718 -3.749 -9.654
9 2HB GLN 2 HB3 GLN 2 -0.084 -3.584 -10.289
10 1HG GLN 2 HG2 GLN 2 -0.319 -5.801 -10.525
11 2HG GLN 2 HG3 GLN 2 0.361 -5.812 -8.898
12 1HE2 GLN 2 2HE2 GLN 2 -1.300 -5.953 -7.043
13 2HE2 GLN 2 1HE2 GLN 2 -2.737 -6.905 -7.369
14 H ASP 3 H ASP 3 -2.385 -2.253 -7.628
15 HA ASP 3 HA ASP 3 -3.260 -4.029 -5.483
16 1HB ASP 3 HB2 ASP 3 -1.905 -2.053 -4.454
17 2HB ASP 3 HB3 ASP 3 -3.233 -1.030 -5.031
18 H ARG 4 H ARG 4 -5.570 -2.868 -4.878
19 HA ARG 4 HA ARG 4 -7.072 -3.252 -7.295
20 1HB ARG 4 HB2 ARG 4 -9.041 -2.883 -5.861
21 2HB ARG 4 HB3 ARG 4 -7.950 -4.108 -5.253
22 1HG ARG 4 HG2 ARG 4 -7.282 -1.468 -4.137
23 2HG ARG 4 HG3 ARG 4 -8.973 -1.843 -3.881
24 1HD ARG 4 HD2 ARG 4 -7.462 -2.430 -2.049
25 2HD ARG 4 HD3 ARG 4 -8.522 -3.774 -2.567
26 HE ARG 4 HE ARG 4 -5.606 -3.412 -2.887
27 1HH1 ARG 4 2HH1 ARG 4 -8.299 -5.698 -2.820
28 2HH1 ARG 4 1HH1 ARG 4 -7.290 -7.111 -2.874
29 1HH2 ARG 4 1HH2 ARG 4 -4.324 -5.125 -2.886
30 2HH2 ARG 4 2HH2 ARG 4 -4.853 -6.779 -2.826
31 H PHE 5 H PHE 5 -6.006 -0.316 -5.641
32 HA PHE 5 HA PHE 5 -6.741 1.201 -8.014
33 1HB PHE 5 HB2 PHE 5 -7.926 3.011 -6.689
34 2HB PHE 5 HB3 PHE 5 -8.813 1.520 -6.871
35 HD1 PHE 5 HD1 PHE 5 -6.813 3.562 -4.485
36 HD2 PHE 5 HD2 PHE 5 -9.541 0.266 -4.992
37 HE1 PHE 5 HE1 PHE 5 -7.142 3.466 -2.031
38 HE2 PHE 5 HE2 PHE 5 -9.938 0.211 -2.526
39 HZ PHE 5 HZ PHE 5 -8.697 1.764 -1.053
40 H VAL 6 H VAL 6 -4.337 0.287 -6.352
41 HA VAL 6 HA VAL 6 -2.950 2.868 -6.204
42 HB VAL 6 HB VAL 6 -3.518 0.874 -3.998
43 1HG1 VAL 6 1HG1 VAL 6 -0.943 2.451 -4.113
44 2HG1 VAL 6 2HG1 VAL 6 -1.572 1.537 -2.717
45 3HG1 VAL 6 3HG1 VAL 6 -1.117 0.660 -4.194
46 1HG2 VAL 6 1HG2 VAL 6 -4.606 3.108 -4.053
47 2HG2 VAL 6 2HG2 VAL 6 -3.589 2.870 -2.630
48 3HG2 VAL 6 3HG2 VAL 6 -3.012 3.879 -3.977
49 H TYR 7 H TYR 7 -0.701 2.531 -6.588
50 HA TYR 7 HA TYR 7 0.257 -0.069 -7.627
51 1HB TYR 7 HB2 TYR 7 -0.003 2.550 -9.168
52 2HB TYR 7 HB3 TYR 7 0.823 1.152 -9.749
53 HD1 TYR 7 HD1 TYR 7 -0.791 -1.048 -9.978
54 HD2 TYR 7 HD2 TYR 7 -2.250 2.949 -9.366
55 HE1 TYR 7 HE1 TYR 7 -3.123 -1.863 -10.192
56 HE2 TYR 7 HE2 TYR 7 -4.574 2.128 -9.508
57 HH TYR 7 HH TYR 7 -5.328 -1.316 -9.686
58 H THR 8 H THR 8 2.640 0.775 -8.734
59 HA THR 8 HA THR 8 3.802 2.762 -6.849
60 HB THR 8 HB THR 8 5.953 1.266 -7.497
61 HG1 THR 8 HG1 THR 8 5.048 -0.312 -8.624
62 1HG2 THR 8 1HG2 THR 8 5.566 1.684 -5.273
63 2HG2 THR 8 2HG2 THR 8 3.998 0.810 -5.265
64 3HG2 THR 8 3HG2 THR 8 5.562 -0.061 -5.381
65 H CYS 9 H CYS 9 5.823 3.640 -7.809
66 HA CYS 9 HA CYS 9 5.803 3.889 -10.796
67 1HB CYS 9 HB2 CYS 9 5.543 6.180 -9.803
68 2HB CYS 9 HB3 CYS 9 6.866 5.872 -8.699
69 H ASN 10 H ASN 10 7.405 2.319 -11.294
70 HA ASN 10 HA ASN 10 9.191 1.470 -9.262
71 1HB ASN 10 HB2 ASN 10 8.257 -0.058 -11.004
72 2HB ASN 10 HB3 ASN 10 9.426 0.639 -12.144
73 1HD2 ASN 10 2HD2 ASN 10 11.102 -0.830 -12.272
74 2HD2 ASN 10 1HD2 ASN 10 11.816 -1.657 -10.886
75 H GLU 11 H GLU 11 9.258 4.345 -10.668
76 HA GLU 11 HA GLU 11 12.170 4.357 -10.705
77 1HB GLU 11 HB2 GLU 11 10.279 5.909 -12.314
78 2HB GLU 11 HB3 GLU 11 11.512 6.883 -11.502
79 1HG GLU 11 HG2 GLU 11 12.220 4.370 -13.093
80 2HG GLU 11 HG3 GLU 11 12.291 5.996 -13.752
81 H CYS 12 H CYS 12 9.262 5.564 -9.126
82 HA CYS 12 HA CYS 12 10.945 7.170 -7.291
83 1HB CYS 12 HB2 CYS 12 7.958 6.630 -7.140
84 2HB CYS 12 HB3 CYS 12 8.884 7.830 -6.249
85 H LYS 13 H LYS 13 9.554 4.021 -7.554
86 HA LYS 13 HA LYS 13 9.241 2.189 -6.167
87 1HB LYS 13 HB2 LYS 13 11.824 3.379 -5.033
88 2HB LYS 13 HB3 LYS 13 11.051 2.031 -4.241
89 1HG LYS 13 HG2 LYS 13 12.889 1.311 -5.549
90 2HG LYS 13 HG3 LYS 13 11.377 0.543 -6.001
91 1HD LYS 13 HD2 LYS 13 12.984 1.062 -7.879
92 2HD LYS 13 HD3 LYS 13 11.330 1.609 -8.079
93 1HE LYS 13 HE2 LYS 13 11.812 3.769 -8.051
94 2HE LYS 13 HE3 LYS 13 13.159 3.654 -6.903
95 1HZ LYS 13 HZ1 LYS 13 13.241 2.957 -9.773
96 2HZ LYS 13 HZ2 LYS 13 13.750 4.339 -9.164
97 3HZ LYS 13 HZ3 LYS 13 14.572 2.973 -8.777
98 H HIS 14 H HIS 14 7.689 4.374 -5.941
99 HA HIS 14 HA HIS 14 6.866 4.362 -3.093
100 1HB HIS 14 HB2 HIS 14 8.055 6.454 -3.499
101 2HB HIS 14 HB3 HIS 14 7.124 6.719 -4.989
102 HD2 HIS 14 HD2 HIS 14 5.418 8.548 -4.640
103 HE1 HIS 14 HE1 HIS 14 3.839 7.396 -0.871
104 HE2 HIS 14 HE2 HIS 14 3.569 8.970 -2.860
105 H HIS 15 H HIS 15 4.623 4.898 -2.911
106 HA HIS 15 HA HIS 15 3.001 3.415 -4.784
107 1HB HIS 15 HB2 HIS 15 2.608 4.623 -2.042
108 2HB HIS 15 HB3 HIS 15 1.190 4.291 -3.026
109 HD2 HIS 15 HD2 HIS 15 1.101 1.649 -4.073
110 HE1 HIS 15 HE1 HIS 15 2.563 0.080 -0.421
111 HE2 HIS 15 HE2 HIS 15 1.235 -0.445 -2.528
112 H VAL 16 H VAL 16 1.300 4.136 -5.954
113 HA VAL 16 HA VAL 16 0.730 6.984 -6.293
114 HB VAL 16 HB VAL 16 1.168 6.931 -8.669
115 1HG1 VAL 16 1HG1 VAL 16 3.519 5.463 -7.431
116 2HG1 VAL 16 2HG1 VAL 16 3.510 6.328 -8.948
117 3HG1 VAL 16 3HG1 VAL 16 3.278 7.239 -7.445
118 1HG2 VAL 16 1HG2 VAL 16 1.927 4.943 -9.924
119 2HG2 VAL 16 2HG2 VAL 16 1.722 3.927 -8.490
120 3HG2 VAL 16 3HG2 VAL 16 0.328 4.698 -9.253
121 H GLU 17 H GLU 17 -1.348 7.068 -7.860
122 HA GLU 17 HA GLU 17 -3.130 4.790 -7.145
123 1HB GLU 17 HB2 GLU 17 -4.910 6.570 -7.504
124 2HB GLU 17 HB3 GLU 17 -4.017 6.529 -5.985
125 1HG GLU 17 HG2 GLU 17 -4.318 8.904 -6.786
126 2HG GLU 17 HG3 GLU 17 -2.627 8.458 -6.668
127 H THR 18 H THR 18 -1.712 6.648 -9.703
128 HA THR 18 HA THR 18 -3.040 4.955 -11.737
129 HB THR 18 HB THR 18 -2.489 7.975 -11.799
130 HG1 THR 18 HG1 THR 18 -4.304 7.711 -10.740
131 1HG2 THR 18 1HG2 THR 18 -4.168 7.463 -13.919
132 2HG2 THR 18 2HG2 THR 18 -2.425 7.702 -14.064
133 3HG2 THR 18 3HG2 THR 18 -3.086 6.080 -14.036
134 H ARG 19 H ARG 19 -1.539 4.149 -13.266
135 HA ARG 19 HA ARG 19 1.199 5.274 -13.287
136 1HB ARG 19 HB2 ARG 19 2.369 3.264 -12.782
137 2HB ARG 19 HB3 ARG 19 1.164 3.365 -11.489
138 1HG ARG 19 HG2 ARG 19 -0.261 1.773 -12.600
139 2HG ARG 19 HG3 ARG 19 0.820 1.651 -13.984
140 1HD ARG 19 HD2 ARG 19 2.346 0.325 -12.943
141 2HD ARG 19 HD3 ARG 19 1.959 0.841 -11.338
142 HE ARG 19 HE ARG 19 -0.375 -0.264 -11.982
143 1HH1 ARG 19 1HH2 ARG 19 2.817 -1.737 -12.172
144 2HH1 ARG 19 2HH2 ARG 19 2.262 -3.260 -12.710
145 1HH2 ARG 19 2HH1 ARG 19 -1.135 -2.402 -12.857
146 2HH2 ARG 19 1HH1 ARG 19 0.093 -3.572 -13.171
147 H TRP 20 H TRP 20 2.532 4.204 -14.874
148 HA TRP 20 HA TRP 20 1.165 3.162 -17.293
149 1HB TRP 20 HB2 TRP 20 3.879 4.458 -16.858
150 2HB TRP 20 HB3 TRP 20 3.265 3.873 -18.388
151 HD1 TRP 20 HD1 TRP 20 2.655 6.701 -15.890
152 HE1 TRP 20 HE1 TRP 20 1.167 8.478 -16.902
153 HE3 TRP 20 HE3 TRP 20 1.637 4.465 -20.346
154 HZ2 TRP 20 HZ2 TRP 20 -0.470 8.830 -19.207
155 HZ3 TRP 20 HZ3 TRP 20 0.053 5.546 -21.951
156 HH2 TRP 20 HH2 TRP 20 -0.972 7.757 -21.429
157 H HIS 21 H HIS 21 1.864 0.971 -17.723
158 HA HIS 21 HA HIS 21 3.746 -0.215 -15.739
159 1HB HIS 21 HB2 HIS 21 1.781 -0.749 -14.720
160 2HB HIS 21 HB3 HIS 21 0.847 -0.774 -16.178
161 HD2 HIS 21 HD2 HIS 21 3.922 -3.108 -15.980
162 HE1 HIS 21 HE1 HIS 21 0.523 -5.597 -15.519
163 HE2 HIS 21 HE2 HIS 21 3.035 -5.533 -15.836
164 H CYS 22 H CYS 22 5.288 -1.259 -16.808
165 HA CYS 22 HA CYS 22 5.230 -1.907 -19.613
166 1HB CYS 22 HB2 CYS 22 7.039 -1.872 -17.268
167 2HB CYS 22 HB3 CYS 22 7.364 -3.189 -18.378
168 H THR 23 H THR 23 4.398 -3.567 -20.528
169 HA THR 23 HA THR 23 3.959 -6.060 -18.966
170 HB THR 23 HB THR 23 2.224 -6.713 -20.652
171 HG1 THR 23 HG1 THR 23 3.115 -4.455 -21.824
172 1HG2 THR 23 1HG2 THR 23 1.942 -4.046 -19.266
173 2HG2 THR 23 2HG2 THR 23 0.593 -5.139 -19.672
174 3HG2 THR 23 3HG2 THR 23 1.767 -5.619 -18.444
175 H VAL 24 H VAL 24 6.282 -4.981 -20.372
176 HA VAL 24 HA VAL 24 7.341 -7.117 -22.062
177 HB VAL 24 HB VAL 24 7.418 -4.888 -22.928
178 1HG1 VAL 24 1HG1 VAL 24 6.984 -3.150 -21.836
179 2HG1 VAL 24 2HG1 VAL 24 7.348 -3.822 -20.287
180 3HG1 VAL 24 3HG1 VAL 24 8.676 -3.159 -21.178
181 1HG2 VAL 24 1HG2 VAL 24 9.627 -6.051 -23.009
182 2HG2 VAL 24 2HG2 VAL 24 9.774 -4.273 -23.017
183 3HG2 VAL 24 3HG2 VAL 24 10.112 -5.167 -21.533
184 H CYS 25 H CYS 25 8.217 -4.905 -19.419
185 HA CYS 25 HA CYS 25 10.189 -6.559 -18.169
186 1HB CYS 25 HB2 CYS 25 8.695 -4.208 -16.994
187 2HB CYS 25 HB3 CYS 25 10.331 -4.753 -16.590
188 H GLU 26 H GLU 26 9.899 -7.063 -15.740
189 HA GLU 26 HA GLU 26 7.417 -8.483 -15.255
190 1HB GLU 26 HB2 GLU 26 10.129 -8.304 -13.944
191 2HB GLU 26 HB3 GLU 26 8.761 -8.754 -12.927
192 1HG GLU 26 HG2 GLU 26 8.122 -10.574 -14.425
193 2HG GLU 26 HG3 GLU 26 9.488 -10.215 -15.485
194 H ASP 27 H ASP 27 5.878 -6.963 -15.158
195 HA ASP 27 HA ASP 27 4.591 -5.256 -14.356
196 1HB ASP 27 HB2 ASP 27 4.257 -7.269 -12.867
197 2HB ASP 27 HB3 ASP 27 5.380 -6.558 -11.722
198 H TYR 28 H TYR 28 7.103 -4.301 -14.887
199 HA TYR 28 HA TYR 28 7.988 -2.417 -12.878
200 1HB TYR 28 HB2 TYR 28 9.369 -3.305 -14.760
201 2HB TYR 28 HB3 TYR 28 8.391 -2.411 -15.898
202 HD1 TYR 28 HD1 TYR 28 11.375 -2.312 -14.008
203 HD2 TYR 28 HD2 TYR 28 8.296 0.189 -15.678
204 HE1 TYR 28 HE1 TYR 28 12.898 -0.368 -13.847
205 HE2 TYR 28 HE2 TYR 28 9.812 2.123 -15.559
206 HH TYR 28 HH TYR 28 13.108 1.944 -14.194
207 H ASP 29 H ASP 29 7.504 -0.205 -12.742
208 HA ASP 29 HA ASP 29 5.014 0.677 -14.141
209 1HB ASP 29 HB2 ASP 29 5.611 1.718 -11.401
210 2HB ASP 29 HB3 ASP 29 4.074 1.383 -12.177
211 H LEU 30 H LEU 30 4.699 3.006 -14.095
212 HA LEU 30 HA LEU 30 6.822 4.689 -13.023
213 1HB LEU 30 HB2 LEU 30 5.928 4.667 -15.944
214 2HB LEU 30 HB3 LEU 30 6.686 6.038 -15.145
215 HG LEU 30 HG LEU 30 7.934 3.290 -15.620
216 1HD1 LEU 30 1HD1 LEU 30 7.833 4.774 -17.576
217 2HD1 LEU 30 2HD1 LEU 30 8.773 6.013 -16.703
218 3HD1 LEU 30 3HD1 LEU 30 9.501 4.443 -17.066
219 1HD2 LEU 30 1HD2 LEU 30 9.343 5.728 -14.413
220 2HD2 LEU 30 2HD2 LEU 30 8.846 4.319 -13.460
221 3HD2 LEU 30 3HD2 LEU 30 10.064 4.138 -14.723
222 H CYS 31 H CYS 31 5.900 6.478 -12.077
223 HA CYS 31 HA CYS 31 3.051 6.962 -12.301
224 1HB CYS 31 HB2 CYS 31 3.550 9.025 -11.119
225 2HB CYS 31 HB3 CYS 31 4.292 7.677 -10.268
226 H ILE 32 H ILE 32 2.295 9.144 -13.074
227 HA ILE 32 HA ILE 32 2.678 9.296 -15.783
228 HB ILE 32 HB ILE 32 1.812 11.625 -14.012
229 1HG1 ILE 32 2HG1 ILE 32 0.399 9.748 -13.398
230 2HG1 ILE 32 3HG1 ILE 32 -0.483 10.958 -14.299
231 1HG2 ILE 32 1HG2 ILE 32 2.229 12.398 -16.225
232 2HG2 ILE 32 2HG2 ILE 32 1.546 10.945 -16.957
233 3HG2 ILE 32 3HG2 ILE 32 0.471 12.127 -16.161
234 1HD1 ILE 32 1HD1 ILE 32 -1.312 8.998 -15.192
235 2HD1 ILE 32 2HD1 ILE 32 -0.155 9.486 -16.382
236 3HD1 ILE 32 3HD1 ILE 32 0.275 8.200 -15.202
237 H ASN 33 H ASN 33 4.306 11.219 -13.276
238 HA ASN 33 HA ASN 33 5.678 13.001 -15.081
239 1HB ASN 33 HB2 ASN 33 5.386 13.699 -12.785
240 2HB ASN 33 HB3 ASN 33 6.086 12.202 -12.152
241 1HD2 ASN 33 2HD2 ASN 33 8.488 11.909 -12.226
242 2HD2 ASN 33 1HD2 ASN 33 9.481 13.312 -12.560
243 H CYS 34 H CYS 34 6.740 9.989 -13.441
244 HA CYS 34 HA CYS 34 9.360 10.145 -14.588
245 1HB CYS 34 HB2 CYS 34 7.800 7.949 -13.202
246 2HB CYS 34 HB3 CYS 34 9.389 7.684 -13.960
247 H TYR 35 H TYR 35 6.329 8.500 -15.600
248 HA TYR 35 HA TYR 35 7.432 7.213 -17.874
249 1HB TYR 35 HB2 TYR 35 5.130 6.824 -17.104
250 2HB TYR 35 HB3 TYR 35 4.680 8.463 -17.555
251 HD1 TYR 35 HD1 TYR 35 6.470 5.541 -19.127
252 HD2 TYR 35 HD2 TYR 35 3.476 8.606 -19.597
253 HE1 TYR 35 HE1 TYR 35 6.077 4.789 -21.434
254 HE2 TYR 35 HE2 TYR 35 3.038 7.820 -21.917
255 HH TYR 35 HH TYR 35 4.893 5.069 -23.334
256 H ASN 36 H ASN 36 6.202 10.520 -17.468
257 HA ASN 36 HA ASN 36 6.695 11.512 -20.061
258 1HB ASN 36 HB2 ASN 36 6.033 12.654 -17.360
259 2HB ASN 36 HB3 ASN 36 6.749 13.766 -18.473
260 1HD2 ASN 36 2HD2 ASN 36 3.993 11.640 -18.002
261 2HD2 ASN 36 1HD2 ASN 36 2.965 12.434 -19.228
262 H THR 37 H THR 37 9.071 10.838 -17.580
263 HA THR 37 HA THR 37 11.012 12.583 -19.018
264 HB THR 37 HB THR 37 12.064 13.060 -16.803
265 HG1 THR 37 HG1 THR 37 9.650 12.191 -15.652
266 1HG2 THR 37 1HG2 THR 37 9.182 13.992 -17.017
267 2HG2 THR 37 2HG2 THR 37 10.460 14.761 -16.056
268 3HG2 THR 37 3HG2 THR 37 10.586 14.750 -17.809
269 H LYS 38 H LYS 38 10.366 9.385 -18.360
270 HA LYS 38 HA LYS 38 13.279 8.681 -18.349
271 1HB LYS 38 HB2 LYS 38 10.989 7.028 -17.214
272 2HB LYS 38 HB3 LYS 38 12.686 6.695 -17.081
273 1HG LYS 38 HG2 LYS 38 11.395 9.160 -15.812
274 2HG LYS 38 HG3 LYS 38 11.515 7.607 -15.035
275 1HD LYS 38 HD2 LYS 38 13.982 7.793 -15.002
276 2HD LYS 38 HD3 LYS 38 13.897 9.229 -16.032
277 1HE LYS 38 HE2 LYS 38 14.216 9.988 -13.750
278 2HE LYS 38 HE3 LYS 38 12.585 10.435 -14.290
279 1HZ LYS 38 HZ1 LYS 38 12.592 9.537 -12.056
280 2HZ LYS 38 HZ2 LYS 38 11.718 8.587 -13.013
281 3HZ LYS 38 HZ3 LYS 38 13.245 8.129 -12.583
282 H SER 39 H SER 39 10.960 9.042 -20.468
283 HA SER 39 HA SER 39 10.130 7.982 -22.296
284 1HB SER 39 HB2 SER 39 13.142 7.870 -22.636
285 2HB SER 39 HB3 SER 39 11.931 7.973 -23.946
286 HG SER 39 HG SER 39 12.833 10.002 -23.360
287 H HIS 40 H HIS 40 9.767 5.961 -20.523
288 HA HIS 40 HA HIS 40 11.042 3.512 -21.327
289 1HB HIS 40 HB2 HIS 40 9.316 4.364 -19.283
290 2HB HIS 40 HB3 HIS 40 8.369 3.204 -20.211
291 HD1 HIS 40 HD1 HIS 40 11.457 3.356 -17.927
292 HD2 HIS 40 HD2 HIS 40 9.315 0.709 -20.369
293 HE1 HIS 40 HE1 HIS 40 12.271 1.037 -17.309
294 H THR 41 H THR 41 10.922 2.937 -23.366
295 HA THR 41 HA THR 41 8.744 3.818 -25.035
296 HB THR 41 HB THR 41 10.901 2.162 -26.209
297 HG1 THR 41 HG1 THR 41 11.651 4.391 -24.650
298 1HG2 THR 41 1HG2 THR 41 9.470 3.666 -27.558
299 2HG2 THR 41 2HG2 THR 41 10.108 5.071 -26.695
300 3HG2 THR 41 3HG2 THR 41 11.187 4.084 -27.701
301 H HIS 42 H HIS 42 8.955 1.004 -23.187
302 HA HIS 42 HA HIS 42 8.482 -0.908 -25.274
303 1HB HIS 42 HB2 HIS 42 8.009 -1.160 -22.306
304 2HB HIS 42 HB3 HIS 42 8.347 -2.453 -23.493
305 HD2 HIS 42 HD2 HIS 42 11.017 -1.178 -24.818
306 HE1 HIS 42 HE1 HIS 42 12.514 -1.184 -20.813
307 HE2 HIS 42 HE2 HIS 42 13.160 -1.054 -23.290
308 H LYS 43 H LYS 43 6.612 -2.513 -24.981
309 HA LYS 43 HA LYS 43 4.133 -1.039 -25.297
310 1HB LYS 43 HB2 LYS 43 4.767 -3.111 -26.662
311 2HB LYS 43 HB3 LYS 43 4.407 -4.074 -25.217
312 1HG LYS 43 HG2 LYS 43 2.186 -2.324 -25.480
313 2HG LYS 43 HG3 LYS 43 2.612 -2.709 -27.150
314 1HD LYS 43 HD2 LYS 43 0.955 -4.254 -26.522
315 2HD LYS 43 HD3 LYS 43 2.462 -5.142 -26.579
316 1HE LYS 43 HE2 LYS 43 1.306 -5.851 -24.563
317 2HE LYS 43 HE3 LYS 43 2.679 -4.860 -24.054
318 1HZ LYS 43 HZ1 LYS 43 -0.179 -4.078 -24.098
319 2HZ LYS 43 HZ2 LYS 43 0.866 -4.250 -22.827
320 3HZ LYS 43 HZ3 LYS 43 1.056 -3.011 -23.818
321 H MET 44 H MET 44 3.814 -0.098 -23.338
322 HA MET 44 HA MET 44 3.416 -1.625 -20.862
323 1HB MET 44 HB2 MET 44 3.328 1.284 -21.798
324 2HB MET 44 HB3 MET 44 2.729 0.866 -20.187
325 1HG MET 44 HG2 MET 44 4.686 0.154 -19.414
326 2HG MET 44 HG3 MET 44 5.439 -0.119 -20.990
327 1HE MET 44 HE1 MET 44 6.187 2.997 -17.990
328 2HE MET 44 HE2 MET 44 4.651 2.092 -17.951
329 3HE MET 44 HE3 MET 44 6.184 1.219 -18.041
330 H VAL 45 H VAL 45 1.353 -0.596 -19.718
331 HA VAL 45 HA VAL 45 -1.123 -0.428 -21.198
332 HB VAL 45 HB VAL 45 -2.106 -1.670 -19.279
333 1HG1 VAL 45 1HG1 VAL 45 -1.838 -3.876 -20.209
334 2HG1 VAL 45 2HG1 VAL 45 -1.790 -2.732 -21.533
335 3HG1 VAL 45 3HG1 VAL 45 -0.257 -3.447 -20.932
336 1HG2 VAL 45 1HG2 VAL 45 -0.718 -3.330 -18.041
337 2HG2 VAL 45 2HG2 VAL 45 0.722 -2.582 -18.695
338 3HG2 VAL 45 3HG2 VAL 45 -0.367 -1.621 -17.680
339 H LYS 46 H LYS 46 -2.631 0.566 -19.169
340 HA LYS 46 HA LYS 46 -1.050 2.242 -17.376
341 1HB LYS 46 HB2 LYS 46 -1.254 3.461 -19.592
342 2HB LYS 46 HB3 LYS 46 -2.994 3.470 -19.398
343 1HG LYS 46 HG2 LYS 46 -1.100 4.774 -17.376
344 2HG LYS 46 HG3 LYS 46 -1.638 5.562 -18.849
345 1HD LYS 46 HD2 LYS 46 -4.042 5.293 -18.012
346 2HD LYS 46 HD3 LYS 46 -3.374 4.684 -16.512
347 1HE LYS 46 HE2 LYS 46 -3.750 7.015 -16.221
348 2HE LYS 46 HE3 LYS 46 -1.994 6.825 -16.346
349 1HZ LYS 46 HZ1 LYS 46 -2.880 8.682 -17.637
350 2HZ LYS 46 HZ2 LYS 46 -2.244 7.582 -18.697
351 3HZ LYS 46 HZ3 LYS 46 -3.876 7.746 -18.435
352 H TRP 47 H TRP 47 -2.221 2.433 -15.539
353 HA TRP 47 HA TRP 47 -5.072 1.573 -15.585
354 1HB TRP 47 HB2 TRP 47 -3.048 0.915 -13.416
355 2HB TRP 47 HB3 TRP 47 -4.699 0.306 -13.550
356 HD1 TRP 47 HD1 TRP 47 -1.223 -0.550 -14.427
357 HE1 TRP 47 HE1 TRP 47 -1.077 -2.572 -15.969
358 HE3 TRP 47 HE3 TRP 47 -6.071 -0.671 -16.049
359 HZ2 TRP 47 HZ2 TRP 47 -2.771 -3.919 -17.873
360 HZ3 TRP 47 HZ3 TRP 47 -6.696 -2.230 -17.884
361 HH2 TRP 47 HH2 TRP 47 -5.095 -3.885 -18.739
362 H GLY 48 H GLY 48 -6.278 3.250 -14.722
363 1HA GLY 48 HA2 GLY 48 -4.884 5.237 -13.071
364 2HA GLY 48 HA3 GLY 48 -5.635 5.756 -14.622
365 H LEU 49 H LEU 49 -5.999 6.139 -11.660
366 HA LEU 49 HA LEU 49 -8.822 5.340 -11.392
367 1HB LEU 49 HB2 LEU 49 -6.525 5.357 -9.457
368 2HB LEU 49 HB3 LEU 49 -8.144 5.514 -8.853
369 HG LEU 49 HG LEU 49 -7.271 3.272 -8.763
370 1HD1 LEU 49 1HD1 LEU 49 -9.694 3.712 -8.676
371 2HD1 LEU 49 2HD1 LEU 49 -9.801 3.490 -10.456
372 3HD1 LEU 49 3HD1 LEU 49 -9.321 2.143 -9.403
373 1HD2 LEU 49 1HD2 LEU 49 -7.129 1.729 -10.503
374 2HD2 LEU 49 2HD2 LEU 49 -7.736 2.864 -11.723
375 3HD2 LEU 49 3HD2 LEU 49 -6.133 3.109 -10.985
376 H GLY 50 H GLY 50 -6.436 8.025 -10.878
377 1HA GLY 50 HA2 GLY 50 -8.684 9.893 -10.881
378 2HA GLY 50 HA3 GLY 50 -7.825 9.746 -9.337
379 H LEU 51 H LEU 51 -5.573 9.310 -11.871
380 HA LEU 51 HA LEU 51 -5.000 12.167 -12.286
381 1HB LEU 51 HB2 LEU 51 -3.919 11.397 -10.121
382 2HB LEU 51 HB3 LEU 51 -3.068 10.161 -11.036
383 HG LEU 51 HG LEU 51 -1.624 11.741 -12.082
384 1HD1 LEU 51 1HD1 LEU 51 -1.833 14.196 -11.730
385 2HD1 LEU 51 2HD1 LEU 51 -3.138 13.516 -12.701
386 3HD1 LEU 51 3HD1 LEU 51 -3.424 13.945 -10.990
387 1HD2 LEU 51 1HD2 LEU 51 -2.102 12.558 -9.180
388 2HD2 LEU 51 2HD2 LEU 51 -1.200 11.145 -9.720
389 3HD2 LEU 51 3HD2 LEU 51 -0.583 12.761 -10.093
390 H ASP 52 H ASP 52 -6.068 10.712 -14.183
391 HA ASP 52 HA ASP 52 -4.266 8.933 -15.523
392 1HB ASP 52 HB2 ASP 52 -6.879 9.044 -15.592
393 2HB ASP 52 HB3 ASP 52 -6.633 10.159 -16.930
Start of MODEL 8
1 1H GLY 1 H1 GLY 1 5.351 -3.222 -9.582
2 2H GLY 1 H2 GLY 1 3.957 -3.596 -10.333
3 3H GLY 1 H3 GLY 1 4.245 -2.043 -9.909
4 1HA GLY 1 HA2 GLY 1 3.706 -4.320 -8.139
5 2HA GLY 1 HA3 GLY 1 4.173 -2.689 -7.561
6 H GLN 2 H GLN 2 1.508 -4.468 -7.464
7 HA GLN 2 HA GLN 2 -0.290 -2.260 -8.271
8 1HB GLN 2 HB2 GLN 2 -0.923 -5.207 -8.760
9 2HB GLN 2 HB3 GLN 2 -1.800 -3.788 -9.335
10 1HG GLN 2 HG2 GLN 2 0.464 -3.256 -10.599
11 2HG GLN 2 HG3 GLN 2 0.763 -4.988 -10.383
12 1HE2 GLN 2 2HE2 GLN 2 0.750 -5.222 -12.701
13 2HE2 GLN 2 1HE2 GLN 2 -0.784 -5.268 -13.570
14 H ASP 3 H ASP 3 -2.446 -2.518 -7.561
15 HA ASP 3 HA ASP 3 -3.339 -4.011 -5.263
16 1HB ASP 3 HB2 ASP 3 -1.955 -1.813 -4.476
17 2HB ASP 3 HB3 ASP 3 -3.447 -1.005 -4.980
18 H ARG 4 H ARG 4 -5.708 -3.180 -4.968
19 HA ARG 4 HA ARG 4 -7.036 -3.461 -7.376
20 1HB ARG 4 HB2 ARG 4 -9.069 -2.438 -5.985
21 2HB ARG 4 HB3 ARG 4 -8.388 -4.027 -5.705
22 1HG ARG 4 HG2 ARG 4 -8.900 -2.879 -3.619
23 2HG ARG 4 HG3 ARG 4 -7.211 -3.282 -3.713
24 1HD ARG 4 HD2 ARG 4 -7.449 -0.617 -4.750
25 2HD ARG 4 HD3 ARG 4 -8.570 -0.699 -3.368
26 HE ARG 4 HE ARG 4 -5.970 -1.781 -2.778
27 1HH1 ARG 4 1HH2 ARG 4 -7.578 1.347 -3.240
28 2HH1 ARG 4 2HH2 ARG 4 -6.390 2.210 -2.330
29 1HH2 ARG 4 1HH1 ARG 4 -4.374 -0.579 -1.726
30 2HH2 ARG 4 2HH1 ARG 4 -4.580 1.076 -1.317
31 H PHE 5 H PHE 5 -5.961 -0.358 -6.171
32 HA PHE 5 HA PHE 5 -6.355 0.867 -8.712
33 1HB PHE 5 HB2 PHE 5 -7.789 2.757 -8.011
34 2HB PHE 5 HB3 PHE 5 -8.631 1.242 -8.110
35 HD1 PHE 5 HD1 PHE 5 -7.308 3.809 -5.780
36 HD2 PHE 5 HD2 PHE 5 -9.737 0.306 -6.218
37 HE1 PHE 5 HE1 PHE 5 -8.221 4.204 -3.519
38 HE2 PHE 5 HE2 PHE 5 -10.754 0.726 -3.958
39 HZ PHE 5 HZ PHE 5 -10.026 2.699 -2.630
40 H VAL 6 H VAL 6 -4.269 0.244 -6.759
41 HA VAL 6 HA VAL 6 -2.983 2.834 -6.448
42 HB VAL 6 HB VAL 6 -3.994 1.120 -4.203
43 1HG1 VAL 6 1HG1 VAL 6 -2.112 1.594 -2.701
44 2HG1 VAL 6 2HG1 VAL 6 -1.560 0.622 -4.049
45 3HG1 VAL 6 3HG1 VAL 6 -1.225 2.379 -4.051
46 1HG2 VAL 6 1HG2 VAL 6 -3.114 3.993 -4.433
47 2HG2 VAL 6 2HG2 VAL 6 -4.766 3.357 -4.611
48 3HG2 VAL 6 3HG2 VAL 6 -3.927 3.257 -3.030
49 H TYR 7 H TYR 7 -0.802 2.532 -6.714
50 HA TYR 7 HA TYR 7 0.179 -0.184 -7.307
51 1HB TYR 7 HB2 TYR 7 0.012 2.085 -9.283
52 2HB TYR 7 HB3 TYR 7 0.666 0.471 -9.564
53 HD1 TYR 7 HD1 TYR 7 -0.808 -1.407 -10.086
54 HD2 TYR 7 HD2 TYR 7 -2.488 2.466 -9.211
55 HE1 TYR 7 HE1 TYR 7 -3.026 -2.158 -10.942
56 HE2 TYR 7 HE2 TYR 7 -4.664 1.709 -9.907
57 HH TYR 7 HH TYR 7 -5.903 -0.064 -11.037
58 H THR 8 H THR 8 2.497 0.633 -8.626
59 HA THR 8 HA THR 8 3.681 2.735 -6.843
60 HB THR 8 HB THR 8 5.818 1.265 -7.452
61 HG1 THR 8 HG1 THR 8 4.941 -0.278 -8.662
62 1HG2 THR 8 1HG2 THR 8 3.819 0.464 -5.293
63 2HG2 THR 8 2HG2 THR 8 5.527 -0.049 -5.363
64 3HG2 THR 8 3HG2 THR 8 5.148 1.650 -5.159
65 H CYS 9 H CYS 9 5.673 3.628 -7.793
66 HA CYS 9 HA CYS 9 5.668 3.755 -10.790
67 1HB CYS 9 HB2 CYS 9 5.442 6.062 -9.838
68 2HB CYS 9 HB3 CYS 9 6.759 5.733 -8.699
69 H ASN 10 H ASN 10 7.236 2.077 -11.204
70 HA ASN 10 HA ASN 10 8.985 1.224 -9.130
71 1HB ASN 10 HB2 ASN 10 8.097 -0.203 -11.047
72 2HB ASN 10 HB3 ASN 10 9.378 0.571 -12.040
73 1HD2 ASN 10 2HD2 ASN 10 10.920 -0.996 -12.218
74 2HD2 ASN 10 1HD2 ASN 10 11.589 -1.908 -10.861
75 H GLU 11 H GLU 11 9.141 4.101 -10.766
76 HA GLU 11 HA GLU 11 12.056 4.094 -10.644
77 1HB GLU 11 HB2 GLU 11 10.165 5.585 -12.288
78 2HB GLU 11 HB3 GLU 11 11.379 6.609 -11.552
79 1HG GLU 11 HG2 GLU 11 12.083 3.998 -13.014
80 2HG GLU 11 HG3 GLU 11 12.177 5.573 -13.775
81 H CYS 12 H CYS 12 9.219 5.319 -8.994
82 HA CYS 12 HA CYS 12 10.939 6.993 -7.214
83 1HB CYS 12 HB2 CYS 12 7.926 6.620 -7.107
84 2HB CYS 12 HB3 CYS 12 8.934 7.799 -6.237
85 H LYS 13 H LYS 13 9.362 3.941 -7.474
86 HA LYS 13 HA LYS 13 8.940 2.201 -6.142
87 1HB LYS 13 HB2 LYS 13 11.672 2.996 -5.080
88 2HB LYS 13 HB3 LYS 13 10.777 1.615 -4.418
89 1HG LYS 13 HG2 LYS 13 11.557 0.333 -5.990
90 2HG LYS 13 HG3 LYS 13 10.523 1.145 -7.132
91 1HD LYS 13 HD2 LYS 13 13.478 1.459 -6.691
92 2HD LYS 13 HD3 LYS 13 12.532 1.077 -8.157
93 1HE LYS 13 HE2 LYS 13 11.631 3.446 -8.051
94 2HE LYS 13 HE3 LYS 13 12.853 3.795 -6.819
95 1HZ LYS 13 HZ1 LYS 13 13.596 4.417 -8.996
96 2HZ LYS 13 HZ2 LYS 13 14.534 3.179 -8.546
97 3HZ LYS 13 HZ3 LYS 13 13.298 2.964 -9.629
98 H HIS 14 H HIS 14 7.545 4.313 -5.797
99 HA HIS 14 HA HIS 14 6.641 4.057 -3.010
100 1HB HIS 14 HB2 HIS 14 7.865 6.147 -3.091
101 2HB HIS 14 HB3 HIS 14 6.949 6.669 -4.528
102 HD2 HIS 14 HD2 HIS 14 4.942 8.187 -4.020
103 HE1 HIS 14 HE1 HIS 14 3.709 6.613 -0.281
104 HE2 HIS 14 HE2 HIS 14 3.206 8.329 -2.088
105 H HIS 15 H HIS 15 4.424 4.720 -2.863
106 HA HIS 15 HA HIS 15 2.825 3.417 -4.820
107 1HB HIS 15 HB2 HIS 15 2.267 4.804 -2.189
108 2HB HIS 15 HB3 HIS 15 0.929 4.331 -3.223
109 HD2 HIS 15 HD2 HIS 15 0.848 1.622 -3.989
110 HE1 HIS 15 HE1 HIS 15 2.470 0.364 -0.262
111 HE2 HIS 15 HE2 HIS 15 1.177 -0.387 -2.332
112 H VAL 16 H VAL 16 1.201 4.198 -6.132
113 HA VAL 16 HA VAL 16 0.734 7.074 -6.459
114 HB VAL 16 HB VAL 16 1.199 6.973 -8.846
115 1HG1 VAL 16 1HG1 VAL 16 3.550 6.396 -9.009
116 2HG1 VAL 16 2HG1 VAL 16 3.215 7.330 -7.513
117 3HG1 VAL 16 3HG1 VAL 16 3.514 5.594 -7.443
118 1HG2 VAL 16 1HG2 VAL 16 2.030 4.914 -9.996
119 2HG2 VAL 16 2HG2 VAL 16 1.716 3.970 -8.520
120 3HG2 VAL 16 3HG2 VAL 16 0.394 4.705 -9.452
121 H GLU 17 H GLU 17 -1.392 7.482 -7.549
122 HA GLU 17 HA GLU 17 -3.250 5.205 -7.229
123 1HB GLU 17 HB2 GLU 17 -4.950 6.692 -7.321
124 2HB GLU 17 HB3 GLU 17 -3.722 7.556 -6.421
125 1HG GLU 17 HG2 GLU 17 -4.729 8.030 -9.232
126 2HG GLU 17 HG3 GLU 17 -4.812 9.129 -7.878
127 H THR 18 H THR 18 -1.797 7.205 -9.855
128 HA THR 18 HA THR 18 -2.818 5.184 -11.785
129 HB THR 18 HB THR 18 -2.314 8.148 -12.213
130 HG1 THR 18 HG1 THR 18 -3.918 8.319 -11.070
131 1HG2 THR 18 1HG2 THR 18 -2.458 6.557 -14.313
132 2HG2 THR 18 2HG2 THR 18 -4.193 6.527 -13.938
133 3HG2 THR 18 3HG2 THR 18 -3.381 8.058 -14.286
134 H ARG 19 H ARG 19 -1.445 4.356 -13.276
135 HA ARG 19 HA ARG 19 1.315 5.478 -13.471
136 1HB ARG 19 HB2 ARG 19 2.343 3.437 -12.931
137 2HB ARG 19 HB3 ARG 19 1.081 3.609 -11.715
138 1HG ARG 19 HG2 ARG 19 -0.356 2.178 -13.537
139 2HG ARG 19 HG3 ARG 19 1.267 1.653 -14.024
140 1HD ARG 19 HD2 ARG 19 1.083 1.615 -11.211
141 2HD ARG 19 HD3 ARG 19 -0.396 0.854 -11.837
142 HE ARG 19 HE ARG 19 2.362 -0.144 -11.952
143 1HH1 ARG 19 1HH1 ARG 19 -1.058 -1.031 -12.680
144 2HH1 ARG 19 2HH1 ARG 19 -0.563 -2.595 -13.167
145 1HH2 ARG 19 1HH2 ARG 19 2.834 -2.100 -12.330
146 2HH2 ARG 19 2HH2 ARG 19 1.770 -3.291 -12.896
147 H TRP 20 H TRP 20 2.608 4.232 -15.021
148 HA TRP 20 HA TRP 20 1.268 3.204 -17.477
149 1HB TRP 20 HB2 TRP 20 3.919 4.587 -17.025
150 2HB TRP 20 HB3 TRP 20 3.325 3.960 -18.580
151 HD1 TRP 20 HD1 TRP 20 2.714 6.762 -16.034
152 HE1 TRP 20 HE1 TRP 20 1.135 8.516 -16.968
153 HE3 TRP 20 HE3 TRP 20 1.706 4.567 -20.494
154 HZ2 TRP 20 HZ2 TRP 20 -0.549 8.862 -19.320
155 HZ3 TRP 20 HZ3 TRP 20 0.143 5.632 -22.115
156 HH2 TRP 20 HH2 TRP 20 -0.983 7.796 -21.529
157 H HIS 21 H HIS 21 1.896 1.049 -17.842
158 HA HIS 21 HA HIS 21 3.767 -0.170 -15.875
159 1HB HIS 21 HB2 HIS 21 1.736 -0.473 -14.901
160 2HB HIS 21 HB3 HIS 21 0.835 -0.581 -16.369
161 HD2 HIS 21 HD2 HIS 21 3.780 -2.983 -16.064
162 HE1 HIS 21 HE1 HIS 21 0.300 -5.359 -15.550
163 HE2 HIS 21 HE2 HIS 21 2.829 -5.407 -15.788
164 H CYS 22 H CYS 22 5.287 -1.226 -16.929
165 HA CYS 22 HA CYS 22 5.292 -1.916 -19.724
166 1HB CYS 22 HB2 CYS 22 7.026 -1.847 -17.333
167 2HB CYS 22 HB3 CYS 22 7.388 -3.194 -18.375
168 H THR 23 H THR 23 4.551 -3.629 -20.646
169 HA THR 23 HA THR 23 4.011 -6.039 -19.010
170 HB THR 23 HB THR 23 2.309 -6.704 -20.784
171 HG1 THR 23 HG1 THR 23 3.310 -4.452 -21.927
172 1HG2 THR 23 1HG2 THR 23 1.999 -4.045 -19.404
173 2HG2 THR 23 2HG2 THR 23 0.657 -5.139 -19.897
174 3HG2 THR 23 3HG2 THR 23 1.773 -5.631 -18.622
175 H VAL 24 H VAL 24 6.414 -5.018 -20.390
176 HA VAL 24 HA VAL 24 7.461 -7.209 -22.015
177 HB VAL 24 HB VAL 24 7.574 -5.014 -22.933
178 1HG1 VAL 24 1HG1 VAL 24 8.817 -3.229 -21.233
179 2HG1 VAL 24 2HG1 VAL 24 7.102 -3.255 -21.800
180 3HG1 VAL 24 3HG1 VAL 24 7.564 -3.928 -20.254
181 1HG2 VAL 24 1HG2 VAL 24 10.226 -5.190 -21.481
182 2HG2 VAL 24 2HG2 VAL 24 9.813 -6.168 -22.933
183 3HG2 VAL 24 3HG2 VAL 24 9.919 -4.387 -23.019
184 H CYS 25 H CYS 25 8.416 -4.987 -19.442
185 HA CYS 25 HA CYS 25 10.353 -6.587 -18.123
186 1HB CYS 25 HB2 CYS 25 8.814 -4.220 -17.052
187 2HB CYS 25 HB3 CYS 25 10.461 -4.712 -16.628
188 H GLU 26 H GLU 26 10.031 -6.870 -15.625
189 HA GLU 26 HA GLU 26 7.634 -8.446 -15.097
190 1HB GLU 26 HB2 GLU 26 10.273 -8.046 -13.750
191 2HB GLU 26 HB3 GLU 26 8.889 -8.448 -12.721
192 1HG GLU 26 HG2 GLU 26 8.365 -10.392 -14.060
193 2HG GLU 26 HG3 GLU 26 9.742 -10.072 -15.129
194 H ASP 27 H ASP 27 6.007 -6.978 -15.132
195 HA ASP 27 HA ASP 27 4.589 -5.331 -14.487
196 1HB ASP 27 HB2 ASP 27 4.287 -7.247 -12.877
197 2HB ASP 27 HB3 ASP 27 5.347 -6.443 -11.745
198 H TYR 28 H TYR 28 7.086 -4.306 -14.946
199 HA TYR 28 HA TYR 28 7.942 -2.407 -12.955
200 1HB TYR 28 HB2 TYR 28 9.363 -3.326 -14.801
201 2HB TYR 28 HB3 TYR 28 8.396 -2.444 -15.955
202 HD1 TYR 28 HD1 TYR 28 11.329 -2.305 -13.920
203 HD2 TYR 28 HD2 TYR 28 8.350 0.125 -15.874
204 HE1 TYR 28 HE1 TYR 28 12.846 -0.353 -13.821
205 HE2 TYR 28 HE2 TYR 28 9.829 2.048 -15.802
206 HH TYR 28 HH TYR 28 13.142 1.899 -14.403
207 H ASP 29 H ASP 29 7.415 -0.196 -12.775
208 HA ASP 29 HA ASP 29 5.039 0.729 -14.325
209 1HB ASP 29 HB2 ASP 29 5.422 1.684 -11.521
210 2HB ASP 29 HB3 ASP 29 3.928 1.305 -12.362
211 H LEU 30 H LEU 30 4.754 3.037 -14.233
212 HA LEU 30 HA LEU 30 6.905 4.671 -13.089
213 1HB LEU 30 HB2 LEU 30 6.004 4.699 -15.998
214 2HB LEU 30 HB3 LEU 30 6.803 6.030 -15.203
215 HG LEU 30 HG LEU 30 7.963 3.240 -15.723
216 1HD1 LEU 30 1HD1 LEU 30 9.554 4.457 -17.136
217 2HD1 LEU 30 2HD1 LEU 30 7.866 4.810 -17.621
218 3HD1 LEU 30 3HD1 LEU 30 8.783 6.006 -16.687
219 1HD2 LEU 30 1HD2 LEU 30 8.915 4.167 -13.542
220 2HD2 LEU 30 2HD2 LEU 30 10.125 4.039 -14.793
221 3HD2 LEU 30 3HD2 LEU 30 9.406 5.611 -14.431
222 H CYS 31 H CYS 31 5.934 6.410 -12.082
223 HA CYS 31 HA CYS 31 3.131 6.930 -12.275
224 1HB CYS 31 HB2 CYS 31 3.683 9.037 -11.162
225 2HB CYS 31 HB3 CYS 31 4.399 7.713 -10.284
226 H ILE 32 H ILE 32 2.367 9.154 -13.058
227 HA ILE 32 HA ILE 32 2.765 9.278 -15.806
228 HB ILE 32 HB ILE 32 1.928 11.623 -14.067
229 1HG1 ILE 32 2HG1 ILE 32 0.542 9.906 -13.226
230 2HG1 ILE 32 3HG1 ILE 32 -0.434 10.874 -14.297
231 1HG2 ILE 32 1HG2 ILE 32 1.326 10.840 -16.953
232 2HG2 ILE 32 2HG2 ILE 32 0.580 12.208 -16.075
233 3HG2 ILE 32 3HG2 ILE 32 2.311 12.197 -16.359
234 1HD1 ILE 32 1HD1 ILE 32 -0.309 9.147 -16.033
235 2HD1 ILE 32 2HD1 ILE 32 0.684 8.120 -14.936
236 3HD1 ILE 32 3HD1 ILE 32 -0.957 8.524 -14.505
237 H ASN 33 H ASN 33 4.341 11.261 -13.270
238 HA ASN 33 HA ASN 33 5.717 12.983 -15.075
239 1HB ASN 33 HB2 ASN 33 5.434 13.737 -12.813
240 2HB ASN 33 HB3 ASN 33 5.999 12.214 -12.131
241 1HD2 ASN 33 2HD2 ASN 33 8.309 11.770 -11.994
242 2HD2 ASN 33 1HD2 ASN 33 9.440 13.088 -12.158
243 H CYS 34 H CYS 34 6.687 9.916 -13.529
244 HA CYS 34 HA CYS 34 9.364 10.059 -14.593
245 1HB CYS 34 HB2 CYS 34 7.734 7.869 -13.289
246 2HB CYS 34 HB3 CYS 34 9.294 7.549 -14.098
247 H TYR 35 H TYR 35 6.319 8.495 -15.692
248 HA TYR 35 HA TYR 35 7.444 7.215 -17.959
249 1HB TYR 35 HB2 TYR 35 5.142 6.843 -17.180
250 2HB TYR 35 HB3 TYR 35 4.703 8.478 -17.641
251 HD1 TYR 35 HD1 TYR 35 6.228 5.394 -19.146
252 HD2 TYR 35 HD2 TYR 35 3.723 8.846 -19.742
253 HE1 TYR 35 HE1 TYR 35 5.758 4.634 -21.456
254 HE2 TYR 35 HE2 TYR 35 3.247 8.102 -22.066
255 HH TYR 35 HH TYR 35 4.711 5.109 -23.408
256 H ASN 36 H ASN 36 6.100 10.478 -17.570
257 HA ASN 36 HA ASN 36 6.577 11.563 -20.101
258 1HB ASN 36 HB2 ASN 36 6.125 12.662 -17.298
259 2HB ASN 36 HB3 ASN 36 6.476 13.759 -18.556
260 1HD2 ASN 36 2HD2 ASN 36 4.328 14.669 -18.133
261 2HD2 ASN 36 1HD2 ASN 36 2.942 13.896 -18.897
262 H THR 37 H THR 37 9.043 10.693 -17.890
263 HA THR 37 HA THR 37 10.900 12.644 -19.201
264 HB THR 37 HB THR 37 12.179 12.598 -17.036
265 HG1 THR 37 HG1 THR 37 9.725 11.923 -15.854
266 1HG2 THR 37 1HG2 THR 37 10.898 14.570 -17.703
267 2HG2 THR 37 2HG2 THR 37 9.430 13.926 -16.948
268 3HG2 THR 37 3HG2 THR 37 10.841 14.336 -15.955
269 H LYS 38 H LYS 38 10.758 9.620 -17.372
270 HA LYS 38 HA LYS 38 13.278 8.620 -18.249
271 1HB LYS 38 HB2 LYS 38 10.917 6.995 -17.285
272 2HB LYS 38 HB3 LYS 38 12.600 6.553 -17.141
273 1HG LYS 38 HG2 LYS 38 11.270 8.884 -15.628
274 2HG LYS 38 HG3 LYS 38 11.515 7.274 -14.995
275 1HD LYS 38 HD2 LYS 38 13.920 7.594 -14.970
276 2HD LYS 38 HD3 LYS 38 13.781 9.054 -15.974
277 1HE LYS 38 HE2 LYS 38 14.203 9.683 -13.663
278 2HE LYS 38 HE3 LYS 38 12.573 10.208 -14.153
279 1HZ LYS 38 HZ1 LYS 38 12.685 9.163 -11.914
280 2HZ LYS 38 HZ2 LYS 38 11.649 8.404 -12.905
281 3HZ LYS 38 HZ3 LYS 38 13.129 7.759 -12.607
282 H SER 39 H SER 39 10.326 8.920 -19.990
283 HA SER 39 HA SER 39 9.576 8.114 -21.937
284 1HB SER 39 HB2 SER 39 12.548 8.418 -22.579
285 2HB SER 39 HB3 SER 39 11.176 8.568 -23.714
286 HG SER 39 HG SER 39 11.857 10.218 -21.504
287 H HIS 40 H HIS 40 9.577 5.957 -20.423
288 HA HIS 40 HA HIS 40 11.021 3.688 -21.416
289 1HB HIS 40 HB2 HIS 40 9.206 4.266 -19.317
290 2HB HIS 40 HB3 HIS 40 8.404 3.041 -20.289
291 HD1 HIS 40 HD1 HIS 40 11.511 3.405 -18.032
292 HD2 HIS 40 HD2 HIS 40 9.417 0.655 -20.397
293 HE1 HIS 40 HE1 HIS 40 12.371 1.079 -17.377
294 H THR 41 H THR 41 10.820 2.892 -23.352
295 HA THR 41 HA THR 41 8.544 3.722 -24.978
296 HB THR 41 HB THR 41 10.802 2.358 -26.298
297 HG1 THR 41 HG1 THR 41 11.391 4.649 -24.760
298 1HG2 THR 41 1HG2 THR 41 9.214 3.777 -27.530
299 2HG2 THR 41 2HG2 THR 41 9.692 5.189 -26.558
300 3HG2 THR 41 3HG2 THR 41 10.851 4.394 -27.673
301 H HIS 42 H HIS 42 8.769 0.972 -23.115
302 HA HIS 42 HA HIS 42 8.569 -0.965 -25.269
303 1HB HIS 42 HB2 HIS 42 8.176 -1.291 -22.316
304 2HB HIS 42 HB3 HIS 42 8.594 -2.546 -23.487
305 HD2 HIS 42 HD2 HIS 42 11.141 -0.924 -24.836
306 HE1 HIS 42 HE1 HIS 42 12.693 -0.864 -20.878
307 HE2 HIS 42 HE2 HIS 42 13.270 -0.604 -23.337
308 H LYS 43 H LYS 43 6.943 -2.774 -24.800
309 HA LYS 43 HA LYS 43 4.370 -1.649 -25.352
310 1HB LYS 43 HB2 LYS 43 5.429 -3.808 -26.259
311 2HB LYS 43 HB3 LYS 43 4.923 -4.592 -24.767
312 1HG LYS 43 HG2 LYS 43 2.962 -2.949 -26.404
313 2HG LYS 43 HG3 LYS 43 3.443 -4.545 -26.985
314 1HD LYS 43 HD2 LYS 43 1.654 -5.262 -25.864
315 2HD LYS 43 HD3 LYS 43 2.725 -5.227 -24.456
316 1HE LYS 43 HE2 LYS 43 1.975 -2.807 -24.142
317 2HE LYS 43 HE3 LYS 43 0.755 -3.079 -25.367
318 1HZ LYS 43 HZ1 LYS 43 -0.180 -4.790 -23.894
319 2HZ LYS 43 HZ2 LYS 43 1.033 -4.499 -22.795
320 3HZ LYS 43 HZ3 LYS 43 -0.063 -3.335 -23.135
321 H MET 44 H MET 44 3.576 -0.502 -23.726
322 HA MET 44 HA MET 44 3.325 -1.659 -20.987
323 1HB MET 44 HB2 MET 44 3.420 1.162 -22.146
324 2HB MET 44 HB3 MET 44 2.809 0.864 -20.504
325 1HG MET 44 HG2 MET 44 4.680 0.074 -19.671
326 2HG MET 44 HG3 MET 44 5.499 -0.212 -21.218
327 1HE MET 44 HE1 MET 44 6.203 1.171 -18.228
328 2HE MET 44 HE2 MET 44 6.259 2.946 -18.243
329 3HE MET 44 HE3 MET 44 4.702 2.105 -18.217
330 H VAL 45 H VAL 45 1.373 -0.622 -19.811
331 HA VAL 45 HA VAL 45 -1.114 -0.336 -21.279
332 HB VAL 45 HB VAL 45 -2.123 -1.576 -19.421
333 1HG1 VAL 45 1HG1 VAL 45 -1.817 -3.804 -20.306
334 2HG1 VAL 45 2HG1 VAL 45 -1.731 -2.657 -21.671
335 3HG1 VAL 45 3HG1 VAL 45 -0.234 -3.378 -20.998
336 1HG2 VAL 45 1HG2 VAL 45 0.690 -2.628 -18.855
337 2HG2 VAL 45 2HG2 VAL 45 -0.266 -1.547 -17.820
338 3HG2 VAL 45 3HG2 VAL 45 -0.786 -3.222 -18.104
339 H LYS 46 H LYS 46 -2.615 0.816 -19.392
340 HA LYS 46 HA LYS 46 -0.999 2.430 -17.545
341 1HB LYS 46 HB2 LYS 46 -0.850 3.747 -19.557
342 2HB LYS 46 HB3 LYS 46 -2.533 3.471 -19.956
343 1HG LYS 46 HG2 LYS 46 -1.957 4.895 -17.365
344 2HG LYS 46 HG3 LYS 46 -1.610 5.728 -18.884
345 1HD LYS 46 HD2 LYS 46 -3.944 5.288 -19.636
346 2HD LYS 46 HD3 LYS 46 -4.326 4.597 -18.047
347 1HE LYS 46 HE2 LYS 46 -3.899 6.644 -16.934
348 2HE LYS 46 HE3 LYS 46 -3.173 7.394 -18.374
349 1HZ LYS 46 HZ1 LYS 46 -5.988 6.579 -18.084
350 2HZ LYS 46 HZ2 LYS 46 -5.484 8.074 -18.012
351 3HZ LYS 46 HZ3 LYS 46 -5.373 7.293 -19.437
352 H TRP 47 H TRP 47 -2.227 2.930 -15.789
353 HA TRP 47 HA TRP 47 -5.122 2.370 -15.774
354 1HB TRP 47 HB2 TRP 47 -3.253 1.140 -13.766
355 2HB TRP 47 HB3 TRP 47 -4.918 0.673 -14.063
356 HD1 TRP 47 HD1 TRP 47 -1.412 -0.206 -14.717
357 HE1 TRP 47 HE1 TRP 47 -1.217 -2.328 -16.093
358 HE3 TRP 47 HE3 TRP 47 -6.160 -0.316 -16.638
359 HZ2 TRP 47 HZ2 TRP 47 -2.900 -3.808 -17.979
360 HZ3 TRP 47 HZ3 TRP 47 -6.777 -2.040 -18.327
361 HH2 TRP 47 HH2 TRP 47 -5.165 -3.811 -18.960
362 H GLY 48 H GLY 48 -5.985 2.887 -13.487
363 1HA GLY 48 HA2 GLY 48 -4.437 3.762 -11.463
364 2HA GLY 48 HA3 GLY 48 -4.741 5.255 -12.400
365 H LEU 49 H LEU 49 -7.151 5.087 -13.297
366 HA LEU 49 HA LEU 49 -9.342 5.290 -12.944
367 1HB LEU 49 HB2 LEU 49 -9.230 4.029 -10.223
368 2HB LEU 49 HB3 LEU 49 -10.575 4.154 -11.338
369 HG LEU 49 HG LEU 49 -8.153 2.331 -11.624
370 1HD1 LEU 49 1HD1 LEU 49 -11.123 1.742 -11.408
371 2HD1 LEU 49 2HD1 LEU 49 -9.787 0.561 -11.396
372 3HD1 LEU 49 3HD1 LEU 49 -9.967 1.706 -10.042
373 1HD2 LEU 49 1HD2 LEU 49 -9.231 1.439 -13.686
374 2HD2 LEU 49 2HD2 LEU 49 -10.457 2.699 -13.607
375 3HD2 LEU 49 3HD2 LEU 49 -8.765 3.133 -13.898
376 H GLY 50 H GLY 50 -7.036 6.905 -11.165
377 1HA GLY 50 HA2 GLY 50 -9.094 8.646 -9.842
378 2HA GLY 50 HA3 GLY 50 -7.473 8.334 -9.209
379 H LEU 51 H LEU 51 -6.356 8.553 -12.046
380 HA LEU 51 HA LEU 51 -6.667 11.386 -12.720
381 1HB LEU 51 HB2 LEU 51 -4.842 10.898 -10.924
382 2HB LEU 51 HB3 LEU 51 -3.980 10.028 -12.207
383 HG LEU 51 HG LEU 51 -3.709 12.096 -13.486
384 1HD1 LEU 51 1HD1 LEU 51 -5.684 13.389 -12.824
385 2HD1 LEU 51 2HD1 LEU 51 -5.197 13.337 -11.125
386 3HD1 LEU 51 3HD1 LEU 51 -4.229 14.259 -12.320
387 1HD2 LEU 51 1HD2 LEU 51 -2.132 13.142 -11.855
388 2HD2 LEU 51 2HD2 LEU 51 -2.890 12.197 -10.537
389 3HD2 LEU 51 3HD2 LEU 51 -2.025 11.375 -11.823
390 H ASP 52 H ASP 52 -7.641 8.982 -13.815
391 HA ASP 52 HA ASP 52 -5.875 7.911 -15.834
392 1HB ASP 52 HB2 ASP 52 -8.035 6.932 -14.366
393 2HB ASP 52 HB3 ASP 52 -8.777 7.251 -15.922
Start of MODEL 9
1 1H GLY 1 H1 GLY 1 4.107 -2.188 -9.888
2 2H GLY 1 H2 GLY 1 5.196 -3.325 -9.407
3 3H GLY 1 H3 GLY 1 3.909 -3.725 -10.372
4 1HA GLY 1 HA2 GLY 1 3.382 -4.483 -8.223
5 2HA GLY 1 HA3 GLY 1 3.783 -2.852 -7.578
6 H GLN 2 H GLN 2 1.092 -4.503 -7.576
7 HA GLN 2 HA GLN 2 -0.519 -2.216 -8.334
8 1HB GLN 2 HB2 GLN 2 -2.048 -3.753 -9.751
9 2HB GLN 2 HB3 GLN 2 -0.599 -3.014 -10.447
10 1HG GLN 2 HG2 GLN 2 0.628 -5.167 -10.233
11 2HG GLN 2 HG3 GLN 2 -0.858 -5.921 -9.599
12 1HE2 GLN 2 2HE2 GLN 2 0.875 -5.882 -12.405
13 2HE2 GLN 2 1HE2 GLN 2 -0.442 -6.013 -13.547
14 H ASP 3 H ASP 3 -2.581 -2.274 -7.647
15 HA ASP 3 HA ASP 3 -3.693 -4.257 -5.795
16 1HB ASP 3 HB2 ASP 3 -2.503 -2.640 -4.335
17 2HB ASP 3 HB3 ASP 3 -3.180 -1.279 -5.246
18 H ARG 4 H ARG 4 -6.127 -3.454 -5.544
19 HA ARG 4 HA ARG 4 -7.132 -3.093 -8.203
20 1HB ARG 4 HB2 ARG 4 -9.399 -2.781 -6.940
21 2HB ARG 4 HB3 ARG 4 -8.623 -4.330 -7.105
22 1HG ARG 4 HG2 ARG 4 -9.563 -4.071 -4.893
23 2HG ARG 4 HG3 ARG 4 -7.812 -4.285 -4.835
24 1HD ARG 4 HD2 ARG 4 -8.153 -1.492 -4.847
25 2HD ARG 4 HD3 ARG 4 -9.530 -2.053 -3.892
26 HE ARG 4 HE ARG 4 -6.693 -2.094 -3.302
27 1HH1 ARG 4 2HH2 ARG 4 -9.784 -3.267 -2.150
28 2HH1 ARG 4 1HH2 ARG 4 -9.142 -4.038 -0.730
29 1HH2 ARG 4 2HH1 ARG 4 -5.798 -3.292 -1.726
30 2HH2 ARG 4 1HH1 ARG 4 -6.703 -4.001 -0.424
31 H PHE 5 H PHE 5 -6.127 -0.656 -5.934
32 HA PHE 5 HA PHE 5 -6.815 1.303 -7.960
33 1HB PHE 5 HB2 PHE 5 -7.929 2.859 -6.325
34 2HB PHE 5 HB3 PHE 5 -8.843 1.525 -6.953
35 HD1 PHE 5 HD1 PHE 5 -6.425 1.305 -4.024
36 HD2 PHE 5 HD2 PHE 5 -10.544 1.303 -5.342
37 HE1 PHE 5 HE1 PHE 5 -7.137 0.718 -1.765
38 HE2 PHE 5 HE2 PHE 5 -11.255 0.679 -3.054
39 HZ PHE 5 HZ PHE 5 -9.549 0.406 -1.239
40 H VAL 6 H VAL 6 -4.460 0.045 -6.300
41 HA VAL 6 HA VAL 6 -3.036 2.576 -6.073
42 HB VAL 6 HB VAL 6 -3.600 0.598 -3.898
43 1HG1 VAL 6 1HG1 VAL 6 -0.752 1.676 -4.137
44 2HG1 VAL 6 2HG1 VAL 6 -1.493 0.963 -2.694
45 3HG1 VAL 6 3HG1 VAL 6 -1.274 -0.021 -4.148
46 1HG2 VAL 6 1HG2 VAL 6 -2.697 3.477 -4.013
47 2HG2 VAL 6 2HG2 VAL 6 -4.376 2.904 -3.933
48 3HG2 VAL 6 3HG2 VAL 6 -3.286 2.626 -2.558
49 H TYR 7 H TYR 7 -0.801 2.289 -6.440
50 HA TYR 7 HA TYR 7 0.167 -0.128 -7.773
51 1HB TYR 7 HB2 TYR 7 -0.187 2.635 -9.031
52 2HB TYR 7 HB3 TYR 7 0.641 1.292 -9.778
53 HD1 TYR 7 HD1 TYR 7 -0.878 -0.883 -10.090
54 HD2 TYR 7 HD2 TYR 7 -2.477 2.960 -9.104
55 HE1 TYR 7 HE1 TYR 7 -3.181 -1.715 -10.633
56 HE2 TYR 7 HE2 TYR 7 -4.757 2.120 -9.454
57 HH TYR 7 HH TYR 7 -5.436 -1.244 -10.352
58 H THR 8 H THR 8 2.449 0.914 -8.820
59 HA THR 8 HA THR 8 3.679 2.725 -6.839
60 HB THR 8 HB THR 8 5.773 1.144 -7.505
61 HG1 THR 8 HG1 THR 8 4.857 -0.436 -8.598
62 1HG2 THR 8 1HG2 THR 8 5.402 1.549 -5.260
63 2HG2 THR 8 2HG2 THR 8 3.808 0.704 -5.257
64 3HG2 THR 8 3HG2 THR 8 5.336 -0.204 -5.405
65 H CYS 9 H CYS 9 5.779 3.564 -7.805
66 HA CYS 9 HA CYS 9 5.775 3.773 -10.765
67 1HB CYS 9 HB2 CYS 9 5.483 6.061 -9.851
68 2HB CYS 9 HB3 CYS 9 6.807 5.804 -8.704
69 H ASN 10 H ASN 10 7.333 2.121 -11.168
70 HA ASN 10 HA ASN 10 9.179 1.383 -9.108
71 1HB ASN 10 HB2 ASN 10 8.247 -0.187 -10.857
72 2HB ASN 10 HB3 ASN 10 9.359 0.578 -12.028
73 1HD2 ASN 10 2HD2 ASN 10 11.072 -0.883 -12.284
74 2HD2 ASN 10 1HD2 ASN 10 11.871 -1.687 -10.933
75 H GLU 11 H GLU 11 9.181 4.192 -10.812
76 HA GLU 11 HA GLU 11 12.097 4.285 -10.799
77 1HB GLU 11 HB2 GLU 11 10.133 5.655 -12.421
78 2HB GLU 11 HB3 GLU 11 11.243 6.774 -11.640
79 1HG GLU 11 HG2 GLU 11 12.137 4.271 -13.179
80 2HG GLU 11 HG3 GLU 11 12.110 5.902 -13.852
81 H CYS 12 H CYS 12 9.297 5.389 -9.036
82 HA CYS 12 HA CYS 12 11.044 7.049 -7.289
83 1HB CYS 12 HB2 CYS 12 8.033 6.668 -7.199
84 2HB CYS 12 HB3 CYS 12 8.988 7.860 -6.294
85 H LYS 13 H LYS 13 9.503 4.014 -7.551
86 HA LYS 13 HA LYS 13 8.994 2.260 -6.214
87 1HB LYS 13 HB2 LYS 13 11.754 2.986 -5.122
88 2HB LYS 13 HB3 LYS 13 10.863 1.567 -4.583
89 1HG LYS 13 HG2 LYS 13 11.629 0.378 -6.270
90 2HG LYS 13 HG3 LYS 13 10.643 1.346 -7.341
91 1HD LYS 13 HD2 LYS 13 13.604 1.661 -6.768
92 2HD LYS 13 HD3 LYS 13 12.737 1.253 -8.273
93 1HE LYS 13 HE2 LYS 13 11.690 3.584 -8.115
94 2HE LYS 13 HE3 LYS 13 12.932 3.977 -6.925
95 1HZ LYS 13 HZ1 LYS 13 13.333 3.109 -9.717
96 2HZ LYS 13 HZ2 LYS 13 13.565 4.596 -9.161
97 3HZ LYS 13 HZ3 LYS 13 14.596 3.404 -8.701
98 H HIS 14 H HIS 14 7.666 4.410 -5.794
99 HA HIS 14 HA HIS 14 6.763 3.979 -3.029
100 1HB HIS 14 HB2 HIS 14 7.869 6.205 -3.012
101 2HB HIS 14 HB3 HIS 14 6.920 6.708 -4.404
102 HD2 HIS 14 HD2 HIS 14 4.734 7.944 -3.839
103 HE1 HIS 14 HE1 HIS 14 3.720 6.129 -0.148
104 HE2 HIS 14 HE2 HIS 14 2.943 7.719 -1.976
105 H HIS 15 H HIS 15 4.493 4.683 -2.902
106 HA HIS 15 HA HIS 15 2.984 3.283 -4.871
107 1HB HIS 15 HB2 HIS 15 1.738 2.936 -3.037
108 2HB HIS 15 HB3 HIS 15 2.663 4.081 -2.109
109 HD2 HIS 15 HD2 HIS 15 -0.487 3.850 -4.315
110 HE1 HIS 15 HE1 HIS 15 -0.817 7.511 -2.180
111 HE2 HIS 15 HE2 HIS 15 -2.011 5.936 -3.768
112 H VAL 16 H VAL 16 1.228 4.022 -6.058
113 HA VAL 16 HA VAL 16 0.746 6.867 -6.407
114 HB VAL 16 HB VAL 16 1.166 6.906 -8.816
115 1HG1 VAL 16 1HG1 VAL 16 3.574 5.470 -7.619
116 2HG1 VAL 16 2HG1 VAL 16 3.479 6.412 -9.086
117 3HG1 VAL 16 3HG1 VAL 16 3.219 7.211 -7.509
118 1HG2 VAL 16 1HG2 VAL 16 0.412 4.676 -9.471
119 2HG2 VAL 16 2HG2 VAL 16 2.055 4.951 -10.057
120 3HG2 VAL 16 3HG2 VAL 16 1.797 3.928 -8.633
121 H GLU 17 H GLU 17 -1.394 7.139 -7.635
122 HA GLU 17 HA GLU 17 -3.188 4.804 -7.133
123 1HB GLU 17 HB2 GLU 17 -4.942 6.652 -7.650
124 2HB GLU 17 HB3 GLU 17 -4.210 6.528 -6.055
125 1HG GLU 17 HG2 GLU 17 -4.410 8.887 -6.794
126 2HG GLU 17 HG3 GLU 17 -2.740 8.405 -6.497
127 H THR 18 H THR 18 -1.667 6.701 -9.602
128 HA THR 18 HA THR 18 -3.002 5.095 -11.716
129 HB THR 18 HB THR 18 -2.422 8.089 -11.635
130 HG1 THR 18 HG1 THR 18 -4.199 7.941 -10.613
131 1HG2 THR 18 1HG2 THR 18 -2.743 8.133 -13.933
132 2HG2 THR 18 2HG2 THR 18 -2.790 6.356 -13.946
133 3HG2 THR 18 3HG2 THR 18 -4.266 7.305 -13.724
134 H ARG 19 H ARG 19 -1.518 4.116 -13.061
135 HA ARG 19 HA ARG 19 1.224 5.219 -13.161
136 1HB ARG 19 HB2 ARG 19 2.335 3.173 -12.775
137 2HB ARG 19 HB3 ARG 19 1.196 3.331 -11.416
138 1HG ARG 19 HG2 ARG 19 -0.354 1.757 -12.475
139 2HG ARG 19 HG3 ARG 19 0.687 1.622 -13.903
140 1HD ARG 19 HD2 ARG 19 2.246 0.317 -12.919
141 2HD ARG 19 HD3 ARG 19 1.816 0.708 -11.272
142 HE ARG 19 HE ARG 19 -0.500 -0.364 -12.080
143 1HH1 ARG 19 1HH2 ARG 19 2.726 -1.812 -12.119
144 2HH1 ARG 19 2HH2 ARG 19 2.195 -3.326 -12.706
145 1HH2 ARG 19 1HH1 ARG 19 -1.189 -2.449 -12.962
146 2HH2 ARG 19 2HH1 ARG 19 0.049 -3.612 -13.288
147 H TRP 20 H TRP 20 2.476 4.135 -14.795
148 HA TRP 20 HA TRP 20 1.053 3.134 -17.195
149 1HB TRP 20 HB2 TRP 20 3.711 4.547 -16.837
150 2HB TRP 20 HB3 TRP 20 3.049 3.958 -18.373
151 HD1 TRP 20 HD1 TRP 20 2.497 6.670 -15.729
152 HE1 TRP 20 HE1 TRP 20 0.925 8.487 -16.598
153 HE3 TRP 20 HE3 TRP 20 1.330 4.589 -20.181
154 HZ2 TRP 20 HZ2 TRP 20 -0.635 8.995 -18.979
155 HZ3 TRP 20 HZ3 TRP 20 -0.238 5.708 -21.770
156 HH2 TRP 20 HH2 TRP 20 -1.224 7.936 -21.168
157 H HIS 21 H HIS 21 1.750 0.970 -17.675
158 HA HIS 21 HA HIS 21 3.700 -0.224 -15.745
159 1HB HIS 21 HB2 HIS 21 1.733 -0.746 -14.714
160 2HB HIS 21 HB3 HIS 21 0.787 -0.780 -16.170
161 HD2 HIS 21 HD2 HIS 21 3.891 -3.039 -15.972
162 HE1 HIS 21 HE1 HIS 21 0.504 -5.593 -15.834
163 HE2 HIS 21 HE2 HIS 21 3.047 -5.493 -16.050
164 H CYS 22 H CYS 22 5.262 -1.223 -16.790
165 HA CYS 22 HA CYS 22 5.277 -1.773 -19.598
166 1HB CYS 22 HB2 CYS 22 7.009 -1.743 -17.221
167 2HB CYS 22 HB3 CYS 22 7.371 -3.120 -18.258
168 H THR 23 H THR 23 4.491 -3.400 -20.593
169 HA THR 23 HA THR 23 3.932 -5.931 -19.129
170 HB THR 23 HB THR 23 2.226 -6.461 -20.879
171 HG1 THR 23 HG1 THR 23 3.230 -4.030 -21.774
172 1HG2 THR 23 1HG2 THR 23 1.900 -3.771 -19.608
173 2HG2 THR 23 2HG2 THR 23 0.579 -4.896 -20.024
174 3HG2 THR 23 3HG2 THR 23 1.692 -5.295 -18.703
175 H VAL 24 H VAL 24 6.341 -5.046 -20.155
176 HA VAL 24 HA VAL 24 7.433 -7.056 -22.015
177 HB VAL 24 HB VAL 24 7.376 -4.793 -22.808
178 1HG1 VAL 24 1HG1 VAL 24 8.745 -3.145 -21.010
179 2HG1 VAL 24 2HG1 VAL 24 7.074 -3.037 -21.653
180 3HG1 VAL 24 3HG1 VAL 24 7.398 -3.840 -20.157
181 1HG2 VAL 24 1HG2 VAL 24 9.591 -5.994 -23.016
182 2HG2 VAL 24 2HG2 VAL 24 9.802 -4.222 -22.957
183 3HG2 VAL 24 3HG2 VAL 24 10.102 -5.175 -21.510
184 H CYS 25 H CYS 25 8.370 -4.858 -19.386
185 HA CYS 25 HA CYS 25 10.285 -6.583 -18.139
186 1HB CYS 25 HB2 CYS 25 8.770 -4.227 -16.973
187 2HB CYS 25 HB3 CYS 25 10.365 -4.790 -16.496
188 H GLU 26 H GLU 26 9.942 -7.031 -15.660
189 HA GLU 26 HA GLU 26 7.448 -8.502 -15.267
190 1HB GLU 26 HB2 GLU 26 10.114 -8.393 -13.894
191 2HB GLU 26 HB3 GLU 26 8.730 -8.759 -12.881
192 1HG GLU 26 HG2 GLU 26 8.054 -10.584 -14.416
193 2HG GLU 26 HG3 GLU 26 9.475 -10.277 -15.420
194 H ASP 27 H ASP 27 5.866 -6.960 -15.140
195 HA ASP 27 HA ASP 27 4.575 -5.296 -14.352
196 1HB ASP 27 HB2 ASP 27 4.250 -7.287 -12.858
197 2HB ASP 27 HB3 ASP 27 5.313 -6.549 -11.688
198 H TYR 28 H TYR 28 7.030 -4.268 -14.876
199 HA TYR 28 HA TYR 28 7.940 -2.458 -12.829
200 1HB TYR 28 HB2 TYR 28 9.367 -3.307 -14.683
201 2HB TYR 28 HB3 TYR 28 8.349 -2.489 -15.846
202 HD1 TYR 28 HD1 TYR 28 11.353 -2.255 -13.937
203 HD2 TYR 28 HD2 TYR 28 8.213 0.094 -15.724
204 HE1 TYR 28 HE1 TYR 28 12.804 -0.273 -13.852
205 HE2 TYR 28 HE2 TYR 28 9.669 2.088 -15.680
206 HH TYR 28 HH TYR 28 12.970 2.016 -14.311
207 H ASP 29 H ASP 29 7.394 -0.251 -12.623
208 HA ASP 29 HA ASP 29 4.907 0.629 -14.064
209 1HB ASP 29 HB2 ASP 29 5.520 1.650 -11.319
210 2HB ASP 29 HB3 ASP 29 4.008 1.357 -12.102
211 H LEU 30 H LEU 30 4.628 2.985 -14.095
212 HA LEU 30 HA LEU 30 6.812 4.623 -13.052
213 1HB LEU 30 HB2 LEU 30 5.812 4.678 -15.929
214 2HB LEU 30 HB3 LEU 30 6.615 6.003 -15.134
215 HG LEU 30 HG LEU 30 7.772 3.253 -15.733
216 1HD1 LEU 30 1HD1 LEU 30 7.552 4.840 -17.672
217 2HD1 LEU 30 2HD1 LEU 30 8.596 5.971 -16.802
218 3HD1 LEU 30 3HD1 LEU 30 9.235 4.385 -17.268
219 1HD2 LEU 30 1HD2 LEU 30 8.792 4.159 -13.611
220 2HD2 LEU 30 2HD2 LEU 30 9.972 4.180 -14.946
221 3HD2 LEU 30 3HD2 LEU 30 9.137 5.664 -14.448
222 H CYS 31 H CYS 31 5.913 6.458 -12.046
223 HA CYS 31 HA CYS 31 3.107 6.965 -12.229
224 1HB CYS 31 HB2 CYS 31 3.616 9.024 -11.075
225 2HB CYS 31 HB3 CYS 31 4.393 7.740 -10.227
226 H ILE 32 H ILE 32 2.444 9.191 -12.938
227 HA ILE 32 HA ILE 32 2.675 9.379 -15.676
228 HB ILE 32 HB ILE 32 2.002 11.665 -13.788
229 1HG1 ILE 32 2HG1 ILE 32 0.684 10.008 -12.821
230 2HG1 ILE 32 3HG1 ILE 32 -0.412 10.872 -13.858
231 1HG2 ILE 32 1HG2 ILE 32 2.127 12.278 -16.088
232 2HG2 ILE 32 2HG2 ILE 32 1.005 10.964 -16.561
233 3HG2 ILE 32 3HG2 ILE 32 0.432 12.318 -15.558
234 1HD1 ILE 32 1HD1 ILE 32 -0.497 9.055 -15.441
235 2HD1 ILE 32 2HD1 ILE 32 0.848 8.196 -14.634
236 3HD1 ILE 32 3HD1 ILE 32 -0.664 8.372 -13.794
237 H ASN 33 H ASN 33 4.430 11.290 -13.221
238 HA ASN 33 HA ASN 33 5.686 13.025 -15.104
239 1HB ASN 33 HB2 ASN 33 5.650 13.770 -12.800
240 2HB ASN 33 HB3 ASN 33 6.222 12.214 -12.187
241 1HD2 ASN 33 2HD2 ASN 33 8.528 11.720 -12.246
242 2HD2 ASN 33 1HD2 ASN 33 9.673 13.010 -12.562
243 H CYS 34 H CYS 34 6.753 9.983 -13.566
244 HA CYS 34 HA CYS 34 9.341 10.071 -14.783
245 1HB CYS 34 HB2 CYS 34 7.749 7.855 -13.450
246 2HB CYS 34 HB3 CYS 34 9.372 7.633 -14.159
247 H TYR 35 H TYR 35 6.289 8.440 -15.718
248 HA TYR 35 HA TYR 35 7.239 7.181 -18.060
249 1HB TYR 35 HB2 TYR 35 5.068 6.681 -17.234
250 2HB TYR 35 HB3 TYR 35 4.541 8.363 -17.313
251 HD1 TYR 35 HD1 TYR 35 5.713 5.548 -19.542
252 HD2 TYR 35 HD2 TYR 35 3.242 9.066 -19.112
253 HE1 TYR 35 HE1 TYR 35 4.725 5.159 -21.787
254 HE2 TYR 35 HE2 TYR 35 2.268 8.676 -21.337
255 HH TYR 35 HH TYR 35 2.246 7.290 -23.175
256 H ASN 36 H ASN 36 6.070 10.509 -17.549
257 HA ASN 36 HA ASN 36 6.288 11.459 -20.187
258 1HB ASN 36 HB2 ASN 36 5.947 12.582 -17.454
259 2HB ASN 36 HB3 ASN 36 6.643 13.713 -18.556
260 1HD2 ASN 36 2HD2 ASN 36 3.808 11.758 -17.905
261 2HD2 ASN 36 1HD2 ASN 36 2.736 12.583 -19.047
262 H THR 37 H THR 37 8.920 10.742 -17.993
263 HA THR 37 HA THR 37 10.699 12.553 -19.614
264 HB THR 37 HB THR 37 12.009 12.852 -17.508
265 HG1 THR 37 HG1 THR 37 9.667 12.076 -16.161
266 1HG2 THR 37 1HG2 THR 37 10.443 14.599 -18.322
267 2HG2 THR 37 2HG2 THR 37 9.132 13.880 -17.353
268 3HG2 THR 37 3HG2 THR 37 10.543 14.567 -16.545
269 H LYS 38 H LYS 38 10.659 9.641 -17.598
270 HA LYS 38 HA LYS 38 13.302 8.798 -18.208
271 1HB LYS 38 HB2 LYS 38 10.985 7.069 -17.307
272 2HB LYS 38 HB3 LYS 38 12.691 6.762 -17.025
273 1HG LYS 38 HG2 LYS 38 11.211 9.131 -15.773
274 2HG LYS 38 HG3 LYS 38 11.424 7.567 -15.028
275 1HD LYS 38 HD2 LYS 38 13.860 7.884 -14.954
276 2HD LYS 38 HD3 LYS 38 13.705 9.361 -15.932
277 1HE LYS 38 HE2 LYS 38 14.026 10.006 -13.619
278 2HE LYS 38 HE3 LYS 38 12.400 10.459 -14.145
279 1HZ LYS 38 HZ1 LYS 38 13.063 8.063 -12.581
280 2HZ LYS 38 HZ2 LYS 38 12.500 9.431 -11.912
281 3HZ LYS 38 HZ3 LYS 38 11.535 8.607 -12.918
282 H SER 39 H SER 39 10.761 8.933 -20.317
283 HA SER 39 HA SER 39 10.205 7.994 -22.274
284 1HB SER 39 HB2 SER 39 13.237 8.046 -22.560
285 2HB SER 39 HB3 SER 39 12.048 8.177 -23.862
286 HG SER 39 HG SER 39 12.531 10.018 -21.752
287 H HIS 40 H HIS 40 9.850 5.963 -20.628
288 HA HIS 40 HA HIS 40 11.266 3.553 -21.305
289 1HB HIS 40 HB2 HIS 40 9.280 4.389 -19.456
290 2HB HIS 40 HB3 HIS 40 8.504 3.158 -20.445
291 HD1 HIS 40 HD1 HIS 40 11.418 3.491 -17.985
292 HD2 HIS 40 HD2 HIS 40 9.416 0.704 -20.367
293 HE1 HIS 40 HE1 HIS 40 12.228 1.185 -17.220
294 H THR 41 H THR 41 11.262 2.789 -23.300
295 HA THR 41 HA THR 41 9.206 3.646 -25.125
296 HB THR 41 HB THR 41 11.457 2.053 -26.169
297 HG1 THR 41 HG1 THR 41 12.055 4.293 -24.547
298 1HG2 THR 41 1HG2 THR 41 10.613 4.955 -26.590
299 2HG2 THR 41 2HG2 THR 41 11.872 4.086 -27.504
300 3HG2 THR 41 3HG2 THR 41 10.179 3.557 -27.594
301 H HIS 42 H HIS 42 8.961 1.059 -23.169
302 HA HIS 42 HA HIS 42 8.637 -0.992 -25.220
303 1HB HIS 42 HB2 HIS 42 8.212 -1.130 -22.234
304 2HB HIS 42 HB3 HIS 42 8.531 -2.450 -23.387
305 HD2 HIS 42 HD2 HIS 42 11.221 -1.199 -24.719
306 HE1 HIS 42 HE1 HIS 42 12.699 -1.179 -20.734
307 HE2 HIS 42 HE2 HIS 42 13.349 -1.123 -23.195
308 H LYS 43 H LYS 43 6.770 -2.536 -24.849
309 HA LYS 43 HA LYS 43 4.263 -1.152 -25.189
310 1HB LYS 43 HB2 LYS 43 4.779 -3.370 -26.310
311 2HB LYS 43 HB3 LYS 43 4.748 -4.122 -24.707
312 1HG LYS 43 HG2 LYS 43 2.337 -3.165 -24.504
313 2HG LYS 43 HG3 LYS 43 2.483 -2.736 -26.194
314 1HD LYS 43 HD2 LYS 43 1.362 -4.696 -26.334
315 2HD LYS 43 HD3 LYS 43 2.999 -5.277 -26.583
316 1HE LYS 43 HE2 LYS 43 1.550 -5.231 -23.868
317 2HE LYS 43 HE3 LYS 43 1.428 -6.601 -24.960
318 1HZ LYS 43 HZ1 LYS 43 3.815 -6.947 -24.767
319 2HZ LYS 43 HZ2 LYS 43 3.930 -5.600 -23.807
320 3HZ LYS 43 HZ3 LYS 43 3.145 -6.881 -23.275
321 H MET 44 H MET 44 3.428 -0.090 -23.511
322 HA MET 44 HA MET 44 3.266 -1.398 -20.835
323 1HB MET 44 HB2 MET 44 3.368 1.518 -21.769
324 2HB MET 44 HB3 MET 44 2.761 1.049 -20.168
325 1HG MET 44 HG2 MET 44 4.695 0.228 -19.389
326 2HG MET 44 HG3 MET 44 5.467 0.050 -20.949
327 1HE MET 44 HE1 MET 44 4.524 2.321 -17.939
328 2HE MET 44 HE2 MET 44 5.953 1.280 -17.888
329 3HE MET 44 HE3 MET 44 6.125 3.056 -17.804
330 H VAL 45 H VAL 45 1.303 -0.633 -19.658
331 HA VAL 45 HA VAL 45 -1.159 -0.213 -21.190
332 HB VAL 45 HB VAL 45 -2.187 -1.482 -19.302
333 1HG1 VAL 45 1HG1 VAL 45 -0.448 -3.224 -21.090
334 2HG1 VAL 45 2HG1 VAL 45 -1.995 -3.671 -20.341
335 3HG1 VAL 45 3HG1 VAL 45 -1.983 -2.457 -21.602
336 1HG2 VAL 45 1HG2 VAL 45 -0.437 -1.547 -17.720
337 2HG2 VAL 45 2HG2 VAL 45 -0.822 -3.261 -18.158
338 3HG2 VAL 45 3HG2 VAL 45 0.617 -2.472 -18.760
339 H LYS 46 H LYS 46 -2.697 0.681 -19.145
340 HA LYS 46 HA LYS 46 -1.168 2.370 -17.312
341 1HB LYS 46 HB2 LYS 46 -1.426 3.601 -19.526
342 2HB LYS 46 HB3 LYS 46 -3.157 3.581 -19.304
343 1HG LYS 46 HG2 LYS 46 -1.235 4.843 -17.293
344 2HG LYS 46 HG3 LYS 46 -1.837 5.696 -18.697
345 1HD LYS 46 HD2 LYS 46 -4.215 5.328 -17.805
346 2HD LYS 46 HD3 LYS 46 -3.463 4.744 -16.309
347 1HE LYS 46 HE2 LYS 46 -3.835 7.031 -15.963
348 2HE LYS 46 HE3 LYS 46 -2.104 6.856 -16.212
349 1HZ LYS 46 HZ1 LYS 46 -2.542 7.635 -18.550
350 2HZ LYS 46 HZ2 LYS 46 -4.140 7.826 -18.102
351 3HZ LYS 46 HZ3 LYS 46 -3.026 8.708 -17.414
352 H TRP 47 H TRP 47 -2.267 2.509 -15.491
353 HA TRP 47 HA TRP 47 -5.106 1.663 -15.413
354 1HB TRP 47 HB2 TRP 47 -3.032 0.919 -13.337
355 2HB TRP 47 HB3 TRP 47 -4.701 0.357 -13.442
356 HD1 TRP 47 HD1 TRP 47 -1.239 -0.524 -14.431
357 HE1 TRP 47 HE1 TRP 47 -1.129 -2.479 -16.040
358 HE3 TRP 47 HE3 TRP 47 -6.099 -0.551 -15.951
359 HZ2 TRP 47 HZ2 TRP 47 -2.882 -3.776 -17.954
360 HZ3 TRP 47 HZ3 TRP 47 -6.782 -2.052 -17.838
361 HH2 TRP 47 HH2 TRP 47 -5.211 -3.690 -18.775
362 H GLY 48 H GLY 48 -6.303 3.238 -14.285
363 1HA GLY 48 HA2 GLY 48 -4.810 5.300 -12.844
364 2HA GLY 48 HA3 GLY 48 -5.679 5.758 -14.341
365 H LEU 49 H LEU 49 -5.934 6.359 -11.450
366 HA LEU 49 HA LEU 49 -8.805 5.813 -11.134
367 1HB LEU 49 HB2 LEU 49 -6.781 4.309 -9.810
368 2HB LEU 49 HB3 LEU 49 -7.436 5.369 -8.598
369 HG LEU 49 HG LEU 49 -8.516 3.232 -8.652
370 1HD1 LEU 49 1HD1 LEU 49 -10.866 3.902 -8.628
371 2HD1 LEU 49 2HD1 LEU 49 -9.859 5.160 -7.909
372 3HD1 LEU 49 3HD1 LEU 49 -10.471 5.383 -9.560
373 1HD2 LEU 49 1HD2 LEU 49 -9.743 3.745 -11.368
374 2HD2 LEU 49 2HD2 LEU 49 -8.312 2.726 -11.105
375 3HD2 LEU 49 3HD2 LEU 49 -9.834 2.294 -10.346
376 H GLY 50 H GLY 50 -6.462 8.225 -11.135
377 1HA GLY 50 HA2 GLY 50 -8.308 10.004 -9.708
378 2HA GLY 50 HA3 GLY 50 -6.797 9.714 -8.864
379 H LEU 51 H LEU 51 -4.919 9.772 -10.908
380 HA LEU 51 HA LEU 51 -5.238 12.457 -12.159
381 1HB LEU 51 HB2 LEU 51 -2.827 11.209 -10.758
382 2HB LEU 51 HB3 LEU 51 -2.768 12.723 -11.636
383 HG LEU 51 HG LEU 51 -4.531 12.217 -9.178
384 1HD1 LEU 51 1HD1 LEU 51 -1.847 13.642 -9.335
385 2HD1 LEU 51 2HD1 LEU 51 -2.892 13.476 -7.905
386 3HD1 LEU 51 3HD1 LEU 51 -2.131 12.035 -8.624
387 1HD2 LEU 51 1HD2 LEU 51 -5.368 14.068 -10.551
388 2HD2 LEU 51 2HD2 LEU 51 -4.651 14.688 -9.054
389 3HD2 LEU 51 3HD2 LEU 51 -3.751 14.802 -10.582
390 H ASP 52 H ASP 52 -6.053 11.064 -13.935
391 HA ASP 52 HA ASP 52 -4.366 9.082 -15.167
392 1HB ASP 52 HB2 ASP 52 -6.916 9.280 -15.224
393 2HB ASP 52 HB3 ASP 52 -6.665 10.394 -16.574
Start of MODEL 10
1 1H GLY 1 H1 GLY 1 4.177 -3.682 -10.193
2 2H GLY 1 H2 GLY 1 4.410 -2.110 -9.834
3 3H GLY 1 H3 GLY 1 5.543 -3.231 -9.421
4 1HA GLY 1 HA2 GLY 1 3.911 -4.310 -7.938
5 2HA GLY 1 HA3 GLY 1 4.378 -2.677 -7.417
6 H GLN 2 H GLN 2 1.714 -4.467 -7.258
7 HA GLN 2 HA GLN 2 -0.086 -2.246 -7.980
8 1HB GLN 2 HB2 GLN 2 -0.821 -5.137 -8.540
9 2HB GLN 2 HB3 GLN 2 -1.627 -3.675 -9.077
10 1HG GLN 2 HG2 GLN 2 0.671 -3.230 -10.324
11 2HG GLN 2 HG3 GLN 2 0.892 -4.973 -10.102
12 1HE2 GLN 2 2HE2 GLN 2 0.882 -5.105 -12.467
13 2HE2 GLN 2 1HE2 GLN 2 -0.646 -5.081 -13.346
14 H ASP 3 H ASP 3 -2.180 -2.488 -7.088
15 HA ASP 3 HA ASP 3 -2.668 -4.119 -4.694
16 1HB ASP 3 HB2 ASP 3 -1.818 -1.890 -3.856
17 2HB ASP 3 HB3 ASP 3 -3.102 -1.105 -4.768
18 H ARG 4 H ARG 4 -5.179 -2.052 -4.804
19 HA ARG 4 HA ARG 4 -6.600 -3.487 -7.015
20 1HB ARG 4 HB2 ARG 4 -7.742 -2.427 -4.382
21 2HB ARG 4 HB3 ARG 4 -8.610 -3.259 -5.653
22 1HG ARG 4 HG2 ARG 4 -8.316 -4.911 -4.074
23 2HG ARG 4 HG3 ARG 4 -7.065 -5.263 -5.273
24 1HD ARG 4 HD2 ARG 4 -5.348 -4.353 -3.794
25 2HD ARG 4 HD3 ARG 4 -6.577 -3.832 -2.623
26 HE ARG 4 HE ARG 4 -6.890 -6.583 -3.165
27 1HH1 ARG 4 1HH1 ARG 4 -4.390 -4.511 -1.680
28 2HH1 ARG 4 2HH1 ARG 4 -3.920 -5.647 -0.505
29 1HH2 ARG 4 2HH2 ARG 4 -6.158 -8.161 -1.665
30 2HH2 ARG 4 1HH2 ARG 4 -4.900 -7.775 -0.532
31 H PHE 5 H PHE 5 -5.961 -0.440 -5.324
32 HA PHE 5 HA PHE 5 -6.794 1.040 -7.732
33 1HB PHE 5 HB2 PHE 5 -7.900 2.756 -6.438
34 2HB PHE 5 HB3 PHE 5 -8.701 1.206 -6.166
35 HD1 PHE 5 HD1 PHE 5 -8.290 -0.019 -3.937
36 HD2 PHE 5 HD2 PHE 5 -6.881 3.980 -4.686
37 HE1 PHE 5 HE1 PHE 5 -7.960 0.323 -1.519
38 HE2 PHE 5 HE2 PHE 5 -6.556 4.325 -2.251
39 HZ PHE 5 HZ PHE 5 -7.078 2.477 -0.661
40 H VAL 6 H VAL 6 -4.351 0.166 -5.760
41 HA VAL 6 HA VAL 6 -2.904 2.722 -6.105
42 HB VAL 6 HB VAL 6 -3.414 0.988 -3.691
43 1HG1 VAL 6 1HG1 VAL 6 -0.829 2.498 -4.022
44 2HG1 VAL 6 2HG1 VAL 6 -1.425 1.783 -2.500
45 3HG1 VAL 6 3HG1 VAL 6 -1.024 0.714 -3.840
46 1HG2 VAL 6 1HG2 VAL 6 -4.444 3.246 -4.058
47 2HG2 VAL 6 2HG2 VAL 6 -3.523 3.108 -2.551
48 3HG2 VAL 6 3HG2 VAL 6 -2.809 3.958 -3.942
49 H TYR 7 H TYR 7 -0.632 2.346 -6.360
50 HA TYR 7 HA TYR 7 0.370 -0.311 -7.119
51 1HB TYR 7 HB2 TYR 7 0.224 2.038 -9.040
52 2HB TYR 7 HB3 TYR 7 0.793 0.366 -9.356
53 HD1 TYR 7 HD1 TYR 7 -0.800 -1.380 -9.881
54 HD2 TYR 7 HD2 TYR 7 -2.186 2.579 -8.871
55 HE1 TYR 7 HE1 TYR 7 -3.113 -1.998 -10.604
56 HE2 TYR 7 HE2 TYR 7 -4.477 1.909 -9.383
57 HH TYR 7 HH TYR 7 -5.875 0.187 -10.197
58 H THR 8 H THR 8 2.729 0.516 -8.329
59 HA THR 8 HA THR 8 3.809 2.724 -6.603
60 HB THR 8 HB THR 8 5.997 1.335 -7.145
61 HG1 THR 8 HG1 THR 8 5.118 -0.246 -8.373
62 1HG2 THR 8 1HG2 THR 8 4.051 0.426 -4.994
63 2HG2 THR 8 2HG2 THR 8 5.800 0.052 -5.073
64 3HG2 THR 8 3HG2 THR 8 5.273 1.719 -4.868
65 H CYS 9 H CYS 9 5.692 3.792 -7.621
66 HA CYS 9 HA CYS 9 5.654 3.774 -10.612
67 1HB CYS 9 HB2 CYS 9 5.490 6.094 -9.795
68 2HB CYS 9 HB3 CYS 9 6.792 5.820 -8.629
69 H ASN 10 H ASN 10 7.185 2.089 -11.017
70 HA ASN 10 HA ASN 10 9.018 1.232 -9.015
71 1HB ASN 10 HB2 ASN 10 8.022 -0.197 -10.886
72 2HB ASN 10 HB3 ASN 10 9.232 0.582 -11.951
73 1HD2 ASN 10 2HD2 ASN 10 10.768 -1.043 -12.224
74 2HD2 ASN 10 1HD2 ASN 10 11.536 -1.905 -10.886
75 H GLU 11 H GLU 11 9.104 4.077 -10.736
76 HA GLU 11 HA GLU 11 12.012 4.041 -10.656
77 1HB GLU 11 HB2 GLU 11 10.147 5.549 -12.333
78 2HB GLU 11 HB3 GLU 11 11.372 6.548 -11.599
79 1HG GLU 11 HG2 GLU 11 12.089 3.926 -12.997
80 2HG GLU 11 HG3 GLU 11 12.148 5.511 -13.785
81 H CYS 12 H CYS 12 9.237 5.351 -8.996
82 HA CYS 12 HA CYS 12 10.969 7.094 -7.319
83 1HB CYS 12 HB2 CYS 12 7.980 6.527 -7.127
84 2HB CYS 12 HB3 CYS 12 8.890 7.760 -6.233
85 H LYS 13 H LYS 13 9.475 4.016 -7.470
86 HA LYS 13 HA LYS 13 9.012 2.289 -6.105
87 1HB LYS 13 HB2 LYS 13 11.785 3.005 -5.020
88 2HB LYS 13 HB3 LYS 13 10.845 1.665 -4.379
89 1HG LYS 13 HG2 LYS 13 11.662 0.376 -5.943
90 2HG LYS 13 HG3 LYS 13 10.582 1.171 -7.061
91 1HD LYS 13 HD2 LYS 13 13.562 1.478 -6.734
92 2HD LYS 13 HD3 LYS 13 12.575 1.103 -8.164
93 1HE LYS 13 HE2 LYS 13 11.685 3.450 -8.070
94 2HE LYS 13 HE3 LYS 13 12.915 3.833 -6.868
95 1HZ LYS 13 HZ1 LYS 13 14.581 3.192 -8.594
96 2HZ LYS 13 HZ2 LYS 13 13.335 2.947 -9.651
97 3HZ LYS 13 HZ3 LYS 13 13.579 4.410 -9.072
98 H HIS 14 H HIS 14 7.611 4.320 -5.736
99 HA HIS 14 HA HIS 14 6.876 4.333 -2.891
100 1HB HIS 14 HB2 HIS 14 8.157 6.404 -3.231
101 2HB HIS 14 HB3 HIS 14 7.316 6.692 -4.761
102 HD2 HIS 14 HD2 HIS 14 5.455 8.365 -4.688
103 HE1 HIS 14 HE1 HIS 14 3.929 7.590 -0.796
104 HE2 HIS 14 HE2 HIS 14 3.586 8.921 -2.948
105 H HIS 15 H HIS 15 4.567 5.015 -2.742
106 HA HIS 15 HA HIS 15 3.023 3.549 -4.690
107 1HB HIS 15 HB2 HIS 15 2.375 4.918 -2.063
108 2HB HIS 15 HB3 HIS 15 1.095 4.309 -3.107
109 HD2 HIS 15 HD2 HIS 15 1.235 1.604 -3.775
110 HE1 HIS 15 HE1 HIS 15 3.038 0.597 -0.056
111 HE2 HIS 15 HE2 HIS 15 1.767 -0.317 -2.060
112 H VAL 16 H VAL 16 1.351 4.196 -5.902
113 HA VAL 16 HA VAL 16 0.738 7.026 -6.400
114 HB VAL 16 HB VAL 16 1.160 6.781 -8.777
115 1HG1 VAL 16 1HG1 VAL 16 3.525 6.433 -8.930
116 2HG1 VAL 16 2HG1 VAL 16 3.143 7.357 -7.447
117 3HG1 VAL 16 3HG1 VAL 16 3.589 5.637 -7.343
118 1HG2 VAL 16 1HG2 VAL 16 1.900 3.878 -8.241
119 2HG2 VAL 16 2HG2 VAL 16 0.496 4.481 -9.182
120 3HG2 VAL 16 3HG2 VAL 16 2.114 4.736 -9.781
121 H GLU 17 H GLU 17 -1.348 6.975 -7.967
122 HA GLU 17 HA GLU 17 -3.092 4.652 -7.249
123 1HB GLU 17 HB2 GLU 17 -4.912 6.441 -7.705
124 2HB GLU 17 HB3 GLU 17 -4.101 6.345 -6.142
125 1HG GLU 17 HG2 GLU 17 -4.439 8.647 -6.864
126 2HG GLU 17 HG3 GLU 17 -2.715 8.290 -6.650
127 H THR 18 H THR 18 -1.802 6.780 -9.765
128 HA THR 18 HA THR 18 -3.024 5.064 -11.841
129 HB THR 18 HB THR 18 -2.552 8.090 -11.806
130 HG1 THR 18 HG1 THR 18 -4.311 7.825 -10.750
131 1HG2 THR 18 1HG2 THR 18 -3.097 6.238 -14.086
132 2HG2 THR 18 2HG2 THR 18 -4.353 7.476 -13.895
133 3HG2 THR 18 3HG2 THR 18 -2.677 7.950 -14.135
134 H ARG 19 H ARG 19 -1.541 4.283 -13.360
135 HA ARG 19 HA ARG 19 1.217 5.402 -13.410
136 1HB ARG 19 HB2 ARG 19 2.305 3.476 -12.755
137 2HB ARG 19 HB3 ARG 19 1.002 3.642 -11.576
138 1HG ARG 19 HG2 ARG 19 -0.297 1.993 -13.284
139 2HG ARG 19 HG3 ARG 19 1.366 1.607 -13.807
140 1HD ARG 19 HD2 ARG 19 1.427 1.569 -11.020
141 2HD ARG 19 HD3 ARG 19 -0.158 0.864 -11.467
142 HE ARG 19 HE ARG 19 2.553 -0.200 -11.843
143 1HH1 ARG 19 1HH2 ARG 19 -0.918 -0.957 -12.337
144 2HH1 ARG 19 2HH2 ARG 19 -0.550 -2.551 -12.856
145 1HH2 ARG 19 2HH1 ARG 19 2.938 -2.185 -12.351
146 2HH2 ARG 19 1HH1 ARG 19 1.775 -3.313 -12.841
147 H TRP 20 H TRP 20 2.533 4.281 -14.927
148 HA TRP 20 HA TRP 20 1.225 3.164 -17.363
149 1HB TRP 20 HB2 TRP 20 3.896 4.563 -16.905
150 2HB TRP 20 HB3 TRP 20 3.310 3.960 -18.442
151 HD1 TRP 20 HD1 TRP 20 2.609 6.736 -15.889
152 HE1 TRP 20 HE1 TRP 20 0.988 8.432 -16.808
153 HE3 TRP 20 HE3 TRP 20 1.655 4.533 -20.362
154 HZ2 TRP 20 HZ2 TRP 20 -0.516 8.873 -19.208
155 HZ3 TRP 20 HZ3 TRP 20 0.088 5.623 -21.976
156 HH2 TRP 20 HH2 TRP 20 -1.021 7.761 -21.427
157 H HIS 21 H HIS 21 1.913 1.025 -17.747
158 HA HIS 21 HA HIS 21 3.811 -0.184 -15.767
159 1HB HIS 21 HB2 HIS 21 1.820 -0.622 -14.763
160 2HB HIS 21 HB3 HIS 21 0.910 -0.692 -16.240
161 HD2 HIS 21 HD2 HIS 21 3.956 -3.070 -15.987
162 HE1 HIS 21 HE1 HIS 21 0.522 -5.469 -15.421
163 HE2 HIS 21 HE2 HIS 21 3.048 -5.463 -15.789
164 H CYS 22 H CYS 22 5.322 -1.219 -16.818
165 HA CYS 22 HA CYS 22 5.283 -1.908 -19.623
166 1HB CYS 22 HB2 CYS 22 7.122 -1.842 -17.290
167 2HB CYS 22 HB3 CYS 22 7.469 -3.139 -18.424
168 H THR 23 H THR 23 4.449 -3.553 -20.503
169 HA THR 23 HA THR 23 4.019 -6.033 -18.916
170 HB THR 23 HB THR 23 2.271 -6.683 -20.618
171 HG1 THR 23 HG1 THR 23 3.142 -4.414 -21.784
172 1HG2 THR 23 1HG2 THR 23 1.988 -4.058 -19.178
173 2HG2 THR 23 2HG2 THR 23 0.632 -5.121 -19.641
174 3HG2 THR 23 3HG2 THR 23 1.782 -5.634 -18.391
175 H VAL 24 H VAL 24 6.317 -4.961 -20.363
176 HA VAL 24 HA VAL 24 7.357 -7.087 -22.081
177 HB VAL 24 HB VAL 24 7.370 -4.871 -22.943
178 1HG1 VAL 24 1HG1 VAL 24 8.669 -3.114 -21.215
179 2HG1 VAL 24 2HG1 VAL 24 6.982 -3.094 -21.824
180 3HG1 VAL 24 3HG1 VAL 24 7.380 -3.797 -20.287
181 1HG2 VAL 24 1HG2 VAL 24 9.651 -6.016 -23.040
182 2HG2 VAL 24 2HG2 VAL 24 9.756 -4.234 -23.089
183 3HG2 VAL 24 3HG2 VAL 24 10.095 -5.120 -21.588
184 H CYS 25 H CYS 25 8.245 -4.890 -19.445
185 HA CYS 25 HA CYS 25 10.269 -6.575 -18.260
186 1HB CYS 25 HB2 CYS 25 8.799 -4.239 -17.021
187 2HB CYS 25 HB3 CYS 25 10.436 -4.787 -16.633
188 H GLU 26 H GLU 26 9.961 -6.937 -15.748
189 HA GLU 26 HA GLU 26 7.496 -8.467 -15.333
190 1HB GLU 26 HB2 GLU 26 10.216 -8.348 -14.093
191 2HB GLU 26 HB3 GLU 26 8.912 -8.688 -12.966
192 1HG GLU 26 HG2 GLU 26 8.095 -10.518 -14.385
193 2HG GLU 26 HG3 GLU 26 9.472 -10.295 -15.470
194 H ASP 27 H ASP 27 5.929 -6.987 -15.134
195 HA ASP 27 HA ASP 27 4.622 -5.333 -14.323
196 1HB ASP 27 HB2 ASP 27 4.299 -7.291 -12.834
197 2HB ASP 27 HB3 ASP 27 5.435 -6.588 -11.692
198 H TYR 28 H TYR 28 7.052 -4.293 -14.915
199 HA TYR 28 HA TYR 28 7.978 -2.440 -12.869
200 1HB TYR 28 HB2 TYR 28 9.373 -3.341 -14.761
201 2HB TYR 28 HB3 TYR 28 8.384 -2.507 -15.894
202 HD1 TYR 28 HD1 TYR 28 11.353 -2.274 -13.928
203 HD2 TYR 28 HD2 TYR 28 8.254 0.110 -15.772
204 HE1 TYR 28 HE1 TYR 28 12.818 -0.274 -13.853
205 HE2 TYR 28 HE2 TYR 28 9.742 2.049 -15.776
206 HH TYR 28 HH TYR 28 13.092 1.959 -14.480
207 H ASP 29 H ASP 29 7.465 -0.283 -12.703
208 HA ASP 29 HA ASP 29 5.030 0.656 -14.142
209 1HB ASP 29 HB2 ASP 29 5.486 1.653 -11.387
210 2HB ASP 29 HB3 ASP 29 3.992 1.307 -12.196
211 H LEU 30 H LEU 30 4.760 2.978 -14.168
212 HA LEU 30 HA LEU 30 6.869 4.625 -13.023
213 1HB LEU 30 HB2 LEU 30 5.943 4.737 -15.924
214 2HB LEU 30 HB3 LEU 30 6.787 6.012 -15.098
215 HG LEU 30 HG LEU 30 7.902 3.220 -15.719
216 1HD1 LEU 30 1HD1 LEU 30 9.446 4.486 -17.165
217 2HD1 LEU 30 2HD1 LEU 30 7.760 4.791 -17.630
218 3HD1 LEU 30 3HD1 LEU 30 8.672 6.011 -16.690
219 1HD2 LEU 30 1HD2 LEU 30 10.079 4.060 -14.842
220 2HD2 LEU 30 2HD2 LEU 30 9.327 5.601 -14.432
221 3HD2 LEU 30 3HD2 LEU 30 8.905 4.135 -13.542
222 H CYS 31 H CYS 31 5.917 6.436 -12.043
223 HA CYS 31 HA CYS 31 3.099 6.931 -12.260
224 1HB CYS 31 HB2 CYS 31 3.622 9.016 -11.157
225 2HB CYS 31 HB3 CYS 31 4.343 7.686 -10.272
226 H ILE 32 H ILE 32 2.403 9.100 -13.071
227 HA ILE 32 HA ILE 32 2.738 9.246 -15.811
228 HB ILE 32 HB ILE 32 1.878 11.584 -14.070
229 1HG1 ILE 32 2HG1 ILE 32 0.605 9.957 -13.029
230 2HG1 ILE 32 3HG1 ILE 32 -0.461 10.658 -14.212
231 1HG2 ILE 32 1HG2 ILE 32 1.153 10.679 -16.869
232 2HG2 ILE 32 2HG2 ILE 32 0.369 12.004 -15.993
233 3HG2 ILE 32 3HG2 ILE 32 2.111 12.113 -16.341
234 1HD1 ILE 32 1HD1 ILE 32 -0.378 8.645 -15.577
235 2HD1 ILE 32 2HD1 ILE 32 0.955 7.964 -14.605
236 3HD1 ILE 32 3HD1 ILE 32 -0.588 8.170 -13.853
237 H ASN 33 H ASN 33 4.251 11.258 -13.326
238 HA ASN 33 HA ASN 33 5.588 13.006 -15.116
239 1HB ASN 33 HB2 ASN 33 5.189 13.721 -12.861
240 2HB ASN 33 HB3 ASN 33 5.946 12.274 -12.177
241 1HD2 ASN 33 2HD2 ASN 33 8.159 12.275 -11.757
242 2HD2 ASN 33 1HD2 ASN 33 9.190 13.643 -12.144
243 H CYS 34 H CYS 34 6.621 9.951 -13.516
244 HA CYS 34 HA CYS 34 9.315 10.124 -14.525
245 1HB CYS 34 HB2 CYS 34 7.633 7.937 -13.292
246 2HB CYS 34 HB3 CYS 34 9.178 7.597 -14.106
247 H TYR 35 H TYR 35 6.292 8.555 -15.690
248 HA TYR 35 HA TYR 35 7.412 7.255 -17.952
249 1HB TYR 35 HB2 TYR 35 5.136 6.838 -17.196
250 2HB TYR 35 HB3 TYR 35 4.631 8.459 -17.623
251 HD1 TYR 35 HD1 TYR 35 6.436 5.538 -19.208
252 HD2 TYR 35 HD2 TYR 35 3.454 8.625 -19.717
253 HE1 TYR 35 HE1 TYR 35 6.007 4.747 -21.491
254 HE2 TYR 35 HE2 TYR 35 3.076 7.878 -22.033
255 HH TYR 35 HH TYR 35 4.914 5.101 -23.441
256 H ASN 36 H ASN 36 6.188 10.577 -17.574
257 HA ASN 36 HA ASN 36 6.599 11.600 -20.132
258 1HB ASN 36 HB2 ASN 36 6.124 12.666 -17.373
259 2HB ASN 36 HB3 ASN 36 6.867 13.789 -18.428
260 1HD2 ASN 36 2HD2 ASN 36 4.014 11.774 -17.950
261 2HD2 ASN 36 1HD2 ASN 36 2.984 12.661 -19.067
262 H THR 37 H THR 37 9.127 10.778 -17.883
263 HA THR 37 HA THR 37 10.969 12.568 -19.410
264 HB THR 37 HB THR 37 12.257 12.689 -17.221
265 HG1 THR 37 HG1 THR 37 9.819 12.079 -15.983
266 1HG2 THR 37 1HG2 THR 37 10.942 14.592 -18.029
267 2HG2 THR 37 2HG2 THR 37 9.468 13.966 -17.254
268 3HG2 THR 37 3HG2 THR 37 10.854 14.492 -16.265
269 H LYS 38 H LYS 38 10.666 9.541 -17.596
270 HA LYS 38 HA LYS 38 13.283 8.572 -18.250
271 1HB LYS 38 HB2 LYS 38 10.866 6.969 -17.353
272 2HB LYS 38 HB3 LYS 38 12.550 6.493 -17.228
273 1HG LYS 38 HG2 LYS 38 11.357 8.894 -15.764
274 2HG LYS 38 HG3 LYS 38 11.431 7.277 -15.086
275 1HD LYS 38 HD2 LYS 38 13.881 7.395 -15.023
276 2HD LYS 38 HD3 LYS 38 13.875 8.880 -15.994
277 1HE LYS 38 HE2 LYS 38 14.240 9.444 -13.678
278 2HE LYS 38 HE3 LYS 38 12.707 10.106 -14.240
279 1HZ LYS 38 HZ1 LYS 38 11.563 8.342 -13.062
280 2HZ LYS 38 HZ2 LYS 38 13.001 7.641 -12.642
281 3HZ LYS 38 HZ3 LYS 38 12.560 9.089 -12.029
282 H SER 39 H SER 39 10.575 8.935 -20.265
283 HA SER 39 HA SER 39 9.990 8.131 -22.274
284 1HB SER 39 HB2 SER 39 13.038 8.043 -22.560
285 2HB SER 39 HB3 SER 39 11.861 8.284 -23.869
286 HG SER 39 HG SER 39 12.494 10.022 -21.717
287 H HIS 40 H HIS 40 9.648 6.010 -20.620
288 HA HIS 40 HA HIS 40 11.027 3.618 -21.425
289 1HB HIS 40 HB2 HIS 40 9.280 4.370 -19.352
290 2HB HIS 40 HB3 HIS 40 8.348 3.227 -20.320
291 HD1 HIS 40 HD1 HIS 40 11.407 3.414 -18.022
292 HD2 HIS 40 HD2 HIS 40 9.356 0.714 -20.460
293 HE1 HIS 40 HE1 HIS 40 12.215 1.091 -17.350
294 H THR 41 H THR 41 10.906 2.983 -23.460
295 HA THR 41 HA THR 41 8.689 3.793 -25.115
296 HB THR 41 HB THR 41 10.936 2.205 -26.240
297 HG1 THR 41 HG1 THR 41 11.527 4.528 -24.759
298 1HG2 THR 41 1HG2 THR 41 11.118 4.101 -27.784
299 2HG2 THR 41 2HG2 THR 41 9.458 3.515 -27.657
300 3HG2 THR 41 3HG2 THR 41 9.923 5.011 -26.806
301 H HIS 42 H HIS 42 8.956 1.007 -23.252
302 HA HIS 42 HA HIS 42 8.520 -0.943 -25.336
303 1HB HIS 42 HB2 HIS 42 8.078 -1.116 -22.358
304 2HB HIS 42 HB3 HIS 42 8.394 -2.451 -23.493
305 HD2 HIS 42 HD2 HIS 42 11.064 -1.195 -24.887
306 HE1 HIS 42 HE1 HIS 42 12.568 -1.260 -20.873
307 HE2 HIS 42 HE2 HIS 42 13.231 -1.107 -23.343
308 H LYS 43 H LYS 43 6.613 -2.566 -25.008
309 HA LYS 43 HA LYS 43 4.186 -1.024 -25.277
310 1HB LYS 43 HB2 LYS 43 4.728 -3.086 -26.637
311 2HB LYS 43 HB3 LYS 43 4.351 -4.064 -25.248
312 1HG LYS 43 HG2 LYS 43 2.165 -2.235 -25.422
313 2HG LYS 43 HG3 LYS 43 2.570 -2.577 -27.103
314 1HD LYS 43 HD2 LYS 43 0.858 -4.140 -26.411
315 2HD LYS 43 HD3 LYS 43 2.363 -5.034 -26.550
316 1HE LYS 43 HE2 LYS 43 1.346 -5.770 -24.511
317 2HE LYS 43 HE3 LYS 43 2.699 -4.750 -24.058
318 1HZ LYS 43 HZ1 LYS 43 1.071 -2.925 -23.736
319 2HZ LYS 43 HZ2 LYS 43 -0.155 -3.996 -23.969
320 3HZ LYS 43 HZ3 LYS 43 0.919 -4.166 -22.730
321 H MET 44 H MET 44 3.841 -0.073 -23.342
322 HA MET 44 HA MET 44 3.447 -1.601 -20.869
323 1HB MET 44 HB2 MET 44 3.323 1.326 -21.798
324 2HB MET 44 HB3 MET 44 2.762 0.873 -20.187
325 1HG MET 44 HG2 MET 44 4.720 0.140 -19.455
326 2HG MET 44 HG3 MET 44 5.474 -0.056 -21.023
327 1HE MET 44 HE1 MET 44 6.171 1.224 -18.059
328 2HE MET 44 HE2 MET 44 6.236 3.019 -17.982
329 3HE MET 44 HE3 MET 44 4.692 2.177 -17.943
330 H VAL 45 H VAL 45 1.403 -0.580 -19.694
331 HA VAL 45 HA VAL 45 -1.087 -0.403 -21.192
332 HB VAL 45 HB VAL 45 -2.078 -1.645 -19.293
333 1HG1 VAL 45 1HG1 VAL 45 -1.774 -3.862 -20.221
334 2HG1 VAL 45 2HG1 VAL 45 -1.702 -2.706 -21.567
335 3HG1 VAL 45 3HG1 VAL 45 -0.195 -3.424 -20.906
336 1HG2 VAL 45 1HG2 VAL 45 0.763 -2.530 -18.723
337 2HG2 VAL 45 2HG2 VAL 45 -0.304 -1.553 -17.715
338 3HG2 VAL 45 3HG2 VAL 45 -0.646 -3.300 -18.044
339 H LYS 46 H LYS 46 -2.633 0.685 -19.310
340 HA LYS 46 HA LYS 46 -1.077 2.300 -17.405
341 1HB LYS 46 HB2 LYS 46 -1.218 3.585 -19.594
342 2HB LYS 46 HB3 LYS 46 -2.969 3.550 -19.463
343 1HG LYS 46 HG2 LYS 46 -1.165 4.829 -17.337
344 2HG LYS 46 HG3 LYS 46 -1.661 5.641 -18.810
345 1HD LYS 46 HD2 LYS 46 -4.084 5.363 -18.062
346 2HD LYS 46 HD3 LYS 46 -3.466 4.765 -16.524
347 1HE LYS 46 HE2 LYS 46 -3.927 7.110 -16.321
348 2HE LYS 46 HE3 LYS 46 -2.171 6.870 -16.213
349 1HZ LYS 46 HZ1 LYS 46 -2.645 8.704 -17.585
350 2HZ LYS 46 HZ2 LYS 46 -2.175 7.563 -18.655
351 3HZ LYS 46 HZ3 LYS 46 -3.770 8.030 -18.382
352 H TRP 47 H TRP 47 -2.232 2.529 -15.603
353 HA TRP 47 HA TRP 47 -5.086 1.683 -15.613
354 1HB TRP 47 HB2 TRP 47 -3.087 1.009 -13.446
355 2HB TRP 47 HB3 TRP 47 -4.742 0.392 -13.618
356 HD1 TRP 47 HD1 TRP 47 -1.232 -0.344 -14.511
357 HE1 TRP 47 HE1 TRP 47 -1.031 -2.422 -15.956
358 HE3 TRP 47 HE3 TRP 47 -6.090 -0.677 -16.092
359 HZ2 TRP 47 HZ2 TRP 47 -2.699 -3.879 -17.816
360 HZ3 TRP 47 HZ3 TRP 47 -6.665 -2.279 -17.907
361 HH2 TRP 47 HH2 TRP 47 -4.996 -3.900 -18.729
362 H GLY 48 H GLY 48 -6.318 3.247 -14.534
363 1HA GLY 48 HA2 GLY 48 -4.857 5.249 -12.937
364 2HA GLY 48 HA3 GLY 48 -5.713 5.798 -14.397
365 H LEU 49 H LEU 49 -5.849 6.104 -11.459
366 HA LEU 49 HA LEU 49 -8.720 5.527 -11.000
367 1HB LEU 49 HB2 LEU 49 -6.305 4.953 -9.289
368 2HB LEU 49 HB3 LEU 49 -7.795 5.332 -8.483
369 HG LEU 49 HG LEU 49 -7.481 3.025 -8.598
370 1HD1 LEU 49 1HD1 LEU 49 -9.767 3.648 -10.513
371 2HD1 LEU 49 2HD1 LEU 49 -9.624 2.243 -9.465
372 3HD1 LEU 49 3HD1 LEU 49 -9.788 3.858 -8.745
373 1HD2 LEU 49 1HD2 LEU 49 -6.144 2.884 -10.749
374 2HD2 LEU 49 2HD2 LEU 49 -7.293 1.582 -10.404
375 3HD2 LEU 49 3HD2 LEU 49 -7.717 2.807 -11.594
376 H GLY 50 H GLY 50 -6.498 8.109 -11.270
377 1HA GLY 50 HA2 GLY 50 -8.495 9.924 -10.263
378 2HA GLY 50 HA3 GLY 50 -7.174 9.774 -9.115
379 H LEU 51 H LEU 51 -4.930 9.706 -10.927
380 HA LEU 51 HA LEU 51 -5.054 12.402 -12.222
381 1HB LEU 51 HB2 LEU 51 -2.844 11.107 -10.559
382 2HB LEU 51 HB3 LEU 51 -2.704 12.615 -11.420
383 HG LEU 51 HG LEU 51 -4.647 12.102 -9.110
384 1HD1 LEU 51 1HD1 LEU 51 -2.001 13.599 -9.215
385 2HD1 LEU 51 2HD1 LEU 51 -3.087 13.536 -7.793
386 3HD1 LEU 51 3HD1 LEU 51 -2.297 12.064 -8.403
387 1HD2 LEU 51 1HD2 LEU 51 -3.928 14.707 -10.491
388 2HD2 LEU 51 2HD2 LEU 51 -5.500 13.870 -10.582
389 3HD2 LEU 51 3HD2 LEU 51 -4.944 14.504 -9.030
390 H ASP 52 H ASP 52 -5.589 11.359 -14.184
391 HA ASP 52 HA ASP 52 -4.184 9.242 -15.347
392 1HB ASP 52 HB2 ASP 52 -6.425 10.212 -16.062
393 2HB ASP 52 HB3 ASP 52 -5.511 11.433 -16.962
Start of MODEL 11
1 1H GLY 1 H1 GLY 1 4.282 -2.108 -9.995
2 2H GLY 1 H2 GLY 1 5.324 -3.278 -9.509
3 3H GLY 1 H3 GLY 1 4.021 -3.669 -10.415
4 1HA GLY 1 HA2 GLY 1 3.543 -4.331 -8.222
5 2HA GLY 1 HA3 GLY 1 3.986 -2.698 -7.645
6 H GLN 2 H GLN 2 1.258 -4.366 -7.592
7 HA GLN 2 HA GLN 2 -0.406 -2.111 -8.388
8 1HB GLN 2 HB2 GLN 2 -1.911 -3.885 -9.625
9 2HB GLN 2 HB3 GLN 2 -0.596 -3.112 -10.455
10 1HG GLN 2 HG2 GLN 2 0.859 -5.091 -10.183
11 2HG GLN 2 HG3 GLN 2 -0.405 -5.924 -9.284
12 1HE2 GLN 2 2HE2 GLN 2 0.991 -5.831 -12.320
13 2HE2 GLN 2 1HE2 GLN 2 -0.387 -6.384 -13.247
14 H ASP 3 H ASP 3 -2.522 -2.239 -7.699
15 HA ASP 3 HA ASP 3 -3.520 -4.107 -5.688
16 1HB ASP 3 HB2 ASP 3 -2.328 -2.438 -4.346
17 2HB ASP 3 HB3 ASP 3 -3.037 -1.104 -5.259
18 H ARG 4 H ARG 4 -5.960 -3.348 -5.429
19 HA ARG 4 HA ARG 4 -7.047 -3.133 -8.096
20 1HB ARG 4 HB2 ARG 4 -9.273 -2.787 -6.780
21 2HB ARG 4 HB3 ARG 4 -8.473 -4.346 -6.908
22 1HG ARG 4 HG2 ARG 4 -9.365 -4.048 -4.710
23 2HG ARG 4 HG3 ARG 4 -7.623 -4.214 -4.672
24 1HD ARG 4 HD2 ARG 4 -8.017 -1.433 -4.765
25 2HD ARG 4 HD3 ARG 4 -9.368 -1.970 -3.780
26 HE ARG 4 HE ARG 4 -6.508 -2.016 -3.295
27 1HH1 ARG 4 1HH2 ARG 4 -9.552 -3.080 -1.941
28 2HH1 ARG 4 2HH2 ARG 4 -8.856 -3.858 -0.550
29 1HH2 ARG 4 1HH1 ARG 4 -5.549 -3.046 -1.630
30 2HH2 ARG 4 2HH1 ARG 4 -6.421 -3.680 -0.274
31 H PHE 5 H PHE 5 -6.137 -0.590 -5.879
32 HA PHE 5 HA PHE 5 -6.893 1.271 -8.011
33 1HB PHE 5 HB2 PHE 5 -7.909 2.894 -6.379
34 2HB PHE 5 HB3 PHE 5 -8.867 1.545 -6.876
35 HD1 PHE 5 HD1 PHE 5 -10.456 1.435 -5.144
36 HD2 PHE 5 HD2 PHE 5 -6.250 1.423 -4.128
37 HE1 PHE 5 HE1 PHE 5 -11.011 0.887 -2.817
38 HE2 PHE 5 HE2 PHE 5 -6.816 0.878 -1.811
39 HZ PHE 5 HZ PHE 5 -9.220 0.618 -1.112
40 H VAL 6 H VAL 6 -4.493 0.135 -6.228
41 HA VAL 6 HA VAL 6 -3.055 2.712 -6.224
42 HB VAL 6 HB VAL 6 -3.520 0.768 -3.999
43 1HG1 VAL 6 1HG1 VAL 6 -0.867 2.232 -4.239
44 2HG1 VAL 6 2HG1 VAL 6 -1.450 1.329 -2.825
45 3HG1 VAL 6 3HG1 VAL 6 -1.107 0.468 -4.343
46 1HG2 VAL 6 1HG2 VAL 6 -4.485 3.044 -4.076
47 2HG2 VAL 6 2HG2 VAL 6 -3.405 2.825 -2.681
48 3HG2 VAL 6 3HG2 VAL 6 -2.842 3.725 -4.122
49 H TYR 7 H TYR 7 -0.789 2.417 -6.528
50 HA TYR 7 HA TYR 7 0.154 -0.055 -7.832
51 1HB TYR 7 HB2 TYR 7 -0.228 2.709 -9.074
52 2HB TYR 7 HB3 TYR 7 0.648 1.420 -9.841
53 HD1 TYR 7 HD1 TYR 7 -0.815 -0.839 -10.168
54 HD2 TYR 7 HD2 TYR 7 -2.496 2.995 -9.231
55 HE1 TYR 7 HE1 TYR 7 -3.118 -1.699 -10.712
56 HE2 TYR 7 HE2 TYR 7 -4.747 2.132 -9.600
57 HH TYR 7 HH TYR 7 -5.387 -1.249 -10.463
58 H THR 8 H THR 8 2.540 0.765 -8.795
59 HA THR 8 HA THR 8 3.705 2.701 -6.865
60 HB THR 8 HB THR 8 5.833 1.180 -7.497
61 HG1 THR 8 HG1 THR 8 5.002 -0.370 -8.666
62 1HG2 THR 8 1HG2 THR 8 3.792 0.614 -5.341
63 2HG2 THR 8 2HG2 THR 8 5.374 -0.207 -5.428
64 3HG2 THR 8 3HG2 THR 8 5.321 1.544 -5.237
65 H CYS 9 H CYS 9 5.778 3.604 -7.795
66 HA CYS 9 HA CYS 9 5.738 3.853 -10.778
67 1HB CYS 9 HB2 CYS 9 5.521 6.140 -9.813
68 2HB CYS 9 HB3 CYS 9 6.869 5.821 -8.710
69 H ASN 10 H ASN 10 7.398 2.248 -11.287
70 HA ASN 10 HA ASN 10 9.161 1.415 -9.200
71 1HB ASN 10 HB2 ASN 10 8.338 -0.072 -11.036
72 2HB ASN 10 HB3 ASN 10 9.499 0.740 -12.123
73 1HD2 ASN 10 2HD2 ASN 10 11.179 -0.768 -12.333
74 2HD2 ASN 10 1HD2 ASN 10 11.952 -1.585 -10.973
75 H GLU 11 H GLU 11 9.194 4.281 -10.814
76 HA GLU 11 HA GLU 11 12.143 4.395 -10.741
77 1HB GLU 11 HB2 GLU 11 10.131 5.883 -12.294
78 2HB GLU 11 HB3 GLU 11 11.321 6.905 -11.520
79 1HG GLU 11 HG2 GLU 11 12.028 4.443 -13.221
80 2HG GLU 11 HG3 GLU 11 12.040 6.090 -13.838
81 H CYS 12 H CYS 12 9.270 5.370 -9.003
82 HA CYS 12 HA CYS 12 10.935 7.082 -7.226
83 1HB CYS 12 HB2 CYS 12 7.955 6.564 -7.067
84 2HB CYS 12 HB3 CYS 12 8.870 7.765 -6.191
85 H LYS 13 H LYS 13 9.485 3.980 -7.528
86 HA LYS 13 HA LYS 13 8.966 2.226 -6.211
87 1HB LYS 13 HB2 LYS 13 11.715 2.905 -5.073
88 2HB LYS 13 HB3 LYS 13 10.816 1.505 -4.583
89 1HG LYS 13 HG2 LYS 13 11.631 0.352 -6.295
90 2HG LYS 13 HG3 LYS 13 10.624 1.311 -7.355
91 1HD LYS 13 HD2 LYS 13 13.583 1.621 -6.757
92 2HD LYS 13 HD3 LYS 13 12.741 1.264 -8.287
93 1HE LYS 13 HE2 LYS 13 11.691 3.544 -8.090
94 2HE LYS 13 HE3 LYS 13 12.912 3.920 -6.857
95 1HZ LYS 13 HZ1 LYS 13 13.351 3.117 -9.678
96 2HZ LYS 13 HZ2 LYS 13 13.546 4.609 -9.081
97 3HZ LYS 13 HZ3 LYS 13 14.597 3.432 -8.628
98 H HIS 14 H HIS 14 7.556 4.204 -5.825
99 HA HIS 14 HA HIS 14 6.754 4.085 -3.004
100 1HB HIS 14 HB2 HIS 14 7.949 6.179 -3.199
101 2HB HIS 14 HB3 HIS 14 7.092 6.599 -4.692
102 HD2 HIS 14 HD2 HIS 14 5.320 8.370 -4.277
103 HE1 HIS 14 HE1 HIS 14 3.761 7.006 -0.556
104 HE2 HIS 14 HE2 HIS 14 3.489 8.722 -2.430
105 H HIS 15 H HIS 15 4.470 4.691 -2.886
106 HA HIS 15 HA HIS 15 2.914 3.348 -4.903
107 1HB HIS 15 HB2 HIS 15 2.273 4.578 -2.215
108 2HB HIS 15 HB3 HIS 15 0.997 4.035 -3.298
109 HD2 HIS 15 HD2 HIS 15 1.215 1.326 -4.132
110 HE1 HIS 15 HE1 HIS 15 2.739 0.181 -0.323
111 HE2 HIS 15 HE2 HIS 15 1.660 -0.661 -2.487
112 H VAL 16 H VAL 16 1.239 4.137 -6.120
113 HA VAL 16 HA VAL 16 0.696 7.010 -6.370
114 HB VAL 16 HB VAL 16 1.195 7.041 -8.742
115 1HG1 VAL 16 1HG1 VAL 16 3.575 6.457 -8.936
116 2HG1 VAL 16 2HG1 VAL 16 3.256 7.278 -7.381
117 3HG1 VAL 16 3HG1 VAL 16 3.527 5.513 -7.495
118 1HG2 VAL 16 1HG2 VAL 16 2.039 5.094 -10.019
119 2HG2 VAL 16 2HG2 VAL 16 1.754 4.031 -8.638
120 3HG2 VAL 16 3HG2 VAL 16 0.401 4.840 -9.463
121 H GLU 17 H GLU 17 -1.409 7.238 -7.703
122 HA GLU 17 HA GLU 17 -3.188 4.873 -7.239
123 1HB GLU 17 HB2 GLU 17 -4.936 6.729 -7.750
124 2HB GLU 17 HB3 GLU 17 -4.204 6.588 -6.154
125 1HG GLU 17 HG2 GLU 17 -4.420 8.955 -6.904
126 2HG GLU 17 HG3 GLU 17 -2.750 8.483 -6.571
127 H THR 18 H THR 18 -1.624 6.756 -9.695
128 HA THR 18 HA THR 18 -2.973 5.152 -11.798
129 HB THR 18 HB THR 18 -2.376 8.141 -11.719
130 HG1 THR 18 HG1 THR 18 -4.144 7.948 -10.705
131 1HG2 THR 18 1HG2 THR 18 -2.716 8.228 -13.971
132 2HG2 THR 18 2HG2 THR 18 -2.601 6.467 -14.059
133 3HG2 THR 18 3HG2 THR 18 -4.180 7.293 -13.857
134 H ARG 19 H ARG 19 -1.444 4.226 -13.239
135 HA ARG 19 HA ARG 19 1.296 5.328 -13.324
136 1HB ARG 19 HB2 ARG 19 2.400 3.270 -12.841
137 2HB ARG 19 HB3 ARG 19 1.262 3.506 -11.514
138 1HG ARG 19 HG2 ARG 19 -0.313 1.892 -12.485
139 2HG ARG 19 HG3 ARG 19 0.695 1.701 -13.923
140 1HD ARG 19 HD2 ARG 19 2.276 0.419 -12.962
141 2HD ARG 19 HD3 ARG 19 1.844 0.813 -11.323
142 HE ARG 19 HE ARG 19 -0.477 -0.248 -12.239
143 1HH1 ARG 19 1HH2 ARG 19 2.768 -1.732 -12.133
144 2HH1 ARG 19 2HH2 ARG 19 2.214 -3.266 -12.654
145 1HH2 ARG 19 1HH1 ARG 19 -1.155 -2.355 -13.044
146 2HH2 ARG 19 2HH1 ARG 19 0.066 -3.569 -13.232
147 H TRP 20 H TRP 20 2.579 4.181 -14.897
148 HA TRP 20 HA TRP 20 1.198 3.092 -17.317
149 1HB TRP 20 HB2 TRP 20 3.927 4.414 -16.937
150 2HB TRP 20 HB3 TRP 20 3.282 3.803 -18.443
151 HD1 TRP 20 HD1 TRP 20 3.015 6.762 -16.079
152 HE1 TRP 20 HE1 TRP 20 1.500 8.568 -17.041
153 HE3 TRP 20 HE3 TRP 20 1.495 4.370 -20.292
154 HZ2 TRP 20 HZ2 TRP 20 -0.413 8.834 -19.169
155 HZ3 TRP 20 HZ3 TRP 20 -0.210 5.423 -21.805
156 HH2 TRP 20 HH2 TRP 20 -1.174 7.652 -21.238
157 H HIS 21 H HIS 21 1.917 0.956 -17.733
158 HA HIS 21 HA HIS 21 3.847 -0.196 -15.800
159 1HB HIS 21 HB2 HIS 21 1.907 -0.758 -14.711
160 2HB HIS 21 HB3 HIS 21 0.926 -0.787 -16.158
161 HD2 HIS 21 HD2 HIS 21 4.029 -3.055 -15.948
162 HE1 HIS 21 HE1 HIS 21 0.621 -5.577 -15.648
163 HE2 HIS 21 HE2 HIS 21 3.146 -5.525 -15.913
164 H CYS 22 H CYS 22 5.326 -1.284 -16.837
165 HA CYS 22 HA CYS 22 5.289 -1.893 -19.649
166 1HB CYS 22 HB2 CYS 22 7.128 -1.827 -17.321
167 2HB CYS 22 HB3 CYS 22 7.424 -3.185 -18.378
168 H THR 23 H THR 23 4.431 -3.536 -20.549
169 HA THR 23 HA THR 23 3.943 -6.032 -18.964
170 HB THR 23 HB THR 23 2.247 -6.660 -20.666
171 HG1 THR 23 HG1 THR 23 3.142 -4.390 -21.833
172 1HG2 THR 23 1HG2 THR 23 1.973 -4.001 -19.275
173 2HG2 THR 23 2HG2 THR 23 0.615 -5.079 -19.752
174 3HG2 THR 23 3HG2 THR 23 1.726 -5.596 -18.479
175 H VAL 24 H VAL 24 6.310 -5.019 -20.353
176 HA VAL 24 HA VAL 24 7.313 -7.196 -22.019
177 HB VAL 24 HB VAL 24 7.388 -4.987 -22.922
178 1HG1 VAL 24 1HG1 VAL 24 7.012 -3.205 -21.786
179 2HG1 VAL 24 2HG1 VAL 24 7.475 -3.906 -20.250
180 3HG1 VAL 24 3HG1 VAL 24 8.718 -3.225 -21.255
181 1HG2 VAL 24 1HG2 VAL 24 9.643 -6.155 -23.027
182 2HG2 VAL 24 2HG2 VAL 24 9.743 -4.390 -23.099
183 3HG2 VAL 24 3HG2 VAL 24 10.105 -5.208 -21.572
184 H CYS 25 H CYS 25 8.272 -4.991 -19.441
185 HA CYS 25 HA CYS 25 10.266 -6.644 -18.227
186 1HB CYS 25 HB2 CYS 25 8.817 -4.250 -17.040
187 2HB CYS 25 HB3 CYS 25 10.444 -4.790 -16.667
188 H GLU 26 H GLU 26 10.050 -6.950 -15.686
189 HA GLU 26 HA GLU 26 7.688 -8.547 -15.094
190 1HB GLU 26 HB2 GLU 26 10.409 -8.145 -13.927
191 2HB GLU 26 HB3 GLU 26 9.106 -8.476 -12.766
192 1HG GLU 26 HG2 GLU 26 8.424 -10.448 -13.993
193 2HG GLU 26 HG3 GLU 26 9.731 -10.206 -15.176
194 H ASP 27 H ASP 27 6.023 -6.995 -15.116
195 HA ASP 27 HA ASP 27 4.651 -5.345 -14.344
196 1HB ASP 27 HB2 ASP 27 4.355 -7.291 -12.801
197 2HB ASP 27 HB3 ASP 27 5.432 -6.519 -11.666
198 H TYR 28 H TYR 28 7.126 -4.291 -14.893
199 HA TYR 28 HA TYR 28 8.021 -2.408 -12.889
200 1HB TYR 28 HB2 TYR 28 9.394 -3.338 -14.771
201 2HB TYR 28 HB3 TYR 28 8.397 -2.459 -15.907
202 HD1 TYR 28 HD1 TYR 28 11.426 -2.346 -14.043
203 HD2 TYR 28 HD2 TYR 28 8.318 0.135 -15.728
204 HE1 TYR 28 HE1 TYR 28 12.917 -0.403 -13.897
205 HE2 TYR 28 HE2 TYR 28 9.843 2.079 -15.624
206 HH TYR 28 HH TYR 28 13.121 1.887 -14.218
207 H ASP 29 H ASP 29 7.522 -0.186 -12.752
208 HA ASP 29 HA ASP 29 5.029 0.666 -14.164
209 1HB ASP 29 HB2 ASP 29 5.585 1.713 -11.414
210 2HB ASP 29 HB3 ASP 29 4.067 1.367 -12.233
211 H LEU 30 H LEU 30 4.704 3.002 -14.119
212 HA LEU 30 HA LEU 30 6.840 4.679 -13.061
213 1HB LEU 30 HB2 LEU 30 5.947 4.668 -15.979
214 2HB LEU 30 HB3 LEU 30 6.709 6.034 -15.182
215 HG LEU 30 HG LEU 30 7.943 3.276 -15.638
216 1HD1 LEU 30 1HD1 LEU 30 7.803 4.813 -17.615
217 2HD1 LEU 30 2HD1 LEU 30 8.826 5.972 -16.719
218 3HD1 LEU 30 3HD1 LEU 30 9.477 4.387 -17.130
219 1HD2 LEU 30 1HD2 LEU 30 9.222 5.761 -14.387
220 2HD2 LEU 30 2HD2 LEU 30 8.864 4.276 -13.507
221 3HD2 LEU 30 3HD2 LEU 30 10.086 4.257 -14.747
222 H CYS 31 H CYS 31 5.871 6.453 -12.045
223 HA CYS 31 HA CYS 31 3.062 6.996 -12.352
224 1HB CYS 31 HB2 CYS 31 3.535 9.002 -11.088
225 2HB CYS 31 HB3 CYS 31 4.347 7.686 -10.308
226 H ILE 32 H ILE 32 2.387 9.192 -13.119
227 HA ILE 32 HA ILE 32 2.843 9.349 -15.859
228 HB ILE 32 HB ILE 32 1.889 11.646 -14.075
229 1HG1 ILE 32 2HG1 ILE 32 0.495 9.746 -13.454
230 2HG1 ILE 32 3HG1 ILE 32 -0.438 10.882 -14.427
231 1HG2 ILE 32 1HG2 ILE 32 2.322 12.404 -16.272
232 2HG2 ILE 32 2HG2 ILE 32 1.562 10.977 -17.018
233 3HG2 ILE 32 3HG2 ILE 32 0.570 12.200 -16.181
234 1HD1 ILE 32 1HD1 ILE 32 0.613 8.165 -15.200
235 2HD1 ILE 32 2HD1 ILE 32 -1.046 8.742 -15.153
236 3HD1 ILE 32 3HD1 ILE 32 -0.015 9.364 -16.413
237 H ASN 33 H ASN 33 4.331 11.326 -13.312
238 HA ASN 33 HA ASN 33 5.764 13.035 -15.153
239 1HB ASN 33 HB2 ASN 33 5.546 13.848 -12.851
240 2HB ASN 33 HB3 ASN 33 6.097 12.322 -12.180
241 1HD2 ASN 33 2HD2 ASN 33 8.362 11.805 -12.105
242 2HD2 ASN 33 1HD2 ASN 33 9.541 13.079 -12.278
243 H CYS 34 H CYS 34 6.731 10.047 -13.474
244 HA CYS 34 HA CYS 34 9.403 10.130 -14.539
245 1HB CYS 34 HB2 CYS 34 7.732 8.007 -13.139
246 2HB CYS 34 HB3 CYS 34 9.325 7.679 -13.858
247 H TYR 35 H TYR 35 6.386 8.537 -15.628
248 HA TYR 35 HA TYR 35 7.543 7.182 -17.864
249 1HB TYR 35 HB2 TYR 35 5.276 6.749 -17.216
250 2HB TYR 35 HB3 TYR 35 4.790 8.413 -17.488
251 HD1 TYR 35 HD1 TYR 35 6.172 5.402 -19.233
252 HD2 TYR 35 HD2 TYR 35 3.981 9.089 -19.616
253 HE1 TYR 35 HE1 TYR 35 5.637 4.821 -21.579
254 HE2 TYR 35 HE2 TYR 35 3.483 8.543 -21.990
255 HH TYR 35 HH TYR 35 3.729 6.975 -23.710
256 H ASN 36 H ASN 36 6.173 10.450 -17.530
257 HA ASN 36 HA ASN 36 6.718 11.456 -20.089
258 1HB ASN 36 HB2 ASN 36 6.138 12.657 -17.362
259 2HB ASN 36 HB3 ASN 36 6.504 13.720 -18.673
260 1HD2 ASN 36 2HD2 ASN 36 4.108 14.188 -17.718
261 2HD2 ASN 36 1HD2 ASN 36 2.866 13.474 -18.735
262 H THR 37 H THR 37 9.050 10.862 -17.562
263 HA THR 37 HA THR 37 11.003 12.611 -19.047
264 HB THR 37 HB THR 37 12.130 13.023 -16.897
265 HG1 THR 37 HG1 THR 37 9.706 12.251 -15.719
266 1HG2 THR 37 1HG2 THR 37 10.610 14.798 -16.125
267 2HG2 THR 37 2HG2 THR 37 10.634 14.736 -17.897
268 3HG2 THR 37 3HG2 THR 37 9.263 14.070 -17.011
269 H LYS 38 H LYS 38 10.401 9.378 -17.977
270 HA LYS 38 HA LYS 38 13.219 8.807 -18.492
271 1HB LYS 38 HB2 LYS 38 11.245 7.217 -16.856
272 2HB LYS 38 HB3 LYS 38 12.799 6.601 -17.378
273 1HG LYS 38 HG2 LYS 38 13.408 7.485 -15.321
274 2HG LYS 38 HG3 LYS 38 13.803 8.805 -16.465
275 1HD LYS 38 HD2 LYS 38 12.008 10.040 -15.934
276 2HD LYS 38 HD3 LYS 38 11.191 8.747 -14.995
277 1HE LYS 38 HE2 LYS 38 13.797 9.962 -14.080
278 2HE LYS 38 HE3 LYS 38 12.242 10.772 -13.759
279 1HZ LYS 38 HZ1 LYS 38 12.777 9.405 -11.894
280 2HZ LYS 38 HZ2 LYS 38 11.531 8.699 -12.628
281 3HZ LYS 38 HZ3 LYS 38 13.070 8.119 -12.813
282 H SER 39 H SER 39 10.465 9.027 -20.150
283 HA SER 39 HA SER 39 9.428 8.019 -21.874
284 1HB SER 39 HB2 SER 39 12.278 8.398 -22.848
285 2HB SER 39 HB3 SER 39 10.809 8.516 -23.837
286 HG SER 39 HG SER 39 10.150 10.278 -22.434
287 H HIS 40 H HIS 40 9.515 5.859 -20.450
288 HA HIS 40 HA HIS 40 11.041 3.664 -21.458
289 1HB HIS 40 HB2 HIS 40 9.218 4.208 -19.334
290 2HB HIS 40 HB3 HIS 40 8.418 3.017 -20.319
291 HD1 HIS 40 HD1 HIS 40 11.475 3.291 -18.003
292 HD2 HIS 40 HD2 HIS 40 9.407 0.607 -20.463
293 HE1 HIS 40 HE1 HIS 40 12.283 0.961 -17.341
294 H THR 41 H THR 41 10.827 2.877 -23.463
295 HA THR 41 HA THR 41 8.538 3.725 -25.001
296 HB THR 41 HB THR 41 10.796 2.255 -26.264
297 HG1 THR 41 HG1 THR 41 11.241 4.662 -24.845
298 1HG2 THR 41 1HG2 THR 41 10.805 4.201 -27.788
299 2HG2 THR 41 2HG2 THR 41 9.178 3.516 -27.605
300 3HG2 THR 41 3HG2 THR 41 9.602 5.015 -26.752
301 H HIS 42 H HIS 42 8.945 0.875 -23.227
302 HA HIS 42 HA HIS 42 8.495 -1.034 -25.354
303 1HB HIS 42 HB2 HIS 42 8.099 -1.310 -22.382
304 2HB HIS 42 HB3 HIS 42 8.417 -2.599 -23.566
305 HD2 HIS 42 HD2 HIS 42 11.064 -1.185 -24.940
306 HE1 HIS 42 HE1 HIS 42 12.600 -1.115 -20.943
307 HE2 HIS 42 HE2 HIS 42 13.206 -0.945 -23.408
308 H LYS 43 H LYS 43 6.596 -2.661 -25.082
309 HA LYS 43 HA LYS 43 4.185 -1.126 -25.253
310 1HB LYS 43 HB2 LYS 43 4.625 -3.239 -26.600
311 2HB LYS 43 HB3 LYS 43 4.282 -4.145 -25.121
312 1HG LYS 43 HG2 LYS 43 2.148 -2.298 -25.234
313 2HG LYS 43 HG3 LYS 43 2.487 -2.546 -26.940
314 1HD LYS 43 HD2 LYS 43 0.739 -4.039 -26.393
315 2HD LYS 43 HD3 LYS 43 2.202 -5.035 -26.515
316 1HE LYS 43 HE2 LYS 43 0.976 -5.773 -24.590
317 2HE LYS 43 HE3 LYS 43 2.459 -4.971 -24.058
318 1HZ LYS 43 HZ1 LYS 43 -0.300 -3.883 -23.907
319 2HZ LYS 43 HZ2 LYS 43 0.737 -4.246 -22.694
320 3HZ LYS 43 HZ3 LYS 43 1.026 -2.972 -23.631
321 H MET 44 H MET 44 3.839 -0.143 -23.380
322 HA MET 44 HA MET 44 3.397 -1.578 -20.845
323 1HB MET 44 HB2 MET 44 3.380 1.310 -21.825
324 2HB MET 44 HB3 MET 44 2.791 0.890 -20.208
325 1HG MET 44 HG2 MET 44 4.740 0.140 -19.443
326 2HG MET 44 HG3 MET 44 5.498 -0.099 -21.024
327 1HE MET 44 HE1 MET 44 6.176 1.182 -18.014
328 2HE MET 44 HE2 MET 44 6.290 2.967 -17.966
329 3HE MET 44 HE3 MET 44 4.712 2.177 -17.948
330 H VAL 45 H VAL 45 1.365 -0.554 -19.740
331 HA VAL 45 HA VAL 45 -1.116 -0.430 -21.219
332 HB VAL 45 HB VAL 45 -2.089 -1.600 -19.230
333 1HG1 VAL 45 1HG1 VAL 45 -1.784 -3.867 -20.112
334 2HG1 VAL 45 2HG1 VAL 45 -1.850 -2.740 -21.469
335 3HG1 VAL 45 3HG1 VAL 45 -0.263 -3.379 -20.913
336 1HG2 VAL 45 1HG2 VAL 45 0.735 -2.520 -18.723
337 2HG2 VAL 45 2HG2 VAL 45 -0.315 -1.510 -17.707
338 3HG2 VAL 45 3HG2 VAL 45 -0.669 -3.244 -17.973
339 H LYS 46 H LYS 46 -2.629 0.626 -19.223
340 HA LYS 46 HA LYS 46 -1.033 2.283 -17.406
341 1HB LYS 46 HB2 LYS 46 -1.268 3.572 -19.565
342 2HB LYS 46 HB3 LYS 46 -3.032 3.521 -19.356
343 1HG LYS 46 HG2 LYS 46 -1.117 4.806 -17.352
344 2HG LYS 46 HG3 LYS 46 -1.756 5.633 -18.776
345 1HD LYS 46 HD2 LYS 46 -4.105 5.276 -17.860
346 2HD LYS 46 HD3 LYS 46 -3.350 4.709 -16.364
347 1HE LYS 46 HE2 LYS 46 -3.745 6.998 -16.024
348 2HE LYS 46 HE3 LYS 46 -2.004 6.852 -16.280
349 1HZ LYS 46 HZ1 LYS 46 -2.452 7.599 -18.610
350 2HZ LYS 46 HZ2 LYS 46 -4.045 7.798 -18.174
351 3HZ LYS 46 HZ3 LYS 46 -2.960 8.678 -17.456
352 H TRP 47 H TRP 47 -2.232 2.607 -15.563
353 HA TRP 47 HA TRP 47 -5.048 1.669 -15.508
354 1HB TRP 47 HB2 TRP 47 -2.947 1.021 -13.392
355 2HB TRP 47 HB3 TRP 47 -4.595 0.412 -13.469
356 HD1 TRP 47 HD1 TRP 47 -1.140 -0.323 -14.483
357 HE1 TRP 47 HE1 TRP 47 -0.962 -2.425 -15.937
358 HE3 TRP 47 HE3 TRP 47 -6.015 -0.680 -15.896
359 HZ2 TRP 47 HZ2 TRP 47 -2.679 -3.857 -17.785
360 HZ3 TRP 47 HZ3 TRP 47 -6.647 -2.277 -17.725
361 HH2 TRP 47 HH2 TRP 47 -5.008 -3.877 -18.612
362 H GLY 48 H GLY 48 -6.269 3.298 -14.407
363 1HA GLY 48 HA2 GLY 48 -4.738 5.319 -12.934
364 2HA GLY 48 HA3 GLY 48 -5.665 5.803 -14.398
365 H LEU 49 H LEU 49 -5.920 6.403 -11.512
366 HA LEU 49 HA LEU 49 -8.760 5.768 -11.246
367 1HB LEU 49 HB2 LEU 49 -6.756 4.301 -9.887
368 2HB LEU 49 HB3 LEU 49 -7.405 5.351 -8.660
369 HG LEU 49 HG LEU 49 -8.470 3.211 -8.726
370 1HD1 LEU 49 1HD1 LEU 49 -10.794 3.842 -8.650
371 2HD1 LEU 49 2HD1 LEU 49 -9.800 5.154 -7.996
372 3HD1 LEU 49 3HD1 LEU 49 -10.491 5.300 -9.634
373 1HD2 LEU 49 1HD2 LEU 49 -9.678 3.751 -11.430
374 2HD2 LEU 49 2HD2 LEU 49 -8.268 2.692 -11.124
375 3HD2 LEU 49 3HD2 LEU 49 -9.839 2.295 -10.420
376 H GLY 50 H GLY 50 -6.353 8.193 -11.009
377 1HA GLY 50 HA2 GLY 50 -8.346 9.918 -9.671
378 2HA GLY 50 HA3 GLY 50 -6.771 9.683 -8.864
379 H LEU 51 H LEU 51 -5.088 9.701 -11.163
380 HA LEU 51 HA LEU 51 -5.487 12.416 -12.322
381 1HB LEU 51 HB2 LEU 51 -3.025 11.242 -10.959
382 2HB LEU 51 HB3 LEU 51 -3.010 12.747 -11.877
383 HG LEU 51 HG LEU 51 -4.678 12.282 -9.340
384 1HD1 LEU 51 1HD1 LEU 51 -2.995 13.627 -8.154
385 2HD1 LEU 51 2HD1 LEU 51 -2.313 12.138 -8.826
386 3HD1 LEU 51 3HD1 LEU 51 -1.998 13.683 -9.641
387 1HD2 LEU 51 1HD2 LEU 51 -5.587 14.081 -10.774
388 2HD2 LEU 51 2HD2 LEU 51 -4.871 14.781 -9.330
389 3HD2 LEU 51 3HD2 LEU 51 -3.975 14.833 -10.862
390 H ASP 52 H ASP 52 -6.311 10.679 -13.962
391 HA ASP 52 HA ASP 52 -4.434 8.917 -15.186
392 1HB ASP 52 HB2 ASP 52 -6.993 8.766 -15.243
393 2HB ASP 52 HB3 ASP 52 -6.946 9.945 -16.550
Start of MODEL 12
1 1H GLY 1 H1 GLY 1 4.390 -2.080 -9.870
2 2H GLY 1 H2 GLY 1 5.562 -3.187 -9.547
3 3H GLY 1 H3 GLY 1 4.193 -3.625 -10.344
4 1HA GLY 1 HA2 GLY 1 4.038 -4.422 -8.116
5 2HA GLY 1 HA3 GLY 1 4.292 -2.752 -7.547
6 H GLN 2 H GLN 2 1.883 -4.606 -7.145
7 HA GLN 2 HA GLN 2 -0.106 -2.631 -7.933
8 1HB GLN 2 HB2 GLN 2 -1.442 -4.076 -9.221
9 2HB GLN 2 HB3 GLN 2 0.158 -4.277 -9.876
10 1HG GLN 2 HG2 GLN 2 -1.429 -6.211 -8.169
11 2HG GLN 2 HG3 GLN 2 -0.910 -6.387 -9.851
12 1HE2 GLN 2 2HE2 GLN 2 1.937 -6.022 -9.775
13 2HE2 GLN 2 1HE2 GLN 2 2.537 -7.200 -8.642
14 H ASP 3 H ASP 3 -2.269 -3.045 -7.090
15 HA ASP 3 HA ASP 3 -2.638 -4.708 -4.721
16 1HB ASP 3 HB2 ASP 3 -1.375 -2.568 -4.049
17 2HB ASP 3 HB3 ASP 3 -2.855 -1.700 -4.517
18 H ARG 4 H ARG 4 -5.018 -3.177 -3.897
19 HA ARG 4 HA ARG 4 -6.907 -4.079 -5.875
20 1HB ARG 4 HB2 ARG 4 -7.262 -2.252 -3.460
21 2HB ARG 4 HB3 ARG 4 -8.558 -2.985 -4.390
22 1HG ARG 4 HG2 ARG 4 -8.592 -4.614 -2.913
23 2HG ARG 4 HG3 ARG 4 -7.162 -5.246 -3.703
24 1HD ARG 4 HD2 ARG 4 -6.731 -3.204 -1.521
25 2HD ARG 4 HD3 ARG 4 -7.407 -4.757 -1.009
26 HE ARG 4 HE ARG 4 -4.738 -4.126 -1.860
27 1HH1 ARG 4 1HH2 ARG 4 -6.954 -6.837 -1.356
28 2HH1 ARG 4 2HH2 ARG 4 -5.675 -8.025 -1.388
29 1HH2 ARG 4 2HH1 ARG 4 -3.161 -5.599 -1.884
30 2HH2 ARG 4 1HH1 ARG 4 -3.398 -7.301 -1.826
31 H PHE 5 H PHE 5 -5.750 -0.848 -4.859
32 HA PHE 5 HA PHE 5 -6.416 0.291 -7.489
33 1HB PHE 5 HB2 PHE 5 -7.584 2.264 -6.329
34 2HB PHE 5 HB3 PHE 5 -8.490 0.779 -6.437
35 HD1 PHE 5 HD1 PHE 5 -6.444 2.787 -4.079
36 HD2 PHE 5 HD2 PHE 5 -9.347 -0.340 -4.551
37 HE1 PHE 5 HE1 PHE 5 -6.715 2.690 -1.611
38 HE2 PHE 5 HE2 PHE 5 -9.637 -0.443 -2.087
39 HZ PHE 5 HZ PHE 5 -8.296 1.059 -0.603
40 H VAL 6 H VAL 6 -4.056 -0.426 -5.778
41 HA VAL 6 HA VAL 6 -2.652 2.170 -5.787
42 HB VAL 6 HB VAL 6 -3.221 0.307 -3.496
43 1HG1 VAL 6 1HG1 VAL 6 -1.219 0.809 -2.298
44 2HG1 VAL 6 2HG1 VAL 6 -0.832 -0.136 -3.733
45 3HG1 VAL 6 3HG1 VAL 6 -0.483 1.610 -3.704
46 1HG2 VAL 6 1HG2 VAL 6 -2.561 3.269 -3.780
47 2HG2 VAL 6 2HG2 VAL 6 -4.163 2.534 -3.592
48 3HG2 VAL 6 3HG2 VAL 6 -3.006 2.426 -2.250
49 H TYR 7 H TYR 7 -0.502 1.934 -6.309
50 HA TYR 7 HA TYR 7 0.618 -0.621 -7.200
51 1HB TYR 7 HB2 TYR 7 0.171 1.803 -8.985
52 2HB TYR 7 HB3 TYR 7 0.814 0.211 -9.462
53 HD1 TYR 7 HD1 TYR 7 -0.718 -1.723 -9.739
54 HD2 TYR 7 HD2 TYR 7 -2.216 2.215 -8.809
55 HE1 TYR 7 HE1 TYR 7 -3.066 -2.546 -10.006
56 HE2 TYR 7 HE2 TYR 7 -4.498 1.404 -8.970
57 HH TYR 7 HH TYR 7 -5.304 -2.013 -9.576
58 H THR 8 H THR 8 2.728 0.663 -8.569
59 HA THR 8 HA THR 8 3.796 2.709 -6.698
60 HB THR 8 HB THR 8 6.018 1.305 -7.315
61 HG1 THR 8 HG1 THR 8 5.160 -0.269 -8.525
62 1HG2 THR 8 1HG2 THR 8 4.048 0.548 -5.116
63 2HG2 THR 8 2HG2 THR 8 5.716 -0.093 -5.275
64 3HG2 THR 8 3HG2 THR 8 5.445 1.622 -5.009
65 H CYS 9 H CYS 9 5.797 3.743 -7.686
66 HA CYS 9 HA CYS 9 5.785 3.833 -10.674
67 1HB CYS 9 HB2 CYS 9 5.555 6.186 -9.755
68 2HB CYS 9 HB3 CYS 9 6.873 5.866 -8.628
69 H ASN 10 H ASN 10 7.284 2.185 -11.047
70 HA ASN 10 HA ASN 10 9.097 1.393 -9.026
71 1HB ASN 10 HB2 ASN 10 8.159 -0.039 -10.894
72 2HB ASN 10 HB3 ASN 10 9.415 0.683 -11.940
73 1HD2 ASN 10 2HD2 ASN 10 10.889 -0.954 -12.137
74 2HD2 ASN 10 1HD2 ASN 10 11.578 -1.849 -10.771
75 H GLU 11 H GLU 11 9.177 4.257 -10.681
76 HA GLU 11 HA GLU 11 12.098 4.243 -10.637
77 1HB GLU 11 HB2 GLU 11 10.236 5.710 -12.282
78 2HB GLU 11 HB3 GLU 11 11.301 6.822 -11.422
79 1HG GLU 11 HG2 GLU 11 12.347 4.409 -12.942
80 2HG GLU 11 HG3 GLU 11 12.312 6.027 -13.595
81 H CYS 12 H CYS 12 9.285 5.404 -8.934
82 HA CYS 12 HA CYS 12 10.969 7.164 -7.219
83 1HB CYS 12 HB2 CYS 12 7.988 6.618 -7.036
84 2HB CYS 12 HB3 CYS 12 8.895 7.890 -6.197
85 H LYS 13 H LYS 13 9.480 4.070 -7.393
86 HA LYS 13 HA LYS 13 9.117 2.291 -6.035
87 1HB LYS 13 HB2 LYS 13 11.860 3.128 -5.047
88 2HB LYS 13 HB3 LYS 13 10.984 1.763 -4.352
89 1HG LYS 13 HG2 LYS 13 11.737 0.456 -5.985
90 2HG LYS 13 HG3 LYS 13 10.663 1.293 -7.081
91 1HD LYS 13 HD2 LYS 13 13.635 1.616 -6.711
92 2HD LYS 13 HD3 LYS 13 12.660 1.226 -8.140
93 1HE LYS 13 HE2 LYS 13 11.730 3.574 -8.049
94 2HE LYS 13 HE3 LYS 13 12.947 3.969 -6.846
95 1HZ LYS 13 HZ1 LYS 13 13.630 4.540 -9.072
96 2HZ LYS 13 HZ2 LYS 13 14.637 3.374 -8.553
97 3HZ LYS 13 HZ3 LYS 13 13.390 3.058 -9.613
98 H HIS 14 H HIS 14 7.756 4.485 -5.634
99 HA HIS 14 HA HIS 14 6.876 4.129 -2.870
100 1HB HIS 14 HB2 HIS 14 7.945 6.346 -2.941
101 2HB HIS 14 HB3 HIS 14 6.975 6.787 -4.366
102 HD2 HIS 14 HD2 HIS 14 4.738 7.942 -3.882
103 HE1 HIS 14 HE1 HIS 14 3.769 6.203 -0.121
104 HE2 HIS 14 HE2 HIS 14 2.950 7.732 -2.002
105 H HIS 15 H HIS 15 4.539 4.746 -2.787
106 HA HIS 15 HA HIS 15 3.134 3.214 -4.753
107 1HB HIS 15 HB2 HIS 15 1.819 2.867 -3.024
108 2HB HIS 15 HB3 HIS 15 2.659 4.064 -2.055
109 HD2 HIS 15 HD2 HIS 15 -0.355 3.740 -4.429
110 HE1 HIS 15 HE1 HIS 15 -0.757 7.510 -2.490
111 HE2 HIS 15 HE2 HIS 15 -1.863 5.887 -4.115
112 H VAL 16 H VAL 16 1.424 3.818 -6.079
113 HA VAL 16 HA VAL 16 0.707 6.589 -6.451
114 HB VAL 16 HB VAL 16 1.204 6.738 -8.808
115 1HG1 VAL 16 1HG1 VAL 16 3.140 7.349 -7.492
116 2HG1 VAL 16 2HG1 VAL 16 3.718 5.649 -7.478
117 3HG1 VAL 16 3HG1 VAL 16 3.600 6.505 -9.002
118 1HG2 VAL 16 1HG2 VAL 16 2.045 3.828 -8.604
119 2HG2 VAL 16 2HG2 VAL 16 0.693 4.486 -9.528
120 3HG2 VAL 16 3HG2 VAL 16 2.339 4.864 -10.038
121 H GLU 17 H GLU 17 -1.398 6.700 -7.659
122 HA GLU 17 HA GLU 17 -2.899 4.164 -7.419
123 1HB GLU 17 HB2 GLU 17 -4.730 5.399 -6.917
124 2HB GLU 17 HB3 GLU 17 -3.455 6.297 -6.132
125 1HG GLU 17 HG2 GLU 17 -4.984 6.987 -8.677
126 2HG GLU 17 HG3 GLU 17 -5.014 7.868 -7.167
127 H THR 18 H THR 18 -1.703 6.483 -9.694
128 HA THR 18 HA THR 18 -3.068 5.092 -11.926
129 HB THR 18 HB THR 18 -2.419 8.066 -11.624
130 HG1 THR 18 HG1 THR 18 -4.114 7.992 -10.675
131 1HG2 THR 18 1HG2 THR 18 -2.593 6.698 -14.090
132 2HG2 THR 18 2HG2 THR 18 -4.268 7.250 -13.805
133 3HG2 THR 18 3HG2 THR 18 -2.991 8.416 -13.843
134 H ARG 19 H ARG 19 -1.572 4.391 -13.486
135 HA ARG 19 HA ARG 19 1.212 5.414 -13.429
136 1HB ARG 19 HB2 ARG 19 2.255 3.394 -12.855
137 2HB ARG 19 HB3 ARG 19 1.005 3.658 -11.641
138 1HG ARG 19 HG2 ARG 19 -0.470 2.133 -13.291
139 2HG ARG 19 HG3 ARG 19 1.122 1.600 -13.882
140 1HD ARG 19 HD2 ARG 19 1.069 1.626 -11.012
141 2HD ARG 19 HD3 ARG 19 -0.382 0.781 -11.606
142 HE ARG 19 HE ARG 19 2.456 0.001 -11.865
143 1HH1 ARG 19 1HH1 ARG 19 -0.910 -1.111 -12.208
144 2HH1 ARG 19 2HH1 ARG 19 -0.399 -2.686 -12.717
145 1HH2 ARG 19 1HH2 ARG 19 3.006 -2.026 -12.229
146 2HH2 ARG 19 2HH2 ARG 19 1.934 -3.271 -12.663
147 H TRP 20 H TRP 20 2.555 4.319 -14.975
148 HA TRP 20 HA TRP 20 1.264 3.221 -17.425
149 1HB TRP 20 HB2 TRP 20 3.921 4.598 -16.936
150 2HB TRP 20 HB3 TRP 20 3.346 3.970 -18.497
151 HD1 TRP 20 HD1 TRP 20 2.685 6.802 -15.972
152 HE1 TRP 20 HE1 TRP 20 1.015 8.458 -16.885
153 HE3 TRP 20 HE3 TRP 20 1.703 4.533 -20.417
154 HZ2 TRP 20 HZ2 TRP 20 -0.690 8.754 -19.225
155 HZ3 TRP 20 HZ3 TRP 20 0.065 5.574 -22.019
156 HH2 TRP 20 HH2 TRP 20 -1.146 7.636 -21.409
157 H HIS 21 H HIS 21 1.870 1.043 -17.739
158 HA HIS 21 HA HIS 21 3.748 -0.147 -15.752
159 1HB HIS 21 HB2 HIS 21 1.770 -0.546 -14.705
160 2HB HIS 21 HB3 HIS 21 0.837 -0.621 -16.185
161 HD2 HIS 21 HD2 HIS 21 3.794 -3.082 -16.026
162 HE1 HIS 21 HE1 HIS 21 0.328 -5.327 -15.082
163 HE2 HIS 21 HE2 HIS 21 2.811 -5.444 -15.660
164 H CYS 22 H CYS 22 5.238 -1.245 -16.779
165 HA CYS 22 HA CYS 22 5.216 -1.873 -19.596
166 1HB CYS 22 HB2 CYS 22 7.041 -1.777 -17.279
167 2HB CYS 22 HB3 CYS 22 7.351 -3.128 -18.345
168 H THR 23 H THR 23 4.397 -3.534 -20.497
169 HA THR 23 HA THR 23 3.930 -6.006 -18.902
170 HB THR 23 HB THR 23 2.248 -6.695 -20.594
171 HG1 THR 23 HG1 THR 23 3.123 -4.427 -21.815
172 1HG2 THR 23 1HG2 THR 23 1.920 -4.017 -19.274
173 2HG2 THR 23 2HG2 THR 23 0.572 -5.137 -19.664
174 3HG2 THR 23 3HG2 THR 23 1.753 -5.556 -18.425
175 H VAL 24 H VAL 24 6.288 -4.926 -20.384
176 HA VAL 24 HA VAL 24 7.367 -7.152 -21.948
177 HB VAL 24 HB VAL 24 7.489 -4.956 -22.883
178 1HG1 VAL 24 1HG1 VAL 24 7.436 -3.834 -20.238
179 2HG1 VAL 24 2HG1 VAL 24 8.682 -3.129 -21.214
180 3HG1 VAL 24 3HG1 VAL 24 6.998 -3.184 -21.803
181 1HG2 VAL 24 1HG2 VAL 24 9.736 -6.097 -22.910
182 2HG2 VAL 24 2HG2 VAL 24 9.847 -4.325 -22.923
183 3HG2 VAL 24 3HG2 VAL 24 10.121 -5.196 -21.404
184 H CYS 25 H CYS 25 8.163 -4.898 -19.368
185 HA CYS 25 HA CYS 25 10.122 -6.499 -18.001
186 1HB CYS 25 HB2 CYS 25 8.633 -4.040 -17.024
187 2HB CYS 25 HB3 CYS 25 10.214 -4.568 -16.489
188 H GLU 26 H GLU 26 9.923 -6.660 -15.647
189 HA GLU 26 HA GLU 26 7.863 -8.450 -14.948
190 1HB GLU 26 HB2 GLU 26 10.490 -8.173 -14.354
191 2HB GLU 26 HB3 GLU 26 9.828 -7.413 -12.912
192 1HG GLU 26 HG2 GLU 26 8.290 -9.535 -12.842
193 2HG GLU 26 HG3 GLU 26 9.393 -10.177 -14.079
194 H ASP 27 H ASP 27 6.104 -6.709 -15.316
195 HA ASP 27 HA ASP 27 4.497 -5.296 -14.570
196 1HB ASP 27 HB2 ASP 27 3.970 -7.160 -13.074
197 2HB ASP 27 HB3 ASP 27 5.132 -6.550 -11.884
198 H TYR 28 H TYR 28 7.084 -4.322 -14.847
199 HA TYR 28 HA TYR 28 7.885 -2.446 -12.864
200 1HB TYR 28 HB2 TYR 28 9.325 -3.294 -14.746
201 2HB TYR 28 HB3 TYR 28 8.334 -2.391 -15.881
202 HD1 TYR 28 HD1 TYR 28 11.270 -2.341 -13.905
203 HD2 TYR 28 HD2 TYR 28 8.265 0.183 -15.684
204 HE1 TYR 28 HE1 TYR 28 12.707 -0.325 -13.496
205 HE2 TYR 28 HE2 TYR 28 9.645 2.158 -15.259
206 HH TYR 28 HH TYR 28 11.491 2.973 -14.000
207 H ASP 29 H ASP 29 7.440 -0.220 -12.683
208 HA ASP 29 HA ASP 29 4.998 0.727 -14.136
209 1HB ASP 29 HB2 ASP 29 5.588 1.727 -11.382
210 2HB ASP 29 HB3 ASP 29 4.051 1.415 -12.149
211 H LEU 30 H LEU 30 4.726 3.042 -14.142
212 HA LEU 30 HA LEU 30 6.863 4.695 -13.004
213 1HB LEU 30 HB2 LEU 30 5.962 4.746 -15.931
214 2HB LEU 30 HB3 LEU 30 6.717 6.089 -15.116
215 HG LEU 30 HG LEU 30 7.945 3.340 -15.649
216 1HD1 LEU 30 1HD1 LEU 30 7.811 4.825 -17.576
217 2HD1 LEU 30 2HD1 LEU 30 8.742 6.061 -16.670
218 3HD1 LEU 30 3HD1 LEU 30 9.485 4.493 -17.084
219 1HD2 LEU 30 1HD2 LEU 30 9.162 5.781 -14.270
220 2HD2 LEU 30 2HD2 LEU 30 8.930 4.216 -13.503
221 3HD2 LEU 30 3HD2 LEU 30 10.125 4.375 -14.798
222 H CYS 31 H CYS 31 5.892 6.493 -11.995
223 HA CYS 31 HA CYS 31 3.069 6.986 -12.153
224 1HB CYS 31 HB2 CYS 31 3.603 9.078 -11.047
225 2HB CYS 31 HB3 CYS 31 4.381 7.773 -10.215
226 H ILE 32 H ILE 32 2.356 9.217 -12.953
227 HA ILE 32 HA ILE 32 2.722 9.313 -15.706
228 HB ILE 32 HB ILE 32 1.841 11.668 -13.972
229 1HG1 ILE 32 2HG1 ILE 32 0.484 9.876 -13.142
230 2HG1 ILE 32 3HG1 ILE 32 -0.486 10.874 -14.197
231 1HG2 ILE 32 1HG2 ILE 32 1.358 10.852 -16.857
232 2HG2 ILE 32 2HG2 ILE 32 0.443 12.133 -16.013
233 3HG2 ILE 32 3HG2 ILE 32 2.195 12.298 -16.218
234 1HD1 ILE 32 1HD1 ILE 32 -0.944 8.489 -14.492
235 2HD1 ILE 32 2HD1 ILE 32 -0.332 9.209 -15.982
236 3HD1 ILE 32 3HD1 ILE 32 0.721 8.178 -14.929
237 H ASN 33 H ASN 33 4.324 11.279 -13.216
238 HA ASN 33 HA ASN 33 5.661 13.039 -15.060
239 1HB ASN 33 HB2 ASN 33 5.501 13.842 -12.784
240 2HB ASN 33 HB3 ASN 33 5.976 12.286 -12.103
241 1HD2 ASN 33 2HD2 ASN 33 8.198 11.793 -11.766
242 2HD2 ASN 33 1HD2 ASN 33 9.414 13.028 -12.038
243 H CYS 34 H CYS 34 6.727 10.023 -13.459
244 HA CYS 34 HA CYS 34 9.365 10.180 -14.579
245 1HB CYS 34 HB2 CYS 34 7.787 7.930 -13.308
246 2HB CYS 34 HB3 CYS 34 9.396 7.740 -14.037
247 H TYR 35 H TYR 35 6.321 8.532 -15.628
248 HA TYR 35 HA TYR 35 7.437 7.272 -17.871
249 1HB TYR 35 HB2 TYR 35 5.162 6.874 -17.101
250 2HB TYR 35 HB3 TYR 35 4.658 8.476 -17.566
251 HD1 TYR 35 HD1 TYR 35 6.483 5.545 -19.097
252 HD2 TYR 35 HD2 TYR 35 3.451 8.557 -19.603
253 HE1 TYR 35 HE1 TYR 35 6.072 4.711 -21.388
254 HE2 TYR 35 HE2 TYR 35 3.041 7.728 -21.919
255 HH TYR 35 HH TYR 35 4.921 4.996 -23.296
256 H ASN 36 H ASN 36 6.194 10.581 -17.514
257 HA ASN 36 HA ASN 36 6.543 11.560 -20.108
258 1HB ASN 36 HB2 ASN 36 6.109 12.660 -17.374
259 2HB ASN 36 HB3 ASN 36 6.804 13.807 -18.463
260 1HD2 ASN 36 2HD2 ASN 36 4.000 11.805 -17.879
261 2HD2 ASN 36 1HD2 ASN 36 2.935 12.631 -19.021
262 H THR 37 H THR 37 9.106 10.751 -17.928
263 HA THR 37 HA THR 37 10.958 12.523 -19.518
264 HB THR 37 HB THR 37 12.311 12.656 -17.376
265 HG1 THR 37 HG1 THR 37 9.881 12.090 -16.081
266 1HG2 THR 37 1HG2 THR 37 10.977 14.572 -18.161
267 2HG2 THR 37 2HG2 THR 37 9.546 13.954 -17.330
268 3HG2 THR 37 3HG2 THR 37 10.966 14.484 -16.395
269 H LYS 38 H LYS 38 10.683 9.570 -17.599
270 HA LYS 38 HA LYS 38 13.249 8.517 -18.274
271 1HB LYS 38 HB2 LYS 38 10.803 7.046 -17.262
272 2HB LYS 38 HB3 LYS 38 12.459 6.505 -17.156
273 1HG LYS 38 HG2 LYS 38 11.307 8.987 -15.763
274 2HG LYS 38 HG3 LYS 38 11.420 7.417 -15.022
275 1HD LYS 38 HD2 LYS 38 13.831 7.620 -14.896
276 2HD LYS 38 HD3 LYS 38 13.832 8.994 -16.035
277 1HE LYS 38 HE2 LYS 38 14.117 9.901 -13.834
278 2HE LYS 38 HE3 LYS 38 12.520 10.348 -14.414
279 1HZ LYS 38 HZ1 LYS 38 12.554 9.608 -12.084
280 2HZ LYS 38 HZ2 LYS 38 11.570 8.669 -12.952
281 3HZ LYS 38 HZ3 LYS 38 13.093 8.154 -12.541
282 H SER 39 H SER 39 10.763 9.000 -20.391
283 HA SER 39 HA SER 39 10.012 8.040 -22.294
284 1HB SER 39 HB2 SER 39 13.022 7.941 -22.676
285 2HB SER 39 HB3 SER 39 11.800 8.156 -23.953
286 HG SER 39 HG SER 39 12.432 9.916 -21.831
287 H HIS 40 H HIS 40 9.639 5.969 -20.636
288 HA HIS 40 HA HIS 40 10.982 3.550 -21.413
289 1HB HIS 40 HB2 HIS 40 9.154 4.382 -19.409
290 2HB HIS 40 HB3 HIS 40 8.271 3.188 -20.338
291 HD1 HIS 40 HD1 HIS 40 11.249 3.449 -17.965
292 HD2 HIS 40 HD2 HIS 40 9.289 0.708 -20.457
293 HE1 HIS 40 HE1 HIS 40 11.977 1.125 -17.181
294 H THR 41 H THR 41 10.858 2.847 -23.405
295 HA THR 41 HA THR 41 8.701 3.708 -25.128
296 HB THR 41 HB THR 41 10.904 2.060 -26.229
297 HG1 THR 41 HG1 THR 41 11.618 4.334 -24.711
298 1HG2 THR 41 1HG2 THR 41 11.281 4.059 -27.654
299 2HG2 THR 41 2HG2 THR 41 9.570 3.608 -27.637
300 3HG2 THR 41 3HG2 THR 41 10.132 4.992 -26.660
301 H HIS 42 H HIS 42 8.940 0.964 -23.246
302 HA HIS 42 HA HIS 42 8.491 -1.008 -25.300
303 1HB HIS 42 HB2 HIS 42 8.014 -1.182 -22.333
304 2HB HIS 42 HB3 HIS 42 8.348 -2.497 -23.493
305 HD2 HIS 42 HD2 HIS 42 11.032 -1.225 -24.827
306 HE1 HIS 42 HE1 HIS 42 12.523 -1.179 -20.834
307 HE2 HIS 42 HE2 HIS 42 13.172 -1.082 -23.303
308 H LYS 43 H LYS 43 6.596 -2.597 -25.035
309 HA LYS 43 HA LYS 43 4.182 -1.077 -25.304
310 1HB LYS 43 HB2 LYS 43 4.727 -3.170 -26.636
311 2HB LYS 43 HB3 LYS 43 4.338 -4.113 -25.213
312 1HG LYS 43 HG2 LYS 43 2.142 -2.323 -25.497
313 2HG LYS 43 HG3 LYS 43 2.577 -2.701 -27.145
314 1HD LYS 43 HD2 LYS 43 0.858 -4.215 -26.443
315 2HD LYS 43 HD3 LYS 43 2.362 -5.152 -26.557
316 1HE LYS 43 HE2 LYS 43 1.259 -5.835 -24.519
317 2HE LYS 43 HE3 LYS 43 2.646 -4.850 -24.076
318 1HZ LYS 43 HZ1 LYS 43 0.913 -4.203 -22.766
319 2HZ LYS 43 HZ2 LYS 43 1.085 -2.967 -23.754
320 3HZ LYS 43 HZ3 LYS 43 -0.178 -3.998 -24.000
321 H MET 44 H MET 44 3.845 -0.107 -23.382
322 HA MET 44 HA MET 44 3.425 -1.604 -20.889
323 1HB MET 44 HB2 MET 44 3.358 1.312 -21.851
324 2HB MET 44 HB3 MET 44 2.751 0.907 -20.242
325 1HG MET 44 HG2 MET 44 4.743 0.134 -19.465
326 2HG MET 44 HG3 MET 44 5.456 -0.122 -21.036
327 1HE MET 44 HE1 MET 44 6.154 1.190 -18.037
328 2HE MET 44 HE2 MET 44 6.384 2.942 -18.029
329 3HE MET 44 HE3 MET 44 4.748 2.234 -17.964
330 H VAL 45 H VAL 45 1.369 -0.547 -19.718
331 HA VAL 45 HA VAL 45 -1.104 -0.413 -21.229
332 HB VAL 45 HB VAL 45 -2.088 -1.607 -19.275
333 1HG1 VAL 45 1HG1 VAL 45 -1.859 -3.830 -20.212
334 2HG1 VAL 45 2HG1 VAL 45 -1.742 -2.696 -21.556
335 3HG1 VAL 45 3HG1 VAL 45 -0.259 -3.441 -20.918
336 1HG2 VAL 45 1HG2 VAL 45 -0.321 -1.558 -17.685
337 2HG2 VAL 45 2HG2 VAL 45 -0.743 -3.270 -18.015
338 3HG2 VAL 45 3HG2 VAL 45 0.709 -2.558 -18.698
339 H LYS 46 H LYS 46 -2.637 0.665 -19.279
340 HA LYS 46 HA LYS 46 -1.054 2.341 -17.499
341 1HB LYS 46 HB2 LYS 46 -1.209 3.660 -19.588
342 2HB LYS 46 HB3 LYS 46 -2.957 3.511 -19.624
343 1HG LYS 46 HG2 LYS 46 -1.454 4.891 -17.330
344 2HG LYS 46 HG3 LYS 46 -1.843 5.677 -18.843
345 1HD LYS 46 HD2 LYS 46 -4.329 5.179 -18.328
346 2HD LYS 46 HD3 LYS 46 -3.782 4.899 -16.651
347 1HE LYS 46 HE2 LYS 46 -3.036 7.093 -16.385
348 2HE LYS 46 HE3 LYS 46 -2.753 7.337 -18.089
349 1HZ LYS 46 HZ1 LYS 46 -4.600 8.553 -17.222
350 2HZ LYS 46 HZ2 LYS 46 -5.146 7.598 -18.422
351 3HZ LYS 46 HZ3 LYS 46 -5.437 7.301 -16.836
352 H TRP 47 H TRP 47 -2.214 2.647 -15.664
353 HA TRP 47 HA TRP 47 -5.074 1.781 -15.647
354 1HB TRP 47 HB2 TRP 47 -3.017 1.065 -13.502
355 2HB TRP 47 HB3 TRP 47 -4.673 0.527 -13.614
356 HD1 TRP 47 HD1 TRP 47 -1.274 -0.494 -14.450
357 HE1 TRP 47 HE1 TRP 47 -1.183 -2.502 -15.977
358 HE3 TRP 47 HE3 TRP 47 -6.111 -0.402 -16.216
359 HZ2 TRP 47 HZ2 TRP 47 -2.885 -3.825 -17.891
360 HZ3 TRP 47 HZ3 TRP 47 -6.745 -1.962 -18.049
361 HH2 TRP 47 HH2 TRP 47 -5.185 -3.695 -18.845
362 H GLY 48 H GLY 48 -6.289 3.399 -14.657
363 1HA GLY 48 HA2 GLY 48 -4.833 5.368 -13.038
364 2HA GLY 48 HA3 GLY 48 -5.766 5.883 -14.476
365 H LEU 49 H LEU 49 -5.879 6.240 -11.519
366 HA LEU 49 HA LEU 49 -8.745 5.720 -11.114
367 1HB LEU 49 HB2 LEU 49 -6.606 4.627 -9.231
368 2HB LEU 49 HB3 LEU 49 -8.285 4.747 -8.780
369 HG LEU 49 HG LEU 49 -7.209 3.103 -11.100
370 1HD1 LEU 49 1HD1 LEU 49 -6.643 2.316 -8.833
371 2HD1 LEU 49 2HD1 LEU 49 -8.374 2.224 -8.473
372 3HD1 LEU 49 3HD1 LEU 49 -7.679 1.204 -9.774
373 1HD2 LEU 49 1HD2 LEU 49 -9.610 3.792 -11.528
374 2HD2 LEU 49 2HD2 LEU 49 -9.440 2.081 -11.166
375 3HD2 LEU 49 3HD2 LEU 49 -10.028 3.206 -9.902
376 H GLY 50 H GLY 50 -6.472 8.103 -11.099
377 1HA GLY 50 HA2 GLY 50 -8.144 9.749 -9.349
378 2HA GLY 50 HA3 GLY 50 -6.562 9.407 -8.674
379 H LEU 51 H LEU 51 -4.636 9.982 -10.037
380 HA LEU 51 HA LEU 51 -5.024 12.609 -11.361
381 1HB LEU 51 HB2 LEU 51 -2.556 11.056 -10.437
382 2HB LEU 51 HB3 LEU 51 -2.488 12.503 -11.392
383 HG LEU 51 HG LEU 51 -3.510 13.840 -9.643
384 1HD1 LEU 51 1HD1 LEU 51 -4.930 12.276 -8.453
385 2HD1 LEU 51 2HD1 LEU 51 -3.510 11.283 -7.991
386 3HD1 LEU 51 3HD1 LEU 51 -3.726 12.919 -7.314
387 1HD2 LEU 51 1HD2 LEU 51 -1.066 13.534 -9.751
388 2HD2 LEU 51 2HD2 LEU 51 -1.600 13.739 -8.082
389 3HD2 LEU 51 3HD2 LEU 51 -1.199 12.114 -8.686
390 H ASP 52 H ASP 52 -6.315 11.077 -12.875
391 HA ASP 52 HA ASP 52 -5.199 9.034 -14.346
392 1HB ASP 52 HB2 ASP 52 -7.624 9.670 -14.267
393 2HB ASP 52 HB3 ASP 52 -7.291 10.900 -15.491
Start of MODEL 13
1 1H GLY 1 H1 GLY 1 4.432 -2.295 -10.123
2 2H GLY 1 H2 GLY 1 5.400 -3.538 -9.698
3 3H GLY 1 H3 GLY 1 3.900 -3.836 -10.315
4 1HA GLY 1 HA2 GLY 1 3.843 -4.199 -7.948
5 2HA GLY 1 HA3 GLY 1 4.443 -2.515 -7.761
6 H GLN 2 H GLN 2 1.591 -4.464 -7.875
7 HA GLN 2 HA GLN 2 -0.036 -2.020 -8.037
8 1HB GLN 2 HB2 GLN 2 -1.524 -2.985 -9.695
9 2HB GLN 2 HB3 GLN 2 0.093 -2.629 -10.274
10 1HG GLN 2 HG2 GLN 2 0.654 -5.010 -10.272
11 2HG GLN 2 HG3 GLN 2 -1.038 -5.392 -9.859
12 1HE2 GLN 2 2HE2 GLN 2 0.900 -5.409 -12.588
13 2HE2 GLN 2 1HE2 GLN 2 -0.268 -4.849 -13.741
14 H ASP 3 H ASP 3 -2.140 -2.201 -7.452
15 HA ASP 3 HA ASP 3 -3.063 -4.367 -5.697
16 1HB ASP 3 HB2 ASP 3 -1.853 -2.373 -4.494
17 2HB ASP 3 HB3 ASP 3 -3.276 -1.411 -4.978
18 H ARG 4 H ARG 4 -5.449 -3.120 -4.994
19 HA ARG 4 HA ARG 4 -7.084 -3.437 -7.319
20 1HB ARG 4 HB2 ARG 4 -7.738 -2.101 -4.676
21 2HB ARG 4 HB3 ARG 4 -8.909 -2.860 -5.765
22 1HG ARG 4 HG2 ARG 4 -8.623 -4.899 -4.866
23 2HG ARG 4 HG3 ARG 4 -6.855 -4.772 -4.786
24 1HD ARG 4 HD2 ARG 4 -7.211 -3.162 -2.810
25 2HD ARG 4 HD3 ARG 4 -8.875 -3.729 -2.772
26 HE ARG 4 HE ARG 4 -8.092 -5.994 -2.314
27 1HH1 ARG 4 1HH2 ARG 4 -5.603 -3.478 -1.996
28 2HH1 ARG 4 2HH2 ARG 4 -4.488 -4.422 -1.351
29 1HH2 ARG 4 1HH1 ARG 4 -6.567 -7.321 -1.156
30 2HH2 ARG 4 2HH1 ARG 4 -5.129 -6.579 -0.510
31 H PHE 5 H PHE 5 -5.846 -0.600 -5.610
32 HA PHE 5 HA PHE 5 -6.477 1.138 -7.858
33 1HB PHE 5 HB2 PHE 5 -7.680 2.792 -6.427
34 2HB PHE 5 HB3 PHE 5 -8.563 1.300 -6.594
35 HD1 PHE 5 HD1 PHE 5 -6.559 3.355 -4.243
36 HD2 PHE 5 HD2 PHE 5 -9.074 -0.097 -4.730
37 HE1 PHE 5 HE1 PHE 5 -6.713 3.130 -1.772
38 HE2 PHE 5 HE2 PHE 5 -9.253 -0.309 -2.245
39 HZ PHE 5 HZ PHE 5 -8.062 1.300 -0.780
40 H VAL 6 H VAL 6 -4.209 0.003 -6.006
41 HA VAL 6 HA VAL 6 -2.773 2.544 -5.655
42 HB VAL 6 HB VAL 6 -3.483 0.484 -3.596
43 1HG1 VAL 6 1HG1 VAL 6 -1.459 0.709 -2.249
44 2HG1 VAL 6 2HG1 VAL 6 -1.090 -0.052 -3.807
45 3HG1 VAL 6 3HG1 VAL 6 -0.674 1.645 -3.546
46 1HG2 VAL 6 1HG2 VAL 6 -3.289 2.464 -2.152
47 2HG2 VAL 6 2HG2 VAL 6 -2.581 3.377 -3.510
48 3HG2 VAL 6 3HG2 VAL 6 -4.260 2.805 -3.594
49 H TYR 7 H TYR 7 -0.561 2.293 -5.942
50 HA TYR 7 HA TYR 7 0.532 -0.116 -7.252
51 1HB TYR 7 HB2 TYR 7 0.173 2.639 -8.529
52 2HB TYR 7 HB3 TYR 7 0.904 1.226 -9.273
53 HD1 TYR 7 HD1 TYR 7 -0.648 -0.711 -9.867
54 HD2 TYR 7 HD2 TYR 7 -2.195 3.009 -8.445
55 HE1 TYR 7 HE1 TYR 7 -2.935 -1.295 -10.797
56 HE2 TYR 7 HE2 TYR 7 -4.465 2.366 -9.126
57 HH TYR 7 HH TYR 7 -5.759 0.828 -10.402
58 H THR 8 H THR 8 2.763 1.000 -8.336
59 HA THR 8 HA THR 8 3.903 2.949 -6.465
60 HB THR 8 HB THR 8 6.085 1.482 -7.096
61 HG1 THR 8 HG1 THR 8 5.068 -0.147 -8.273
62 1HG2 THR 8 1HG2 THR 8 4.143 0.710 -4.880
63 2HG2 THR 8 2HG2 THR 8 5.847 0.167 -5.012
64 3HG2 THR 8 3HG2 THR 8 5.510 1.879 -4.811
65 H CYS 9 H CYS 9 5.620 4.245 -7.565
66 HA CYS 9 HA CYS 9 5.567 3.951 -10.559
67 1HB CYS 9 HB2 CYS 9 5.589 6.339 -9.792
68 2HB CYS 9 HB3 CYS 9 6.953 6.017 -8.747
69 H ASN 10 H ASN 10 7.009 2.263 -11.020
70 HA ASN 10 HA ASN 10 8.727 1.318 -8.969
71 1HB ASN 10 HB2 ASN 10 7.716 -0.136 -10.787
72 2HB ASN 10 HB3 ASN 10 9.003 0.496 -11.864
73 1HD2 ASN 10 2HD2 ASN 10 10.469 -1.148 -11.986
74 2HD2 ASN 10 1HD2 ASN 10 11.151 -2.008 -10.598
75 H GLU 11 H GLU 11 9.021 4.110 -10.712
76 HA GLU 11 HA GLU 11 11.933 3.960 -10.632
77 1HB GLU 11 HB2 GLU 11 10.125 5.507 -12.352
78 2HB GLU 11 HB3 GLU 11 11.370 6.474 -11.605
79 1HG GLU 11 HG2 GLU 11 12.000 3.801 -12.942
80 2HG GLU 11 HG3 GLU 11 12.105 5.352 -13.789
81 H CYS 12 H CYS 12 9.135 5.462 -9.071
82 HA CYS 12 HA CYS 12 10.930 7.154 -7.439
83 1HB CYS 12 HB2 CYS 12 7.950 6.666 -7.168
84 2HB CYS 12 HB3 CYS 12 8.870 7.936 -6.364
85 H LYS 13 H LYS 13 9.375 4.060 -7.342
86 HA LYS 13 HA LYS 13 9.248 2.334 -5.880
87 1HB LYS 13 HB2 LYS 13 11.815 3.651 -4.909
88 2HB LYS 13 HB3 LYS 13 11.062 2.479 -3.860
89 1HG LYS 13 HG2 LYS 13 12.849 1.547 -5.146
90 2HG LYS 13 HG3 LYS 13 11.312 0.703 -5.361
91 1HD LYS 13 HD2 LYS 13 12.745 0.895 -7.418
92 2HD LYS 13 HD3 LYS 13 11.082 1.427 -7.593
93 1HE LYS 13 HE2 LYS 13 11.578 3.579 -7.897
94 2HE LYS 13 HE3 LYS 13 12.979 3.615 -6.848
95 1HZ LYS 13 HZ1 LYS 13 12.882 2.525 -9.600
96 2HZ LYS 13 HZ2 LYS 13 13.527 3.935 -9.179
97 3HZ LYS 13 HZ3 LYS 13 14.252 2.562 -8.665
98 H HIS 14 H HIS 14 7.930 4.982 -5.509
99 HA HIS 14 HA HIS 14 6.916 4.499 -2.758
100 1HB HIS 14 HB2 HIS 14 7.983 6.691 -2.888
101 2HB HIS 14 HB3 HIS 14 6.976 7.145 -4.258
102 HD2 HIS 14 HD2 HIS 14 4.728 8.253 -3.758
103 HE1 HIS 14 HE1 HIS 14 3.845 6.564 0.032
104 HE2 HIS 14 HE2 HIS 14 2.958 7.991 -1.870
105 H HIS 15 H HIS 15 4.601 5.055 -2.642
106 HA HIS 15 HA HIS 15 3.181 3.504 -4.565
107 1HB HIS 15 HB2 HIS 15 2.036 3.123 -2.707
108 2HB HIS 15 HB3 HIS 15 2.771 4.469 -1.860
109 HD2 HIS 15 HD2 HIS 15 -0.259 3.763 -4.196
110 HE1 HIS 15 HE1 HIS 15 -1.052 7.416 -2.151
111 HE2 HIS 15 HE2 HIS 15 -1.996 5.684 -3.792
112 H VAL 16 H VAL 16 1.430 4.127 -5.889
113 HA VAL 16 HA VAL 16 0.703 6.902 -6.242
114 HB VAL 16 HB VAL 16 1.225 7.046 -8.617
115 1HG1 VAL 16 1HG1 VAL 16 3.706 5.833 -7.354
116 2HG1 VAL 16 2HG1 VAL 16 3.621 6.898 -8.752
117 3HG1 VAL 16 3HG1 VAL 16 3.156 7.524 -7.166
118 1HG2 VAL 16 1HG2 VAL 16 2.317 5.224 -9.904
119 2HG2 VAL 16 2HG2 VAL 16 2.095 4.127 -8.529
120 3HG2 VAL 16 3HG2 VAL 16 0.691 4.811 -9.386
121 H GLU 17 H GLU 17 -1.209 7.044 -7.831
122 HA GLU 17 HA GLU 17 -3.063 4.727 -7.366
123 1HB GLU 17 HB2 GLU 17 -4.799 6.581 -7.678
124 2HB GLU 17 HB3 GLU 17 -3.991 6.402 -6.138
125 1HG GLU 17 HG2 GLU 17 -4.274 8.796 -6.803
126 2HG GLU 17 HG3 GLU 17 -2.590 8.338 -6.532
127 H THR 18 H THR 18 -1.586 6.811 -9.759
128 HA THR 18 HA THR 18 -2.956 5.265 -11.892
129 HB THR 18 HB THR 18 -2.382 8.258 -11.735
130 HG1 THR 18 HG1 THR 18 -4.116 8.049 -10.649
131 1HG2 THR 18 1HG2 THR 18 -2.572 6.767 -14.142
132 2HG2 THR 18 2HG2 THR 18 -4.242 7.300 -13.839
133 3HG2 THR 18 3HG2 THR 18 -2.932 8.473 -13.973
134 H ARG 19 H ARG 19 -1.514 4.454 -13.430
135 HA ARG 19 HA ARG 19 1.249 5.478 -13.588
136 1HB ARG 19 HB2 ARG 19 2.290 3.540 -12.836
137 2HB ARG 19 HB3 ARG 19 1.003 3.797 -11.651
138 1HG ARG 19 HG2 ARG 19 -0.401 2.113 -13.069
139 2HG ARG 19 HG3 ARG 19 1.107 1.744 -13.922
140 1HD ARG 19 HD2 ARG 19 1.833 1.647 -11.232
141 2HD ARG 19 HD3 ARG 19 0.154 1.053 -11.241
142 HE ARG 19 HE ARG 19 2.562 -0.271 -12.161
143 1HH1 ARG 19 2HH2 ARG 19 -0.971 -0.457 -12.237
144 2HH1 ARG 19 1HH2 ARG 19 -0.944 -2.141 -12.621
145 1HH2 ARG 19 1HH1 ARG 19 2.601 -2.344 -12.432
146 2HH2 ARG 19 2HH1 ARG 19 1.226 -3.261 -12.898
147 H TRP 20 H TRP 20 2.509 4.290 -15.086
148 HA TRP 20 HA TRP 20 1.182 3.015 -17.450
149 1HB TRP 20 HB2 TRP 20 3.919 4.308 -17.054
150 2HB TRP 20 HB3 TRP 20 3.279 3.626 -18.552
151 HD1 TRP 20 HD1 TRP 20 2.958 6.654 -16.299
152 HE1 TRP 20 HE1 TRP 20 1.402 8.392 -17.302
153 HE3 TRP 20 HE3 TRP 20 1.538 4.074 -20.430
154 HZ2 TRP 20 HZ2 TRP 20 -0.566 8.477 -19.400
155 HZ3 TRP 20 HZ3 TRP 20 -0.248 4.996 -21.936
156 HH2 TRP 20 HH2 TRP 20 -1.334 7.186 -21.395
157 H HIS 21 H HIS 21 1.903 0.881 -17.808
158 HA HIS 21 HA HIS 21 3.822 -0.265 -15.876
159 1HB HIS 21 HB2 HIS 21 1.992 -0.831 -14.743
160 2HB HIS 21 HB3 HIS 21 0.927 -0.846 -16.106
161 HD2 HIS 21 HD2 HIS 21 4.019 -3.184 -16.191
162 HE1 HIS 21 HE1 HIS 21 0.660 -5.676 -15.547
163 HE2 HIS 21 HE2 HIS 21 3.165 -5.625 -16.039
164 H CYS 22 H CYS 22 5.321 -1.303 -16.895
165 HA CYS 22 HA CYS 22 5.386 -1.901 -19.721
166 1HB CYS 22 HB2 CYS 22 7.082 -1.910 -17.288
167 2HB CYS 22 HB3 CYS 22 7.461 -3.206 -18.419
168 H THR 23 H THR 23 4.459 -3.489 -20.638
169 HA THR 23 HA THR 23 4.005 -6.038 -19.166
170 HB THR 23 HB THR 23 2.357 -6.572 -21.031
171 HG1 THR 23 HG1 THR 23 3.339 -4.276 -21.977
172 1HG2 THR 23 1HG2 THR 23 1.977 -4.075 -19.412
173 2HG2 THR 23 2HG2 THR 23 0.673 -5.197 -19.939
174 3HG2 THR 23 3HG2 THR 23 1.835 -5.712 -18.706
175 H VAL 24 H VAL 24 6.405 -4.946 -20.505
176 HA VAL 24 HA VAL 24 7.390 -7.003 -22.330
177 HB VAL 24 HB VAL 24 7.565 -4.737 -23.041
178 1HG1 VAL 24 1HG1 VAL 24 7.671 -3.877 -20.283
179 2HG1 VAL 24 2HG1 VAL 24 8.776 -3.052 -21.355
180 3HG1 VAL 24 3HG1 VAL 24 7.024 -3.162 -21.742
181 1HG2 VAL 24 1HG2 VAL 24 9.935 -4.200 -23.093
182 2HG2 VAL 24 2HG2 VAL 24 10.221 -5.102 -21.597
183 3HG2 VAL 24 3HG2 VAL 24 9.808 -5.980 -23.089
184 H CYS 25 H CYS 25 8.308 -5.085 -19.542
185 HA CYS 25 HA CYS 25 10.272 -6.851 -18.368
186 1HB CYS 25 HB2 CYS 25 8.936 -4.366 -17.212
187 2HB CYS 25 HB3 CYS 25 10.569 -4.960 -16.873
188 H GLU 26 H GLU 26 10.117 -6.916 -15.904
189 HA GLU 26 HA GLU 26 7.854 -8.605 -15.316
190 1HB GLU 26 HB2 GLU 26 10.454 -8.866 -14.745
191 2HB GLU 26 HB3 GLU 26 9.960 -8.064 -13.233
192 1HG GLU 26 HG2 GLU 26 8.023 -9.770 -13.207
193 2HG GLU 26 HG3 GLU 26 8.829 -10.520 -14.585
194 H ASP 27 H ASP 27 6.120 -7.183 -15.202
195 HA ASP 27 HA ASP 27 4.692 -5.626 -14.428
196 1HB ASP 27 HB2 ASP 27 4.501 -7.558 -12.859
197 2HB ASP 27 HB3 ASP 27 5.557 -6.708 -11.737
198 H TYR 28 H TYR 28 7.091 -4.422 -15.014
199 HA TYR 28 HA TYR 28 7.911 -2.605 -12.939
200 1HB TYR 28 HB2 TYR 28 9.332 -3.479 -14.798
201 2HB TYR 28 HB3 TYR 28 8.382 -2.599 -15.941
202 HD1 TYR 28 HD1 TYR 28 11.176 -2.384 -13.671
203 HD2 TYR 28 HD2 TYR 28 8.349 -0.103 -15.971
204 HE1 TYR 28 HE1 TYR 28 12.693 -0.410 -13.573
205 HE2 TYR 28 HE2 TYR 28 9.813 1.873 -15.878
206 HH TYR 28 HH TYR 28 13.037 1.781 -14.241
207 H ASP 29 H ASP 29 7.348 -0.402 -12.726
208 HA ASP 29 HA ASP 29 4.914 0.515 -14.199
209 1HB ASP 29 HB2 ASP 29 5.492 1.412 -11.406
210 2HB ASP 29 HB3 ASP 29 3.946 1.285 -12.215
211 H LEU 30 H LEU 30 4.654 2.853 -14.224
212 HA LEU 30 HA LEU 30 6.787 4.478 -13.078
213 1HB LEU 30 HB2 LEU 30 5.931 4.518 -15.999
214 2HB LEU 30 HB3 LEU 30 6.791 5.842 -15.197
215 HG LEU 30 HG LEU 30 7.864 3.028 -15.653
216 1HD1 LEU 30 1HD1 LEU 30 9.448 4.119 -17.087
217 2HD1 LEU 30 2HD1 LEU 30 7.823 4.580 -17.644
218 3HD1 LEU 30 3HD1 LEU 30 8.814 5.732 -16.706
219 1HD2 LEU 30 1HD2 LEU 30 10.019 3.889 -14.776
220 2HD2 LEU 30 2HD2 LEU 30 9.233 5.466 -14.423
221 3HD2 LEU 30 3HD2 LEU 30 8.802 4.035 -13.499
222 H CYS 31 H CYS 31 5.844 6.390 -12.191
223 HA CYS 31 HA CYS 31 3.005 6.862 -12.455
224 1HB CYS 31 HB2 CYS 31 3.499 8.935 -11.349
225 2HB CYS 31 HB3 CYS 31 4.256 7.615 -10.495
226 H ILE 32 H ILE 32 2.283 9.031 -13.355
227 HA ILE 32 HA ILE 32 2.792 9.150 -16.075
228 HB ILE 32 HB ILE 32 1.874 11.474 -14.341
229 1HG1 ILE 32 2HG1 ILE 32 0.418 9.664 -13.664
230 2HG1 ILE 32 3HG1 ILE 32 -0.475 10.784 -14.680
231 1HG2 ILE 32 1HG2 ILE 32 0.533 12.043 -16.378
232 2HG2 ILE 32 2HG2 ILE 32 2.290 12.184 -16.566
233 3HG2 ILE 32 3HG2 ILE 32 1.453 10.786 -17.257
234 1HD1 ILE 32 1HD1 ILE 32 -1.108 8.516 -15.215
235 2HD1 ILE 32 2HD1 ILE 32 -0.181 9.173 -16.589
236 3HD1 ILE 32 3HD1 ILE 32 0.564 8.032 -15.417
237 H ASN 33 H ASN 33 4.280 11.137 -13.515
238 HA ASN 33 HA ASN 33 5.711 12.868 -15.323
239 1HB ASN 33 HB2 ASN 33 5.325 13.609 -13.049
240 2HB ASN 33 HB3 ASN 33 5.958 12.122 -12.361
241 1HD2 ASN 33 2HD2 ASN 33 8.239 11.822 -12.109
242 2HD2 ASN 33 1HD2 ASN 33 9.340 13.151 -12.365
243 H CYS 34 H CYS 34 6.667 9.848 -13.653
244 HA CYS 34 HA CYS 34 9.367 9.965 -14.664
245 1HB CYS 34 HB2 CYS 34 7.731 7.799 -13.344
246 2HB CYS 34 HB3 CYS 34 9.312 7.482 -14.066
247 H TYR 35 H TYR 35 6.349 8.367 -15.825
248 HA TYR 35 HA TYR 35 7.583 7.073 -18.065
249 1HB TYR 35 HB2 TYR 35 5.331 6.515 -17.412
250 2HB TYR 35 HB3 TYR 35 4.780 8.175 -17.714
251 HD1 TYR 35 HD1 TYR 35 6.354 5.205 -19.427
252 HD2 TYR 35 HD2 TYR 35 3.838 8.691 -19.815
253 HE1 TYR 35 HE1 TYR 35 5.927 4.607 -21.778
254 HE2 TYR 35 HE2 TYR 35 3.444 8.119 -22.191
255 HH TYR 35 HH TYR 35 3.997 6.712 -23.937
256 H ASN 36 H ASN 36 6.151 10.292 -17.730
257 HA ASN 36 HA ASN 36 6.634 11.326 -20.274
258 1HB ASN 36 HB2 ASN 36 6.095 12.485 -17.545
259 2HB ASN 36 HB3 ASN 36 6.436 13.558 -18.855
260 1HD2 ASN 36 2HD2 ASN 36 4.180 14.256 -18.213
261 2HD2 ASN 36 1HD2 ASN 36 2.837 13.455 -19.039
262 H THR 37 H THR 37 9.071 10.597 -17.983
263 HA THR 37 HA THR 37 10.896 12.558 -19.347
264 HB THR 37 HB THR 37 12.123 12.684 -17.158
265 HG1 THR 37 HG1 THR 37 9.723 11.824 -15.973
266 1HG2 THR 37 1HG2 THR 37 9.282 13.774 -17.146
267 2HG2 THR 37 2HG2 THR 37 10.620 14.322 -16.106
268 3HG2 THR 37 3HG2 THR 37 10.718 14.525 -17.869
269 H LYS 38 H LYS 38 10.864 9.626 -17.364
270 HA LYS 38 HA LYS 38 13.424 8.654 -18.179
271 1HB LYS 38 HB2 LYS 38 11.068 7.007 -17.242
272 2HB LYS 38 HB3 LYS 38 12.781 6.611 -17.067
273 1HG LYS 38 HG2 LYS 38 11.359 8.890 -15.616
274 2HG LYS 38 HG3 LYS 38 11.604 7.297 -14.962
275 1HD LYS 38 HD2 LYS 38 14.028 7.649 -14.905
276 2HD LYS 38 HD3 LYS 38 13.889 9.153 -15.803
277 1HE LYS 38 HE2 LYS 38 14.176 9.697 -13.469
278 2HE LYS 38 HE3 LYS 38 12.552 10.167 -14.007
279 1HZ LYS 38 HZ1 LYS 38 12.611 9.044 -11.827
280 2HZ LYS 38 HZ2 LYS 38 11.666 8.268 -12.888
281 3HZ LYS 38 HZ3 LYS 38 13.175 7.685 -12.540
282 H SER 39 H SER 39 10.436 8.801 -19.901
283 HA SER 39 HA SER 39 9.722 7.928 -21.837
284 1HB SER 39 HB2 SER 39 12.684 8.318 -22.503
285 2HB SER 39 HB3 SER 39 11.318 8.381 -23.641
286 HG SER 39 HG SER 39 11.930 10.164 -21.502
287 H HIS 40 H HIS 40 10.058 5.801 -20.139
288 HA HIS 40 HA HIS 40 11.497 3.607 -21.333
289 1HB HIS 40 HB2 HIS 40 10.738 4.193 -18.861
290 2HB HIS 40 HB3 HIS 40 9.230 3.404 -19.309
291 HD1 HIS 40 HD1 HIS 40 12.364 2.660 -17.634
292 HD2 HIS 40 HD2 HIS 40 9.672 0.690 -20.211
293 HE1 HIS 40 HE1 HIS 40 12.685 0.191 -17.228
294 H THR 41 H THR 41 10.458 4.223 -23.453
295 HA THR 41 HA THR 41 7.739 4.056 -24.021
296 HB THR 41 HB THR 41 10.145 3.866 -25.888
297 HG1 THR 41 HG1 THR 41 10.308 5.655 -24.403
298 1HG2 THR 41 1HG2 THR 41 8.272 3.676 -27.306
299 2HG2 THR 41 2HG2 THR 41 7.338 4.890 -26.379
300 3HG2 THR 41 3HG2 THR 41 8.718 5.382 -27.367
301 H HIS 42 H HIS 42 8.654 1.292 -22.793
302 HA HIS 42 HA HIS 42 8.544 -0.476 -25.102
303 1HB HIS 42 HB2 HIS 42 8.118 -0.983 -22.170
304 2HB HIS 42 HB3 HIS 42 8.438 -2.199 -23.440
305 HD2 HIS 42 HD2 HIS 42 10.928 -0.418 -24.775
306 HE1 HIS 42 HE1 HIS 42 12.719 -1.061 -20.965
307 HE2 HIS 42 HE2 HIS 42 13.171 -0.424 -23.423
308 H LYS 43 H LYS 43 6.753 -2.327 -24.987
309 HA LYS 43 HA LYS 43 4.249 -0.950 -25.262
310 1HB LYS 43 HB2 LYS 43 5.174 -3.046 -26.505
311 2HB LYS 43 HB3 LYS 43 4.497 -3.963 -25.176
312 1HG LYS 43 HG2 LYS 43 3.092 -1.946 -26.966
313 2HG LYS 43 HG3 LYS 43 2.946 -3.716 -27.146
314 1HD LYS 43 HD2 LYS 43 1.813 -1.888 -25.003
315 2HD LYS 43 HD3 LYS 43 0.909 -2.782 -26.213
316 1HE LYS 43 HE2 LYS 43 1.493 -4.933 -25.160
317 2HE LYS 43 HE3 LYS 43 2.582 -4.114 -24.041
318 1HZ LYS 43 HZ1 LYS 43 -0.338 -4.081 -24.010
319 2HZ LYS 43 HZ2 LYS 43 0.782 -4.321 -22.800
320 3HZ LYS 43 HZ3 LYS 43 0.530 -2.832 -23.372
321 H MET 44 H MET 44 3.346 -0.207 -23.631
322 HA MET 44 HA MET 44 3.272 -1.573 -20.988
323 1HB MET 44 HB2 MET 44 3.201 1.315 -21.911
324 2HB MET 44 HB3 MET 44 2.672 0.879 -20.287
325 1HG MET 44 HG2 MET 44 4.696 0.043 -19.623
326 2HG MET 44 HG3 MET 44 5.389 -0.024 -21.221
327 1HE MET 44 HE1 MET 44 4.672 1.905 -17.935
328 2HE MET 44 HE2 MET 44 6.241 1.111 -18.169
329 3HE MET 44 HE3 MET 44 6.141 2.876 -17.980
330 H VAL 45 H VAL 45 1.281 -0.649 -19.725
331 HA VAL 45 HA VAL 45 -1.274 -0.464 -21.133
332 HB VAL 45 HB VAL 45 -2.138 -1.713 -19.150
333 1HG1 VAL 45 1HG1 VAL 45 -0.346 -3.473 -20.899
334 2HG1 VAL 45 2HG1 VAL 45 -1.855 -3.929 -20.084
335 3HG1 VAL 45 3HG1 VAL 45 -1.896 -2.777 -21.427
336 1HG2 VAL 45 1HG2 VAL 45 -0.139 -1.551 -17.741
337 2HG2 VAL 45 2HG2 VAL 45 -0.625 -3.276 -17.954
338 3HG2 VAL 45 3HG2 VAL 45 0.750 -2.628 -18.823
339 H LYS 46 H LYS 46 -2.738 0.660 -19.281
340 HA LYS 46 HA LYS 46 -1.155 2.372 -17.505
341 1HB LYS 46 HB2 LYS 46 -1.458 3.607 -19.655
342 2HB LYS 46 HB3 LYS 46 -3.203 3.441 -19.526
343 1HG LYS 46 HG2 LYS 46 -1.507 4.975 -17.475
344 2HG LYS 46 HG3 LYS 46 -2.215 5.674 -18.930
345 1HD LYS 46 HD2 LYS 46 -4.514 4.949 -17.964
346 2HD LYS 46 HD3 LYS 46 -3.638 4.678 -16.468
347 1HE LYS 46 HE2 LYS 46 -4.224 6.844 -16.112
348 2HE LYS 46 HE3 LYS 46 -2.638 7.081 -16.887
349 1HZ LYS 46 HZ1 LYS 46 -4.268 8.527 -17.792
350 2HZ LYS 46 HZ2 LYS 46 -3.990 7.449 -18.992
351 3HZ LYS 46 HZ3 LYS 46 -5.349 7.431 -17.996
352 H TRP 47 H TRP 47 -2.256 2.656 -15.636
353 HA TRP 47 HA TRP 47 -5.060 1.716 -15.431
354 1HB TRP 47 HB2 TRP 47 -2.892 1.111 -13.386
355 2HB TRP 47 HB3 TRP 47 -4.530 0.491 -13.458
356 HD1 TRP 47 HD1 TRP 47 -1.049 -0.145 -14.577
357 HE1 TRP 47 HE1 TRP 47 -0.855 -2.309 -15.892
358 HE3 TRP 47 HE3 TRP 47 -5.976 -0.785 -15.741
359 HZ2 TRP 47 HZ2 TRP 47 -2.591 -3.938 -17.582
360 HZ3 TRP 47 HZ3 TRP 47 -6.603 -2.493 -17.455
361 HH2 TRP 47 HH2 TRP 47 -4.971 -4.117 -18.275
362 H GLY 48 H GLY 48 -6.207 3.287 -14.385
363 1HA GLY 48 HA2 GLY 48 -4.720 5.376 -12.935
364 2HA GLY 48 HA3 GLY 48 -5.767 5.798 -14.333
365 H LEU 49 H LEU 49 -5.876 6.424 -11.522
366 HA LEU 49 HA LEU 49 -8.663 5.706 -11.068
367 1HB LEU 49 HB2 LEU 49 -6.603 4.161 -9.904
368 2HB LEU 49 HB3 LEU 49 -7.091 5.228 -8.620
369 HG LEU 49 HG LEU 49 -8.153 3.053 -8.623
370 1HD1 LEU 49 1HD1 LEU 49 -9.408 4.995 -7.646
371 2HD1 LEU 49 2HD1 LEU 49 -10.315 5.129 -9.158
372 3HD1 LEU 49 3HD1 LEU 49 -10.469 3.668 -8.164
373 1HD2 LEU 49 1HD2 LEU 49 -8.283 2.582 -11.013
374 2HD2 LEU 49 2HD2 LEU 49 -9.804 2.269 -10.156
375 3HD2 LEU 49 3HD2 LEU 49 -9.617 3.721 -11.175
376 H GLY 50 H GLY 50 -6.324 8.150 -10.962
377 1HA GLY 50 HA2 GLY 50 -8.133 9.819 -9.331
378 2HA GLY 50 HA3 GLY 50 -6.510 9.549 -8.682
379 H LEU 51 H LEU 51 -4.939 9.713 -10.995
380 HA LEU 51 HA LEU 51 -5.402 12.474 -12.039
381 1HB LEU 51 HB2 LEU 51 -2.863 11.157 -10.999
382 2HB LEU 51 HB3 LEU 51 -2.915 12.718 -11.834
383 HG LEU 51 HG LEU 51 -4.390 12.188 -9.226
384 1HD1 LEU 51 1HD1 LEU 51 -1.647 13.428 -9.648
385 2HD1 LEU 51 2HD1 LEU 51 -2.588 13.402 -8.121
386 3HD1 LEU 51 3HD1 LEU 51 -2.019 11.886 -8.843
387 1HD2 LEU 51 1HD2 LEU 51 -5.285 14.090 -10.484
388 2HD2 LEU 51 2HD2 LEU 51 -4.407 14.665 -9.071
389 3HD2 LEU 51 3HD2 LEU 51 -3.683 14.790 -10.708
390 H ASP 52 H ASP 52 -6.476 10.559 -13.410
391 HA ASP 52 HA ASP 52 -4.958 8.866 -15.023
392 1HB ASP 52 HB2 ASP 52 -7.447 8.780 -14.647
393 2HB ASP 52 HB3 ASP 52 -7.615 10.046 -15.877
Start of MODEL 14
1 1H GLY 1 H1 GLY 1 4.159 -2.210 -10.035
2 2H GLY 1 H2 GLY 1 5.168 -3.439 -9.568
3 3H GLY 1 H3 GLY 1 3.819 -3.763 -10.417
4 1HA GLY 1 HA2 GLY 1 3.452 -4.335 -8.132
5 2HA GLY 1 HA3 GLY 1 3.913 -2.667 -7.680
6 H GLN 2 H GLN 2 1.163 -4.435 -7.653
7 HA GLN 2 HA GLN 2 -0.442 -2.113 -8.343
8 1HB GLN 2 HB2 GLN 2 -1.918 -3.539 -9.865
9 2HB GLN 2 HB3 GLN 2 -0.412 -2.900 -10.461
10 1HG GLN 2 HG2 GLN 2 0.717 -5.072 -10.261
11 2HG GLN 2 HG3 GLN 2 -0.783 -5.786 -9.616
12 1HE2 GLN 2 2HE2 GLN 2 1.055 -5.571 -12.440
13 2HE2 GLN 2 1HE2 GLN 2 -0.233 -5.740 -13.604
14 H ASP 3 H ASP 3 -2.484 -2.111 -7.709
15 HA ASP 3 HA ASP 3 -3.766 -4.116 -5.983
16 1HB ASP 3 HB2 ASP 3 -2.624 -2.617 -4.394
17 2HB ASP 3 HB3 ASP 3 -3.176 -1.184 -5.290
18 H ARG 4 H ARG 4 -6.220 -3.398 -5.956
19 HA ARG 4 HA ARG 4 -6.955 -2.817 -8.644
20 1HB ARG 4 HB2 ARG 4 -9.351 -2.570 -7.577
21 2HB ARG 4 HB3 ARG 4 -8.532 -4.101 -7.758
22 1HG ARG 4 HG2 ARG 4 -9.672 -3.997 -5.619
23 2HG ARG 4 HG3 ARG 4 -7.950 -4.188 -5.414
24 1HD ARG 4 HD2 ARG 4 -8.261 -1.411 -5.336
25 2HD ARG 4 HD3 ARG 4 -9.699 -1.959 -4.490
26 HE ARG 4 HE ARG 4 -6.873 -2.167 -3.771
27 1HH1 ARG 4 1HH1 ARG 4 -10.093 -3.168 -2.801
28 2HH1 ARG 4 2HH1 ARG 4 -9.582 -3.952 -1.342
29 1HH2 ARG 4 1HH2 ARG 4 -6.159 -3.235 -2.077
30 2HH2 ARG 4 2HH2 ARG 4 -7.149 -3.915 -0.821
31 H PHE 5 H PHE 5 -6.244 -0.520 -6.157
32 HA PHE 5 HA PHE 5 -6.786 1.562 -8.130
33 1HB PHE 5 HB2 PHE 5 -7.932 3.014 -6.436
34 2HB PHE 5 HB3 PHE 5 -8.856 1.737 -7.168
35 HD1 PHE 5 HD1 PHE 5 -6.518 1.312 -4.223
36 HD2 PHE 5 HD2 PHE 5 -10.586 1.484 -5.611
37 HE1 PHE 5 HE1 PHE 5 -7.290 0.574 -2.008
38 HE2 PHE 5 HE2 PHE 5 -11.368 0.686 -3.405
39 HZ PHE 5 HZ PHE 5 -9.737 0.228 -1.578
40 H VAL 6 H VAL 6 -4.552 0.207 -6.277
41 HA VAL 6 HA VAL 6 -3.043 2.709 -6.028
42 HB VAL 6 HB VAL 6 -3.717 0.709 -3.917
43 1HG1 VAL 6 1HG1 VAL 6 -1.683 0.992 -2.637
44 2HG1 VAL 6 2HG1 VAL 6 -1.378 0.132 -4.150
45 3HG1 VAL 6 3HG1 VAL 6 -0.881 1.833 -3.991
46 1HG2 VAL 6 1HG2 VAL 6 -4.493 3.024 -3.930
47 2HG2 VAL 6 2HG2 VAL 6 -3.420 2.745 -2.538
48 3HG2 VAL 6 3HG2 VAL 6 -2.813 3.617 -3.971
49 H TYR 7 H TYR 7 -0.810 2.396 -6.319
50 HA TYR 7 HA TYR 7 0.158 -0.041 -7.636
51 1HB TYR 7 HB2 TYR 7 -0.122 2.744 -8.911
52 2HB TYR 7 HB3 TYR 7 0.696 1.398 -9.655
53 HD1 TYR 7 HD1 TYR 7 -0.772 -0.741 -10.100
54 HD2 TYR 7 HD2 TYR 7 -2.423 3.020 -8.953
55 HE1 TYR 7 HE1 TYR 7 -2.995 -1.490 -10.949
56 HE2 TYR 7 HE2 TYR 7 -4.674 2.231 -9.510
57 HH TYR 7 HH TYR 7 -5.945 0.442 -10.486
58 H THR 8 H THR 8 2.448 1.001 -8.647
59 HA THR 8 HA THR 8 3.665 2.848 -6.699
60 HB THR 8 HB THR 8 5.762 1.207 -7.313
61 HG1 THR 8 HG1 THR 8 4.732 -0.345 -8.456
62 1HG2 THR 8 1HG2 THR 8 5.349 -0.033 -5.176
63 2HG2 THR 8 2HG2 THR 8 5.251 1.724 -5.045
64 3HG2 THR 8 3HG2 THR 8 3.750 0.764 -5.115
65 H CYS 9 H CYS 9 5.640 3.783 -7.631
66 HA CYS 9 HA CYS 9 5.706 3.801 -10.614
67 1HB CYS 9 HB2 CYS 9 5.504 6.165 -9.784
68 2HB CYS 9 HB3 CYS 9 6.816 5.872 -8.611
69 H ASN 10 H ASN 10 7.181 2.066 -10.837
70 HA ASN 10 HA ASN 10 8.928 1.446 -8.621
71 1HB ASN 10 HB2 ASN 10 9.095 -0.540 -9.443
72 2HB ASN 10 HB3 ASN 10 7.871 -0.117 -10.635
73 1HD2 ASN 10 2HD2 ASN 10 9.066 1.252 -12.546
74 2HD2 ASN 10 1HD2 ASN 10 10.421 0.352 -13.214
75 H GLU 11 H GLU 11 9.102 4.031 -10.670
76 HA GLU 11 HA GLU 11 12.039 3.940 -10.630
77 1HB GLU 11 HB2 GLU 11 10.118 5.404 -12.309
78 2HB GLU 11 HB3 GLU 11 11.358 6.422 -11.587
79 1HG GLU 11 HG2 GLU 11 12.033 3.779 -12.991
80 2HG GLU 11 HG3 GLU 11 12.040 5.335 -13.818
81 H CYS 12 H CYS 12 9.284 5.251 -8.922
82 HA CYS 12 HA CYS 12 11.117 6.973 -7.317
83 1HB CYS 12 HB2 CYS 12 8.077 6.709 -7.147
84 2HB CYS 12 HB3 CYS 12 9.120 7.851 -6.284
85 H LYS 13 H LYS 13 9.408 4.007 -7.358
86 HA LYS 13 HA LYS 13 8.921 2.320 -5.986
87 1HB LYS 13 HB2 LYS 13 11.651 3.093 -4.896
88 2HB LYS 13 HB3 LYS 13 10.725 1.744 -4.213
89 1HG LYS 13 HG2 LYS 13 11.495 0.395 -5.784
90 2HG LYS 13 HG3 LYS 13 10.527 1.247 -6.949
91 1HD LYS 13 HD2 LYS 13 13.475 1.526 -6.383
92 2HD LYS 13 HD3 LYS 13 12.580 1.070 -7.867
93 1HE LYS 13 HE2 LYS 13 11.681 3.454 -7.829
94 2HE LYS 13 HE3 LYS 13 13.002 3.857 -6.738
95 1HZ LYS 13 HZ1 LYS 13 14.533 3.040 -8.566
96 2HZ LYS 13 HZ2 LYS 13 13.193 2.727 -9.476
97 3HZ LYS 13 HZ3 LYS 13 13.533 4.241 -9.075
98 H HIS 14 H HIS 14 7.722 4.697 -5.630
99 HA HIS 14 HA HIS 14 6.735 4.321 -2.882
100 1HB HIS 14 HB2 HIS 14 7.835 6.519 -2.971
101 2HB HIS 14 HB3 HIS 14 6.900 6.953 -4.416
102 HD2 HIS 14 HD2 HIS 14 4.720 8.262 -3.889
103 HE1 HIS 14 HE1 HIS 14 3.568 6.427 -0.247
104 HE2 HIS 14 HE2 HIS 14 2.845 8.009 -2.085
105 H HIS 15 H HIS 15 4.430 4.935 -2.822
106 HA HIS 15 HA HIS 15 2.964 3.433 -4.772
107 1HB HIS 15 HB2 HIS 15 1.736 3.127 -2.964
108 2HB HIS 15 HB3 HIS 15 2.631 4.338 -2.052
109 HD2 HIS 15 HD2 HIS 15 -0.494 3.981 -4.271
110 HE1 HIS 15 HE1 HIS 15 -0.888 7.670 -2.181
111 HE2 HIS 15 HE2 HIS 15 -2.039 6.044 -3.795
112 H VAL 16 H VAL 16 1.215 4.157 -6.046
113 HA VAL 16 HA VAL 16 0.689 6.974 -6.421
114 HB VAL 16 HB VAL 16 1.186 7.039 -8.794
115 1HG1 VAL 16 1HG1 VAL 16 3.575 5.684 -7.531
116 2HG1 VAL 16 2HG1 VAL 16 3.517 6.608 -9.029
117 3HG1 VAL 16 3HG1 VAL 16 3.171 7.438 -7.492
118 1HG2 VAL 16 1HG2 VAL 16 2.106 5.111 -10.044
119 2HG2 VAL 16 2HG2 VAL 16 1.828 4.052 -8.653
120 3HG2 VAL 16 3HG2 VAL 16 0.458 4.804 -9.502
121 H GLU 17 H GLU 17 -1.366 7.214 -7.774
122 HA GLU 17 HA GLU 17 -3.179 4.910 -7.245
123 1HB GLU 17 HB2 GLU 17 -4.916 6.755 -7.720
124 2HB GLU 17 HB3 GLU 17 -4.126 6.638 -6.148
125 1HG GLU 17 HG2 GLU 17 -4.343 8.976 -6.895
126 2HG GLU 17 HG3 GLU 17 -2.663 8.501 -6.639
127 H THR 18 H THR 18 -1.615 6.741 -9.738
128 HA THR 18 HA THR 18 -2.988 5.145 -11.822
129 HB THR 18 HB THR 18 -2.420 8.145 -11.812
130 HG1 THR 18 HG1 THR 18 -4.178 8.011 -10.762
131 1HG2 THR 18 1HG2 THR 18 -2.824 6.314 -14.068
132 2HG2 THR 18 2HG2 THR 18 -4.255 7.355 -13.930
133 3HG2 THR 18 3HG2 THR 18 -2.676 8.078 -14.120
134 H ARG 19 H ARG 19 -1.474 4.226 -13.215
135 HA ARG 19 HA ARG 19 1.275 5.347 -13.300
136 1HB ARG 19 HB2 ARG 19 2.373 3.267 -12.871
137 2HB ARG 19 HB3 ARG 19 1.273 3.508 -11.514
138 1HG ARG 19 HG2 ARG 19 -0.329 1.972 -12.473
139 2HG ARG 19 HG3 ARG 19 0.634 1.734 -13.924
140 1HD ARG 19 HD2 ARG 19 2.254 0.410 -12.895
141 2HD ARG 19 HD3 ARG 19 1.710 0.829 -11.270
142 HE ARG 19 HE ARG 19 -0.551 -0.127 -12.173
143 1HH1 ARG 19 2HH2 ARG 19 2.593 -1.800 -12.266
144 2HH1 ARG 19 1HH2 ARG 19 1.957 -3.287 -12.774
145 1HH2 ARG 19 1HH1 ARG 19 -1.386 -2.070 -13.060
146 2HH2 ARG 19 2HH1 ARG 19 -0.389 -3.460 -13.127
147 H TRP 20 H TRP 20 2.593 4.117 -14.848
148 HA TRP 20 HA TRP 20 1.205 3.102 -17.288
149 1HB TRP 20 HB2 TRP 20 3.885 4.499 -16.860
150 2HB TRP 20 HB3 TRP 20 3.273 3.880 -18.395
151 HD1 TRP 20 HD1 TRP 20 2.751 6.724 -15.887
152 HE1 TRP 20 HE1 TRP 20 1.129 8.472 -16.819
153 HE3 TRP 20 HE3 TRP 20 1.542 4.443 -20.264
154 HZ2 TRP 20 HZ2 TRP 20 -0.461 8.878 -19.183
155 HZ3 TRP 20 HZ3 TRP 20 -0.033 5.525 -21.870
156 HH2 TRP 20 HH2 TRP 20 -1.074 7.722 -21.316
157 H HIS 21 H HIS 21 1.870 0.953 -17.675
158 HA HIS 21 HA HIS 21 3.869 -0.233 -15.806
159 1HB HIS 21 HB2 HIS 21 1.927 -0.758 -14.690
160 2HB HIS 21 HB3 HIS 21 0.953 -0.796 -16.131
161 HD2 HIS 21 HD2 HIS 21 4.054 -3.105 -16.034
162 HE1 HIS 21 HE1 HIS 21 0.637 -5.576 -15.759
163 HE2 HIS 21 HE2 HIS 21 3.167 -5.543 -16.036
164 H CYS 22 H CYS 22 5.342 -1.321 -16.874
165 HA CYS 22 HA CYS 22 5.307 -1.862 -19.696
166 1HB CYS 22 HB2 CYS 22 7.111 -1.802 -17.378
167 2HB CYS 22 HB3 CYS 22 7.439 -3.172 -18.432
168 H THR 23 H THR 23 4.507 -3.575 -20.666
169 HA THR 23 HA THR 23 4.091 -6.075 -19.109
170 HB THR 23 HB THR 23 2.326 -6.678 -20.778
171 HG1 THR 23 HG1 THR 23 3.263 -4.427 -21.926
172 1HG2 THR 23 1HG2 THR 23 2.021 -4.010 -19.400
173 2HG2 THR 23 2HG2 THR 23 0.708 -5.167 -19.787
174 3HG2 THR 23 3HG2 THR 23 1.937 -5.557 -18.542
175 H VAL 24 H VAL 24 6.413 -5.026 -20.416
176 HA VAL 24 HA VAL 24 7.498 -7.130 -22.171
177 HB VAL 24 HB VAL 24 7.471 -4.904 -23.002
178 1HG1 VAL 24 1HG1 VAL 24 7.511 -3.877 -20.328
179 2HG1 VAL 24 2HG1 VAL 24 8.759 -3.144 -21.273
180 3HG1 VAL 24 3HG1 VAL 24 7.058 -3.154 -21.851
181 1HG2 VAL 24 1HG2 VAL 24 9.715 -6.065 -23.131
182 2HG2 VAL 24 2HG2 VAL 24 9.827 -4.294 -23.210
183 3HG2 VAL 24 3HG2 VAL 24 10.221 -5.121 -21.701
184 H CYS 25 H CYS 25 8.380 -4.935 -19.527
185 HA CYS 25 HA CYS 25 10.406 -6.597 -18.335
186 1HB CYS 25 HB2 CYS 25 8.924 -4.211 -17.139
187 2HB CYS 25 HB3 CYS 25 10.559 -4.726 -16.738
188 H GLU 26 H GLU 26 10.108 -7.017 -15.773
189 HA GLU 26 HA GLU 26 7.582 -8.466 -15.360
190 1HB GLU 26 HB2 GLU 26 10.259 -8.389 -13.993
191 2HB GLU 26 HB3 GLU 26 8.851 -8.779 -13.023
192 1HG GLU 26 HG2 GLU 26 8.208 -10.576 -14.550
193 2HG GLU 26 HG3 GLU 26 9.576 -10.237 -15.607
194 H ASP 27 H ASP 27 5.990 -7.056 -15.104
195 HA ASP 27 HA ASP 27 4.718 -5.347 -14.361
196 1HB ASP 27 HB2 ASP 27 4.425 -7.318 -12.812
197 2HB ASP 27 HB3 ASP 27 5.482 -6.503 -11.673
198 H TYR 28 H TYR 28 7.128 -4.277 -14.933
199 HA TYR 28 HA TYR 28 8.118 -2.414 -12.932
200 1HB TYR 28 HB2 TYR 28 9.438 -3.374 -14.863
201 2HB TYR 28 HB3 TYR 28 8.375 -2.550 -15.967
202 HD1 TYR 28 HD1 TYR 28 11.402 -2.266 -14.019
203 HD2 TYR 28 HD2 TYR 28 8.334 -0.017 -16.024
204 HE1 TYR 28 HE1 TYR 28 12.903 -0.312 -14.103
205 HE2 TYR 28 HE2 TYR 28 9.800 1.947 -16.127
206 HH TYR 28 HH TYR 28 13.167 1.908 -14.783
207 H ASP 29 H ASP 29 7.493 -0.291 -12.640
208 HA ASP 29 HA ASP 29 5.077 0.661 -14.133
209 1HB ASP 29 HB2 ASP 29 5.486 1.552 -11.297
210 2HB ASP 29 HB3 ASP 29 4.013 1.300 -12.174
211 H LEU 30 H LEU 30 4.805 2.940 -14.180
212 HA LEU 30 HA LEU 30 6.884 4.596 -12.932
213 1HB LEU 30 HB2 LEU 30 5.965 4.701 -15.854
214 2HB LEU 30 HB3 LEU 30 6.872 5.944 -15.034
215 HG LEU 30 HG LEU 30 7.828 3.116 -15.638
216 1HD1 LEU 30 1HD1 LEU 30 7.757 4.643 -17.571
217 2HD1 LEU 30 2HD1 LEU 30 8.741 5.827 -16.678
218 3HD1 LEU 30 3HD1 LEU 30 9.443 4.256 -17.090
219 1HD2 LEU 30 1HD2 LEU 30 9.455 5.399 -14.444
220 2HD2 LEU 30 2HD2 LEU 30 8.799 4.093 -13.460
221 3HD2 LEU 30 3HD2 LEU 30 9.999 3.725 -14.705
222 H CYS 31 H CYS 31 5.969 6.416 -12.021
223 HA CYS 31 HA CYS 31 3.161 6.989 -12.228
224 1HB CYS 31 HB2 CYS 31 3.743 9.115 -11.225
225 2HB CYS 31 HB3 CYS 31 4.441 7.813 -10.268
226 H ILE 32 H ILE 32 2.493 9.162 -13.037
227 HA ILE 32 HA ILE 32 2.805 9.292 -15.783
228 HB ILE 32 HB ILE 32 2.048 11.646 -14.027
229 1HG1 ILE 32 2HG1 ILE 32 0.713 9.983 -13.058
230 2HG1 ILE 32 3HG1 ILE 32 -0.326 10.827 -14.178
231 1HG2 ILE 32 1HG2 ILE 32 1.311 10.779 -16.847
232 2HG2 ILE 32 2HG2 ILE 32 0.570 12.148 -16.007
233 3HG2 ILE 32 3HG2 ILE 32 2.318 12.171 -16.354
234 1HD1 ILE 32 1HD1 ILE 32 0.938 8.105 -14.744
235 2HD1 ILE 32 2HD1 ILE 32 -0.613 8.350 -14.026
236 3HD1 ILE 32 3HD1 ILE 32 -0.367 8.961 -15.685
237 H ASN 33 H ASN 33 4.474 11.245 -13.315
238 HA ASN 33 HA ASN 33 5.828 12.907 -15.208
239 1HB ASN 33 HB2 ASN 33 5.663 13.739 -12.962
240 2HB ASN 33 HB3 ASN 33 6.299 12.249 -12.268
241 1HD2 ASN 33 2HD2 ASN 33 8.557 11.926 -12.085
242 2HD2 ASN 33 1HD2 ASN 33 9.695 13.180 -12.521
243 H CYS 34 H CYS 34 6.848 9.906 -13.523
244 HA CYS 34 HA CYS 34 9.483 9.954 -14.648
245 1HB CYS 34 HB2 CYS 34 7.758 7.812 -13.359
246 2HB CYS 34 HB3 CYS 34 9.301 7.410 -14.141
247 H TYR 35 H TYR 35 6.377 8.477 -15.734
248 HA TYR 35 HA TYR 35 7.448 7.185 -18.026
249 1HB TYR 35 HB2 TYR 35 5.178 6.802 -17.246
250 2HB TYR 35 HB3 TYR 35 4.706 8.463 -17.600
251 HD1 TYR 35 HD1 TYR 35 6.144 5.395 -19.263
252 HD2 TYR 35 HD2 TYR 35 3.753 8.973 -19.701
253 HE1 TYR 35 HE1 TYR 35 5.581 4.729 -21.582
254 HE2 TYR 35 HE2 TYR 35 3.224 8.307 -22.020
255 HH TYR 35 HH TYR 35 4.517 5.328 -23.486
256 H ASN 36 H ASN 36 6.136 10.459 -17.631
257 HA ASN 36 HA ASN 36 6.630 11.493 -20.178
258 1HB ASN 36 HB2 ASN 36 6.150 12.606 -17.407
259 2HB ASN 36 HB3 ASN 36 6.539 13.731 -18.664
260 1HD2 ASN 36 2HD2 ASN 36 4.155 14.328 -17.724
261 2HD2 ASN 36 1HD2 ASN 36 2.905 13.656 -18.783
262 H THR 37 H THR 37 9.081 10.681 -17.939
263 HA THR 37 HA THR 37 10.923 12.604 -19.318
264 HB THR 37 HB THR 37 12.166 12.701 -17.141
265 HG1 THR 37 HG1 THR 37 9.757 11.867 -15.928
266 1HG2 THR 37 1HG2 THR 37 9.334 13.788 -16.984
267 2HG2 THR 37 2HG2 THR 37 10.738 14.397 -16.114
268 3HG2 THR 37 3HG2 THR 37 10.642 14.548 -17.888
269 H LYS 38 H LYS 38 10.746 9.583 -17.479
270 HA LYS 38 HA LYS 38 13.274 8.539 -18.351
271 1HB LYS 38 HB2 LYS 38 10.877 6.968 -17.348
272 2HB LYS 38 HB3 LYS 38 12.560 6.493 -17.263
273 1HG LYS 38 HG2 LYS 38 11.358 8.860 -15.724
274 2HG LYS 38 HG3 LYS 38 11.542 7.242 -15.081
275 1HD LYS 38 HD2 LYS 38 13.944 7.414 -15.121
276 2HD LYS 38 HD3 LYS 38 13.887 8.890 -16.090
277 1HE LYS 38 HE2 LYS 38 14.319 9.526 -13.804
278 2HE LYS 38 HE3 LYS 38 12.715 10.096 -14.295
279 1HZ LYS 38 HZ1 LYS 38 12.795 9.044 -12.034
280 2HZ LYS 38 HZ2 LYS 38 11.708 8.391 -13.037
281 3HZ LYS 38 HZ3 LYS 38 13.152 7.637 -12.734
282 H SER 39 H SER 39 10.351 8.981 -20.052
283 HA SER 39 HA SER 39 9.531 8.194 -22.012
284 1HB SER 39 HB2 SER 39 12.483 8.371 -22.712
285 2HB SER 39 HB3 SER 39 11.105 8.669 -23.785
286 HG SER 39 HG SER 39 11.964 10.244 -21.581
287 H HIS 40 H HIS 40 9.550 5.987 -20.496
288 HA HIS 40 HA HIS 40 10.971 3.740 -21.499
289 1HB HIS 40 HB2 HIS 40 9.244 4.339 -19.358
290 2HB HIS 40 HB3 HIS 40 8.356 3.129 -20.280
291 HD1 HIS 40 HD1 HIS 40 11.582 3.369 -18.150
292 HD2 HIS 40 HD2 HIS 40 9.362 0.703 -20.498
293 HE1 HIS 40 HE1 HIS 40 12.470 1.043 -17.632
294 H THR 41 H THR 41 10.769 3.083 -23.505
295 HA THR 41 HA THR 41 8.456 3.833 -25.043
296 HB THR 41 HB THR 41 10.721 2.421 -26.345
297 HG1 THR 41 HG1 THR 41 11.263 4.732 -24.835
298 1HG2 THR 41 1HG2 THR 41 9.485 5.167 -26.736
299 2HG2 THR 41 2HG2 THR 41 10.701 4.393 -27.803
300 3HG2 THR 41 3HG2 THR 41 9.087 3.688 -27.632
301 H HIS 42 H HIS 42 8.834 1.041 -23.220
302 HA HIS 42 HA HIS 42 8.499 -0.895 -25.329
303 1HB HIS 42 HB2 HIS 42 8.121 -1.171 -22.351
304 2HB HIS 42 HB3 HIS 42 8.460 -2.449 -23.562
305 HD2 HIS 42 HD2 HIS 42 11.040 -0.955 -24.964
306 HE1 HIS 42 HE1 HIS 42 12.647 -1.014 -21.011
307 HE2 HIS 42 HE2 HIS 42 13.205 -0.769 -23.489
308 H LYS 43 H LYS 43 6.652 -2.628 -25.024
309 HA LYS 43 HA LYS 43 4.230 -1.155 -25.285
310 1HB LYS 43 HB2 LYS 43 4.986 -3.336 -26.517
311 2HB LYS 43 HB3 LYS 43 4.296 -4.171 -25.143
312 1HG LYS 43 HG2 LYS 43 2.938 -2.073 -26.897
313 2HG LYS 43 HG3 LYS 43 2.731 -3.836 -27.124
314 1HD LYS 43 HD2 LYS 43 1.694 -2.055 -24.912
315 2HD LYS 43 HD3 LYS 43 0.763 -2.911 -26.134
316 1HE LYS 43 HE2 LYS 43 1.310 -5.087 -25.139
317 2HE LYS 43 HE3 LYS 43 2.475 -4.306 -24.047
318 1HZ LYS 43 HZ1 LYS 43 -0.435 -4.271 -23.898
319 2HZ LYS 43 HZ2 LYS 43 0.725 -4.557 -22.735
320 3HZ LYS 43 HZ3 LYS 43 0.434 -3.038 -23.237
321 H MET 44 H MET 44 3.446 -0.287 -23.596
322 HA MET 44 HA MET 44 3.317 -1.622 -20.920
323 1HB MET 44 HB2 MET 44 3.261 1.271 -21.927
324 2HB MET 44 HB3 MET 44 2.724 0.839 -20.286
325 1HG MET 44 HG2 MET 44 4.654 0.085 -19.572
326 2HG MET 44 HG3 MET 44 5.401 -0.122 -21.145
327 1HE MET 44 HE1 MET 44 6.155 2.925 -18.061
328 2HE MET 44 HE2 MET 44 4.646 2.025 -18.014
329 3HE MET 44 HE3 MET 44 6.173 1.140 -18.100
330 H VAL 45 H VAL 45 1.332 -0.561 -19.710
331 HA VAL 45 HA VAL 45 -1.185 -0.389 -21.135
332 HB VAL 45 HB VAL 45 -2.100 -1.662 -19.182
333 1HG1 VAL 45 1HG1 VAL 45 -1.812 -2.695 -21.514
334 2HG1 VAL 45 2HG1 VAL 45 -0.317 -3.461 -20.888
335 3HG1 VAL 45 3HG1 VAL 45 -1.898 -3.855 -20.184
336 1HG2 VAL 45 1HG2 VAL 45 0.745 -2.596 -18.800
337 2HG2 VAL 45 2HG2 VAL 45 -0.231 -1.617 -17.704
338 3HG2 VAL 45 3HG2 VAL 45 -0.657 -3.324 -18.039
339 H LYS 46 H LYS 46 -2.679 0.700 -19.251
340 HA LYS 46 HA LYS 46 -1.073 2.344 -17.418
341 1HB LYS 46 HB2 LYS 46 -1.344 3.563 -19.642
342 2HB LYS 46 HB3 LYS 46 -3.092 3.531 -19.393
343 1HG LYS 46 HG2 LYS 46 -1.149 4.872 -17.449
344 2HG LYS 46 HG3 LYS 46 -1.817 5.646 -18.868
345 1HD LYS 46 HD2 LYS 46 -4.138 5.314 -17.910
346 2HD LYS 46 HD3 LYS 46 -3.370 4.738 -16.423
347 1HE LYS 46 HE2 LYS 46 -3.799 7.049 -16.170
348 2HE LYS 46 HE3 LYS 46 -2.043 6.869 -16.324
349 1HZ LYS 46 HZ1 LYS 46 -3.977 7.832 -18.344
350 2HZ LYS 46 HZ2 LYS 46 -2.915 8.706 -17.598
351 3HZ LYS 46 HZ3 LYS 46 -2.355 7.605 -18.690
352 H TRP 47 H TRP 47 -2.234 2.578 -15.550
353 HA TRP 47 HA TRP 47 -5.075 1.687 -15.492
354 1HB TRP 47 HB2 TRP 47 -3.008 1.013 -13.350
355 2HB TRP 47 HB3 TRP 47 -4.644 0.415 -13.486
356 HD1 TRP 47 HD1 TRP 47 -1.126 -0.242 -14.500
357 HE1 TRP 47 HE1 TRP 47 -0.935 -2.346 -15.935
358 HE3 TRP 47 HE3 TRP 47 -6.016 -0.707 -15.894
359 HZ2 TRP 47 HZ2 TRP 47 -2.648 -3.886 -17.706
360 HZ3 TRP 47 HZ3 TRP 47 -6.650 -2.387 -17.628
361 HH2 TRP 47 HH2 TRP 47 -4.982 -3.988 -18.482
362 H GLY 48 H GLY 48 -6.271 3.334 -14.492
363 1HA GLY 48 HA2 GLY 48 -4.817 5.293 -12.859
364 2HA GLY 48 HA3 GLY 48 -5.577 5.811 -14.400
365 H LEU 49 H LEU 49 -5.967 6.426 -11.593
366 HA LEU 49 HA LEU 49 -8.868 5.943 -11.389
367 1HB LEU 49 HB2 LEU 49 -6.728 5.147 -9.429
368 2HB LEU 49 HB3 LEU 49 -8.242 5.681 -8.781
369 HG LEU 49 HG LEU 49 -8.351 3.447 -8.778
370 1HD1 LEU 49 1HD1 LEU 49 -10.293 2.839 -9.999
371 2HD1 LEU 49 2HD1 LEU 49 -10.410 4.581 -9.643
372 3HD1 LEU 49 3HD1 LEU 49 -9.983 4.029 -11.266
373 1HD2 LEU 49 1HD2 LEU 49 -7.872 2.867 -11.684
374 2HD2 LEU 49 2HD2 LEU 49 -6.524 3.004 -10.513
375 3HD2 LEU 49 3HD2 LEU 49 -7.831 1.822 -10.267
376 H GLY 50 H GLY 50 -6.228 8.248 -10.938
377 1HA GLY 50 HA2 GLY 50 -8.255 10.153 -9.859
378 2HA GLY 50 HA3 GLY 50 -6.704 9.913 -9.018
379 H LEU 51 H LEU 51 -4.789 9.947 -10.942
380 HA LEU 51 HA LEU 51 -5.203 12.540 -12.382
381 1HB LEU 51 HB2 LEU 51 -2.704 11.428 -11.056
382 2HB LEU 51 HB3 LEU 51 -2.783 12.857 -12.064
383 HG LEU 51 HG LEU 51 -2.581 13.653 -9.909
384 1HD1 LEU 51 1HD1 LEU 51 -4.564 14.920 -9.412
385 2HD1 LEU 51 2HD1 LEU 51 -4.312 14.874 -11.155
386 3HD1 LEU 51 3HD1 LEU 51 -5.555 13.837 -10.412
387 1HD2 LEU 51 1HD2 LEU 51 -3.843 13.021 -7.932
388 2HD2 LEU 51 2HD2 LEU 51 -4.838 11.893 -8.863
389 3HD2 LEU 51 3HD2 LEU 51 -3.105 11.578 -8.664
390 H ASP 52 H ASP 52 -6.065 11.081 -14.114
391 HA ASP 52 HA ASP 52 -4.359 9.072 -15.270
392 1HB ASP 52 HB2 ASP 52 -6.903 9.223 -15.440
393 2HB ASP 52 HB3 ASP 52 -6.646 10.387 -16.737
Start of MODEL 15
1 1H GLY 1 H1 GLY 1 3.883 -3.667 -10.371
2 2H GLY 1 H2 GLY 1 4.068 -2.131 -9.853
3 3H GLY 1 H3 GLY 1 5.177 -3.271 -9.426
4 1HA GLY 1 HA2 GLY 1 3.429 -4.491 -8.246
5 2HA GLY 1 HA3 GLY 1 3.757 -2.877 -7.554
6 H GLN 2 H GLN 2 1.124 -4.600 -7.634
7 HA GLN 2 HA GLN 2 -0.559 -2.357 -8.434
8 1HB GLN 2 HB2 GLN 2 -2.015 -3.918 -9.854
9 2HB GLN 2 HB3 GLN 2 -0.498 -3.373 -10.549
10 1HG GLN 2 HG2 GLN 2 0.563 -5.542 -10.089
11 2HG GLN 2 HG3 GLN 2 -0.924 -6.107 -9.303
12 1HE2 GLN 2 2HE2 GLN 2 0.728 -5.748 -12.380
13 2HE2 GLN 2 1HE2 GLN 2 -0.632 -6.345 -13.329
14 H ASP 3 H ASP 3 -2.581 -2.350 -7.675
15 HA ASP 3 HA ASP 3 -3.753 -4.304 -5.842
16 1HB ASP 3 HB2 ASP 3 -2.495 -2.818 -4.358
17 2HB ASP 3 HB3 ASP 3 -3.077 -1.377 -5.198
18 H ARG 4 H ARG 4 -6.130 -3.708 -5.753
19 HA ARG 4 HA ARG 4 -7.080 -3.027 -8.324
20 1HB ARG 4 HB2 ARG 4 -9.391 -2.797 -7.096
21 2HB ARG 4 HB3 ARG 4 -8.593 -4.352 -7.284
22 1HG ARG 4 HG2 ARG 4 -9.548 -4.184 -5.086
23 2HG ARG 4 HG3 ARG 4 -7.792 -4.309 -4.990
24 1HD ARG 4 HD2 ARG 4 -8.199 -1.561 -4.974
25 2HD ARG 4 HD3 ARG 4 -9.570 -2.102 -4.028
26 HE ARG 4 HE ARG 4 -6.721 -2.207 -3.440
27 1HH1 ARG 4 1HH1 ARG 4 -9.856 -3.202 -2.214
28 2HH1 ARG 4 2HH1 ARG 4 -9.216 -3.930 -0.766
29 1HH2 ARG 4 1HH2 ARG 4 -5.872 -3.283 -1.783
30 2HH2 ARG 4 2HH2 ARG 4 -6.773 -3.834 -0.418
31 H PHE 5 H PHE 5 -6.097 -0.697 -5.943
32 HA PHE 5 HA PHE 5 -6.818 1.336 -7.923
33 1HB PHE 5 HB2 PHE 5 -7.801 2.853 -6.170
34 2HB PHE 5 HB3 PHE 5 -8.779 1.588 -6.806
35 HD1 PHE 5 HD1 PHE 5 -10.383 1.277 -5.165
36 HD2 PHE 5 HD2 PHE 5 -6.230 1.248 -3.987
37 HE1 PHE 5 HE1 PHE 5 -11.039 0.507 -2.908
38 HE2 PHE 5 HE2 PHE 5 -6.892 0.548 -1.736
39 HZ PHE 5 HZ PHE 5 -9.280 0.206 -1.155
40 H VAL 6 H VAL 6 -4.430 -0.056 -6.315
41 HA VAL 6 HA VAL 6 -2.889 2.442 -6.060
42 HB VAL 6 HB VAL 6 -3.558 0.512 -3.886
43 1HG1 VAL 6 1HG1 VAL 6 -1.247 -0.133 -4.159
44 2HG1 VAL 6 2HG1 VAL 6 -0.722 1.585 -4.052
45 3HG1 VAL 6 3HG1 VAL 6 -1.492 0.777 -2.657
46 1HG2 VAL 6 1HG2 VAL 6 -3.221 2.485 -2.525
47 2HG2 VAL 6 2HG2 VAL 6 -2.598 3.379 -3.946
48 3HG2 VAL 6 3HG2 VAL 6 -4.284 2.838 -3.891
49 H TYR 7 H TYR 7 -0.722 2.199 -6.344
50 HA TYR 7 HA TYR 7 0.317 -0.193 -7.693
51 1HB TYR 7 HB2 TYR 7 -0.101 2.571 -8.921
52 2HB TYR 7 HB3 TYR 7 0.743 1.261 -9.701
53 HD1 TYR 7 HD1 TYR 7 -0.705 -0.922 -10.160
54 HD2 TYR 7 HD2 TYR 7 -2.453 2.822 -8.925
55 HE1 TYR 7 HE1 TYR 7 -2.914 -1.693 -10.967
56 HE2 TYR 7 HE2 TYR 7 -4.654 1.971 -9.454
57 HH TYR 7 HH TYR 7 -5.892 0.265 -10.457
58 H THR 8 H THR 8 2.524 0.945 -8.767
59 HA THR 8 HA THR 8 3.809 2.736 -6.802
60 HB THR 8 HB THR 8 5.881 1.146 -7.536
61 HG1 THR 8 HG1 THR 8 4.903 -0.415 -8.632
62 1HG2 THR 8 1HG2 THR 8 5.526 1.575 -5.269
63 2HG2 THR 8 2HG2 THR 8 3.955 0.720 -5.274
64 3HG2 THR 8 3HG2 THR 8 5.497 -0.171 -5.407
65 H CYS 9 H CYS 9 5.879 3.564 -7.843
66 HA CYS 9 HA CYS 9 5.804 3.733 -10.817
67 1HB CYS 9 HB2 CYS 9 5.537 6.036 -9.915
68 2HB CYS 9 HB3 CYS 9 6.861 5.766 -8.778
69 H ASN 10 H ASN 10 7.394 2.098 -11.207
70 HA ASN 10 HA ASN 10 9.236 1.372 -9.127
71 1HB ASN 10 HB2 ASN 10 8.302 -0.191 -10.884
72 2HB ASN 10 HB3 ASN 10 9.386 0.579 -12.055
73 1HD2 ASN 10 2HD2 ASN 10 10.945 -0.979 -12.368
74 2HD2 ASN 10 1HD2 ASN 10 11.837 -1.774 -11.077
75 H GLU 11 H GLU 11 9.218 4.163 -10.932
76 HA GLU 11 HA GLU 11 12.143 4.217 -10.989
77 1HB GLU 11 HB2 GLU 11 10.174 5.618 -12.555
78 2HB GLU 11 HB3 GLU 11 11.292 6.746 -11.757
79 1HG GLU 11 HG2 GLU 11 12.318 4.331 -13.282
80 2HG GLU 11 HG3 GLU 11 12.154 5.933 -13.991
81 H CYS 12 H CYS 12 9.369 5.318 -9.142
82 HA CYS 12 HA CYS 12 11.108 7.054 -7.471
83 1HB CYS 12 HB2 CYS 12 8.112 6.611 -7.322
84 2HB CYS 12 HB3 CYS 12 9.052 7.798 -6.417
85 H LYS 13 H LYS 13 9.551 4.009 -7.625
86 HA LYS 13 HA LYS 13 9.102 2.276 -6.265
87 1HB LYS 13 HB2 LYS 13 11.888 3.032 -5.235
88 2HB LYS 13 HB3 LYS 13 11.009 1.652 -4.635
89 1HG LYS 13 HG2 LYS 13 11.757 0.413 -6.291
90 2HG LYS 13 HG3 LYS 13 10.758 1.318 -7.396
91 1HD LYS 13 HD2 LYS 13 13.706 1.671 -6.851
92 2HD LYS 13 HD3 LYS 13 12.852 1.224 -8.340
93 1HE LYS 13 HE2 LYS 13 11.808 3.570 -8.211
94 2HE LYS 13 HE3 LYS 13 13.088 3.960 -7.056
95 1HZ LYS 13 HZ1 LYS 13 14.698 3.411 -8.867
96 2HZ LYS 13 HZ2 LYS 13 13.406 3.032 -9.838
97 3HZ LYS 13 HZ3 LYS 13 13.649 4.547 -9.359
98 H HIS 14 H HIS 14 7.803 4.464 -5.877
99 HA HIS 14 HA HIS 14 6.985 4.128 -3.069
100 1HB HIS 14 HB2 HIS 14 8.054 6.326 -3.207
101 2HB HIS 14 HB3 HIS 14 7.054 6.754 -4.600
102 HD2 HIS 14 HD2 HIS 14 4.895 8.042 -4.035
103 HE1 HIS 14 HE1 HIS 14 3.898 6.263 -0.315
104 HE2 HIS 14 HE2 HIS 14 3.112 7.829 -2.152
105 H HIS 15 H HIS 15 4.694 4.742 -2.950
106 HA HIS 15 HA HIS 15 3.117 3.230 -4.789
107 1HB HIS 15 HB2 HIS 15 1.988 2.999 -2.861
108 2HB HIS 15 HB3 HIS 15 2.925 4.280 -2.097
109 HD2 HIS 15 HD2 HIS 15 -0.287 3.779 -4.200
110 HE1 HIS 15 HE1 HIS 15 -0.638 7.574 -2.322
111 HE2 HIS 15 HE2 HIS 15 -1.821 5.840 -3.771
112 H VAL 16 H VAL 16 1.346 3.981 -6.024
113 HA VAL 16 HA VAL 16 0.823 6.806 -6.391
114 HB VAL 16 HB VAL 16 1.251 6.914 -8.735
115 1HG1 VAL 16 1HG1 VAL 16 3.555 6.323 -9.126
116 2HG1 VAL 16 2HG1 VAL 16 3.361 7.126 -7.558
117 3HG1 VAL 16 3HG1 VAL 16 3.651 5.360 -7.659
118 1HG2 VAL 16 1HG2 VAL 16 1.968 5.018 -10.138
119 2HG2 VAL 16 2HG2 VAL 16 1.767 3.890 -8.788
120 3HG2 VAL 16 3HG2 VAL 16 0.376 4.746 -9.488
121 H GLU 17 H GLU 17 -1.279 7.032 -7.695
122 HA GLU 17 HA GLU 17 -3.047 4.681 -7.141
123 1HB GLU 17 HB2 GLU 17 -4.849 6.512 -7.509
124 2HB GLU 17 HB3 GLU 17 -3.983 6.388 -5.969
125 1HG GLU 17 HG2 GLU 17 -4.307 8.749 -6.671
126 2HG GLU 17 HG3 GLU 17 -2.619 8.311 -6.451
127 H THR 18 H THR 18 -1.661 6.630 -9.615
128 HA THR 18 HA THR 18 -3.044 5.058 -11.724
129 HB THR 18 HB THR 18 -2.474 8.071 -11.611
130 HG1 THR 18 HG1 THR 18 -4.252 7.866 -10.528
131 1HG2 THR 18 1HG2 THR 18 -2.922 8.229 -13.821
132 2HG2 THR 18 2HG2 THR 18 -2.769 6.472 -13.966
133 3HG2 THR 18 3HG2 THR 18 -4.355 7.234 -13.700
134 H ARG 19 H ARG 19 -1.574 4.139 -13.141
135 HA ARG 19 HA ARG 19 1.185 5.240 -13.251
136 1HB ARG 19 HB2 ARG 19 2.277 3.153 -12.845
137 2HB ARG 19 HB3 ARG 19 1.206 3.391 -11.485
138 1HG ARG 19 HG2 ARG 19 -0.415 1.851 -12.376
139 2HG ARG 19 HG3 ARG 19 0.503 1.657 -13.896
140 1HD ARG 19 HD2 ARG 19 2.181 0.386 -12.976
141 2HD ARG 19 HD3 ARG 19 1.708 0.674 -11.327
142 HE ARG 19 HE ARG 19 -0.576 -0.356 -12.291
143 1HH1 ARG 19 1HH1 ARG 19 2.690 -1.747 -12.082
144 2HH1 ARG 19 2HH1 ARG 19 2.202 -3.287 -12.685
145 1HH2 ARG 19 2HH2 ARG 19 -1.162 -2.480 -13.170
146 2HH2 ARG 19 1HH2 ARG 19 0.079 -3.663 -13.295
147 H TRP 20 H TRP 20 2.429 4.208 -14.841
148 HA TRP 20 HA TRP 20 1.052 3.139 -17.267
149 1HB TRP 20 HB2 TRP 20 3.737 4.526 -16.882
150 2HB TRP 20 HB3 TRP 20 3.080 3.939 -18.416
151 HD1 TRP 20 HD1 TRP 20 2.550 6.722 -15.839
152 HE1 TRP 20 HE1 TRP 20 0.923 8.476 -16.707
153 HE3 TRP 20 HE3 TRP 20 1.306 4.508 -20.246
154 HZ2 TRP 20 HZ2 TRP 20 -0.719 8.899 -19.054
155 HZ3 TRP 20 HZ3 TRP 20 -0.313 5.592 -21.793
156 HH2 TRP 20 HH2 TRP 20 -1.345 7.787 -21.188
157 H HIS 21 H HIS 21 1.803 1.010 -17.730
158 HA HIS 21 HA HIS 21 3.703 -0.191 -15.792
159 1HB HIS 21 HB2 HIS 21 1.797 -0.770 -14.746
160 2HB HIS 21 HB3 HIS 21 0.803 -0.743 -16.184
161 HD2 HIS 21 HD2 HIS 21 3.893 -3.098 -16.080
162 HE1 HIS 21 HE1 HIS 21 0.429 -5.552 -15.935
163 HE2 HIS 21 HE2 HIS 21 2.996 -5.520 -16.171
164 H CYS 22 H CYS 22 5.228 -1.168 -16.815
165 HA CYS 22 HA CYS 22 5.334 -1.775 -19.624
166 1HB CYS 22 HB2 CYS 22 6.972 -1.813 -17.156
167 2HB CYS 22 HB3 CYS 22 7.411 -3.080 -18.292
168 H THR 23 H THR 23 4.424 -3.405 -20.583
169 HA THR 23 HA THR 23 3.911 -5.917 -19.085
170 HB THR 23 HB THR 23 2.284 -6.491 -20.942
171 HG1 THR 23 HG1 THR 23 3.340 -4.240 -21.923
172 1HG2 THR 23 1HG2 THR 23 1.920 -3.931 -19.405
173 2HG2 THR 23 2HG2 THR 23 0.584 -5.028 -19.950
174 3HG2 THR 23 3HG2 THR 23 1.721 -5.543 -18.700
175 H VAL 24 H VAL 24 6.349 -4.910 -20.346
176 HA VAL 24 HA VAL 24 7.404 -6.992 -22.098
177 HB VAL 24 HB VAL 24 7.610 -4.749 -22.833
178 1HG1 VAL 24 1HG1 VAL 24 7.082 -3.076 -21.569
179 2HG1 VAL 24 2HG1 VAL 24 7.547 -3.882 -20.096
180 3HG1 VAL 24 3HG1 VAL 24 8.789 -3.092 -20.992
181 1HG2 VAL 24 1HG2 VAL 24 9.995 -4.147 -22.736
182 2HG2 VAL 24 2HG2 VAL 24 10.203 -5.162 -21.300
183 3HG2 VAL 24 3HG2 VAL 24 9.855 -5.919 -22.880
184 H CYS 25 H CYS 25 8.275 -5.013 -19.309
185 HA CYS 25 HA CYS 25 10.095 -6.839 -18.030
186 1HB CYS 25 HB2 CYS 25 8.694 -4.444 -16.848
187 2HB CYS 25 HB3 CYS 25 10.315 -5.040 -16.475
188 H GLU 26 H GLU 26 9.729 -7.191 -15.571
189 HA GLU 26 HA GLU 26 7.207 -8.588 -15.150
190 1HB GLU 26 HB2 GLU 26 9.863 -8.456 -13.750
191 2HB GLU 26 HB3 GLU 26 8.430 -8.842 -12.795
192 1HG GLU 26 HG2 GLU 26 7.799 -10.635 -14.278
193 2HG GLU 26 HG3 GLU 26 9.221 -10.347 -15.300
194 H ASP 27 H ASP 27 5.678 -7.010 -15.112
195 HA ASP 27 HA ASP 27 4.374 -5.334 -14.398
196 1HB ASP 27 HB2 ASP 27 3.980 -7.291 -12.860
197 2HB ASP 27 HB3 ASP 27 5.027 -6.520 -11.666
198 H TYR 28 H TYR 28 6.897 -4.402 -14.812
199 HA TYR 28 HA TYR 28 7.786 -2.529 -12.835
200 1HB TYR 28 HB2 TYR 28 9.207 -3.433 -14.622
201 2HB TYR 28 HB3 TYR 28 8.228 -2.691 -15.863
202 HD1 TYR 28 HD1 TYR 28 11.236 -2.346 -14.116
203 HD2 TYR 28 HD2 TYR 28 8.021 -0.033 -15.806
204 HE1 TYR 28 HE1 TYR 28 12.621 -0.302 -13.974
205 HE2 TYR 28 HE2 TYR 28 9.406 1.994 -15.689
206 HH TYR 28 HH TYR 28 11.354 2.907 -14.859
207 H ASP 29 H ASP 29 7.327 -0.298 -12.680
208 HA ASP 29 HA ASP 29 4.900 0.609 -14.155
209 1HB ASP 29 HB2 ASP 29 5.463 1.671 -11.398
210 2HB ASP 29 HB3 ASP 29 3.951 1.338 -12.179
211 H LEU 30 H LEU 30 4.620 2.967 -14.163
212 HA LEU 30 HA LEU 30 6.782 4.613 -13.103
213 1HB LEU 30 HB2 LEU 30 5.774 4.702 -15.991
214 2HB LEU 30 HB3 LEU 30 6.636 6.004 -15.184
215 HG LEU 30 HG LEU 30 7.724 3.232 -15.815
216 1HD1 LEU 30 1HD1 LEU 30 9.275 4.436 -17.265
217 2HD1 LEU 30 2HD1 LEU 30 7.609 4.743 -17.764
218 3HD1 LEU 30 3HD1 LEU 30 8.516 5.979 -16.841
219 1HD2 LEU 30 1HD2 LEU 30 9.955 4.235 -15.012
220 2HD2 LEU 30 2HD2 LEU 30 9.039 5.642 -14.464
221 3HD2 LEU 30 3HD2 LEU 30 8.790 4.081 -13.685
222 H CYS 31 H CYS 31 5.882 6.409 -12.096
223 HA CYS 31 HA CYS 31 3.079 6.972 -12.256
224 1HB CYS 31 HB2 CYS 31 3.635 9.008 -11.058
225 2HB CYS 31 HB3 CYS 31 4.413 7.679 -10.257
226 H ILE 32 H ILE 32 2.388 9.157 -12.985
227 HA ILE 32 HA ILE 32 2.629 9.319 -15.748
228 HB ILE 32 HB ILE 32 1.890 11.633 -13.938
229 1HG1 ILE 32 2HG1 ILE 32 0.561 9.978 -12.970
230 2HG1 ILE 32 3HG1 ILE 32 -0.493 10.863 -14.028
231 1HG2 ILE 32 1HG2 ILE 32 0.365 12.156 -15.874
232 2HG2 ILE 32 2HG2 ILE 32 2.110 12.214 -16.232
233 3HG2 ILE 32 3HG2 ILE 32 1.157 10.813 -16.760
234 1HD1 ILE 32 1HD1 ILE 32 -0.540 9.017 -15.630
235 2HD1 ILE 32 2HD1 ILE 32 0.740 8.145 -14.739
236 3HD1 ILE 32 3HD1 ILE 32 -0.816 8.376 -13.991
237 H ASN 33 H ASN 33 4.369 11.246 -13.330
238 HA ASN 33 HA ASN 33 5.665 12.984 -15.157
239 1HB ASN 33 HB2 ASN 33 5.757 13.766 -12.927
240 2HB ASN 33 HB3 ASN 33 5.978 12.158 -12.251
241 1HD2 ASN 33 2HD2 ASN 33 8.110 11.388 -11.841
242 2HD2 ASN 33 1HD2 ASN 33 9.496 12.418 -12.112
243 H CYS 34 H CYS 34 6.739 9.919 -13.684
244 HA CYS 34 HA CYS 34 9.320 10.056 -14.948
245 1HB CYS 34 HB2 CYS 34 7.732 7.818 -13.644
246 2HB CYS 34 HB3 CYS 34 9.351 7.636 -14.372
247 H TYR 35 H TYR 35 6.213 8.492 -15.850
248 HA TYR 35 HA TYR 35 7.188 7.181 -18.143
249 1HB TYR 35 HB2 TYR 35 4.954 6.794 -17.235
250 2HB TYR 35 HB3 TYR 35 4.472 8.435 -17.636
251 HD1 TYR 35 HD1 TYR 35 5.873 5.346 -19.305
252 HD2 TYR 35 HD2 TYR 35 3.318 8.800 -19.621
253 HE1 TYR 35 HE1 TYR 35 5.274 4.658 -21.592
254 HE2 TYR 35 HE2 TYR 35 2.636 8.068 -21.920
255 HH TYR 35 HH TYR 35 4.041 5.124 -23.416
256 H ASN 36 H ASN 36 5.990 10.487 -17.649
257 HA ASN 36 HA ASN 36 6.193 11.522 -20.265
258 1HB ASN 36 HB2 ASN 36 5.814 12.611 -17.499
259 2HB ASN 36 HB3 ASN 36 6.428 13.752 -18.641
260 1HD2 ASN 36 2HD2 ASN 36 3.712 11.581 -18.035
261 2HD2 ASN 36 1HD2 ASN 36 2.576 12.416 -19.103
262 H THR 37 H THR 37 8.809 10.812 -18.094
263 HA THR 37 HA THR 37 10.556 12.654 -19.699
264 HB THR 37 HB THR 37 11.858 13.045 -17.621
265 HG1 THR 37 HG1 THR 37 9.576 12.222 -16.203
266 1HG2 THR 37 1HG2 THR 37 10.221 14.724 -18.440
267 2HG2 THR 37 2HG2 THR 37 8.974 13.969 -17.440
268 3HG2 THR 37 3HG2 THR 37 10.385 14.720 -16.673
269 H LYS 38 H LYS 38 10.621 9.851 -17.564
270 HA LYS 38 HA LYS 38 13.298 9.049 -18.192
271 1HB LYS 38 HB2 LYS 38 11.055 7.257 -17.216
272 2HB LYS 38 HB3 LYS 38 12.769 7.005 -16.986
273 1HG LYS 38 HG2 LYS 38 11.160 9.310 -15.763
274 2HG LYS 38 HG3 LYS 38 11.500 7.797 -14.955
275 1HD LYS 38 HD2 LYS 38 13.924 8.312 -14.956
276 2HD LYS 38 HD3 LYS 38 13.615 9.770 -15.911
277 1HE LYS 38 HE2 LYS 38 13.850 10.425 -13.568
278 2HE LYS 38 HE3 LYS 38 12.180 10.679 -14.103
279 1HZ LYS 38 HZ1 LYS 38 13.119 8.326 -12.604
280 2HZ LYS 38 HZ2 LYS 38 12.357 9.608 -11.885
281 3HZ LYS 38 HZ3 LYS 38 11.566 8.680 -12.954
282 H SER 39 H SER 39 10.466 8.882 -20.083
283 HA SER 39 HA SER 39 9.914 7.813 -21.994
284 1HB SER 39 HB2 SER 39 12.867 8.396 -22.483
285 2HB SER 39 HB3 SER 39 11.575 8.300 -23.695
286 HG SER 39 HG SER 39 11.995 10.250 -21.686
287 H HIS 40 H HIS 40 10.260 5.823 -20.170
288 HA HIS 40 HA HIS 40 11.878 3.615 -21.077
289 1HB HIS 40 HB2 HIS 40 10.846 4.219 -18.773
290 2HB HIS 40 HB3 HIS 40 9.372 3.466 -19.381
291 HD1 HIS 40 HD1 HIS 40 12.516 2.759 -17.566
292 HD2 HIS 40 HD2 HIS 40 9.757 0.722 -19.989
293 HE1 HIS 40 HE1 HIS 40 12.742 0.311 -16.959
294 H THR 41 H THR 41 11.458 3.585 -23.284
295 HA THR 41 HA THR 41 9.098 3.899 -24.595
296 HB THR 41 HB THR 41 11.244 2.317 -25.919
297 HG1 THR 41 HG1 THR 41 11.939 4.746 -24.656
298 1HG2 THR 41 1HG2 THR 41 9.607 3.635 -27.210
299 2HG2 THR 41 2HG2 THR 41 10.168 5.132 -26.425
300 3HG2 THR 41 3HG2 THR 41 11.253 4.224 -27.507
301 H HIS 42 H HIS 42 9.145 1.141 -22.733
302 HA HIS 42 HA HIS 42 8.812 -0.749 -24.926
303 1HB HIS 42 HB2 HIS 42 8.274 -1.072 -22.002
304 2HB HIS 42 HB3 HIS 42 8.598 -2.333 -23.230
305 HD2 HIS 42 HD2 HIS 42 11.329 -0.982 -24.439
306 HE1 HIS 42 HE1 HIS 42 12.764 -1.309 -20.441
307 HE2 HIS 42 HE2 HIS 42 13.444 -1.014 -22.873
308 H LYS 43 H LYS 43 6.943 -2.394 -24.692
309 HA LYS 43 HA LYS 43 4.530 -0.887 -25.146
310 1HB LYS 43 HB2 LYS 43 5.398 -3.037 -26.369
311 2HB LYS 43 HB3 LYS 43 4.643 -3.916 -25.050
312 1HG LYS 43 HG2 LYS 43 3.373 -1.838 -26.913
313 2HG LYS 43 HG3 LYS 43 3.214 -3.577 -27.135
314 1HD LYS 43 HD2 LYS 43 1.986 -1.790 -25.031
315 2HD LYS 43 HD3 LYS 43 1.146 -2.674 -26.288
316 1HE LYS 43 HE2 LYS 43 1.656 -4.816 -25.230
317 2HE LYS 43 HE3 LYS 43 2.684 -4.018 -24.049
318 1HZ LYS 43 HZ1 LYS 43 -0.236 -3.971 -24.155
319 2HZ LYS 43 HZ2 LYS 43 0.791 -4.252 -22.883
320 3HZ LYS 43 HZ3 LYS 43 0.590 -2.751 -23.427
321 H MET 44 H MET 44 3.503 -0.119 -23.569
322 HA MET 44 HA MET 44 3.283 -1.491 -20.913
323 1HB MET 44 HB2 MET 44 3.294 1.415 -21.847
324 2HB MET 44 HB3 MET 44 2.717 0.929 -20.242
325 1HG MET 44 HG2 MET 44 4.710 0.204 -19.512
326 2HG MET 44 HG3 MET 44 5.456 0.003 -21.077
327 1HE MET 44 HE1 MET 44 6.069 3.110 -17.960
328 2HE MET 44 HE2 MET 44 4.515 2.246 -18.006
329 3HE MET 44 HE3 MET 44 6.019 1.326 -17.944
330 H VAL 45 H VAL 45 1.296 -0.469 -19.761
331 HA VAL 45 HA VAL 45 -1.188 -0.236 -21.241
332 HB VAL 45 HB VAL 45 -2.158 -1.528 -19.295
333 1HG1 VAL 45 1HG1 VAL 45 -0.358 -3.308 -21.003
334 2HG1 VAL 45 2HG1 VAL 45 -1.941 -3.721 -20.296
335 3HG1 VAL 45 3HG1 VAL 45 -1.876 -2.547 -21.610
336 1HG2 VAL 45 1HG2 VAL 45 -0.373 -1.528 -17.762
337 2HG2 VAL 45 2HG2 VAL 45 -0.759 -3.230 -18.171
338 3HG2 VAL 45 3HG2 VAL 45 0.664 -2.477 -18.844
339 H LYS 46 H LYS 46 -2.708 0.692 -19.223
340 HA LYS 46 HA LYS 46 -1.140 2.363 -17.373
341 1HB LYS 46 HB2 LYS 46 -1.408 3.639 -19.538
342 2HB LYS 46 HB3 LYS 46 -3.148 3.563 -19.340
343 1HG LYS 46 HG2 LYS 46 -1.284 4.894 -17.274
344 2HG LYS 46 HG3 LYS 46 -1.880 5.676 -18.727
345 1HD LYS 46 HD2 LYS 46 -4.268 5.301 -17.865
346 2HD LYS 46 HD3 LYS 46 -3.511 4.772 -16.346
347 1HE LYS 46 HE2 LYS 46 -3.918 7.006 -15.991
348 2HE LYS 46 HE3 LYS 46 -2.177 6.925 -16.350
349 1HZ LYS 46 HZ1 LYS 46 -4.346 7.761 -18.167
350 2HZ LYS 46 HZ2 LYS 46 -3.322 8.712 -17.467
351 3HZ LYS 46 HZ3 LYS 46 -2.731 7.676 -18.618
352 H TRP 47 H TRP 47 -2.325 2.662 -15.540
353 HA TRP 47 HA TRP 47 -5.125 1.693 -15.472
354 1HB TRP 47 HB2 TRP 47 -3.036 1.037 -13.372
355 2HB TRP 47 HB3 TRP 47 -4.678 0.439 -13.477
356 HD1 TRP 47 HD1 TRP 47 -1.190 -0.347 -14.493
357 HE1 TRP 47 HE1 TRP 47 -1.035 -2.366 -16.032
358 HE3 TRP 47 HE3 TRP 47 -6.119 -0.699 -15.905
359 HZ2 TRP 47 HZ2 TRP 47 -2.765 -3.803 -17.861
360 HZ3 TRP 47 HZ3 TRP 47 -6.725 -2.202 -17.773
361 HH2 TRP 47 HH2 TRP 47 -5.086 -3.798 -18.690
362 H GLY 48 H GLY 48 -6.377 3.172 -14.192
363 1HA GLY 48 HA2 GLY 48 -4.882 5.262 -12.787
364 2HA GLY 48 HA3 GLY 48 -5.815 5.727 -14.244
365 H LEU 49 H LEU 49 -6.064 6.394 -11.450
366 HA LEU 49 HA LEU 49 -8.906 5.709 -11.094
367 1HB LEU 49 HB2 LEU 49 -6.766 4.459 -9.576
368 2HB LEU 49 HB3 LEU 49 -7.615 5.509 -8.502
369 HG LEU 49 HG LEU 49 -8.443 3.252 -8.465
370 1HD1 LEU 49 1HD1 LEU 49 -10.851 3.739 -8.573
371 2HD1 LEU 49 2HD1 LEU 49 -9.938 5.050 -7.812
372 3HD1 LEU 49 3HD1 LEU 49 -10.502 5.234 -9.488
373 1HD2 LEU 49 1HD2 LEU 49 -9.638 2.125 -10.142
374 2HD2 LEU 49 2HD2 LEU 49 -9.651 3.509 -11.245
375 3HD2 LEU 49 3HD2 LEU 49 -8.124 2.668 -10.880
376 H GLY 50 H GLY 50 -6.305 8.041 -10.602
377 1HA GLY 50 HA2 GLY 50 -8.351 9.894 -9.454
378 2HA GLY 50 HA3 GLY 50 -6.798 9.650 -8.628
379 H LEU 51 H LEU 51 -5.056 9.634 -10.960
380 HA LEU 51 HA LEU 51 -5.473 12.359 -12.093
381 1HB LEU 51 HB2 LEU 51 -2.994 11.165 -10.766
382 2HB LEU 51 HB3 LEU 51 -3.005 12.702 -11.631
383 HG LEU 51 HG LEU 51 -4.680 12.183 -9.144
384 1HD1 LEU 51 1HD1 LEU 51 -2.962 13.476 -7.921
385 2HD1 LEU 51 2HD1 LEU 51 -2.351 11.950 -8.558
386 3HD1 LEU 51 3HD1 LEU 51 -1.938 13.474 -9.382
387 1HD2 LEU 51 1HD2 LEU 51 -3.876 14.758 -10.581
388 2HD2 LEU 51 2HD2 LEU 51 -5.511 14.039 -10.513
389 3HD2 LEU 51 3HD2 LEU 51 -4.769 14.689 -9.048
390 H ASP 52 H ASP 52 -6.341 10.613 -13.696
391 HA ASP 52 HA ASP 52 -4.540 8.929 -15.096
392 1HB ASP 52 HB2 ASP 52 -7.103 8.835 -15.029
393 2HB ASP 52 HB3 ASP 52 -7.101 10.032 -16.314
Start of MODEL 16
1 1H GLY 1 H1 GLY 1 3.506 -3.742 -10.121
2 2H GLY 1 H2 GLY 1 3.661 -2.185 -9.700
3 3H GLY 1 H3 GLY 1 4.800 -3.300 -9.226
4 1HA GLY 1 HA2 GLY 1 3.053 -4.434 -7.933
5 2HA GLY 1 HA3 GLY 1 3.451 -2.781 -7.355
6 H GLN 2 H GLN 2 0.789 -4.195 -6.979
7 HA GLN 2 HA GLN 2 -0.891 -2.064 -7.996
8 1HB GLN 2 HB2 GLN 2 -2.413 -3.553 -9.229
9 2HB GLN 2 HB3 GLN 2 -0.834 -3.532 -9.967
10 1HG GLN 2 HG2 GLN 2 -1.838 -5.736 -8.137
11 2HG GLN 2 HG3 GLN 2 -1.904 -5.787 -9.907
12 1HE2 GLN 2 2HE2 GLN 2 0.312 -5.523 -11.067
13 2HE2 GLN 2 1HE2 GLN 2 1.694 -6.176 -10.263
14 H ASP 3 H ASP 3 -3.036 -2.246 -7.377
15 HA ASP 3 HA ASP 3 -4.137 -3.924 -5.305
16 1HB ASP 3 HB2 ASP 3 -3.104 -2.359 -3.794
17 2HB ASP 3 HB3 ASP 3 -3.408 -0.996 -4.892
18 H ARG 4 H ARG 4 -6.559 -2.908 -5.185
19 HA ARG 4 HA ARG 4 -7.515 -2.620 -7.872
20 1HB ARG 4 HB2 ARG 4 -9.704 -2.065 -6.813
21 2HB ARG 4 HB3 ARG 4 -8.996 -3.641 -6.477
22 1HG ARG 4 HG2 ARG 4 -10.106 -2.732 -4.517
23 2HG ARG 4 HG3 ARG 4 -8.385 -2.941 -4.199
24 1HD ARG 4 HD2 ARG 4 -8.021 -0.556 -4.372
25 2HD ARG 4 HD3 ARG 4 -9.640 -0.285 -5.009
26 HE ARG 4 HE ARG 4 -10.543 -0.395 -2.896
27 1HH1 ARG 4 1HH2 ARG 4 -7.067 -1.292 -2.664
28 2HH1 ARG 4 2HH2 ARG 4 -7.001 -1.208 -0.998
29 1HH2 ARG 4 1HH1 ARG 4 -10.459 -0.318 -0.622
30 2HH2 ARG 4 2HH1 ARG 4 -8.965 -0.585 0.221
31 H PHE 5 H PHE 5 -6.347 -0.121 -5.614
32 HA PHE 5 HA PHE 5 -6.635 1.719 -7.825
33 1HB PHE 5 HB2 PHE 5 -7.807 3.468 -6.668
34 2HB PHE 5 HB3 PHE 5 -8.792 2.054 -6.803
35 HD1 PHE 5 HD1 PHE 5 -10.300 3.164 -5.253
36 HD2 PHE 5 HD2 PHE 5 -6.366 1.898 -3.997
37 HE1 PHE 5 HE1 PHE 5 -10.972 3.384 -2.890
38 HE2 PHE 5 HE2 PHE 5 -7.007 2.149 -1.665
39 HZ PHE 5 HZ PHE 5 -9.327 2.841 -1.056
40 H VAL 6 H VAL 6 -4.513 0.414 -6.149
41 HA VAL 6 HA VAL 6 -2.841 2.801 -5.930
42 HB VAL 6 HB VAL 6 -3.654 0.936 -3.725
43 1HG1 VAL 6 1HG1 VAL 6 -1.587 1.154 -2.492
44 2HG1 VAL 6 2HG1 VAL 6 -1.355 0.181 -3.943
45 3HG1 VAL 6 3HG1 VAL 6 -0.752 1.862 -3.897
46 1HG2 VAL 6 1HG2 VAL 6 -2.705 3.812 -3.933
47 2HG2 VAL 6 2HG2 VAL 6 -4.347 3.240 -3.769
48 3HG2 VAL 6 3HG2 VAL 6 -3.222 2.993 -2.422
49 H TYR 7 H TYR 7 -0.688 2.342 -6.264
50 HA TYR 7 HA TYR 7 0.217 -0.170 -7.475
51 1HB TYR 7 HB2 TYR 7 -0.138 2.510 -8.914
52 2HB TYR 7 HB3 TYR 7 0.666 1.141 -9.602
53 HD1 TYR 7 HD1 TYR 7 -0.965 -1.007 -10.073
54 HD2 TYR 7 HD2 TYR 7 -2.422 2.824 -8.780
55 HE1 TYR 7 HE1 TYR 7 -3.263 -1.612 -10.838
56 HE2 TYR 7 HE2 TYR 7 -4.708 2.148 -9.321
57 HH TYR 7 HH TYR 7 -6.084 0.421 -10.206
58 H THR 8 H THR 8 2.469 0.887 -8.671
59 HA THR 8 HA THR 8 3.745 2.718 -6.743
60 HB THR 8 HB THR 8 5.860 1.147 -7.438
61 HG1 THR 8 HG1 THR 8 4.961 -0.410 -8.557
62 1HG2 THR 8 1HG2 THR 8 5.498 -0.208 -5.360
63 2HG2 THR 8 2HG2 THR 8 5.462 1.544 -5.190
64 3HG2 THR 8 3HG2 THR 8 3.924 0.611 -5.185
65 H CYS 9 H CYS 9 5.857 3.560 -7.766
66 HA CYS 9 HA CYS 9 5.852 3.737 -10.731
67 1HB CYS 9 HB2 CYS 9 5.536 6.034 -9.840
68 2HB CYS 9 HB3 CYS 9 6.832 5.791 -8.669
69 H ASN 10 H ASN 10 7.413 2.127 -11.083
70 HA ASN 10 HA ASN 10 9.223 1.320 -9.041
71 1HB ASN 10 HB2 ASN 10 8.301 -0.157 -10.880
72 2HB ASN 10 HB3 ASN 10 9.445 0.622 -11.986
73 1HD2 ASN 10 2HD2 ASN 10 11.102 -0.893 -12.284
74 2HD2 ASN 10 1HD2 ASN 10 11.884 -1.733 -10.947
75 H GLU 11 H GLU 11 9.257 4.176 -10.745
76 HA GLU 11 HA GLU 11 12.187 4.216 -10.732
77 1HB GLU 11 HB2 GLU 11 10.236 5.680 -12.338
78 2HB GLU 11 HB3 GLU 11 11.412 6.721 -11.572
79 1HG GLU 11 HG2 GLU 11 12.203 4.195 -13.118
80 2HG GLU 11 HG3 GLU 11 12.242 5.816 -13.806
81 H CYS 12 H CYS 12 9.390 5.354 -8.965
82 HA CYS 12 HA CYS 12 11.118 7.084 -7.249
83 1HB CYS 12 HB2 CYS 12 8.116 6.625 -7.086
84 2HB CYS 12 HB3 CYS 12 9.069 7.824 -6.216
85 H LYS 13 H LYS 13 9.551 4.033 -7.484
86 HA LYS 13 HA LYS 13 9.081 2.287 -6.149
87 1HB LYS 13 HB2 LYS 13 11.834 3.002 -5.069
88 2HB LYS 13 HB3 LYS 13 10.920 1.610 -4.502
89 1HG LYS 13 HG2 LYS 13 11.668 0.396 -6.203
90 2HG LYS 13 HG3 LYS 13 10.700 1.376 -7.284
91 1HD LYS 13 HD2 LYS 13 13.657 1.626 -6.633
92 2HD LYS 13 HD3 LYS 13 12.842 1.180 -8.147
93 1HE LYS 13 HE2 LYS 13 11.818 3.544 -8.057
94 2HE LYS 13 HE3 LYS 13 13.096 3.939 -6.903
95 1HZ LYS 13 HZ1 LYS 13 13.719 4.473 -9.157
96 2HZ LYS 13 HZ2 LYS 13 14.695 3.253 -8.666
97 3HZ LYS 13 HZ3 LYS 13 13.403 2.996 -9.680
98 H HIS 14 H HIS 14 7.740 4.327 -5.789
99 HA HIS 14 HA HIS 14 6.871 4.222 -2.995
100 1HB HIS 14 HB2 HIS 14 7.385 6.716 -4.663
101 2HB HIS 14 HB3 HIS 14 6.100 6.696 -3.478
102 HD2 HIS 14 HD2 HIS 14 9.690 7.471 -3.659
103 HE1 HIS 14 HE1 HIS 14 9.119 6.363 0.409
104 HE2 HIS 14 HE2 HIS 14 10.715 7.443 -1.250
105 H HIS 15 H HIS 15 4.624 4.894 -2.910
106 HA HIS 15 HA HIS 15 3.099 3.391 -4.828
107 1HB HIS 15 HB2 HIS 15 1.871 3.082 -2.980
108 2HB HIS 15 HB3 HIS 15 2.772 4.319 -2.098
109 HD2 HIS 15 HD2 HIS 15 -0.354 3.898 -4.313
110 HE1 HIS 15 HE1 HIS 15 -0.706 7.721 -2.485
111 HE2 HIS 15 HE2 HIS 15 -1.893 6.003 -3.949
112 H VAL 16 H VAL 16 1.249 4.131 -5.971
113 HA VAL 16 HA VAL 16 0.824 6.950 -6.486
114 HB VAL 16 HB VAL 16 1.207 6.846 -8.885
115 1HG1 VAL 16 1HG1 VAL 16 3.522 6.305 -9.209
116 2HG1 VAL 16 2HG1 VAL 16 3.293 7.294 -7.737
117 3HG1 VAL 16 3HG1 VAL 16 3.648 5.547 -7.627
118 1HG2 VAL 16 1HG2 VAL 16 0.412 4.613 -9.393
119 2HG2 VAL 16 2HG2 VAL 16 2.051 4.803 -10.030
120 3HG2 VAL 16 3HG2 VAL 16 1.795 3.866 -8.562
121 H GLU 17 H GLU 17 -1.364 7.096 -7.781
122 HA GLU 17 HA GLU 17 -3.037 4.713 -7.142
123 1HB GLU 17 HB2 GLU 17 -4.889 6.475 -7.448
124 2HB GLU 17 HB3 GLU 17 -3.949 6.463 -5.960
125 1HG GLU 17 HG2 GLU 17 -4.387 8.785 -6.816
126 2HG GLU 17 HG3 GLU 17 -2.679 8.412 -6.600
127 H THR 18 H THR 18 -1.736 6.554 -9.674
128 HA THR 18 HA THR 18 -3.109 4.964 -11.798
129 HB THR 18 HB THR 18 -2.440 7.940 -11.589
130 HG1 THR 18 HG1 THR 18 -4.336 7.716 -10.684
131 1HG2 THR 18 1HG2 THR 18 -4.051 7.228 -13.924
132 2HG2 THR 18 2HG2 THR 18 -2.718 8.334 -13.716
133 3HG2 THR 18 3HG2 THR 18 -2.379 6.609 -14.010
134 H ARG 19 H ARG 19 -1.584 4.145 -13.270
135 HA ARG 19 HA ARG 19 1.162 5.218 -13.288
136 1HB ARG 19 HB2 ARG 19 2.298 3.208 -12.754
137 2HB ARG 19 HB3 ARG 19 1.101 3.365 -11.476
138 1HG ARG 19 HG2 ARG 19 -0.371 1.759 -12.581
139 2HG ARG 19 HG3 ARG 19 0.781 1.595 -13.932
140 1HD ARG 19 HD2 ARG 19 2.276 0.356 -12.837
141 2HD ARG 19 HD3 ARG 19 1.792 0.858 -11.230
142 HE ARG 19 HE ARG 19 -0.429 -0.350 -11.855
143 1HH1 ARG 19 1HH2 ARG 19 2.803 -1.715 -12.062
144 2HH1 ARG 19 2HH2 ARG 19 2.302 -3.233 -12.666
145 1HH2 ARG 19 1HH1 ARG 19 -1.118 -2.424 -12.714
146 2HH2 ARG 19 2HH1 ARG 19 0.105 -3.590 -13.112
147 H TRP 20 H TRP 20 2.497 4.192 -14.829
148 HA TRP 20 HA TRP 20 1.205 3.096 -17.280
149 1HB TRP 20 HB2 TRP 20 3.849 4.505 -16.745
150 2HB TRP 20 HB3 TRP 20 3.352 3.786 -18.290
151 HD1 TRP 20 HD1 TRP 20 2.455 6.672 -15.929
152 HE1 TRP 20 HE1 TRP 20 0.717 8.168 -17.001
153 HE3 TRP 20 HE3 TRP 20 1.780 4.162 -20.337
154 HZ2 TRP 20 HZ2 TRP 20 -0.836 8.292 -19.383
155 HZ3 TRP 20 HZ3 TRP 20 0.158 5.029 -22.028
156 HH2 TRP 20 HH2 TRP 20 -1.173 7.068 -21.554
157 H HIS 21 H HIS 21 1.817 0.922 -17.645
158 HA HIS 21 HA HIS 21 3.732 -0.259 -15.674
159 1HB HIS 21 HB2 HIS 21 1.795 -0.782 -14.643
160 2HB HIS 21 HB3 HIS 21 0.833 -0.795 -16.101
161 HD2 HIS 21 HD2 HIS 21 3.901 -3.118 -15.950
162 HE1 HIS 21 HE1 HIS 21 0.525 -5.617 -15.367
163 HE2 HIS 21 HE2 HIS 21 3.017 -5.579 -15.749
164 H CYS 22 H CYS 22 5.266 -1.286 -16.708
165 HA CYS 22 HA CYS 22 5.224 -1.859 -19.536
166 1HB CYS 22 HB2 CYS 22 7.048 -1.799 -17.222
167 2HB CYS 22 HB3 CYS 22 7.381 -3.142 -18.321
168 H THR 23 H THR 23 4.337 -3.473 -20.440
169 HA THR 23 HA THR 23 3.956 -6.008 -18.911
170 HB THR 23 HB THR 23 2.229 -6.599 -20.685
171 HG1 THR 23 HG1 THR 23 3.113 -4.316 -21.748
172 1HG2 THR 23 1HG2 THR 23 1.871 -4.043 -19.161
173 2HG2 THR 23 2HG2 THR 23 0.549 -5.191 -19.581
174 3HG2 THR 23 3HG2 THR 23 1.767 -5.659 -18.386
175 H VAL 24 H VAL 24 6.288 -4.955 -20.283
176 HA VAL 24 HA VAL 24 7.316 -7.061 -22.030
177 HB VAL 24 HB VAL 24 7.336 -4.832 -22.862
178 1HG1 VAL 24 1HG1 VAL 24 6.975 -3.055 -21.770
179 2HG1 VAL 24 2HG1 VAL 24 7.334 -3.759 -20.220
180 3HG1 VAL 24 3HG1 VAL 24 8.652 -3.091 -21.122
181 1HG2 VAL 24 1HG2 VAL 24 10.062 -5.100 -21.536
182 2HG2 VAL 24 2HG2 VAL 24 9.578 -5.990 -23.010
183 3HG2 VAL 24 3HG2 VAL 24 9.712 -4.210 -23.022
184 H CYS 25 H CYS 25 8.183 -4.841 -19.372
185 HA CYS 25 HA CYS 25 10.200 -6.521 -18.158
186 1HB CYS 25 HB2 CYS 25 8.695 -4.215 -16.952
187 2HB CYS 25 HB3 CYS 25 10.322 -4.750 -16.531
188 H GLU 26 H GLU 26 9.903 -7.046 -15.726
189 HA GLU 26 HA GLU 26 7.408 -8.482 -15.320
190 1HB GLU 26 HB2 GLU 26 10.099 -8.397 -13.966
191 2HB GLU 26 HB3 GLU 26 8.692 -8.841 -12.996
192 1HG GLU 26 HG2 GLU 26 8.028 -10.532 -14.592
193 2HG GLU 26 HG3 GLU 26 9.401 -10.155 -15.626
194 H ASP 27 H ASP 27 5.885 -6.930 -15.202
195 HA ASP 27 HA ASP 27 4.551 -5.322 -14.375
196 1HB ASP 27 HB2 ASP 27 4.208 -7.275 -12.912
197 2HB ASP 27 HB3 ASP 27 5.327 -6.604 -11.741
198 H TYR 28 H TYR 28 7.092 -4.362 -14.841
199 HA TYR 28 HA TYR 28 7.974 -2.485 -12.814
200 1HB TYR 28 HB2 TYR 28 9.382 -3.326 -14.697
201 2HB TYR 28 HB3 TYR 28 8.382 -2.469 -15.836
202 HD1 TYR 28 HD1 TYR 28 11.350 -2.320 -13.940
203 HD2 TYR 28 HD2 TYR 28 8.249 0.142 -15.641
204 HE1 TYR 28 HE1 TYR 28 12.862 -0.361 -13.873
205 HE2 TYR 28 HE2 TYR 28 9.758 2.092 -15.591
206 HH TYR 28 HH TYR 28 13.116 1.895 -14.333
207 H ASP 29 H ASP 29 7.478 -0.273 -12.628
208 HA ASP 29 HA ASP 29 4.981 0.585 -14.018
209 1HB ASP 29 HB2 ASP 29 5.518 1.597 -11.269
210 2HB ASP 29 HB3 ASP 29 4.011 1.282 -12.061
211 H LEU 30 H LEU 30 4.669 2.937 -14.025
212 HA LEU 30 HA LEU 30 6.802 4.572 -12.920
213 1HB LEU 30 HB2 LEU 30 5.881 4.706 -15.827
214 2HB LEU 30 HB3 LEU 30 6.702 5.989 -14.989
215 HG LEU 30 HG LEU 30 7.832 3.203 -15.526
216 1HD1 LEU 30 1HD1 LEU 30 9.385 4.354 -17.041
217 2HD1 LEU 30 2HD1 LEU 30 7.712 4.683 -17.517
218 3HD1 LEU 30 3HD1 LEU 30 8.643 5.929 -16.646
219 1HD2 LEU 30 1HD2 LEU 30 10.032 4.183 -14.746
220 2HD2 LEU 30 2HD2 LEU 30 9.142 5.660 -14.288
221 3HD2 LEU 30 3HD2 LEU 30 8.848 4.142 -13.440
222 H CYS 31 H CYS 31 5.951 6.457 -12.012
223 HA CYS 31 HA CYS 31 3.135 6.985 -12.125
224 1HB CYS 31 HB2 CYS 31 3.691 9.053 -11.036
225 2HB CYS 31 HB3 CYS 31 4.474 7.747 -10.170
226 H ILE 32 H ILE 32 2.444 9.150 -12.972
227 HA ILE 32 HA ILE 32 2.759 9.206 -15.716
228 HB ILE 32 HB ILE 32 1.858 11.532 -13.992
229 1HG1 ILE 32 2HG1 ILE 32 0.600 9.763 -13.047
230 2HG1 ILE 32 3HG1 ILE 32 -0.449 10.556 -14.213
231 1HG2 ILE 32 1HG2 ILE 32 0.341 11.917 -15.975
232 2HG2 ILE 32 2HG2 ILE 32 2.082 12.116 -16.288
233 3HG2 ILE 32 3HG2 ILE 32 1.267 10.664 -16.844
234 1HD1 ILE 32 1HD1 ILE 32 1.043 7.936 -14.741
235 2HD1 ILE 32 2HD1 ILE 32 -0.621 8.090 -14.198
236 3HD1 ILE 32 3HD1 ILE 32 -0.155 8.770 -15.787
237 H ASN 33 H ASN 33 4.264 11.282 -13.291
238 HA ASN 33 HA ASN 33 5.578 13.033 -15.135
239 1HB ASN 33 HB2 ASN 33 5.307 13.902 -12.934
240 2HB ASN 33 HB3 ASN 33 5.782 12.381 -12.164
241 1HD2 ASN 33 2HD2 ASN 33 8.000 11.921 -11.732
242 2HD2 ASN 33 1HD2 ASN 33 9.236 13.139 -11.986
243 H CYS 34 H CYS 34 6.651 10.011 -13.507
244 HA CYS 34 HA CYS 34 9.334 10.176 -14.598
245 1HB CYS 34 HB2 CYS 34 7.707 8.004 -13.252
246 2HB CYS 34 HB3 CYS 34 9.259 7.656 -14.036
247 H TYR 35 H TYR 35 6.310 8.490 -15.648
248 HA TYR 35 HA TYR 35 7.482 7.248 -17.885
249 1HB TYR 35 HB2 TYR 35 5.192 6.762 -17.089
250 2HB TYR 35 HB3 TYR 35 4.673 8.362 -17.548
251 HD1 TYR 35 HD1 TYR 35 6.633 5.533 -19.140
252 HD2 TYR 35 HD2 TYR 35 3.392 8.352 -19.564
253 HE1 TYR 35 HE1 TYR 35 6.232 4.712 -21.419
254 HE2 TYR 35 HE2 TYR 35 2.948 7.490 -21.837
255 HH TYR 35 HH TYR 35 5.002 4.905 -23.297
256 H ASN 36 H ASN 36 6.098 10.494 -17.537
257 HA ASN 36 HA ASN 36 6.428 11.459 -20.154
258 1HB ASN 36 HB2 ASN 36 5.980 12.613 -17.419
259 2HB ASN 36 HB3 ASN 36 6.638 13.731 -18.568
260 1HD2 ASN 36 2HD2 ASN 36 3.939 11.490 -18.089
261 2HD2 ASN 36 1HD2 ASN 36 2.827 12.315 -19.187
262 H THR 37 H THR 37 9.016 10.801 -17.949
263 HA THR 37 HA THR 37 10.799 12.650 -19.504
264 HB THR 37 HB THR 37 12.104 12.775 -17.342
265 HG1 THR 37 HG1 THR 37 9.697 12.098 -16.072
266 1HG2 THR 37 1HG2 THR 37 9.297 13.975 -17.267
267 2HG2 THR 37 2HG2 THR 37 10.700 14.545 -16.320
268 3HG2 THR 37 3HG2 THR 37 10.713 14.679 -18.077
269 H LYS 38 H LYS 38 10.656 9.677 -17.582
270 HA LYS 38 HA LYS 38 13.263 8.700 -18.263
271 1HB LYS 38 HB2 LYS 38 10.853 7.152 -17.275
272 2HB LYS 38 HB3 LYS 38 12.543 6.685 -17.113
273 1HG LYS 38 HG2 LYS 38 11.340 9.151 -15.747
274 2HG LYS 38 HG3 LYS 38 11.409 7.564 -15.013
275 1HD LYS 38 HD2 LYS 38 13.866 7.687 -14.996
276 2HD LYS 38 HD3 LYS 38 13.816 9.168 -15.955
277 1HE LYS 38 HE2 LYS 38 14.186 9.806 -13.673
278 2HE LYS 38 HE3 LYS 38 12.584 10.342 -14.140
279 1HZ LYS 38 HZ1 LYS 38 12.685 9.284 -11.914
280 2HZ LYS 38 HZ2 LYS 38 11.655 8.512 -12.901
281 3HZ LYS 38 HZ3 LYS 38 13.160 7.900 -12.603
282 H SER 39 H SER 39 10.621 9.020 -20.296
283 HA SER 39 HA SER 39 9.925 8.067 -22.175
284 1HB SER 39 HB2 SER 39 12.931 8.000 -22.633
285 2HB SER 39 HB3 SER 39 11.680 8.202 -23.867
286 HG SER 39 HG SER 39 12.404 10.024 -21.796
287 H HIS 40 H HIS 40 9.595 6.003 -20.538
288 HA HIS 40 HA HIS 40 11.013 3.601 -21.242
289 1HB HIS 40 HB2 HIS 40 9.105 4.404 -19.314
290 2HB HIS 40 HB3 HIS 40 8.268 3.225 -20.308
291 HD1 HIS 40 HD1 HIS 40 11.270 3.457 -17.907
292 HD2 HIS 40 HD2 HIS 40 9.249 0.751 -20.380
293 HE1 HIS 40 HE1 HIS 40 12.120 1.115 -17.266
294 H THR 41 H THR 41 11.080 3.008 -23.247
295 HA THR 41 HA THR 41 9.057 3.782 -25.093
296 HB THR 41 HB THR 41 11.293 2.089 -26.062
297 HG1 THR 41 HG1 THR 41 11.948 4.368 -24.527
298 1HG2 THR 41 1HG2 THR 41 10.503 4.990 -26.552
299 2HG2 THR 41 2HG2 THR 41 11.739 4.072 -27.464
300 3HG2 THR 41 3HG2 THR 41 10.041 3.609 -27.549
301 H HIS 42 H HIS 42 8.880 1.072 -23.170
302 HA HIS 42 HA HIS 42 8.493 -0.906 -25.265
303 1HB HIS 42 HB2 HIS 42 7.983 -1.069 -22.293
304 2HB HIS 42 HB3 HIS 42 8.300 -2.389 -23.433
305 HD2 HIS 42 HD2 HIS 42 11.008 -1.254 -24.768
306 HE1 HIS 42 HE1 HIS 42 12.499 -1.251 -20.779
307 HE2 HIS 42 HE2 HIS 42 13.154 -1.175 -23.249
308 H LYS 43 H LYS 43 6.606 -2.491 -24.975
309 HA LYS 43 HA LYS 43 4.165 -0.984 -25.259
310 1HB LYS 43 HB2 LYS 43 4.714 -3.088 -26.630
311 2HB LYS 43 HB3 LYS 43 4.379 -4.022 -25.192
312 1HG LYS 43 HG2 LYS 43 2.164 -2.244 -25.440
313 2HG LYS 43 HG3 LYS 43 2.583 -2.615 -27.094
314 1HD LYS 43 HD2 LYS 43 0.918 -4.196 -26.418
315 2HD LYS 43 HD3 LYS 43 2.437 -5.067 -26.495
316 1HE LYS 43 HE2 LYS 43 1.341 -5.790 -24.463
317 2HE LYS 43 HE3 LYS 43 2.682 -4.733 -24.007
318 1HZ LYS 43 HZ1 LYS 43 0.894 -4.180 -22.718
319 2HZ LYS 43 HZ2 LYS 43 1.013 -2.937 -23.719
320 3HZ LYS 43 HZ3 LYS 43 -0.186 -4.026 -23.946
321 H MET 44 H MET 44 3.893 -0.012 -23.270
322 HA MET 44 HA MET 44 3.444 -1.571 -20.813
323 1HB MET 44 HB2 MET 44 3.313 1.375 -21.689
324 2HB MET 44 HB3 MET 44 2.734 0.880 -20.099
325 1HG MET 44 HG2 MET 44 4.725 0.142 -19.362
326 2HG MET 44 HG3 MET 44 5.467 -0.007 -20.939
327 1HE MET 44 HE1 MET 44 6.279 1.191 -17.962
328 2HE MET 44 HE2 MET 44 6.257 2.963 -17.797
329 3HE MET 44 HE3 MET 44 4.747 2.030 -17.705
330 H VAL 45 H VAL 45 1.368 -0.593 -19.662
331 HA VAL 45 HA VAL 45 -1.098 -0.452 -21.214
332 HB VAL 45 HB VAL 45 -2.107 -1.593 -19.237
333 1HG1 VAL 45 1HG1 VAL 45 -0.334 -3.464 -20.867
334 2HG1 VAL 45 2HG1 VAL 45 -1.921 -3.813 -20.126
335 3HG1 VAL 45 3HG1 VAL 45 -1.842 -2.717 -21.483
336 1HG2 VAL 45 1HG2 VAL 45 0.705 -2.541 -18.695
337 2HG2 VAL 45 2HG2 VAL 45 -0.356 -1.499 -17.696
338 3HG2 VAL 45 3HG2 VAL 45 -0.722 -3.230 -17.961
339 H LYS 46 H LYS 46 -2.660 0.615 -19.290
340 HA LYS 46 HA LYS 46 -1.155 2.444 -17.533
341 1HB LYS 46 HB2 LYS 46 -1.340 3.751 -19.558
342 2HB LYS 46 HB3 LYS 46 -3.036 3.354 -19.768
343 1HG LYS 46 HG2 LYS 46 -2.014 4.911 -17.349
344 2HG LYS 46 HG3 LYS 46 -2.404 5.676 -18.892
345 1HD LYS 46 HD2 LYS 46 -4.749 4.628 -18.688
346 2HD LYS 46 HD3 LYS 46 -4.308 4.279 -17.019
347 1HE LYS 46 HE2 LYS 46 -5.595 6.276 -17.061
348 2HE LYS 46 HE3 LYS 46 -3.963 6.668 -16.542
349 1HZ LYS 46 HZ1 LYS 46 -4.811 7.133 -19.332
350 2HZ LYS 46 HZ2 LYS 46 -4.927 8.221 -18.086
351 3HZ LYS 46 HZ3 LYS 46 -3.503 7.722 -18.478
352 H TRP 47 H TRP 47 -2.253 2.576 -15.654
353 HA TRP 47 HA TRP 47 -5.058 1.590 -15.547
354 1HB TRP 47 HB2 TRP 47 -2.892 1.107 -13.461
355 2HB TRP 47 HB3 TRP 47 -4.540 0.452 -13.473
356 HD1 TRP 47 HD1 TRP 47 -1.087 -0.370 -14.501
357 HE1 TRP 47 HE1 TRP 47 -0.993 -2.462 -15.944
358 HE3 TRP 47 HE3 TRP 47 -5.992 -0.639 -15.879
359 HZ2 TRP 47 HZ2 TRP 47 -2.751 -3.870 -17.795
360 HZ3 TRP 47 HZ3 TRP 47 -6.665 -2.219 -17.691
361 HH2 TRP 47 HH2 TRP 47 -5.078 -3.859 -18.595
362 H GLY 48 H GLY 48 -6.220 3.396 -15.000
363 1HA GLY 48 HA2 GLY 48 -4.853 5.400 -13.307
364 2HA GLY 48 HA3 GLY 48 -5.527 5.913 -14.876
365 H LEU 49 H LEU 49 -6.057 6.568 -12.096
366 HA LEU 49 HA LEU 49 -8.996 6.211 -12.048
367 1HB LEU 49 HB2 LEU 49 -7.123 5.430 -9.774
368 2HB LEU 49 HB3 LEU 49 -8.835 5.645 -9.546
369 HG LEU 49 HG LEU 49 -7.591 3.607 -11.469
370 1HD1 LEU 49 1HD1 LEU 49 -9.015 3.266 -8.825
371 2HD1 LEU 49 2HD1 LEU 49 -8.259 1.978 -9.808
372 3HD1 LEU 49 3HD1 LEU 49 -7.235 3.222 -9.092
373 1HD2 LEU 49 1HD2 LEU 49 -9.838 2.679 -11.647
374 2HD2 LEU 49 2HD2 LEU 49 -10.512 4.003 -10.650
375 3HD2 LEU 49 3HD2 LEU 49 -9.874 4.291 -12.290
376 H GLY 50 H GLY 50 -6.492 8.453 -11.944
377 1HA GLY 50 HA2 GLY 50 -8.306 10.515 -11.221
378 2HA GLY 50 HA3 GLY 50 -7.309 10.158 -9.810
379 H LEU 51 H LEU 51 -4.778 9.680 -11.186
380 HA LEU 51 HA LEU 51 -4.123 12.466 -11.544
381 1HB LEU 51 HB2 LEU 51 -2.942 10.750 -10.119
382 2HB LEU 51 HB3 LEU 51 -2.335 9.999 -11.590
383 HG LEU 51 HG LEU 51 -0.939 11.940 -12.085
384 1HD1 LEU 51 1HD1 LEU 51 -0.748 13.761 -10.388
385 2HD1 LEU 51 2HD1 LEU 51 -2.323 13.747 -11.191
386 3HD1 LEU 51 3HD1 LEU 51 -2.157 13.098 -9.531
387 1HD2 LEU 51 1HD2 LEU 51 -0.108 10.110 -10.605
388 2HD2 LEU 51 2HD2 LEU 51 0.580 11.691 -10.121
389 3HD2 LEU 51 3HD2 LEU 51 -0.762 10.951 -9.216
390 H ASP 52 H ASP 52 -4.796 9.934 -13.804
391 HA ASP 52 HA ASP 52 -4.406 11.500 -16.137
392 1HB ASP 52 HB2 ASP 52 -2.126 11.149 -16.274
393 2HB ASP 52 HB3 ASP 52 -2.199 9.725 -15.245
Start of MODEL 17
1 1H GLY 1 H1 GLY 1 4.295 -2.260 -9.905
2 2H GLY 1 H2 GLY 1 5.477 -3.330 -9.484
3 3H GLY 1 H3 GLY 1 4.100 -3.852 -10.205
4 1HA GLY 1 HA2 GLY 1 3.926 -4.382 -7.897
5 2HA GLY 1 HA3 GLY 1 4.344 -2.701 -7.508
6 H GLN 2 H GLN 2 1.803 -4.394 -6.939
7 HA GLN 2 HA GLN 2 -0.125 -2.343 -7.791
8 1HB GLN 2 HB2 GLN 2 -1.620 -3.978 -8.708
9 2HB GLN 2 HB3 GLN 2 -0.128 -4.077 -9.586
10 1HG GLN 2 HG2 GLN 2 -0.967 -6.024 -7.375
11 2HG GLN 2 HG3 GLN 2 -1.115 -6.317 -9.091
12 1HE2 GLN 2 2HE2 GLN 2 0.952 -6.234 -10.454
13 2HE2 GLN 2 1HE2 GLN 2 2.418 -6.709 -9.705
14 H ASP 3 H ASP 3 -2.192 -2.730 -6.959
15 HA ASP 3 HA ASP 3 -2.990 -4.208 -4.649
16 1HB ASP 3 HB2 ASP 3 -1.954 -2.343 -3.464
17 2HB ASP 3 HB3 ASP 3 -2.682 -1.155 -4.561
18 H ARG 4 H ARG 4 -5.480 -3.790 -4.641
19 HA ARG 4 HA ARG 4 -6.405 -3.821 -7.344
20 1HB ARG 4 HB2 ARG 4 -8.733 -3.560 -6.247
21 2HB ARG 4 HB3 ARG 4 -7.803 -5.025 -6.100
22 1HG ARG 4 HG2 ARG 4 -8.865 -4.525 -3.989
23 2HG ARG 4 HG3 ARG 4 -7.123 -4.505 -3.829
24 1HD ARG 4 HD2 ARG 4 -7.717 -1.823 -4.325
25 2HD ARG 4 HD3 ARG 4 -9.074 -2.358 -3.322
26 HE ARG 4 HE ARG 4 -6.226 -2.106 -2.704
27 1HH1 ARG 4 1HH2 ARG 4 -9.313 -3.069 -1.338
28 2HH1 ARG 4 2HH2 ARG 4 -8.678 -3.536 0.208
29 1HH2 ARG 4 1HH1 ARG 4 -5.345 -2.801 -0.901
30 2HH2 ARG 4 2HH1 ARG 4 -6.223 -3.237 0.542
31 H PHE 5 H PHE 5 -5.778 -0.994 -5.403
32 HA PHE 5 HA PHE 5 -6.610 0.526 -7.753
33 1HB PHE 5 HB2 PHE 5 -7.784 2.286 -6.325
34 2HB PHE 5 HB3 PHE 5 -8.635 0.811 -6.689
35 HD1 PHE 5 HD1 PHE 5 -6.102 1.271 -3.898
36 HD2 PHE 5 HD2 PHE 5 -10.232 0.744 -5.002
37 HE1 PHE 5 HE1 PHE 5 -6.690 0.919 -1.518
38 HE2 PHE 5 HE2 PHE 5 -10.827 0.471 -2.602
39 HZ PHE 5 HZ PHE 5 -9.072 0.546 -0.858
40 H VAL 6 H VAL 6 -4.203 -0.126 -5.771
41 HA VAL 6 HA VAL 6 -2.927 2.530 -6.105
42 HB VAL 6 HB VAL 6 -3.373 0.854 -3.647
43 1HG1 VAL 6 1HG1 VAL 6 -0.951 0.690 -3.802
44 2HG1 VAL 6 2HG1 VAL 6 -0.837 2.481 -3.986
45 3HG1 VAL 6 3HG1 VAL 6 -1.424 1.739 -2.483
46 1HG2 VAL 6 1HG2 VAL 6 -4.473 3.052 -4.056
47 2HG2 VAL 6 2HG2 VAL 6 -3.495 3.018 -2.571
48 3HG2 VAL 6 3HG2 VAL 6 -2.868 3.816 -4.029
49 H TYR 7 H TYR 7 -0.608 2.257 -6.359
50 HA TYR 7 HA TYR 7 0.468 -0.377 -7.122
51 1HB TYR 7 HB2 TYR 7 0.161 1.971 -9.006
52 2HB TYR 7 HB3 TYR 7 0.907 0.397 -9.338
53 HD1 TYR 7 HD1 TYR 7 -0.495 -1.545 -9.855
54 HD2 TYR 7 HD2 TYR 7 -2.302 2.226 -8.831
55 HE1 TYR 7 HE1 TYR 7 -2.729 -2.419 -10.559
56 HE2 TYR 7 HE2 TYR 7 -4.502 1.325 -9.308
57 HH TYR 7 HH TYR 7 -5.708 -0.500 -10.167
58 H THR 8 H THR 8 2.688 0.708 -8.514
59 HA THR 8 HA THR 8 3.821 2.710 -6.629
60 HB THR 8 HB THR 8 5.987 1.260 -7.313
61 HG1 THR 8 HG1 THR 8 5.114 -0.342 -8.497
62 1HG2 THR 8 1HG2 THR 8 5.304 1.637 -5.009
63 2HG2 THR 8 2HG2 THR 8 4.043 0.388 -5.153
64 3HG2 THR 8 3HG2 THR 8 5.777 -0.037 -5.233
65 H CYS 9 H CYS 9 5.707 3.855 -7.594
66 HA CYS 9 HA CYS 9 5.666 3.888 -10.602
67 1HB CYS 9 HB2 CYS 9 5.477 6.200 -9.761
68 2HB CYS 9 HB3 CYS 9 6.808 5.914 -8.623
69 H ASN 10 H ASN 10 7.283 2.277 -11.071
70 HA ASN 10 HA ASN 10 9.087 1.484 -8.990
71 1HB ASN 10 HB2 ASN 10 8.126 -0.007 -10.815
72 2HB ASN 10 HB3 ASN 10 9.344 0.717 -11.880
73 1HD2 ASN 10 2HD2 ASN 10 10.877 -0.868 -12.070
74 2HD2 ASN 10 1HD2 ASN 10 11.625 -1.707 -10.703
75 H GLU 11 H GLU 11 9.132 4.314 -10.724
76 HA GLU 11 HA GLU 11 12.051 4.351 -10.636
77 1HB GLU 11 HB2 GLU 11 10.180 5.832 -12.275
78 2HB GLU 11 HB3 GLU 11 11.245 6.923 -11.377
79 1HG GLU 11 HG2 GLU 11 12.334 4.563 -12.967
80 2HG GLU 11 HG3 GLU 11 12.251 6.210 -13.575
81 H CYS 12 H CYS 12 9.196 5.459 -8.936
82 HA CYS 12 HA CYS 12 10.852 7.271 -7.220
83 1HB CYS 12 HB2 CYS 12 7.848 6.732 -7.061
84 2HB CYS 12 HB3 CYS 12 8.789 7.951 -6.208
85 H LYS 13 H LYS 13 9.432 4.151 -7.351
86 HA LYS 13 HA LYS 13 8.994 2.461 -5.918
87 1HB LYS 13 HB2 LYS 13 11.748 3.280 -4.944
88 2HB LYS 13 HB3 LYS 13 10.863 1.932 -4.242
89 1HG LYS 13 HG2 LYS 13 11.616 0.604 -5.874
90 2HG LYS 13 HG3 LYS 13 10.601 1.478 -7.005
91 1HD LYS 13 HD2 LYS 13 13.554 1.782 -6.564
92 2HD LYS 13 HD3 LYS 13 12.613 1.345 -8.008
93 1HE LYS 13 HE2 LYS 13 11.648 3.660 -7.977
94 2HE LYS 13 HE3 LYS 13 12.859 4.096 -6.769
95 1HZ LYS 13 HZ1 LYS 13 13.576 4.621 -9.014
96 2HZ LYS 13 HZ2 LYS 13 14.571 3.471 -8.456
97 3HZ LYS 13 HZ3 LYS 13 13.338 3.115 -9.512
98 H HIS 14 H HIS 14 7.564 4.475 -5.619
99 HA HIS 14 HA HIS 14 6.720 4.498 -2.808
100 1HB HIS 14 HB2 HIS 14 7.828 6.597 -3.058
101 2HB HIS 14 HB3 HIS 14 7.134 6.875 -4.664
102 HD2 HIS 14 HD2 HIS 14 5.224 8.477 -4.784
103 HE1 HIS 14 HE1 HIS 14 3.269 7.622 -1.112
104 HE2 HIS 14 HE2 HIS 14 3.128 8.930 -3.274
105 H HIS 15 H HIS 15 4.401 5.031 -2.720
106 HA HIS 15 HA HIS 15 2.996 3.428 -4.636
107 1HB HIS 15 HB2 HIS 15 2.245 4.886 -2.069
108 2HB HIS 15 HB3 HIS 15 0.995 4.215 -3.112
109 HD2 HIS 15 HD2 HIS 15 1.196 1.478 -3.687
110 HE1 HIS 15 HE1 HIS 15 3.071 0.596 0.022
111 HE2 HIS 15 HE2 HIS 15 1.886 -0.402 -1.982
112 H VAL 16 H VAL 16 1.291 4.036 -5.979
113 HA VAL 16 HA VAL 16 0.634 6.872 -6.387
114 HB VAL 16 HB VAL 16 1.179 6.765 -8.761
115 1HG1 VAL 16 1HG1 VAL 16 3.586 6.547 -8.804
116 2HG1 VAL 16 2HG1 VAL 16 3.097 7.349 -7.311
117 3HG1 VAL 16 3HG1 VAL 16 3.615 5.639 -7.300
118 1HG2 VAL 16 1HG2 VAL 16 2.305 4.767 -9.813
119 2HG2 VAL 16 2HG2 VAL 16 1.966 3.852 -8.334
120 3HG2 VAL 16 3HG2 VAL 16 0.648 4.454 -9.332
121 H GLU 17 H GLU 17 -1.490 7.046 -7.358
122 HA GLU 17 HA GLU 17 -3.197 4.638 -7.190
123 1HB GLU 17 HB2 GLU 17 -5.029 6.155 -7.275
124 2HB GLU 17 HB3 GLU 17 -3.848 6.770 -6.116
125 1HG GLU 17 HG2 GLU 17 -4.569 7.876 -8.844
126 2HG GLU 17 HG3 GLU 17 -4.747 8.701 -7.336
127 H THR 18 H THR 18 -1.704 6.686 -9.578
128 HA THR 18 HA THR 18 -3.021 5.236 -11.822
129 HB THR 18 HB THR 18 -2.064 8.113 -11.675
130 HG1 THR 18 HG1 THR 18 -3.618 8.164 -10.450
131 1HG2 THR 18 1HG2 THR 18 -2.583 6.755 -14.027
132 2HG2 THR 18 2HG2 THR 18 -4.220 7.337 -13.600
133 3HG2 THR 18 3HG2 THR 18 -2.918 8.477 -13.772
134 H ARG 19 H ARG 19 -1.527 4.313 -13.304
135 HA ARG 19 HA ARG 19 1.263 5.283 -13.349
136 1HB ARG 19 HB2 ARG 19 2.300 3.360 -12.672
137 2HB ARG 19 HB3 ARG 19 0.973 3.455 -11.541
138 1HG ARG 19 HG2 ARG 19 -0.207 1.822 -13.388
139 2HG ARG 19 HG3 ARG 19 1.478 1.511 -13.826
140 1HD ARG 19 HD2 ARG 19 1.394 1.434 -11.028
141 2HD ARG 19 HD3 ARG 19 -0.146 0.691 -11.534
142 HE ARG 19 HE ARG 19 2.600 -0.305 -11.807
143 1HH1 ARG 19 1HH2 ARG 19 -0.834 -1.277 -12.280
144 2HH1 ARG 19 2HH2 ARG 19 -0.324 -2.812 -12.898
145 1HH2 ARG 19 1HH1 ARG 19 3.081 -2.286 -12.294
146 2HH2 ARG 19 2HH1 ARG 19 1.977 -3.513 -12.697
147 H TRP 20 H TRP 20 2.564 4.238 -14.897
148 HA TRP 20 HA TRP 20 1.281 3.115 -17.335
149 1HB TRP 20 HB2 TRP 20 3.903 4.566 -16.807
150 2HB TRP 20 HB3 TRP 20 3.428 3.883 -18.377
151 HD1 TRP 20 HD1 TRP 20 2.517 6.714 -15.953
152 HE1 TRP 20 HE1 TRP 20 0.690 8.188 -16.917
153 HE3 TRP 20 HE3 TRP 20 1.763 4.287 -20.393
154 HZ2 TRP 20 HZ2 TRP 20 -0.904 8.340 -19.304
155 HZ3 TRP 20 HZ3 TRP 20 0.063 5.136 -22.016
156 HH2 TRP 20 HH2 TRP 20 -1.316 7.130 -21.430
157 H HIS 21 H HIS 21 1.850 0.986 -17.675
158 HA HIS 21 HA HIS 21 3.846 -0.211 -15.802
159 1HB HIS 21 HB2 HIS 21 1.908 -0.634 -14.677
160 2HB HIS 21 HB3 HIS 21 0.915 -0.712 -16.107
161 HD2 HIS 21 HD2 HIS 21 3.928 -3.116 -15.973
162 HE1 HIS 21 HE1 HIS 21 0.471 -5.423 -15.154
163 HE2 HIS 21 HE2 HIS 21 2.953 -5.509 -15.686
164 H CYS 22 H CYS 22 5.296 -1.315 -16.797
165 HA CYS 22 HA CYS 22 5.220 -1.920 -19.603
166 1HB CYS 22 HB2 CYS 22 7.068 -1.884 -17.304
167 2HB CYS 22 HB3 CYS 22 7.378 -3.228 -18.396
168 H THR 23 H THR 23 4.378 -3.556 -20.538
169 HA THR 23 HA THR 23 3.898 -6.057 -18.991
170 HB THR 23 HB THR 23 2.080 -6.645 -20.580
171 HG1 THR 23 HG1 THR 23 3.003 -4.377 -21.782
172 1HG2 THR 23 1HG2 THR 23 1.899 -3.962 -19.228
173 2HG2 THR 23 2HG2 THR 23 0.531 -5.062 -19.607
174 3HG2 THR 23 3HG2 THR 23 1.718 -5.514 -18.387
175 H VAL 24 H VAL 24 6.224 -5.034 -20.387
176 HA VAL 24 HA VAL 24 7.206 -7.128 -22.179
177 HB VAL 24 HB VAL 24 7.194 -4.893 -22.986
178 1HG1 VAL 24 1HG1 VAL 24 7.305 -3.885 -20.331
179 2HG1 VAL 24 2HG1 VAL 24 8.575 -3.175 -21.295
180 3HG1 VAL 24 3HG1 VAL 24 6.867 -3.147 -21.848
181 1HG2 VAL 24 1HG2 VAL 24 9.580 -4.255 -23.198
182 2HG2 VAL 24 2HG2 VAL 24 9.987 -5.217 -21.774
183 3HG2 VAL 24 3HG2 VAL 24 9.420 -6.031 -23.248
184 H CYS 25 H CYS 25 8.173 -4.951 -19.523
185 HA CYS 25 HA CYS 25 10.213 -6.668 -18.415
186 1HB CYS 25 HB2 CYS 25 8.797 -4.286 -17.131
187 2HB CYS 25 HB3 CYS 25 10.415 -4.882 -16.768
188 H GLU 26 H GLU 26 10.028 -7.094 -15.946
189 HA GLU 26 HA GLU 26 7.593 -8.617 -15.372
190 1HB GLU 26 HB2 GLU 26 10.327 -8.376 -14.175
191 2HB GLU 26 HB3 GLU 26 8.998 -8.802 -13.086
192 1HG GLU 26 HG2 GLU 26 8.302 -10.618 -14.576
193 2HG GLU 26 HG3 GLU 26 9.666 -10.269 -15.649
194 H ASP 27 H ASP 27 6.057 -7.012 -15.344
195 HA ASP 27 HA ASP 27 4.700 -5.415 -14.477
196 1HB ASP 27 HB2 ASP 27 4.454 -7.424 -12.984
197 2HB ASP 27 HB3 ASP 27 5.593 -6.687 -11.882
198 H TYR 28 H TYR 28 7.168 -4.331 -15.042
199 HA TYR 28 HA TYR 28 8.048 -2.530 -12.955
200 1HB TYR 28 HB2 TYR 28 9.446 -3.342 -14.884
201 2HB TYR 28 HB3 TYR 28 8.478 -2.373 -15.986
202 HD1 TYR 28 HD1 TYR 28 11.382 -2.333 -13.865
203 HD2 TYR 28 HD2 TYR 28 8.368 0.147 -15.690
204 HE1 TYR 28 HE1 TYR 28 12.746 -0.310 -13.379
205 HE2 TYR 28 HE2 TYR 28 9.713 2.134 -15.236
206 HH TYR 28 HH TYR 28 11.482 2.976 -13.954
207 H ASP 29 H ASP 29 7.563 -0.300 -12.722
208 HA ASP 29 HA ASP 29 5.055 0.608 -14.092
209 1HB ASP 29 HB2 ASP 29 5.679 1.555 -11.319
210 2HB ASP 29 HB3 ASP 29 4.152 1.283 -12.097
211 H LEU 30 H LEU 30 4.752 2.921 -14.069
212 HA LEU 30 HA LEU 30 6.847 4.627 -12.966
213 1HB LEU 30 HB2 LEU 30 5.953 4.668 -15.894
214 2HB LEU 30 HB3 LEU 30 6.708 6.005 -15.067
215 HG LEU 30 HG LEU 30 7.942 3.258 -15.627
216 1HD1 LEU 30 1HD1 LEU 30 9.464 4.401 -17.092
217 2HD1 LEU 30 2HD1 LEU 30 7.802 4.726 -17.592
218 3HD1 LEU 30 3HD1 LEU 30 8.762 5.973 -16.726
219 1HD2 LEU 30 1HD2 LEU 30 8.951 4.167 -13.492
220 2HD2 LEU 30 2HD2 LEU 30 10.120 4.342 -14.804
221 3HD2 LEU 30 3HD2 LEU 30 9.133 5.727 -14.286
222 H CYS 31 H CYS 31 5.890 6.433 -12.003
223 HA CYS 31 HA CYS 31 3.064 6.913 -12.315
224 1HB CYS 31 HB2 CYS 31 3.505 8.981 -11.165
225 2HB CYS 31 HB3 CYS 31 4.288 7.694 -10.272
226 H ILE 32 H ILE 32 2.389 9.124 -13.080
227 HA ILE 32 HA ILE 32 2.760 9.240 -15.797
228 HB ILE 32 HB ILE 32 1.929 11.608 -14.062
229 1HG1 ILE 32 2HG1 ILE 32 0.617 9.870 -13.127
230 2HG1 ILE 32 3HG1 ILE 32 -0.408 10.794 -14.241
231 1HG2 ILE 32 1HG2 ILE 32 2.220 12.167 -16.311
232 2HG2 ILE 32 2HG2 ILE 32 1.287 10.756 -16.911
233 3HG2 ILE 32 3HG2 ILE 32 0.463 12.079 -16.052
234 1HD1 ILE 32 1HD1 ILE 32 0.877 8.103 -14.854
235 2HD1 ILE 32 2HD1 ILE 32 -0.783 8.330 -14.356
236 3HD1 ILE 32 3HD1 ILE 32 -0.243 9.054 -15.891
237 H ASN 33 H ASN 33 4.345 11.199 -13.321
238 HA ASN 33 HA ASN 33 5.684 12.991 -15.110
239 1HB ASN 33 HB2 ASN 33 5.503 13.696 -12.800
240 2HB ASN 33 HB3 ASN 33 6.089 12.147 -12.204
241 1HD2 ASN 33 2HD2 ASN 33 8.418 11.723 -12.169
242 2HD2 ASN 33 1HD2 ASN 33 9.516 13.077 -12.372
243 H CYS 34 H CYS 34 6.756 9.991 -13.503
244 HA CYS 34 HA CYS 34 9.392 10.086 -14.654
245 1HB CYS 34 HB2 CYS 34 7.810 7.871 -13.325
246 2HB CYS 34 HB3 CYS 34 9.436 7.688 -14.023
247 H TYR 35 H TYR 35 6.352 8.460 -15.646
248 HA TYR 35 HA TYR 35 7.448 7.171 -17.910
249 1HB TYR 35 HB2 TYR 35 5.179 6.751 -17.170
250 2HB TYR 35 HB3 TYR 35 4.687 8.394 -17.588
251 HD1 TYR 35 HD1 TYR 35 6.507 5.521 -19.200
252 HD2 TYR 35 HD2 TYR 35 3.417 8.505 -19.628
253 HE1 TYR 35 HE1 TYR 35 6.031 4.689 -21.486
254 HE2 TYR 35 HE2 TYR 35 2.925 7.668 -21.884
255 HH TYR 35 HH TYR 35 4.795 4.989 -23.385
256 H ASN 36 H ASN 36 6.170 10.478 -17.560
257 HA ASN 36 HA ASN 36 6.636 11.419 -20.158
258 1HB ASN 36 HB2 ASN 36 5.965 12.606 -17.489
259 2HB ASN 36 HB3 ASN 36 6.744 13.712 -18.542
260 1HD2 ASN 36 2HD2 ASN 36 3.991 11.478 -18.404
261 2HD2 ASN 36 1HD2 ASN 36 3.027 12.344 -19.606
262 H THR 37 H THR 37 9.044 10.865 -17.670
263 HA THR 37 HA THR 37 10.966 12.586 -19.189
264 HB THR 37 HB THR 37 12.023 13.110 -17.026
265 HG1 THR 37 HG1 THR 37 9.614 12.224 -15.872
266 1HG2 THR 37 1HG2 THR 37 9.115 14.032 -17.158
267 2HG2 THR 37 2HG2 THR 37 10.490 14.811 -16.313
268 3HG2 THR 37 3HG2 THR 37 10.464 14.740 -18.071
269 H LYS 38 H LYS 38 10.320 9.422 -18.446
270 HA LYS 38 HA LYS 38 13.230 8.736 -18.437
271 1HB LYS 38 HB2 LYS 38 11.011 7.061 -17.253
272 2HB LYS 38 HB3 LYS 38 12.745 6.809 -17.104
273 1HG LYS 38 HG2 LYS 38 11.373 9.256 -15.899
274 2HG LYS 38 HG3 LYS 38 11.476 7.698 -15.072
275 1HD LYS 38 HD2 LYS 38 13.907 7.866 -14.984
276 2HD LYS 38 HD3 LYS 38 13.878 9.267 -16.071
277 1HE LYS 38 HE2 LYS 38 14.176 10.062 -13.812
278 2HE LYS 38 HE3 LYS 38 12.596 10.576 -14.402
279 1HZ LYS 38 HZ1 LYS 38 12.621 9.732 -12.097
280 2HZ LYS 38 HZ2 LYS 38 11.580 8.884 -13.036
281 3HZ LYS 38 HZ3 LYS 38 13.077 8.282 -12.628
282 H SER 39 H SER 39 10.934 9.034 -20.606
283 HA SER 39 HA SER 39 10.103 7.893 -22.367
284 1HB SER 39 HB2 SER 39 13.108 7.793 -22.807
285 2HB SER 39 HB3 SER 39 11.868 7.861 -24.048
286 HG SER 39 HG SER 39 12.774 9.946 -23.530
287 H HIS 40 H HIS 40 9.717 5.914 -20.667
288 HA HIS 40 HA HIS 40 11.040 3.438 -21.404
289 1HB HIS 40 HB2 HIS 40 9.254 4.322 -19.382
290 2HB HIS 40 HB3 HIS 40 8.351 3.146 -20.328
291 HD1 HIS 40 HD1 HIS 40 11.297 3.305 -17.908
292 HD2 HIS 40 HD2 HIS 40 9.321 0.653 -20.483
293 HE1 HIS 40 HE1 HIS 40 11.991 0.957 -17.182
294 H THR 41 H THR 41 10.944 2.805 -23.425
295 HA THR 41 HA THR 41 8.839 3.751 -25.145
296 HB THR 41 HB THR 41 11.017 2.046 -26.255
297 HG1 THR 41 HG1 THR 41 11.711 4.325 -24.719
298 1HG2 THR 41 1HG2 THR 41 9.640 3.540 -27.633
299 2HG2 THR 41 2HG2 THR 41 10.257 4.962 -26.758
300 3HG2 THR 41 3HG2 THR 41 11.365 3.962 -27.731
301 H HIS 42 H HIS 42 8.934 0.966 -23.300
302 HA HIS 42 HA HIS 42 8.421 -0.970 -25.380
303 1HB HIS 42 HB2 HIS 42 7.969 -1.183 -22.400
304 2HB HIS 42 HB3 HIS 42 8.267 -2.495 -23.556
305 HD2 HIS 42 HD2 HIS 42 10.969 -1.349 -24.931
306 HE1 HIS 42 HE1 HIS 42 12.479 -1.297 -20.942
307 HE2 HIS 42 HE2 HIS 42 13.109 -1.231 -23.420
308 H LYS 43 H LYS 43 6.477 -2.525 -25.043
309 HA LYS 43 HA LYS 43 4.083 -0.916 -25.228
310 1HB LYS 43 HB2 LYS 43 4.536 -2.931 -26.666
311 2HB LYS 43 HB3 LYS 43 4.182 -3.949 -25.292
312 1HG LYS 43 HG2 LYS 43 2.015 -2.088 -25.359
313 2HG LYS 43 HG3 LYS 43 2.381 -2.361 -27.047
314 1HD LYS 43 HD2 LYS 43 0.660 -3.875 -26.427
315 2HD LYS 43 HD3 LYS 43 2.121 -4.845 -26.636
316 1HE LYS 43 HE2 LYS 43 1.125 -5.668 -24.639
317 2HE LYS 43 HE3 LYS 43 2.499 -4.710 -24.147
318 1HZ LYS 43 HZ1 LYS 43 0.752 -4.185 -22.747
319 2HZ LYS 43 HZ2 LYS 43 0.926 -2.868 -23.651
320 3HZ LYS 43 HZ3 LYS 43 -0.329 -3.907 -23.956
321 H MET 44 H MET 44 3.820 -0.013 -23.301
322 HA MET 44 HA MET 44 3.404 -1.554 -20.840
323 1HB MET 44 HB2 MET 44 3.359 1.367 -21.743
324 2HB MET 44 HB3 MET 44 2.825 0.905 -20.106
325 1HG MET 44 HG2 MET 44 4.824 0.078 -19.453
326 2HG MET 44 HG3 MET 44 5.491 -0.095 -21.056
327 1HE MET 44 HE1 MET 44 4.756 2.042 -17.920
328 2HE MET 44 HE2 MET 44 6.271 1.152 -17.999
329 3HE MET 44 HE3 MET 44 6.328 2.907 -17.922
330 H VAL 45 H VAL 45 1.375 -0.472 -19.670
331 HA VAL 45 HA VAL 45 -1.121 -0.289 -21.145
332 HB VAL 45 HB VAL 45 -2.090 -1.498 -19.219
333 1HG1 VAL 45 1HG1 VAL 45 -1.794 -2.580 -21.468
334 2HG1 VAL 45 2HG1 VAL 45 -0.264 -3.306 -20.877
335 3HG1 VAL 45 3HG1 VAL 45 -1.830 -3.718 -20.130
336 1HG2 VAL 45 1HG2 VAL 45 0.712 -2.437 -18.646
337 2HG2 VAL 45 2HG2 VAL 45 -0.356 -1.459 -17.612
338 3HG2 VAL 45 3HG2 VAL 45 -0.727 -3.169 -17.980
339 H LYS 46 H LYS 46 -2.631 0.659 -19.188
340 HA LYS 46 HA LYS 46 -1.120 2.461 -17.448
341 1HB LYS 46 HB2 LYS 46 -1.370 3.814 -19.445
342 2HB LYS 46 HB3 LYS 46 -3.071 3.423 -19.604
343 1HG LYS 46 HG2 LYS 46 -1.972 4.977 -17.222
344 2HG LYS 46 HG3 LYS 46 -2.477 5.710 -18.737
345 1HD LYS 46 HD2 LYS 46 -4.768 4.512 -18.341
346 2HD LYS 46 HD3 LYS 46 -4.205 4.330 -16.673
347 1HE LYS 46 HE2 LYS 46 -5.698 6.210 -16.916
348 2HE LYS 46 HE3 LYS 46 -4.095 6.701 -16.357
349 1HZ LYS 46 HZ1 LYS 46 -3.647 7.744 -18.281
350 2HZ LYS 46 HZ2 LYS 46 -4.799 6.976 -19.219
351 3HZ LYS 46 HZ3 LYS 46 -5.118 8.104 -18.046
352 H TRP 47 H TRP 47 -2.194 2.570 -15.531
353 HA TRP 47 HA TRP 47 -5.030 1.634 -15.473
354 1HB TRP 47 HB2 TRP 47 -2.938 0.963 -13.366
355 2HB TRP 47 HB3 TRP 47 -4.612 0.397 -13.446
356 HD1 TRP 47 HD1 TRP 47 -1.164 -0.478 -14.422
357 HE1 TRP 47 HE1 TRP 47 -1.053 -2.517 -15.925
358 HE3 TRP 47 HE3 TRP 47 -6.079 -0.671 -15.882
359 HZ2 TRP 47 HZ2 TRP 47 -2.771 -3.836 -17.841
360 HZ3 TRP 47 HZ3 TRP 47 -6.701 -2.164 -17.767
361 HH2 TRP 47 HH2 TRP 47 -5.105 -3.801 -18.668
362 H GLY 48 H GLY 48 -6.153 3.372 -14.790
363 1HA GLY 48 HA2 GLY 48 -4.772 5.366 -13.071
364 2HA GLY 48 HA3 GLY 48 -5.642 5.847 -14.539
365 H LEU 49 H LEU 49 -5.815 5.851 -11.412
366 HA LEU 49 HA LEU 49 -8.747 5.522 -11.324
367 1HB LEU 49 HB2 LEU 49 -6.753 4.347 -9.344
368 2HB LEU 49 HB3 LEU 49 -8.439 4.541 -8.965
369 HG LEU 49 HG LEU 49 -7.476 2.976 -11.399
370 1HD1 LEU 49 1HD1 LEU 49 -7.893 0.987 -10.129
371 2HD1 LEU 49 2HD1 LEU 49 -6.689 2.031 -9.321
372 3HD1 LEU 49 3HD1 LEU 49 -8.381 1.967 -8.714
373 1HD2 LEU 49 1HD2 LEU 49 -9.814 2.000 -11.198
374 2HD2 LEU 49 2HD2 LEU 49 -10.203 3.267 -10.022
375 3HD2 LEU 49 3HD2 LEU 49 -9.802 3.699 -11.692
376 H GLY 50 H GLY 50 -6.530 7.870 -11.263
377 1HA GLY 50 HA2 GLY 50 -8.345 9.554 -9.832
378 2HA GLY 50 HA3 GLY 50 -6.986 9.150 -8.805
379 H LEU 51 H LEU 51 -5.309 9.342 -11.692
380 HA LEU 51 HA LEU 51 -5.273 12.326 -11.539
381 1HB LEU 51 HB2 LEU 51 -3.649 10.810 -10.031
382 2HB LEU 51 HB3 LEU 51 -2.704 10.791 -11.519
383 HG LEU 51 HG LEU 51 -2.737 13.375 -11.448
384 1HD1 LEU 51 1HD1 LEU 51 -3.871 12.840 -8.664
385 2HD1 LEU 51 2HD1 LEU 51 -3.244 14.416 -9.264
386 3HD1 LEU 51 3HD1 LEU 51 -4.695 13.703 -9.977
387 1HD2 LEU 51 1HD2 LEU 51 -1.572 11.839 -9.081
388 2HD2 LEU 51 2HD2 LEU 51 -0.832 12.024 -10.670
389 3HD2 LEU 51 3HD2 LEU 51 -1.037 13.455 -9.642
390 H ASP 52 H ASP 52 -5.347 9.784 -13.754
391 HA ASP 52 HA ASP 52 -4.988 11.440 -15.985
392 1HB ASP 52 HB2 ASP 52 -2.768 11.341 -16.279
393 2HB ASP 52 HB3 ASP 52 -2.531 10.153 -15.035
Start of MODEL 18
1 1H GLY 1 H1 GLY 1 5.225 -3.434 -9.622
2 2H GLY 1 H2 GLY 1 3.836 -3.706 -10.454
3 3H GLY 1 H3 GLY 1 4.227 -2.183 -9.989
4 1HA GLY 1 HA2 GLY 1 3.494 -4.432 -8.257
5 2HA GLY 1 HA3 GLY 1 4.011 -2.828 -7.659
6 H GLN 2 H GLN 2 1.312 -4.406 -7.509
7 HA GLN 2 HA GLN 2 -0.365 -2.072 -8.045
8 1HB GLN 2 HB2 GLN 2 -1.990 -3.325 -9.372
9 2HB GLN 2 HB3 GLN 2 -0.448 -3.183 -10.142
10 1HG GLN 2 HG2 GLN 2 -0.168 -5.679 -8.962
11 2HG GLN 2 HG3 GLN 2 -1.904 -5.619 -9.230
12 1HE2 GLN 2 2HE2 GLN 2 1.267 -5.848 -10.760
13 2HE2 GLN 2 1HE2 GLN 2 0.728 -5.931 -12.384
14 H ASP 3 H ASP 3 -2.492 -2.274 -7.164
15 HA ASP 3 HA ASP 3 -2.878 -4.122 -4.885
16 1HB ASP 3 HB2 ASP 3 -1.639 -1.951 -4.205
17 2HB ASP 3 HB3 ASP 3 -3.144 -1.110 -4.681
18 H ARG 4 H ARG 4 -5.248 -2.540 -4.043
19 HA ARG 4 HA ARG 4 -7.176 -3.475 -6.033
20 1HB ARG 4 HB2 ARG 4 -7.653 -1.678 -3.606
21 2HB ARG 4 HB3 ARG 4 -8.858 -2.448 -4.590
22 1HG ARG 4 HG2 ARG 4 -8.907 -3.984 -3.006
23 2HG ARG 4 HG3 ARG 4 -7.520 -4.693 -3.819
24 1HD ARG 4 HD2 ARG 4 -6.974 -2.562 -1.734
25 2HD ARG 4 HD3 ARG 4 -7.621 -4.084 -1.131
26 HE ARG 4 HE ARG 4 -4.988 -3.511 -2.073
27 1HH1 ARG 4 1HH2 ARG 4 -7.251 -6.182 -1.675
28 2HH1 ARG 4 2HH2 ARG 4 -6.013 -7.404 -1.528
29 1HH2 ARG 4 1HH1 ARG 4 -3.427 -5.014 -1.892
30 2HH2 ARG 4 2HH1 ARG 4 -3.730 -6.718 -1.704
31 H PHE 5 H PHE 5 -6.042 -0.282 -4.872
32 HA PHE 5 HA PHE 5 -6.697 0.895 -7.495
33 1HB PHE 5 HB2 PHE 5 -7.861 2.828 -6.398
34 2HB PHE 5 HB3 PHE 5 -8.718 1.319 -6.272
35 HD1 PHE 5 HD1 PHE 5 -9.240 0.321 -4.137
36 HD2 PHE 5 HD2 PHE 5 -6.657 3.759 -4.359
37 HE1 PHE 5 HE1 PHE 5 -9.426 0.631 -1.667
38 HE2 PHE 5 HE2 PHE 5 -6.800 4.015 -1.881
39 HZ PHE 5 HZ PHE 5 -8.243 2.506 -0.552
40 H VAL 6 H VAL 6 -4.353 0.180 -5.715
41 HA VAL 6 HA VAL 6 -2.900 2.725 -5.863
42 HB VAL 6 HB VAL 6 -3.339 0.842 -3.559
43 1HG1 VAL 6 1HG1 VAL 6 -0.629 2.179 -3.945
44 2HG1 VAL 6 2HG1 VAL 6 -1.204 1.401 -2.459
45 3HG1 VAL 6 3HG1 VAL 6 -0.949 0.434 -3.918
46 1HG2 VAL 6 1HG2 VAL 6 -3.173 2.931 -2.298
47 2HG2 VAL 6 2HG2 VAL 6 -2.571 3.785 -3.731
48 3HG2 VAL 6 3HG2 VAL 6 -4.242 3.174 -3.701
49 H TYR 7 H TYR 7 -0.692 2.377 -6.263
50 HA TYR 7 HA TYR 7 0.209 -0.099 -7.527
51 1HB TYR 7 HB2 TYR 7 -0.183 2.629 -8.837
52 2HB TYR 7 HB3 TYR 7 0.637 1.300 -9.611
53 HD1 TYR 7 HD1 TYR 7 -0.871 -0.886 -10.020
54 HD2 TYR 7 HD2 TYR 7 -2.476 2.872 -8.723
55 HE1 TYR 7 HE1 TYR 7 -3.142 -1.617 -10.734
56 HE2 TYR 7 HE2 TYR 7 -4.719 2.084 -9.137
57 HH TYR 7 HH TYR 7 -6.015 0.403 -10.117
58 H THR 8 H THR 8 2.545 0.767 -8.636
59 HA THR 8 HA THR 8 3.801 2.706 -6.751
60 HB THR 8 HB THR 8 5.880 1.142 -7.458
61 HG1 THR 8 HG1 THR 8 4.892 -0.389 -8.603
62 1HG2 THR 8 1HG2 THR 8 5.512 -0.160 -5.362
63 2HG2 THR 8 2HG2 THR 8 5.377 1.583 -5.181
64 3HG2 THR 8 3HG2 THR 8 3.894 0.599 -5.238
65 H CYS 9 H CYS 9 5.805 3.612 -7.762
66 HA CYS 9 HA CYS 9 5.684 3.755 -10.734
67 1HB CYS 9 HB2 CYS 9 5.510 6.059 -9.830
68 2HB CYS 9 HB3 CYS 9 6.857 5.749 -8.713
69 H ASN 10 H ASN 10 7.298 2.069 -11.179
70 HA ASN 10 HA ASN 10 9.100 1.311 -9.095
71 1HB ASN 10 HB2 ASN 10 8.180 -0.223 -10.900
72 2HB ASN 10 HB3 ASN 10 9.328 0.535 -12.013
73 1HD2 ASN 10 2HD2 ASN 10 10.966 -0.991 -12.227
74 2HD2 ASN 10 1HD2 ASN 10 11.751 -1.817 -10.868
75 H GLU 11 H GLU 11 9.145 4.119 -10.870
76 HA GLU 11 HA GLU 11 12.065 4.175 -10.817
77 1HB GLU 11 HB2 GLU 11 10.141 5.651 -12.424
78 2HB GLU 11 HB3 GLU 11 11.282 6.697 -11.612
79 1HG GLU 11 HG2 GLU 11 12.166 4.214 -13.161
80 2HG GLU 11 HG3 GLU 11 12.167 5.835 -13.847
81 H CYS 12 H CYS 12 9.270 5.278 -9.060
82 HA CYS 12 HA CYS 12 10.991 7.015 -7.337
83 1HB CYS 12 HB2 CYS 12 7.987 6.615 -7.213
84 2HB CYS 12 HB3 CYS 12 8.951 7.801 -6.317
85 H LYS 13 H LYS 13 9.487 3.937 -7.550
86 HA LYS 13 HA LYS 13 9.020 2.225 -6.197
87 1HB LYS 13 HB2 LYS 13 11.759 3.018 -5.111
88 2HB LYS 13 HB3 LYS 13 10.884 1.629 -4.477
89 1HG LYS 13 HG2 LYS 13 11.711 0.385 -6.080
90 2HG LYS 13 HG3 LYS 13 10.656 1.219 -7.212
91 1HD LYS 13 HD2 LYS 13 13.624 1.600 -6.791
92 2HD LYS 13 HD3 LYS 13 12.703 1.175 -8.238
93 1HE LYS 13 HE2 LYS 13 11.695 3.478 -8.134
94 2HE LYS 13 HE3 LYS 13 12.934 3.901 -6.942
95 1HZ LYS 13 HZ1 LYS 13 14.601 3.331 -8.710
96 2HZ LYS 13 HZ2 LYS 13 13.336 3.049 -9.736
97 3HZ LYS 13 HZ3 LYS 13 13.570 4.514 -9.149
98 H HIS 14 H HIS 14 7.698 4.402 -5.830
99 HA HIS 14 HA HIS 14 6.819 4.209 -3.016
100 1HB HIS 14 HB2 HIS 14 8.052 6.342 -3.248
101 2HB HIS 14 HB3 HIS 14 7.117 6.745 -4.689
102 HD2 HIS 14 HD2 HIS 14 5.186 8.406 -4.174
103 HE1 HIS 14 HE1 HIS 14 4.004 6.957 -0.349
104 HE2 HIS 14 HE2 HIS 14 3.470 8.636 -2.216
105 H HIS 15 H HIS 15 4.577 4.876 -2.856
106 HA HIS 15 HA HIS 15 3.047 3.468 -4.841
107 1HB HIS 15 HB2 HIS 15 2.371 4.784 -2.177
108 2HB HIS 15 HB3 HIS 15 1.116 4.145 -3.228
109 HD2 HIS 15 HD2 HIS 15 1.415 1.418 -3.914
110 HE1 HIS 15 HE1 HIS 15 3.320 0.462 -0.240
111 HE2 HIS 15 HE2 HIS 15 2.110 -0.492 -2.273
112 H VAL 16 H VAL 16 1.311 4.204 -6.017
113 HA VAL 16 HA VAL 16 0.768 7.046 -6.357
114 HB VAL 16 HB VAL 16 1.227 6.972 -8.709
115 1HG1 VAL 16 1HG1 VAL 16 3.275 7.276 -7.390
116 2HG1 VAL 16 2HG1 VAL 16 3.607 5.539 -7.438
117 3HG1 VAL 16 3HG1 VAL 16 3.582 6.450 -8.935
118 1HG2 VAL 16 1HG2 VAL 16 2.047 4.974 -9.926
119 2HG2 VAL 16 2HG2 VAL 16 1.766 3.958 -8.498
120 3HG2 VAL 16 3HG2 VAL 16 0.418 4.743 -9.355
121 H GLU 17 H GLU 17 -1.363 7.186 -7.738
122 HA GLU 17 HA GLU 17 -3.146 4.856 -7.144
123 1HB GLU 17 HB2 GLU 17 -4.893 6.736 -7.621
124 2HB GLU 17 HB3 GLU 17 -4.118 6.597 -6.042
125 1HG GLU 17 HG2 GLU 17 -4.321 8.966 -6.811
126 2HG GLU 17 HG3 GLU 17 -2.641 8.461 -6.508
127 H THR 18 H THR 18 -1.658 6.719 -9.625
128 HA THR 18 HA THR 18 -3.069 5.163 -11.722
129 HB THR 18 HB THR 18 -2.334 8.123 -11.606
130 HG1 THR 18 HG1 THR 18 -4.180 7.995 -10.619
131 1HG2 THR 18 1HG2 THR 18 -2.416 6.816 -13.997
132 2HG2 THR 18 2HG2 THR 18 -4.122 7.274 -13.805
133 3HG2 THR 18 3HG2 THR 18 -2.880 8.507 -13.718
134 H ARG 19 H ARG 19 -1.562 4.240 -13.162
135 HA ARG 19 HA ARG 19 1.183 5.290 -13.245
136 1HB ARG 19 HB2 ARG 19 2.296 3.242 -12.753
137 2HB ARG 19 HB3 ARG 19 1.153 3.465 -11.419
138 1HG ARG 19 HG2 ARG 19 -0.380 1.873 -12.398
139 2HG ARG 19 HG3 ARG 19 0.652 1.673 -13.832
140 1HD ARG 19 HD2 ARG 19 2.208 0.353 -12.840
141 2HD ARG 19 HD3 ARG 19 1.723 0.780 -11.195
142 HE ARG 19 HE ARG 19 -0.569 -0.196 -12.008
143 1HH1 ARG 19 1HH2 ARG 19 2.587 -1.817 -12.176
144 2HH1 ARG 19 2HH2 ARG 19 1.940 -3.319 -12.653
145 1HH2 ARG 19 1HH1 ARG 19 -1.423 -2.187 -12.729
146 2HH2 ARG 19 2HH1 ARG 19 -0.419 -3.564 -12.851
147 H TRP 20 H TRP 20 2.442 4.187 -14.801
148 HA TRP 20 HA TRP 20 1.121 3.064 -17.240
149 1HB TRP 20 HB2 TRP 20 3.761 4.514 -16.761
150 2HB TRP 20 HB3 TRP 20 3.252 3.758 -18.296
151 HD1 TRP 20 HD1 TRP 20 2.335 6.657 -15.960
152 HE1 TRP 20 HE1 TRP 20 0.515 8.097 -16.995
153 HE3 TRP 20 HE3 TRP 20 1.624 4.069 -20.301
154 HZ2 TRP 20 HZ2 TRP 20 -1.026 8.182 -19.403
155 HZ3 TRP 20 HZ3 TRP 20 -0.026 4.871 -21.982
156 HH2 TRP 20 HH2 TRP 20 -1.397 6.896 -21.510
157 H HIS 21 H HIS 21 1.890 0.955 -17.709
158 HA HIS 21 HA HIS 21 3.796 -0.258 -15.775
159 1HB HIS 21 HB2 HIS 21 1.870 -0.789 -14.695
160 2HB HIS 21 HB3 HIS 21 0.902 -0.806 -16.151
161 HD2 HIS 21 HD2 HIS 21 3.951 -3.167 -16.135
162 HE1 HIS 21 HE1 HIS 21 0.557 -5.602 -15.409
163 HE2 HIS 21 HE2 HIS 21 3.027 -5.601 -15.971
164 H CYS 22 H CYS 22 5.270 -1.279 -16.851
165 HA CYS 22 HA CYS 22 5.341 -1.823 -19.683
166 1HB CYS 22 HB2 CYS 22 7.038 -1.772 -17.265
167 2HB CYS 22 HB3 CYS 22 7.423 -3.103 -18.324
168 H THR 23 H THR 23 4.470 -3.412 -20.620
169 HA THR 23 HA THR 23 3.753 -5.896 -19.146
170 HB THR 23 HB THR 23 2.343 -6.552 -21.000
171 HG1 THR 23 HG1 THR 23 3.724 -4.480 -22.161
172 1HG2 THR 23 1HG2 THR 23 1.965 -3.641 -20.309
173 2HG2 THR 23 2HG2 THR 23 0.731 -4.839 -20.823
174 3HG2 THR 23 3HG2 THR 23 1.526 -4.997 -19.245
175 H VAL 24 H VAL 24 6.332 -4.806 -20.528
176 HA VAL 24 HA VAL 24 7.420 -6.960 -22.141
177 HB VAL 24 HB VAL 24 7.655 -4.712 -22.934
178 1HG1 VAL 24 1HG1 VAL 24 8.839 -3.039 -21.153
179 2HG1 VAL 24 2HG1 VAL 24 7.113 -3.064 -21.670
180 3HG1 VAL 24 3HG1 VAL 24 7.633 -3.807 -20.178
181 1HG2 VAL 24 1HG2 VAL 24 10.036 -4.152 -22.855
182 2HG2 VAL 24 2HG2 VAL 24 10.252 -5.129 -21.406
183 3HG2 VAL 24 3HG2 VAL 24 9.848 -5.928 -22.944
184 H CYS 25 H CYS 25 8.325 -4.955 -19.396
185 HA CYS 25 HA CYS 25 10.243 -6.696 -18.209
186 1HB CYS 25 HB2 CYS 25 8.818 -4.315 -16.992
187 2HB CYS 25 HB3 CYS 25 10.414 -4.893 -16.573
188 H GLU 26 H GLU 26 9.972 -7.067 -15.734
189 HA GLU 26 HA GLU 26 7.544 -8.609 -15.196
190 1HB GLU 26 HB2 GLU 26 10.292 -8.424 -14.091
191 2HB GLU 26 HB3 GLU 26 9.029 -8.696 -12.873
192 1HG GLU 26 HG2 GLU 26 8.162 -10.589 -14.195
193 2HG GLU 26 HG3 GLU 26 9.475 -10.402 -15.342
194 H ASP 27 H ASP 27 6.015 -7.053 -15.184
195 HA ASP 27 HA ASP 27 4.652 -5.419 -14.435
196 1HB ASP 27 HB2 ASP 27 4.274 -7.311 -12.893
197 2HB ASP 27 HB3 ASP 27 5.393 -6.570 -11.733
198 H TYR 28 H TYR 28 7.058 -4.314 -15.023
199 HA TYR 28 HA TYR 28 7.942 -2.481 -12.950
200 1HB TYR 28 HB2 TYR 28 9.389 -3.348 -14.779
201 2HB TYR 28 HB3 TYR 28 8.444 -2.467 -15.966
202 HD1 TYR 28 HD1 TYR 28 11.307 -2.406 -13.931
203 HD2 TYR 28 HD2 TYR 28 8.356 0.161 -15.735
204 HE1 TYR 28 HE1 TYR 28 12.822 -0.450 -13.610
205 HE2 TYR 28 HE2 TYR 28 9.829 2.084 -15.488
206 HH TYR 28 HH TYR 28 13.066 1.868 -13.887
207 H ASP 29 H ASP 29 7.404 -0.330 -12.686
208 HA ASP 29 HA ASP 29 4.935 0.571 -14.110
209 1HB ASP 29 HB2 ASP 29 5.527 1.562 -11.318
210 2HB ASP 29 HB3 ASP 29 4.014 1.324 -12.138
211 H LEU 30 H LEU 30 4.608 2.891 -14.108
212 HA LEU 30 HA LEU 30 6.771 4.564 -13.028
213 1HB LEU 30 HB2 LEU 30 5.805 4.573 -15.925
214 2HB LEU 30 HB3 LEU 30 6.609 5.913 -15.188
215 HG LEU 30 HG LEU 30 7.802 3.116 -15.606
216 1HD1 LEU 30 1HD1 LEU 30 7.657 4.547 -17.644
217 2HD1 LEU 30 2HD1 LEU 30 8.619 5.801 -16.778
218 3HD1 LEU 30 3HD1 LEU 30 9.301 4.206 -17.107
219 1HD2 LEU 30 1HD2 LEU 30 9.976 4.210 -14.855
220 2HD2 LEU 30 2HD2 LEU 30 9.022 5.614 -14.343
221 3HD2 LEU 30 3HD2 LEU 30 8.806 4.066 -13.542
222 H CYS 31 H CYS 31 5.876 6.400 -12.038
223 HA CYS 31 HA CYS 31 3.078 6.973 -12.247
224 1HB CYS 31 HB2 CYS 31 3.624 9.041 -11.127
225 2HB CYS 31 HB3 CYS 31 4.390 7.711 -10.281
226 H ILE 32 H ILE 32 2.390 9.114 -13.123
227 HA ILE 32 HA ILE 32 2.748 9.241 -15.840
228 HB ILE 32 HB ILE 32 1.951 11.607 -14.078
229 1HG1 ILE 32 2HG1 ILE 32 0.596 9.875 -13.177
230 2HG1 ILE 32 3HG1 ILE 32 -0.415 10.782 -14.319
231 1HG2 ILE 32 1HG2 ILE 32 2.237 12.194 -16.378
232 2HG2 ILE 32 2HG2 ILE 32 1.269 10.772 -16.911
233 3HG2 ILE 32 3HG2 ILE 32 0.496 12.104 -16.050
234 1HD1 ILE 32 1HD1 ILE 32 0.872 8.085 -14.885
235 2HD1 ILE 32 2HD1 ILE 32 -0.801 8.392 -14.483
236 3HD1 ILE 32 3HD1 ILE 32 -0.153 9.085 -15.985
237 H ASN 33 H ASN 33 4.403 11.224 -13.398
238 HA ASN 33 HA ASN 33 5.726 12.932 -15.296
239 1HB ASN 33 HB2 ASN 33 5.609 13.758 -13.028
240 2HB ASN 33 HB3 ASN 33 6.095 12.207 -12.353
241 1HD2 ASN 33 2HD2 ASN 33 8.403 11.701 -12.160
242 2HD2 ASN 33 1HD2 ASN 33 9.575 12.972 -12.450
243 H CYS 34 H CYS 34 6.764 9.916 -13.652
244 HA CYS 34 HA CYS 34 9.388 10.031 -14.814
245 1HB CYS 34 HB2 CYS 34 7.782 7.817 -13.505
246 2HB CYS 34 HB3 CYS 34 9.397 7.600 -14.199
247 H TYR 35 H TYR 35 6.322 8.409 -15.804
248 HA TYR 35 HA TYR 35 7.408 7.100 -18.037
249 1HB TYR 35 HB2 TYR 35 5.248 6.528 -17.249
250 2HB TYR 35 HB3 TYR 35 4.609 8.140 -17.553
251 HD1 TYR 35 HD1 TYR 35 6.380 5.351 -19.420
252 HD2 TYR 35 HD2 TYR 35 3.306 8.389 -19.523
253 HE1 TYR 35 HE1 TYR 35 5.753 4.638 -21.702
254 HE2 TYR 35 HE2 TYR 35 2.662 7.654 -21.784
255 HH TYR 35 HH TYR 35 4.257 4.885 -23.428
256 H ASN 36 H ASN 36 6.062 10.382 -17.676
257 HA ASN 36 HA ASN 36 6.323 11.303 -20.329
258 1HB ASN 36 HB2 ASN 36 5.874 12.522 -17.616
259 2HB ASN 36 HB3 ASN 36 6.415 13.608 -18.829
260 1HD2 ASN 36 2HD2 ASN 36 3.818 11.320 -18.100
261 2HD2 ASN 36 1HD2 ASN 36 2.649 12.022 -19.238
262 H THR 37 H THR 37 8.900 10.711 -18.116
263 HA THR 37 HA THR 37 10.669 12.519 -19.736
264 HB THR 37 HB THR 37 11.947 12.907 -17.609
265 HG1 THR 37 HG1 THR 37 9.571 12.082 -16.287
266 1HG2 THR 37 1HG2 THR 37 10.413 14.621 -18.513
267 2HG2 THR 37 2HG2 THR 37 9.068 13.919 -17.617
268 3HG2 THR 37 3HG2 THR 37 10.440 14.654 -16.744
269 H LYS 38 H LYS 38 10.677 9.677 -17.624
270 HA LYS 38 HA LYS 38 13.348 8.857 -18.217
271 1HB LYS 38 HB2 LYS 38 11.044 7.110 -17.278
272 2HB LYS 38 HB3 LYS 38 12.759 6.796 -17.057
273 1HG LYS 38 HG2 LYS 38 11.309 9.182 -15.783
274 2HG LYS 38 HG3 LYS 38 11.485 7.615 -15.018
275 1HD LYS 38 HD2 LYS 38 13.916 7.865 -14.956
276 2HD LYS 38 HD3 LYS 38 13.804 9.376 -15.880
277 1HE LYS 38 HE2 LYS 38 14.065 9.960 -13.557
278 2HE LYS 38 HE3 LYS 38 12.450 10.426 -14.096
279 1HZ LYS 38 HZ1 LYS 38 11.572 8.521 -12.911
280 2HZ LYS 38 HZ2 LYS 38 13.094 8.021 -12.518
281 3HZ LYS 38 HZ3 LYS 38 12.461 9.393 -11.897
282 H SER 39 H SER 39 10.727 8.899 -20.281
283 HA SER 39 HA SER 39 10.166 7.849 -22.196
284 1HB SER 39 HB2 SER 39 13.187 8.055 -22.575
285 2HB SER 39 HB3 SER 39 11.952 8.057 -23.852
286 HG SER 39 HG SER 39 12.446 10.043 -21.881
287 H HIS 40 H HIS 40 10.176 5.916 -20.329
288 HA HIS 40 HA HIS 40 11.592 3.512 -21.154
289 1HB HIS 40 HB2 HIS 40 10.660 4.353 -18.851
290 2HB HIS 40 HB3 HIS 40 9.161 3.599 -19.374
291 HD1 HIS 40 HD1 HIS 40 12.200 2.849 -17.446
292 HD2 HIS 40 HD2 HIS 40 9.657 0.804 -20.122
293 HE1 HIS 40 HE1 HIS 40 12.506 0.393 -16.978
294 H THR 41 H THR 41 10.799 4.143 -23.386
295 HA THR 41 HA THR 41 8.173 4.037 -24.279
296 HB THR 41 HB THR 41 10.740 3.645 -25.864
297 HG1 THR 41 HG1 THR 41 10.946 5.456 -24.481
298 1HG2 THR 41 1HG2 THR 41 9.538 5.206 -27.476
299 2HG2 THR 41 2HG2 THR 41 8.944 3.553 -27.430
300 3HG2 THR 41 3HG2 THR 41 8.034 4.829 -26.592
301 H HIS 42 H HIS 42 8.787 1.318 -22.811
302 HA HIS 42 HA HIS 42 8.671 -0.559 -25.043
303 1HB HIS 42 HB2 HIS 42 8.187 -0.972 -22.105
304 2HB HIS 42 HB3 HIS 42 8.533 -2.204 -23.346
305 HD2 HIS 42 HD2 HIS 42 11.097 -0.584 -24.641
306 HE1 HIS 42 HE1 HIS 42 12.748 -1.010 -20.732
307 HE2 HIS 42 HE2 HIS 42 13.295 -0.532 -23.174
308 H LYS 43 H LYS 43 6.795 -2.375 -24.686
309 HA LYS 43 HA LYS 43 4.385 -0.860 -25.149
310 1HB LYS 43 HB2 LYS 43 5.196 -3.086 -26.316
311 2HB LYS 43 HB3 LYS 43 4.463 -3.867 -24.937
312 1HG LYS 43 HG2 LYS 43 3.183 -1.894 -26.900
313 2HG LYS 43 HG3 LYS 43 2.932 -3.662 -26.920
314 1HD LYS 43 HD2 LYS 43 1.776 -1.587 -25.096
315 2HD LYS 43 HD3 LYS 43 0.926 -2.661 -26.196
316 1HE LYS 43 HE2 LYS 43 2.455 -3.409 -23.711
317 2HE LYS 43 HE3 LYS 43 0.700 -3.320 -23.805
318 1HZ LYS 43 HZ1 LYS 43 1.759 -5.554 -23.901
319 2HZ LYS 43 HZ2 LYS 43 0.705 -5.292 -25.169
320 3HZ LYS 43 HZ3 LYS 43 2.335 -5.239 -25.379
321 H MET 44 H MET 44 3.330 -0.125 -23.561
322 HA MET 44 HA MET 44 3.238 -1.494 -20.912
323 1HB MET 44 HB2 MET 44 3.209 1.418 -21.800
324 2HB MET 44 HB3 MET 44 2.660 0.945 -20.175
325 1HG MET 44 HG2 MET 44 4.662 0.128 -19.508
326 2HG MET 44 HG3 MET 44 5.364 0.041 -21.115
327 1HE MET 44 HE1 MET 44 4.647 1.951 -17.824
328 2HE MET 44 HE2 MET 44 6.242 1.195 -18.107
329 3HE MET 44 HE3 MET 44 6.119 2.936 -17.889
330 H VAL 45 H VAL 45 1.297 -0.522 -19.678
331 HA VAL 45 HA VAL 45 -1.248 -0.378 -21.079
332 HB VAL 45 HB VAL 45 -2.109 -1.603 -19.052
333 1HG1 VAL 45 1HG1 VAL 45 -0.636 -3.153 -21.207
334 2HG1 VAL 45 2HG1 VAL 45 -1.867 -3.849 -20.124
335 3HG1 VAL 45 3HG1 VAL 45 -2.344 -2.582 -21.247
336 1HG2 VAL 45 1HG2 VAL 45 0.705 -2.738 -18.909
337 2HG2 VAL 45 2HG2 VAL 45 -0.156 -1.771 -17.710
338 3HG2 VAL 45 3HG2 VAL 45 -0.691 -3.439 -18.095
339 H LYS 46 H LYS 46 -2.749 0.563 -19.141
340 HA LYS 46 HA LYS 46 -1.205 2.428 -17.443
341 1HB LYS 46 HB2 LYS 46 -1.479 3.657 -19.486
342 2HB LYS 46 HB3 LYS 46 -3.201 3.280 -19.607
343 1HG LYS 46 HG2 LYS 46 -2.029 4.958 -17.340
344 2HG LYS 46 HG3 LYS 46 -2.594 5.602 -18.876
345 1HD LYS 46 HD2 LYS 46 -4.835 4.508 -18.400
346 2HD LYS 46 HD3 LYS 46 -4.287 4.284 -16.739
347 1HE LYS 46 HE2 LYS 46 -5.631 6.263 -16.829
348 2HE LYS 46 HE3 LYS 46 -3.982 6.690 -16.440
349 1HZ LYS 46 HZ1 LYS 46 -5.016 6.992 -19.200
350 2HZ LYS 46 HZ2 LYS 46 -5.118 8.122 -18.021
351 3HZ LYS 46 HZ3 LYS 46 -3.680 7.691 -18.448
352 H TRP 47 H TRP 47 -2.246 2.513 -15.499
353 HA TRP 47 HA TRP 47 -5.056 1.572 -15.352
354 1HB TRP 47 HB2 TRP 47 -2.888 0.970 -13.308
355 2HB TRP 47 HB3 TRP 47 -4.522 0.342 -13.348
356 HD1 TRP 47 HD1 TRP 47 -1.079 -0.436 -14.463
357 HE1 TRP 47 HE1 TRP 47 -0.996 -2.516 -15.899
358 HE3 TRP 47 HE3 TRP 47 -6.025 -0.759 -15.660
359 HZ2 TRP 47 HZ2 TRP 47 -2.794 -3.891 -17.766
360 HZ3 TRP 47 HZ3 TRP 47 -6.765 -2.345 -17.431
361 HH2 TRP 47 HH2 TRP 47 -5.176 -3.890 -18.478
362 H GLY 48 H GLY 48 -6.102 3.452 -14.901
363 1HA GLY 48 HA2 GLY 48 -4.729 5.398 -13.121
364 2HA GLY 48 HA3 GLY 48 -5.589 5.873 -14.615
365 H LEU 49 H LEU 49 -5.850 6.238 -11.626
366 HA LEU 49 HA LEU 49 -8.773 5.882 -11.452
367 1HB LEU 49 HB2 LEU 49 -6.783 4.794 -9.431
368 2HB LEU 49 HB3 LEU 49 -8.477 5.032 -9.056
369 HG LEU 49 HG LEU 49 -7.433 3.217 -11.272
370 1HD1 LEU 49 1HD1 LEU 49 -6.988 2.511 -8.952
371 2HD1 LEU 49 2HD1 LEU 49 -8.731 2.569 -8.622
372 3HD1 LEU 49 3HD1 LEU 49 -8.085 1.394 -9.793
373 1HD2 LEU 49 1HD2 LEU 49 -9.819 2.343 -11.289
374 2HD2 LEU 49 2HD2 LEU 49 -10.267 3.710 -10.219
375 3HD2 LEU 49 3HD2 LEU 49 -9.717 3.994 -11.867
376 H GLY 50 H GLY 50 -6.324 8.140 -11.359
377 1HA GLY 50 HA2 GLY 50 -8.064 9.970 -9.893
378 2HA GLY 50 HA3 GLY 50 -6.623 9.525 -8.988
379 H LEU 51 H LEU 51 -4.936 9.567 -11.655
380 HA LEU 51 HA LEU 51 -4.896 12.563 -11.824
381 1HB LEU 51 HB2 LEU 51 -2.650 10.569 -11.344
382 2HB LEU 51 HB3 LEU 51 -2.318 12.127 -12.077
383 HG LEU 51 HG LEU 51 -3.582 11.761 -9.339
384 1HD1 LEU 51 1HD1 LEU 51 -0.749 12.656 -10.131
385 2HD1 LEU 51 2HD1 LEU 51 -1.404 12.495 -8.490
386 3HD1 LEU 51 3HD1 LEU 51 -1.184 11.064 -9.484
387 1HD2 LEU 51 1HD2 LEU 51 -2.698 14.282 -10.848
388 2HD2 LEU 51 2HD2 LEU 51 -4.304 13.904 -10.207
389 3HD2 LEU 51 3HD2 LEU 51 -2.979 14.199 -9.081
390 H ASP 52 H ASP 52 -5.014 9.757 -13.858
391 HA ASP 52 HA ASP 52 -4.873 11.373 -16.225
392 1HB ASP 52 HB2 ASP 52 -2.624 11.251 -16.455
393 2HB ASP 52 HB3 ASP 52 -2.431 9.996 -15.250
Start of MODEL 19
1 1H GLY 1 H1 GLY 1 3.623 -3.904 -10.539
2 2H GLY 1 H2 GLY 1 4.045 -2.363 -10.163
3 3H GLY 1 H3 GLY 1 5.081 -3.587 -9.838
4 1HA GLY 1 HA2 GLY 1 3.469 -4.516 -8.267
5 2HA GLY 1 HA3 GLY 1 4.015 -2.864 -7.814
6 H GLN 2 H GLN 2 1.217 -4.673 -7.819
7 HA GLN 2 HA GLN 2 -0.353 -2.236 -8.067
8 1HB GLN 2 HB2 GLN 2 -1.902 -3.295 -9.700
9 2HB GLN 2 HB3 GLN 2 -0.303 -2.855 -10.291
10 1HG GLN 2 HG2 GLN 2 0.358 -5.240 -10.350
11 2HG GLN 2 HG3 GLN 2 -1.347 -5.657 -9.960
12 1HE2 GLN 2 2HE2 GLN 2 0.611 -5.540 -12.622
13 2HE2 GLN 2 1HE2 GLN 2 -0.520 -4.902 -13.795
14 H ASP 3 H ASP 3 -2.456 -2.318 -7.487
15 HA ASP 3 HA ASP 3 -3.577 -4.454 -5.828
16 1HB ASP 3 HB2 ASP 3 -2.321 -2.706 -4.356
17 2HB ASP 3 HB3 ASP 3 -3.474 -1.516 -4.977
18 H ARG 4 H ARG 4 -5.923 -3.462 -5.237
19 HA ARG 4 HA ARG 4 -7.369 -3.240 -7.633
20 1HB ARG 4 HB2 ARG 4 -8.566 -2.073 -5.146
21 2HB ARG 4 HB3 ARG 4 -9.294 -3.060 -6.397
22 1HG ARG 4 HG2 ARG 4 -9.279 -4.682 -4.818
23 2HG ARG 4 HG3 ARG 4 -7.590 -4.897 -5.292
24 1HD ARG 4 HD2 ARG 4 -7.073 -3.095 -3.503
25 2HD ARG 4 HD3 ARG 4 -8.740 -3.284 -2.972
26 HE ARG 4 HE ARG 4 -7.958 -5.833 -2.910
27 1HH1 ARG 4 2HH2 ARG 4 -5.972 -3.104 -1.842
28 2HH1 ARG 4 1HH2 ARG 4 -5.445 -3.789 -0.404
29 1HH2 ARG 4 1HH1 ARG 4 -6.966 -6.929 -1.130
30 2HH2 ARG 4 2HH1 ARG 4 -5.955 -6.072 -0.032
31 H PHE 5 H PHE 5 -6.063 -0.573 -5.649
32 HA PHE 5 HA PHE 5 -6.618 1.296 -7.831
33 1HB PHE 5 HB2 PHE 5 -7.741 2.952 -6.393
34 2HB PHE 5 HB3 PHE 5 -8.677 1.489 -6.626
35 HD1 PHE 5 HD1 PHE 5 -6.619 3.418 -4.170
36 HD2 PHE 5 HD2 PHE 5 -9.317 0.114 -4.750
37 HE1 PHE 5 HE1 PHE 5 -6.837 3.177 -1.728
38 HE2 PHE 5 HE2 PHE 5 -9.554 -0.117 -2.296
39 HZ PHE 5 HZ PHE 5 -8.277 1.373 -0.769
40 H VAL 6 H VAL 6 -4.330 -0.011 -6.049
41 HA VAL 6 HA VAL 6 -2.808 2.469 -5.689
42 HB VAL 6 HB VAL 6 -3.525 0.433 -3.618
43 1HG1 VAL 6 1HG1 VAL 6 -1.418 0.739 -2.342
44 2HG1 VAL 6 2HG1 VAL 6 -1.189 -0.187 -3.831
45 3HG1 VAL 6 3HG1 VAL 6 -0.689 1.531 -3.747
46 1HG2 VAL 6 1HG2 VAL 6 -2.637 3.364 -3.656
47 2HG2 VAL 6 2HG2 VAL 6 -4.285 2.715 -3.521
48 3HG2 VAL 6 3HG2 VAL 6 -3.149 2.463 -2.195
49 H TYR 7 H TYR 7 -0.693 2.252 -6.199
50 HA TYR 7 HA TYR 7 0.358 -0.226 -7.385
51 1HB TYR 7 HB2 TYR 7 0.064 2.430 -8.838
52 2HB TYR 7 HB3 TYR 7 0.654 0.873 -9.476
53 HD1 TYR 7 HD1 TYR 7 -0.947 -0.928 -9.850
54 HD2 TYR 7 HD2 TYR 7 -2.299 2.947 -8.689
55 HE1 TYR 7 HE1 TYR 7 -3.325 -1.631 -10.346
56 HE2 TYR 7 HE2 TYR 7 -4.648 2.266 -9.059
57 HH TYR 7 HH TYR 7 -5.562 -1.030 -9.967
58 H THR 8 H THR 8 2.525 0.926 -8.642
59 HA THR 8 HA THR 8 3.801 2.786 -6.746
60 HB THR 8 HB THR 8 5.912 1.204 -7.432
61 HG1 THR 8 HG1 THR 8 4.703 -0.362 -8.570
62 1HG2 THR 8 1HG2 THR 8 3.991 0.724 -5.143
63 2HG2 THR 8 2HG2 THR 8 5.548 -0.117 -5.337
64 3HG2 THR 8 3HG2 THR 8 5.509 1.642 -5.166
65 H CYS 9 H CYS 9 5.837 3.684 -7.715
66 HA CYS 9 HA CYS 9 5.846 3.756 -10.689
67 1HB CYS 9 HB2 CYS 9 5.557 6.092 -9.842
68 2HB CYS 9 HB3 CYS 9 6.852 5.853 -8.672
69 H ASN 10 H ASN 10 7.392 2.102 -11.010
70 HA ASN 10 HA ASN 10 9.214 1.363 -8.944
71 1HB ASN 10 HB2 ASN 10 8.324 -0.203 -10.757
72 2HB ASN 10 HB3 ASN 10 9.446 0.618 -11.858
73 1HD2 ASN 10 2HD2 ASN 10 11.041 -0.921 -12.182
74 2HD2 ASN 10 1HD2 ASN 10 11.940 -1.699 -10.884
75 H GLU 11 H GLU 11 9.259 4.206 -10.653
76 HA GLU 11 HA GLU 11 12.184 4.207 -10.632
77 1HB GLU 11 HB2 GLU 11 10.274 5.612 -12.327
78 2HB GLU 11 HB3 GLU 11 11.442 6.683 -11.574
79 1HG GLU 11 HG2 GLU 11 12.237 4.073 -13.001
80 2HG GLU 11 HG3 GLU 11 12.278 5.650 -13.781
81 H CYS 12 H CYS 12 9.382 5.434 -8.965
82 HA CYS 12 HA CYS 12 11.055 7.212 -7.240
83 1HB CYS 12 HB2 CYS 12 8.055 6.633 -7.163
84 2HB CYS 12 HB3 CYS 12 8.952 7.842 -6.236
85 H LYS 13 H LYS 13 9.531 4.142 -7.438
86 HA LYS 13 HA LYS 13 9.090 2.382 -6.123
87 1HB LYS 13 HB2 LYS 13 11.830 3.106 -5.001
88 2HB LYS 13 HB3 LYS 13 10.916 1.721 -4.419
89 1HG LYS 13 HG2 LYS 13 11.649 0.480 -6.080
90 2HG LYS 13 HG3 LYS 13 10.697 1.414 -7.178
91 1HD LYS 13 HD2 LYS 13 13.657 1.670 -6.615
92 2HD LYS 13 HD3 LYS 13 12.784 1.254 -8.114
93 1HE LYS 13 HE2 LYS 13 11.812 3.619 -7.994
94 2HE LYS 13 HE3 LYS 13 13.030 3.991 -6.776
95 1HZ LYS 13 HZ1 LYS 13 13.693 4.606 -9.001
96 2HZ LYS 13 HZ2 LYS 13 14.731 3.428 -8.515
97 3HZ LYS 13 HZ3 LYS 13 13.497 3.142 -9.573
98 H HIS 14 H HIS 14 7.826 4.636 -5.698
99 HA HIS 14 HA HIS 14 6.877 4.300 -2.916
100 1HB HIS 14 HB2 HIS 14 7.930 6.497 -3.060
101 2HB HIS 14 HB3 HIS 14 6.979 6.904 -4.482
102 HD2 HIS 14 HD2 HIS 14 4.771 8.137 -4.000
103 HE1 HIS 14 HE1 HIS 14 3.696 6.414 -0.279
104 HE2 HIS 14 HE2 HIS 14 2.944 7.914 -2.156
105 H HIS 15 H HIS 15 4.566 4.867 -2.845
106 HA HIS 15 HA HIS 15 3.144 3.329 -4.772
107 1HB HIS 15 HB2 HIS 15 1.900 2.999 -2.945
108 2HB HIS 15 HB3 HIS 15 2.785 4.231 -2.063
109 HD2 HIS 15 HD2 HIS 15 -0.384 3.779 -4.206
110 HE1 HIS 15 HE1 HIS 15 -0.805 7.534 -2.246
111 HE2 HIS 15 HE2 HIS 15 -1.984 5.824 -3.695
112 H VAL 16 H VAL 16 1.278 4.010 -5.985
113 HA VAL 16 HA VAL 16 0.710 6.806 -6.359
114 HB VAL 16 HB VAL 16 1.156 6.895 -8.761
115 1HG1 VAL 16 1HG1 VAL 16 3.518 6.377 -9.061
116 2HG1 VAL 16 2HG1 VAL 16 3.226 7.246 -7.529
117 3HG1 VAL 16 3HG1 VAL 16 3.579 5.494 -7.559
118 1HG2 VAL 16 1HG2 VAL 16 2.017 4.992 -10.084
119 2HG2 VAL 16 2HG2 VAL 16 1.874 3.920 -8.691
120 3HG2 VAL 16 3HG2 VAL 16 0.432 4.634 -9.436
121 H GLU 17 H GLU 17 -1.329 7.003 -7.788
122 HA GLU 17 HA GLU 17 -3.110 4.673 -7.240
123 1HB GLU 17 HB2 GLU 17 -4.883 6.503 -7.546
124 2HB GLU 17 HB3 GLU 17 -4.025 6.360 -6.004
125 1HG GLU 17 HG2 GLU 17 -4.342 8.715 -6.678
126 2HG GLU 17 HG3 GLU 17 -2.623 8.267 -6.507
127 H THR 18 H THR 18 -1.698 6.684 -9.693
128 HA THR 18 HA THR 18 -3.091 5.149 -11.825
129 HB THR 18 HB THR 18 -2.517 8.127 -11.669
130 HG1 THR 18 HG1 THR 18 -4.257 7.895 -10.617
131 1HG2 THR 18 1HG2 THR 18 -4.363 7.332 -13.785
132 2HG2 THR 18 2HG2 THR 18 -2.870 8.280 -13.946
133 3HG2 THR 18 3HG2 THR 18 -2.789 6.531 -14.061
134 H ARG 19 H ARG 19 -1.602 4.440 -13.454
135 HA ARG 19 HA ARG 19 1.174 5.468 -13.389
136 1HB ARG 19 HB2 ARG 19 2.202 3.507 -12.721
137 2HB ARG 19 HB3 ARG 19 0.848 3.644 -11.611
138 1HG ARG 19 HG2 ARG 19 -0.390 2.045 -13.383
139 2HG ARG 19 HG3 ARG 19 1.276 1.696 -13.910
140 1HD ARG 19 HD2 ARG 19 1.554 1.494 -11.246
141 2HD ARG 19 HD3 ARG 19 -0.176 1.088 -11.422
142 HE ARG 19 HE ARG 19 2.171 -0.454 -12.227
143 1HH1 ARG 19 1HH1 ARG 19 -1.384 -0.522 -12.169
144 2HH1 ARG 19 2HH1 ARG 19 -1.398 -2.201 -12.557
145 1HH2 ARG 19 1HH2 ARG 19 2.147 -2.474 -12.574
146 2HH2 ARG 19 2HH2 ARG 19 0.713 -3.376 -12.871
147 H TRP 20 H TRP 20 2.508 4.238 -14.901
148 HA TRP 20 HA TRP 20 1.178 3.132 -17.329
149 1HB TRP 20 HB2 TRP 20 3.864 4.474 -16.882
150 2HB TRP 20 HB3 TRP 20 3.229 3.897 -18.441
151 HD1 TRP 20 HD1 TRP 20 2.736 6.694 -15.890
152 HE1 TRP 20 HE1 TRP 20 1.133 8.499 -16.789
153 HE3 TRP 20 HE3 TRP 20 1.536 4.547 -20.332
154 HZ2 TRP 20 HZ2 TRP 20 -0.525 8.904 -19.081
155 HZ3 TRP 20 HZ3 TRP 20 -0.076 5.677 -21.892
156 HH2 TRP 20 HH2 TRP 20 -1.142 7.832 -21.245
157 H HIS 21 H HIS 21 1.873 0.969 -17.708
158 HA HIS 21 HA HIS 21 3.850 -0.188 -15.814
159 1HB HIS 21 HB2 HIS 21 1.911 -0.730 -14.683
160 2HB HIS 21 HB3 HIS 21 0.912 -0.688 -16.111
161 HD2 HIS 21 HD2 HIS 21 3.929 -3.092 -16.040
162 HE1 HIS 21 HE1 HIS 21 0.472 -5.502 -15.549
163 HE2 HIS 21 HE2 HIS 21 3.002 -5.513 -15.908
164 H CYS 22 H CYS 22 5.314 -1.234 -16.832
165 HA CYS 22 HA CYS 22 5.336 -1.832 -19.664
166 1HB CYS 22 HB2 CYS 22 7.101 -1.769 -17.309
167 2HB CYS 22 HB3 CYS 22 7.421 -3.164 -18.322
168 H THR 23 H THR 23 4.499 -3.482 -20.620
169 HA THR 23 HA THR 23 3.980 -5.957 -19.077
170 HB THR 23 HB THR 23 2.284 -6.538 -20.888
171 HG1 THR 23 HG1 THR 23 3.313 -4.318 -21.937
172 1HG2 THR 23 1HG2 THR 23 1.976 -3.928 -19.431
173 2HG2 THR 23 2HG2 THR 23 0.634 -5.019 -19.892
174 3HG2 THR 23 3HG2 THR 23 1.773 -5.520 -18.644
175 H VAL 24 H VAL 24 6.371 -5.028 -20.288
176 HA VAL 24 HA VAL 24 7.432 -7.184 -21.986
177 HB VAL 24 HB VAL 24 7.428 -4.953 -22.885
178 1HG1 VAL 24 1HG1 VAL 24 8.758 -3.175 -21.167
179 2HG1 VAL 24 2HG1 VAL 24 7.068 -3.186 -21.776
180 3HG1 VAL 24 3HG1 VAL 24 7.470 -3.882 -20.240
181 1HG2 VAL 24 1HG2 VAL 24 10.148 -5.222 -21.544
182 2HG2 VAL 24 2HG2 VAL 24 9.659 -6.144 -22.987
183 3HG2 VAL 24 3HG2 VAL 24 9.810 -4.356 -23.030
184 H CYS 25 H CYS 25 8.517 -4.873 -19.496
185 HA CYS 25 HA CYS 25 10.390 -6.579 -18.172
186 1HB CYS 25 HB2 CYS 25 8.942 -4.187 -17.021
187 2HB CYS 25 HB3 CYS 25 10.556 -4.738 -16.610
188 H GLU 26 H GLU 26 10.064 -7.299 -15.834
189 HA GLU 26 HA GLU 26 7.500 -8.557 -15.414
190 1HB GLU 26 HB2 GLU 26 10.145 -8.482 -13.968
191 2HB GLU 26 HB3 GLU 26 8.684 -8.974 -13.088
192 1HG GLU 26 HG2 GLU 26 8.177 -10.675 -14.769
193 2HG GLU 26 HG3 GLU 26 9.601 -10.210 -15.702
194 H ASP 27 H ASP 27 5.893 -7.224 -15.101
195 HA ASP 27 HA ASP 27 4.569 -5.530 -14.374
196 1HB ASP 27 HB2 ASP 27 4.337 -7.564 -12.916
197 2HB ASP 27 HB3 ASP 27 5.292 -6.736 -11.688
198 H TYR 28 H TYR 28 6.953 -4.391 -14.914
199 HA TYR 28 HA TYR 28 7.862 -2.590 -12.829
200 1HB TYR 28 HB2 TYR 28 9.250 -3.460 -14.744
201 2HB TYR 28 HB3 TYR 28 8.213 -2.596 -15.852
202 HD1 TYR 28 HD1 TYR 28 11.196 -2.367 -13.873
203 HD2 TYR 28 HD2 TYR 28 8.129 -0.060 -15.844
204 HE1 TYR 28 HE1 TYR 28 12.646 -0.377 -13.780
205 HE2 TYR 28 HE2 TYR 28 9.580 1.913 -15.799
206 HH TYR 28 HH TYR 28 12.852 1.884 -14.319
207 H ASP 29 H ASP 29 7.318 -0.351 -12.662
208 HA ASP 29 HA ASP 29 5.016 0.587 -14.302
209 1HB ASP 29 HB2 ASP 29 5.235 1.266 -11.393
210 2HB ASP 29 HB3 ASP 29 3.778 1.252 -12.379
211 H LEU 30 H LEU 30 4.680 2.946 -14.093
212 HA LEU 30 HA LEU 30 6.795 4.524 -12.831
213 1HB LEU 30 HB2 LEU 30 5.903 4.744 -15.750
214 2HB LEU 30 HB3 LEU 30 6.760 5.988 -14.881
215 HG LEU 30 HG LEU 30 7.798 3.181 -15.521
216 1HD1 LEU 30 1HD1 LEU 30 9.308 4.340 -17.028
217 2HD1 LEU 30 2HD1 LEU 30 7.639 4.802 -17.438
218 3HD1 LEU 30 3HD1 LEU 30 8.683 5.916 -16.527
219 1HD2 LEU 30 1HD2 LEU 30 8.868 3.982 -13.403
220 2HD2 LEU 30 2HD2 LEU 30 10.016 4.019 -14.743
221 3HD2 LEU 30 3HD2 LEU 30 9.239 5.522 -14.208
222 H CYS 31 H CYS 31 5.920 6.460 -11.971
223 HA CYS 31 HA CYS 31 3.109 6.994 -12.115
224 1HB CYS 31 HB2 CYS 31 3.661 9.081 -11.019
225 2HB CYS 31 HB3 CYS 31 4.426 7.789 -10.135
226 H ILE 32 H ILE 32 2.402 9.151 -12.942
227 HA ILE 32 HA ILE 32 2.752 9.245 -15.686
228 HB ILE 32 HB ILE 32 1.900 11.580 -13.959
229 1HG1 ILE 32 2HG1 ILE 32 0.586 9.875 -13.023
230 2HG1 ILE 32 3HG1 ILE 32 -0.462 10.739 -14.104
231 1HG2 ILE 32 1HG2 ILE 32 2.167 12.185 -16.235
232 2HG2 ILE 32 2HG2 ILE 32 1.210 10.774 -16.805
233 3HG2 ILE 32 3HG2 ILE 32 0.433 12.076 -15.916
234 1HD1 ILE 32 1HD1 ILE 32 -0.376 8.956 -15.755
235 2HD1 ILE 32 2HD1 ILE 32 0.859 8.079 -14.783
236 3HD1 ILE 32 3HD1 ILE 32 -0.771 8.282 -14.161
237 H ASN 33 H ASN 33 4.355 11.285 -13.242
238 HA ASN 33 HA ASN 33 5.639 13.023 -15.133
239 1HB ASN 33 HB2 ASN 33 5.394 13.904 -12.954
240 2HB ASN 33 HB3 ASN 33 5.876 12.397 -12.161
241 1HD2 ASN 33 2HD2 ASN 33 8.082 11.916 -11.789
242 2HD2 ASN 33 1HD2 ASN 33 9.315 13.128 -12.062
243 H CYS 34 H CYS 34 6.700 9.988 -13.525
244 HA CYS 34 HA CYS 34 9.384 10.104 -14.614
245 1HB CYS 34 HB2 CYS 34 7.701 7.978 -13.260
246 2HB CYS 34 HB3 CYS 34 9.249 7.595 -14.056
247 H TYR 35 H TYR 35 6.340 8.463 -15.643
248 HA TYR 35 HA TYR 35 7.404 7.203 -17.934
249 1HB TYR 35 HB2 TYR 35 5.172 6.728 -17.120
250 2HB TYR 35 HB3 TYR 35 4.628 8.361 -17.481
251 HD1 TYR 35 HD1 TYR 35 6.280 5.437 -19.229
252 HD2 TYR 35 HD2 TYR 35 3.487 8.704 -19.495
253 HE1 TYR 35 HE1 TYR 35 5.668 4.723 -21.535
254 HE2 TYR 35 HE2 TYR 35 2.828 7.962 -21.749
255 HH TYR 35 HH TYR 35 4.239 5.046 -23.281
256 H ASN 36 H ASN 36 6.131 10.491 -17.525
257 HA ASN 36 HA ASN 36 6.423 11.463 -20.146
258 1HB ASN 36 HB2 ASN 36 6.004 12.612 -17.400
259 2HB ASN 36 HB3 ASN 36 6.642 13.717 -18.549
260 1HD2 ASN 36 2HD2 ASN 36 3.924 11.571 -17.928
261 2HD2 ASN 36 1HD2 ASN 36 2.781 12.376 -19.002
262 H THR 37 H THR 37 8.989 10.763 -17.916
263 HA THR 37 HA THR 37 10.814 12.571 -19.484
264 HB THR 37 HB THR 37 12.119 12.731 -17.340
265 HG1 THR 37 HG1 THR 37 9.739 12.058 -16.040
266 1HG2 THR 37 1HG2 THR 37 10.705 14.589 -18.132
267 2HG2 THR 37 2HG2 THR 37 9.321 13.932 -17.264
268 3HG2 THR 37 3HG2 THR 37 10.747 14.506 -16.369
269 H LYS 38 H LYS 38 10.664 9.651 -17.517
270 HA LYS 38 HA LYS 38 13.234 8.639 -18.217
271 1HB LYS 38 HB2 LYS 38 10.837 7.039 -17.264
272 2HB LYS 38 HB3 LYS 38 12.517 6.580 -17.110
273 1HG LYS 38 HG2 LYS 38 11.284 9.005 -15.701
274 2HG LYS 38 HG3 LYS 38 11.449 7.405 -14.983
275 1HD LYS 38 HD2 LYS 38 13.879 7.627 -15.010
276 2HD LYS 38 HD3 LYS 38 13.779 9.085 -16.006
277 1HE LYS 38 HE2 LYS 38 14.212 9.738 -13.733
278 2HE LYS 38 HE3 LYS 38 12.579 10.284 -14.183
279 1HZ LYS 38 HZ1 LYS 38 12.710 9.254 -11.947
280 2HZ LYS 38 HZ2 LYS 38 11.686 8.449 -12.881
281 3HZ LYS 38 HZ3 LYS 38 13.212 7.865 -12.608
282 H SER 39 H SER 39 10.537 8.974 -20.184
283 HA SER 39 HA SER 39 9.827 8.048 -22.126
284 1HB SER 39 HB2 SER 39 12.829 8.137 -22.544
285 2HB SER 39 HB3 SER 39 11.577 8.248 -23.796
286 HG SER 39 HG SER 39 12.208 10.094 -21.727
287 H HIS 40 H HIS 40 9.536 5.955 -20.537
288 HA HIS 40 HA HIS 40 11.005 3.584 -21.395
289 1HB HIS 40 HB2 HIS 40 9.140 4.283 -19.331
290 2HB HIS 40 HB3 HIS 40 8.364 3.050 -20.318
291 HD1 HIS 40 HD1 HIS 40 11.347 3.439 -17.942
292 HD2 HIS 40 HD2 HIS 40 9.457 0.645 -20.419
293 HE1 HIS 40 HE1 HIS 40 12.249 1.141 -17.262
294 H THR 41 H THR 41 10.861 2.837 -23.350
295 HA THR 41 HA THR 41 8.688 3.726 -25.060
296 HB THR 41 HB THR 41 10.846 2.213 -26.285
297 HG1 THR 41 HG1 THR 41 11.699 4.364 -24.647
298 1HG2 THR 41 1HG2 THR 41 11.244 4.219 -27.538
299 2HG2 THR 41 2HG2 THR 41 9.522 3.863 -27.477
300 3HG2 THR 41 3HG2 THR 41 10.178 5.165 -26.450
301 H HIS 42 H HIS 42 9.055 0.889 -23.220
302 HA HIS 42 HA HIS 42 8.623 -1.042 -25.325
303 1HB HIS 42 HB2 HIS 42 8.179 -1.275 -22.353
304 2HB HIS 42 HB3 HIS 42 8.526 -2.576 -23.517
305 HD2 HIS 42 HD2 HIS 42 11.185 -1.118 -24.850
306 HE1 HIS 42 HE1 HIS 42 12.691 -1.047 -20.873
307 HE2 HIS 42 HE2 HIS 42 13.309 -0.851 -23.353
308 H LYS 43 H LYS 43 6.646 -2.663 -25.100
309 HA LYS 43 HA LYS 43 4.311 -1.037 -25.267
310 1HB LYS 43 HB2 LYS 43 4.735 -3.223 -26.560
311 2HB LYS 43 HB3 LYS 43 4.286 -4.070 -25.070
312 1HG LYS 43 HG2 LYS 43 2.218 -2.204 -25.295
313 2HG LYS 43 HG3 LYS 43 2.648 -2.428 -26.972
314 1HD LYS 43 HD2 LYS 43 0.851 -3.936 -26.502
315 2HD LYS 43 HD3 LYS 43 2.312 -4.922 -26.618
316 1HE LYS 43 HE2 LYS 43 1.069 -5.682 -24.681
317 2HE LYS 43 HE3 LYS 43 2.511 -4.841 -24.111
318 1HZ LYS 43 HZ1 LYS 43 0.852 -4.082 -22.788
319 2HZ LYS 43 HZ2 LYS 43 1.012 -2.858 -23.774
320 3HZ LYS 43 HZ3 LYS 43 -0.272 -3.875 -23.968
321 H MET 44 H MET 44 3.580 -0.138 -23.532
322 HA MET 44 HA MET 44 3.368 -1.537 -20.910
323 1HB MET 44 HB2 MET 44 3.338 1.360 -21.864
324 2HB MET 44 HB3 MET 44 2.766 0.916 -20.244
325 1HG MET 44 HG2 MET 44 4.730 0.172 -19.510
326 2HG MET 44 HG3 MET 44 5.471 -0.084 -21.086
327 1HE MET 44 HE1 MET 44 6.237 3.045 -18.098
328 2HE MET 44 HE2 MET 44 4.676 2.217 -18.064
329 3HE MET 44 HE3 MET 44 6.156 1.251 -18.113
330 H VAL 45 H VAL 45 1.364 -0.483 -19.731
331 HA VAL 45 HA VAL 45 -1.134 -0.303 -21.191
332 HB VAL 45 HB VAL 45 -2.085 -1.550 -19.257
333 1HG1 VAL 45 1HG1 VAL 45 -0.314 -3.330 -20.985
334 2HG1 VAL 45 2HG1 VAL 45 -1.847 -3.754 -20.192
335 3HG1 VAL 45 3HG1 VAL 45 -1.867 -2.600 -21.510
336 1HG2 VAL 45 1HG2 VAL 45 -0.247 -1.515 -17.702
337 2HG2 VAL 45 2HG2 VAL 45 -0.669 -3.221 -18.056
338 3HG2 VAL 45 3HG2 VAL 45 0.748 -2.488 -18.782
339 H LYS 46 H LYS 46 -2.639 0.782 -19.366
340 HA LYS 46 HA LYS 46 -1.113 2.452 -17.482
341 1HB LYS 46 HB2 LYS 46 -1.331 3.731 -19.629
342 2HB LYS 46 HB3 LYS 46 -3.083 3.615 -19.526
343 1HG LYS 46 HG2 LYS 46 -1.338 5.030 -17.429
344 2HG LYS 46 HG3 LYS 46 -1.931 5.806 -18.874
345 1HD LYS 46 HD2 LYS 46 -4.296 5.399 -18.116
346 2HD LYS 46 HD3 LYS 46 -3.654 4.754 -16.593
347 1HE LYS 46 HE2 LYS 46 -4.067 7.026 -16.177
348 2HE LYS 46 HE3 LYS 46 -2.312 6.889 -16.346
349 1HZ LYS 46 HZ1 LYS 46 -4.275 7.943 -18.256
350 2HZ LYS 46 HZ2 LYS 46 -3.180 8.774 -17.512
351 3HZ LYS 46 HZ3 LYS 46 -2.658 7.756 -18.680
352 H TRP 47 H TRP 47 -2.342 2.746 -15.687
353 HA TRP 47 HA TRP 47 -5.128 1.768 -15.646
354 1HB TRP 47 HB2 TRP 47 -3.082 1.127 -13.498
355 2HB TRP 47 HB3 TRP 47 -4.738 0.531 -13.647
356 HD1 TRP 47 HD1 TRP 47 -1.225 -0.209 -14.592
357 HE1 TRP 47 HE1 TRP 47 -1.047 -2.332 -15.949
358 HE3 TRP 47 HE3 TRP 47 -6.124 -0.634 -16.044
359 HZ2 TRP 47 HZ2 TRP 47 -2.711 -3.772 -17.834
360 HZ3 TRP 47 HZ3 TRP 47 -6.730 -2.338 -17.767
361 HH2 TRP 47 HH2 TRP 47 -5.050 -3.912 -18.626
362 H GLY 48 H GLY 48 -6.359 3.294 -14.446
363 1HA GLY 48 HA2 GLY 48 -4.911 5.389 -13.020
364 2HA GLY 48 HA3 GLY 48 -5.842 5.845 -14.495
365 H LEU 49 H LEU 49 -6.092 6.458 -11.649
366 HA LEU 49 HA LEU 49 -8.907 5.732 -11.247
367 1HB LEU 49 HB2 LEU 49 -6.731 4.428 -9.871
368 2HB LEU 49 HB3 LEU 49 -7.499 5.450 -8.695
369 HG LEU 49 HG LEU 49 -8.341 3.193 -8.728
370 1HD1 LEU 49 1HD1 LEU 49 -10.734 3.660 -8.612
371 2HD1 LEU 49 2HD1 LEU 49 -9.845 5.053 -7.954
372 3HD1 LEU 49 3HD1 LEU 49 -10.531 5.137 -9.587
373 1HD2 LEU 49 1HD2 LEU 49 -9.639 3.639 -11.430
374 2HD2 LEU 49 2HD2 LEU 49 -8.161 2.688 -11.124
375 3HD2 LEU 49 3HD2 LEU 49 -9.683 2.192 -10.404
376 H GLY 50 H GLY 50 -6.318 8.080 -10.670
377 1HA GLY 50 HA2 GLY 50 -8.385 9.856 -9.460
378 2HA GLY 50 HA3 GLY 50 -6.813 9.611 -8.666
379 H LEU 51 H LEU 51 -5.112 9.668 -10.912
380 HA LEU 51 HA LEU 51 -5.455 12.410 -12.048
381 1HB LEU 51 HB2 LEU 51 -3.030 11.175 -10.665
382 2HB LEU 51 HB3 LEU 51 -2.994 12.689 -11.526
383 HG LEU 51 HG LEU 51 -4.745 12.200 -9.065
384 1HD1 LEU 51 1HD1 LEU 51 -2.046 13.572 -9.163
385 2HD1 LEU 51 2HD1 LEU 51 -3.154 13.407 -7.752
386 3HD1 LEU 51 3HD1 LEU 51 -2.387 11.976 -8.458
387 1HD2 LEU 51 1HD2 LEU 51 -5.579 14.042 -10.464
388 2HD2 LEU 51 2HD2 LEU 51 -4.905 14.656 -8.953
389 3HD2 LEU 51 3HD2 LEU 51 -3.964 14.796 -10.453
390 H ASP 52 H ASP 52 -6.259 10.902 -13.786
391 HA ASP 52 HA ASP 52 -4.558 9.040 -15.083
392 1HB ASP 52 HB2 ASP 52 -7.133 9.343 -15.252
393 2HB ASP 52 HB3 ASP 52 -6.778 10.498 -16.533
Start of MODEL 20
1 1H GLY 1 H1 GLY 1 3.545 -3.984 -10.223
2 2H GLY 1 H2 GLY 1 3.980 -2.406 -10.036
3 3H GLY 1 H3 GLY 1 4.949 -3.605 -9.481
4 1HA GLY 1 HA2 GLY 1 3.229 -4.265 -7.899
5 2HA GLY 1 HA3 GLY 1 3.816 -2.616 -7.640
6 H GLN 2 H GLN 2 1.137 -4.145 -7.200
7 HA GLN 2 HA GLN 2 -0.671 -2.019 -8.014
8 1HB GLN 2 HB2 GLN 2 -2.270 -3.599 -8.982
9 2HB GLN 2 HB3 GLN 2 -0.788 -3.580 -9.913
10 1HG GLN 2 HG2 GLN 2 -1.545 -5.733 -7.867
11 2HG GLN 2 HG3 GLN 2 -1.723 -5.870 -9.626
12 1HE2 GLN 2 2HE2 GLN 2 0.363 -5.800 -10.967
13 2HE2 GLN 2 1HE2 GLN 2 1.826 -6.340 -10.224
14 H ASP 3 H ASP 3 -2.755 -2.281 -6.982
15 HA ASP 3 HA ASP 3 -2.994 -3.902 -4.541
16 1HB ASP 3 HB2 ASP 3 -1.663 -1.751 -4.030
17 2HB ASP 3 HB3 ASP 3 -3.145 -0.880 -4.491
18 H ARG 4 H ARG 4 -5.322 -2.324 -3.650
19 HA ARG 4 HA ARG 4 -7.318 -3.300 -5.507
20 1HB ARG 4 HB2 ARG 4 -7.673 -1.331 -3.197
21 2HB ARG 4 HB3 ARG 4 -8.928 -2.164 -4.067
22 1HG ARG 4 HG2 ARG 4 -8.908 -3.562 -2.368
23 2HG ARG 4 HG3 ARG 4 -7.584 -4.349 -3.215
24 1HD ARG 4 HD2 ARG 4 -6.900 -2.102 -1.300
25 2HD ARG 4 HD3 ARG 4 -7.551 -3.560 -0.595
26 HE ARG 4 HE ARG 4 -4.943 -3.102 -1.649
27 1HH1 ARG 4 1HH1 ARG 4 -7.210 -5.717 -1.070
28 2HH1 ARG 4 2HH1 ARG 4 -5.988 -6.956 -0.942
29 1HH2 ARG 4 1HH2 ARG 4 -3.377 -4.615 -1.515
30 2HH2 ARG 4 2HH2 ARG 4 -3.670 -6.292 -1.222
31 H PHE 5 H PHE 5 -5.930 -0.097 -4.824
32 HA PHE 5 HA PHE 5 -6.732 0.916 -7.417
33 1HB PHE 5 HB2 PHE 5 -7.890 2.966 -6.331
34 2HB PHE 5 HB3 PHE 5 -8.780 1.478 -6.354
35 HD1 PHE 5 HD1 PHE 5 -9.615 0.512 -4.317
36 HD2 PHE 5 HD2 PHE 5 -6.618 3.605 -4.138
37 HE1 PHE 5 HE1 PHE 5 -9.850 0.599 -1.842
38 HE2 PHE 5 HE2 PHE 5 -6.859 3.678 -1.681
39 HZ PHE 5 HZ PHE 5 -8.442 2.147 -0.510
40 H VAL 6 H VAL 6 -4.353 0.313 -5.667
41 HA VAL 6 HA VAL 6 -2.918 2.889 -5.901
42 HB VAL 6 HB VAL 6 -3.318 1.088 -3.507
43 1HG1 VAL 6 1HG1 VAL 6 -1.196 1.701 -2.494
44 2HG1 VAL 6 2HG1 VAL 6 -0.912 0.717 -3.933
45 3HG1 VAL 6 3HG1 VAL 6 -0.648 2.476 -4.008
46 1HG2 VAL 6 1HG2 VAL 6 -4.223 3.436 -3.736
47 2HG2 VAL 6 2HG2 VAL 6 -3.189 3.148 -2.327
48 3HG2 VAL 6 3HG2 VAL 6 -2.526 3.995 -3.750
49 H TYR 7 H TYR 7 -0.701 2.509 -6.327
50 HA TYR 7 HA TYR 7 0.179 -0.057 -7.490
51 1HB TYR 7 HB2 TYR 7 -0.226 2.627 -8.898
52 2HB TYR 7 HB3 TYR 7 0.618 1.292 -9.625
53 HD1 TYR 7 HD1 TYR 7 -0.909 -0.930 -9.961
54 HD2 TYR 7 HD2 TYR 7 -2.525 2.903 -8.805
55 HE1 TYR 7 HE1 TYR 7 -3.205 -1.701 -10.538
56 HE2 TYR 7 HE2 TYR 7 -4.761 2.067 -9.131
57 HH TYR 7 HH TYR 7 -6.070 0.362 -10.007
58 H THR 8 H THR 8 2.509 0.810 -8.686
59 HA THR 8 HA THR 8 3.694 2.816 -6.843
60 HB THR 8 HB THR 8 5.829 1.267 -7.446
61 HG1 THR 8 HG1 THR 8 4.951 -0.375 -8.457
62 1HG2 THR 8 1HG2 THR 8 5.336 1.837 -5.210
63 2HG2 THR 8 2HG2 THR 8 3.858 0.844 -5.175
64 3HG2 THR 8 3HG2 THR 8 5.471 0.085 -5.251
65 H CYS 9 H CYS 9 5.715 3.712 -7.790
66 HA CYS 9 HA CYS 9 5.748 3.784 -10.777
67 1HB CYS 9 HB2 CYS 9 5.490 6.117 -9.924
68 2HB CYS 9 HB3 CYS 9 6.795 5.870 -8.770
69 H ASN 10 H ASN 10 7.308 1.986 -10.915
70 HA ASN 10 HA ASN 10 9.089 1.613 -8.679
71 1HB ASN 10 HB2 ASN 10 9.402 -0.413 -9.278
72 2HB ASN 10 HB3 ASN 10 8.054 -0.167 -10.391
73 1HD2 ASN 10 2HD2 ASN 10 9.000 1.065 -12.581
74 2HD2 ASN 10 1HD2 ASN 10 10.301 0.116 -13.251
75 H GLU 11 H GLU 11 9.167 4.087 -10.765
76 HA GLU 11 HA GLU 11 12.101 4.056 -10.824
77 1HB GLU 11 HB2 GLU 11 10.156 5.495 -12.476
78 2HB GLU 11 HB3 GLU 11 11.339 6.553 -11.731
79 1HG GLU 11 HG2 GLU 11 12.228 4.007 -13.123
80 2HG GLU 11 HG3 GLU 11 12.139 5.576 -13.936
81 H CYS 12 H CYS 12 9.339 5.319 -9.098
82 HA CYS 12 HA CYS 12 11.070 7.090 -7.442
83 1HB CYS 12 HB2 CYS 12 8.069 6.619 -7.310
84 2HB CYS 12 HB3 CYS 12 8.975 7.818 -6.410
85 H LYS 13 H LYS 13 9.472 4.049 -7.569
86 HA LYS 13 HA LYS 13 9.043 2.307 -6.228
87 1HB LYS 13 HB2 LYS 13 11.772 3.075 -5.082
88 2HB LYS 13 HB3 LYS 13 10.837 1.700 -4.486
89 1HG LYS 13 HG2 LYS 13 11.743 0.450 -6.028
90 2HG LYS 13 HG3 LYS 13 10.718 1.249 -7.193
91 1HD LYS 13 HD2 LYS 13 13.666 1.645 -6.638
92 2HD LYS 13 HD3 LYS 13 12.795 1.228 -8.127
93 1HE LYS 13 HE2 LYS 13 11.813 3.582 -8.017
94 2HE LYS 13 HE3 LYS 13 13.136 3.980 -6.917
95 1HZ LYS 13 HZ1 LYS 13 13.684 4.469 -9.214
96 2HZ LYS 13 HZ2 LYS 13 14.658 3.240 -8.736
97 3HZ LYS 13 HZ3 LYS 13 13.335 2.974 -9.685
98 H HIS 14 H HIS 14 7.651 4.417 -5.950
99 HA HIS 14 HA HIS 14 6.878 4.393 -3.118
100 1HB HIS 14 HB2 HIS 14 8.110 6.456 -3.434
101 2HB HIS 14 HB3 HIS 14 7.246 6.803 -4.926
102 HD2 HIS 14 HD2 HIS 14 5.312 8.448 -4.679
103 HE1 HIS 14 HE1 HIS 14 3.993 7.518 -0.755
104 HE2 HIS 14 HE2 HIS 14 3.555 8.939 -2.821
105 H HIS 15 H HIS 15 4.607 5.077 -2.926
106 HA HIS 15 HA HIS 15 2.990 3.609 -4.812
107 1HB HIS 15 HB2 HIS 15 2.378 5.083 -2.238
108 2HB HIS 15 HB3 HIS 15 1.116 4.351 -3.240
109 HD2 HIS 15 HD2 HIS 15 1.439 1.644 -3.873
110 HE1 HIS 15 HE1 HIS 15 3.375 0.802 -0.175
111 HE2 HIS 15 HE2 HIS 15 2.221 -0.242 -2.188
112 H VAL 16 H VAL 16 1.338 4.311 -6.044
113 HA VAL 16 HA VAL 16 0.769 7.169 -6.467
114 HB VAL 16 HB VAL 16 1.150 6.977 -8.880
115 1HG1 VAL 16 1HG1 VAL 16 3.198 7.501 -7.645
116 2HG1 VAL 16 2HG1 VAL 16 3.582 5.776 -7.484
117 3HG1 VAL 16 3HG1 VAL 16 3.534 6.487 -9.069
118 1HG2 VAL 16 1HG2 VAL 16 1.808 4.009 -8.438
119 2HG2 VAL 16 2HG2 VAL 16 0.418 4.695 -9.315
120 3HG2 VAL 16 3HG2 VAL 16 2.037 4.946 -9.928
121 H GLU 17 H GLU 17 -1.389 7.308 -7.772
122 HA GLU 17 HA GLU 17 -3.127 4.962 -7.143
123 1HB GLU 17 HB2 GLU 17 -4.922 6.750 -7.687
124 2HB GLU 17 HB3 GLU 17 -4.160 6.737 -6.107
125 1HG GLU 17 HG2 GLU 17 -4.472 9.028 -6.988
126 2HG GLU 17 HG3 GLU 17 -2.777 8.606 -6.638
127 H THR 18 H THR 18 -1.672 6.780 -9.682
128 HA THR 18 HA THR 18 -2.981 5.040 -11.691
129 HB THR 18 HB THR 18 -2.432 8.053 -11.759
130 HG1 THR 18 HG1 THR 18 -4.247 7.918 -10.798
131 1HG2 THR 18 1HG2 THR 18 -3.074 6.098 -13.981
132 2HG2 THR 18 2HG2 THR 18 -4.012 7.609 -13.908
133 3HG2 THR 18 3HG2 THR 18 -2.245 7.665 -14.028
134 H ARG 19 H ARG 19 -1.514 4.146 -13.133
135 HA ARG 19 HA ARG 19 1.226 5.242 -13.254
136 1HB ARG 19 HB2 ARG 19 2.352 3.172 -12.819
137 2HB ARG 19 HB3 ARG 19 1.272 3.439 -11.456
138 1HG ARG 19 HG2 ARG 19 -0.338 1.835 -12.408
139 2HG ARG 19 HG3 ARG 19 0.696 1.625 -13.839
140 1HD ARG 19 HD2 ARG 19 2.239 0.330 -12.811
141 2HD ARG 19 HD3 ARG 19 1.775 0.782 -11.181
142 HE ARG 19 HE ARG 19 -0.516 -0.306 -11.913
143 1HH1 ARG 19 1HH2 ARG 19 2.712 -1.773 -12.153
144 2HH1 ARG 19 2HH2 ARG 19 2.148 -3.293 -12.668
145 1HH2 ARG 19 2HH1 ARG 19 -1.255 -2.434 -12.734
146 2HH2 ARG 19 1HH1 ARG 19 -0.043 -3.640 -12.997
147 H TRP 20 H TRP 20 2.530 4.036 -14.817
148 HA TRP 20 HA TRP 20 1.127 2.991 -17.230
149 1HB TRP 20 HB2 TRP 20 3.816 4.333 -16.825
150 2HB TRP 20 HB3 TRP 20 3.282 3.630 -18.349
151 HD1 TRP 20 HD1 TRP 20 2.699 6.591 -16.077
152 HE1 TRP 20 HE1 TRP 20 1.054 8.251 -17.118
153 HE3 TRP 20 HE3 TRP 20 1.408 3.939 -20.230
154 HZ2 TRP 20 HZ2 TRP 20 -0.654 8.393 -19.421
155 HZ3 TRP 20 HZ3 TRP 20 -0.217 4.869 -21.886
156 HH2 TRP 20 HH2 TRP 20 -1.299 7.081 -21.437
157 H HIS 21 H HIS 21 1.853 0.855 -17.669
158 HA HIS 21 HA HIS 21 3.804 -0.370 -15.750
159 1HB HIS 21 HB2 HIS 21 1.909 -0.871 -14.677
160 2HB HIS 21 HB3 HIS 21 0.880 -0.864 -16.087
161 HD2 HIS 21 HD2 HIS 21 3.929 -3.239 -16.150
162 HE1 HIS 21 HE1 HIS 21 0.476 -5.622 -15.547
163 HE2 HIS 21 HE2 HIS 21 2.972 -5.658 -15.991
164 H CYS 22 H CYS 22 5.312 -1.328 -16.834
165 HA CYS 22 HA CYS 22 5.366 -1.873 -19.655
166 1HB CYS 22 HB2 CYS 22 7.037 -2.024 -17.180
167 2HB CYS 22 HB3 CYS 22 7.450 -3.201 -18.379
168 H THR 23 H THR 23 4.446 -3.450 -20.623
169 HA THR 23 HA THR 23 3.962 -6.011 -19.167
170 HB THR 23 HB THR 23 2.308 -6.552 -20.997
171 HG1 THR 23 HG1 THR 23 3.274 -4.250 -22.002
172 1HG2 THR 23 1HG2 THR 23 1.937 -4.043 -19.408
173 2HG2 THR 23 2HG2 THR 23 0.625 -5.160 -19.968
174 3HG2 THR 23 3HG2 THR 23 1.771 -5.707 -18.759
175 H VAL 24 H VAL 24 6.354 -4.893 -20.460
176 HA VAL 24 HA VAL 24 7.412 -6.984 -22.211
177 HB VAL 24 HB VAL 24 7.558 -4.719 -22.976
178 1HG1 VAL 24 1HG1 VAL 24 7.032 -3.053 -21.713
179 2HG1 VAL 24 2HG1 VAL 24 7.523 -3.833 -20.226
180 3HG1 VAL 24 3HG1 VAL 24 8.738 -3.015 -21.160
181 1HG2 VAL 24 1HG2 VAL 24 9.932 -4.108 -22.944
182 2HG2 VAL 24 2HG2 VAL 24 10.191 -5.078 -21.502
183 3HG2 VAL 24 3HG2 VAL 24 9.816 -5.888 -23.034
184 H CYS 25 H CYS 25 8.376 -4.930 -19.479
185 HA CYS 25 HA CYS 25 10.216 -6.758 -18.271
186 1HB CYS 25 HB2 CYS 25 8.870 -4.278 -17.140
187 2HB CYS 25 HB3 CYS 25 10.463 -4.892 -16.690
188 H GLU 26 H GLU 26 9.969 -6.972 -15.777
189 HA GLU 26 HA GLU 26 7.640 -8.636 -15.278
190 1HB GLU 26 HB2 GLU 26 10.351 -8.693 -14.578
191 2HB GLU 26 HB3 GLU 26 9.569 -8.295 -13.060
192 1HG GLU 26 HG2 GLU 26 7.967 -10.229 -13.539
193 2HG GLU 26 HG3 GLU 26 8.999 -10.641 -14.907
194 H ASP 27 H ASP 27 6.125 -6.889 -15.474
195 HA ASP 27 HA ASP 27 4.626 -5.361 -14.650
196 1HB ASP 27 HB2 ASP 27 4.016 -7.297 -13.330
197 2HB ASP 27 HB3 ASP 27 5.203 -6.879 -12.081
198 H TYR 28 H TYR 28 7.195 -4.434 -14.912
199 HA TYR 28 HA TYR 28 8.026 -2.615 -12.864
200 1HB TYR 28 HB2 TYR 28 9.440 -3.493 -14.723
201 2HB TYR 28 HB3 TYR 28 8.380 -2.741 -15.887
202 HD1 TYR 28 HD1 TYR 28 11.405 -2.370 -14.019
203 HD2 TYR 28 HD2 TYR 28 8.250 -0.170 -15.989
204 HE1 TYR 28 HE1 TYR 28 12.874 -0.373 -14.173
205 HE2 TYR 28 HE2 TYR 28 9.701 1.811 -16.131
206 HH TYR 28 HH TYR 28 11.695 2.706 -15.576
207 H ASP 29 H ASP 29 7.394 -0.488 -12.494
208 HA ASP 29 HA ASP 29 5.020 0.504 -14.061
209 1HB ASP 29 HB2 ASP 29 5.557 1.518 -11.290
210 2HB ASP 29 HB3 ASP 29 4.041 1.257 -12.101
211 H LEU 30 H LEU 30 4.704 2.812 -14.109
212 HA LEU 30 HA LEU 30 6.794 4.505 -12.987
213 1HB LEU 30 HB2 LEU 30 5.867 4.583 -15.890
214 2HB LEU 30 HB3 LEU 30 6.775 5.863 -15.071
215 HG LEU 30 HG LEU 30 7.749 3.022 -15.622
216 1HD1 LEU 30 1HD1 LEU 30 9.307 4.132 -17.166
217 2HD1 LEU 30 2HD1 LEU 30 7.625 4.457 -17.628
218 3HD1 LEU 30 3HD1 LEU 30 8.581 5.695 -16.794
219 1HD2 LEU 30 1HD2 LEU 30 9.408 5.348 -14.607
220 2HD2 LEU 30 2HD2 LEU 30 8.762 4.125 -13.513
221 3HD2 LEU 30 3HD2 LEU 30 9.883 3.628 -14.768
222 H CYS 31 H CYS 31 5.897 6.415 -12.140
223 HA CYS 31 HA CYS 31 3.059 6.975 -12.375
224 1HB CYS 31 HB2 CYS 31 3.659 9.071 -11.299
225 2HB CYS 31 HB3 CYS 31 4.329 7.723 -10.394
226 H ILE 32 H ILE 32 2.372 9.100 -13.228
227 HA ILE 32 HA ILE 32 2.737 9.215 -15.959
228 HB ILE 32 HB ILE 32 1.891 11.517 -14.136
229 1HG1 ILE 32 2HG1 ILE 32 0.458 9.622 -13.548
230 2HG1 ILE 32 3HG1 ILE 32 -0.435 10.862 -14.398
231 1HG2 ILE 32 1HG2 ILE 32 1.471 10.966 -17.080
232 2HG2 ILE 32 2HG2 ILE 32 0.526 12.164 -16.144
233 3HG2 ILE 32 3HG2 ILE 32 2.303 12.327 -16.302
234 1HD1 ILE 32 1HD1 ILE 32 -1.273 8.962 -15.358
235 2HD1 ILE 32 2HD1 ILE 32 -0.070 9.408 -16.539
236 3HD1 ILE 32 3HD1 ILE 32 0.296 8.113 -15.349
237 H ASN 33 H ASN 33 4.462 11.056 -13.457
238 HA ASN 33 HA ASN 33 5.826 12.845 -15.274
239 1HB ASN 33 HB2 ASN 33 5.706 13.483 -12.923
240 2HB ASN 33 HB3 ASN 33 6.375 11.946 -12.395
241 1HD2 ASN 33 2HD2 ASN 33 8.664 11.565 -12.433
242 2HD2 ASN 33 1HD2 ASN 33 9.764 12.900 -12.759
243 H CYS 34 H CYS 34 6.762 9.736 -13.778
244 HA CYS 34 HA CYS 34 9.401 9.851 -14.916
245 1HB CYS 34 HB2 CYS 34 7.758 7.722 -13.499
246 2HB CYS 34 HB3 CYS 34 9.330 7.363 -14.235
247 H TYR 35 H TYR 35 6.319 8.305 -15.903
248 HA TYR 35 HA TYR 35 7.320 6.968 -18.219
249 1HB TYR 35 HB2 TYR 35 5.094 6.568 -17.366
250 2HB TYR 35 HB3 TYR 35 4.627 8.240 -17.656
251 HD1 TYR 35 HD1 TYR 35 6.079 5.287 -19.541
252 HD2 TYR 35 HD2 TYR 35 3.373 8.664 -19.614
253 HE1 TYR 35 HE1 TYR 35 5.277 4.583 -21.736
254 HE2 TYR 35 HE2 TYR 35 2.564 7.952 -21.830
255 HH TYR 35 HH TYR 35 3.766 4.990 -23.434
256 H ASN 36 H ASN 36 6.227 10.318 -17.701
257 HA ASN 36 HA ASN 36 6.563 11.341 -20.302
258 1HB ASN 36 HB2 ASN 36 6.261 12.411 -17.561
259 2HB ASN 36 HB3 ASN 36 7.129 13.497 -18.598
260 1HD2 ASN 36 2HD2 ASN 36 4.059 11.908 -18.069
261 2HD2 ASN 36 1HD2 ASN 36 3.136 12.937 -19.181
262 H THR 37 H THR 37 8.866 11.542 -17.501
263 HA THR 37 HA THR 37 10.872 12.746 -19.255
264 HB THR 37 HB THR 37 12.116 13.019 -17.092
265 HG1 THR 37 HG1 THR 37 9.736 12.204 -15.840
266 1HG2 THR 37 1HG2 THR 37 10.619 14.790 -17.946
267 2HG2 THR 37 2HG2 THR 37 9.236 14.066 -17.095
268 3HG2 THR 37 3HG2 THR 37 10.599 14.741 -16.182
269 H LYS 38 H LYS 38 10.572 9.654 -17.559
270 HA LYS 38 HA LYS 38 13.349 8.925 -18.200
271 1HB LYS 38 HB2 LYS 38 11.179 7.073 -17.189
272 2HB LYS 38 HB3 LYS 38 12.909 6.881 -17.012
273 1HG LYS 38 HG2 LYS 38 11.269 9.066 -15.629
274 2HG LYS 38 HG3 LYS 38 11.697 7.534 -14.906
275 1HD LYS 38 HD2 LYS 38 14.093 8.142 -14.962
276 2HD LYS 38 HD3 LYS 38 13.698 9.602 -15.868
277 1HE LYS 38 HE2 LYS 38 14.034 10.121 -13.496
278 2HE LYS 38 HE3 LYS 38 12.367 10.478 -14.030
279 1HZ LYS 38 HZ1 LYS 38 12.533 9.305 -11.827
280 2HZ LYS 38 HZ2 LYS 38 11.666 8.471 -12.922
281 3HZ LYS 38 HZ3 LYS 38 13.201 8.025 -12.586
282 H SER 39 H SER 39 10.542 9.167 -19.907
283 HA SER 39 HA SER 39 9.550 8.139 -21.670
284 1HB SER 39 HB2 SER 39 12.348 8.562 -22.767
285 2HB SER 39 HB3 SER 39 10.820 8.729 -23.636
286 HG SER 39 HG SER 39 10.347 10.483 -22.097
287 H HIS 40 H HIS 40 10.125 5.999 -20.071
288 HA HIS 40 HA HIS 40 11.551 3.860 -21.345
289 1HB HIS 40 HB2 HIS 40 10.660 4.325 -18.892
290 2HB HIS 40 HB3 HIS 40 9.221 3.463 -19.468
291 HD1 HIS 40 HD1 HIS 40 12.690 2.872 -18.082
292 HD2 HIS 40 HD2 HIS 40 9.667 0.772 -20.141
293 HE1 HIS 40 HE1 HIS 40 13.035 0.431 -17.552
294 H THR 41 H THR 41 11.016 3.696 -23.420
295 HA THR 41 HA THR 41 8.443 4.154 -24.447
296 HB THR 41 HB THR 41 10.531 2.839 -26.157
297 HG1 THR 41 HG1 THR 41 11.115 5.130 -24.641
298 1HG2 THR 41 1HG2 THR 41 9.109 5.519 -26.304
299 2HG2 THR 41 2HG2 THR 41 10.194 4.860 -27.552
300 3HG2 THR 41 3HG2 THR 41 8.649 4.047 -27.196
301 H HIS 42 H HIS 42 8.873 1.283 -22.831
302 HA HIS 42 HA HIS 42 8.527 -0.519 -25.026
303 1HB HIS 42 HB2 HIS 42 8.107 -0.958 -22.094
304 2HB HIS 42 HB3 HIS 42 8.432 -2.179 -23.377
305 HD2 HIS 42 HD2 HIS 42 10.982 -0.605 -24.714
306 HE1 HIS 42 HE1 HIS 42 12.666 -1.115 -20.835
307 HE2 HIS 42 HE2 HIS 42 13.185 -0.632 -23.283
308 H LYS 43 H LYS 43 6.862 -2.300 -24.781
309 HA LYS 43 HA LYS 43 4.268 -1.198 -25.283
310 1HB LYS 43 HB2 LYS 43 5.378 -3.225 -26.332
311 2HB LYS 43 HB3 LYS 43 4.977 -4.147 -24.890
312 1HG LYS 43 HG2 LYS 43 2.865 -2.553 -26.407
313 2HG LYS 43 HG3 LYS 43 3.412 -4.104 -27.018
314 1HD LYS 43 HD2 LYS 43 1.690 -4.955 -25.832
315 2HD LYS 43 HD3 LYS 43 2.781 -4.817 -24.460
316 1HE LYS 43 HE2 LYS 43 1.867 -2.455 -24.123
317 2HE LYS 43 HE3 LYS 43 0.682 -2.793 -25.393
318 1HZ LYS 43 HZ1 LYS 43 -0.246 -4.480 -24.023
319 2HZ LYS 43 HZ2 LYS 43 0.971 -4.287 -22.890
320 3HZ LYS 43 HZ3 LYS 43 -0.100 -3.082 -23.137
321 H MET 44 H MET 44 3.355 -0.250 -23.591
322 HA MET 44 HA MET 44 3.222 -1.582 -20.923
323 1HB MET 44 HB2 MET 44 3.254 1.302 -21.876
324 2HB MET 44 HB3 MET 44 2.674 0.879 -20.253
325 1HG MET 44 HG2 MET 44 4.653 0.066 -19.532
326 2HG MET 44 HG3 MET 44 5.401 -0.046 -21.125
327 1HE MET 44 HE1 MET 44 6.272 1.200 -18.047
328 2HE MET 44 HE2 MET 44 5.955 2.957 -17.894
329 3HE MET 44 HE3 MET 44 4.616 1.802 -17.901
330 H VAL 45 H VAL 45 1.292 -0.644 -19.650
331 HA VAL 45 HA VAL 45 -1.264 -0.454 -21.045
332 HB VAL 45 HB VAL 45 -2.149 -1.691 -19.112
333 1HG1 VAL 45 1HG1 VAL 45 -0.373 -3.376 -20.915
334 2HG1 VAL 45 2HG1 VAL 45 -1.862 -3.895 -20.100
335 3HG1 VAL 45 3HG1 VAL 45 -1.969 -2.681 -21.385
336 1HG2 VAL 45 1HG2 VAL 45 -0.716 -3.361 -17.953
337 2HG2 VAL 45 2HG2 VAL 45 0.710 -2.604 -18.641
338 3HG2 VAL 45 3HG2 VAL 45 -0.342 -1.661 -17.584
339 H LYS 46 H LYS 46 -2.734 0.563 -19.087
340 HA LYS 46 HA LYS 46 -1.181 2.376 -17.379
341 1HB LYS 46 HB2 LYS 46 -1.510 3.500 -19.600
342 2HB LYS 46 HB3 LYS 46 -3.253 3.327 -19.425
343 1HG LYS 46 HG2 LYS 46 -1.445 4.915 -17.524
344 2HG LYS 46 HG3 LYS 46 -2.264 5.584 -18.933
345 1HD LYS 46 HD2 LYS 46 -4.472 4.774 -17.804
346 2HD LYS 46 HD3 LYS 46 -3.470 4.640 -16.351
347 1HE LYS 46 HE2 LYS 46 -4.265 6.814 -16.170
348 2HE LYS 46 HE3 LYS 46 -2.670 7.073 -16.934
349 1HZ LYS 46 HZ1 LYS 46 -5.360 7.262 -18.076
350 2HZ LYS 46 HZ2 LYS 46 -4.251 8.372 -17.955
351 3HZ LYS 46 HZ3 LYS 46 -4.026 7.206 -19.084
352 H TRP 47 H TRP 47 -2.323 2.541 -15.483
353 HA TRP 47 HA TRP 47 -5.155 1.606 -15.401
354 1HB TRP 47 HB2 TRP 47 -3.062 0.949 -13.309
355 2HB TRP 47 HB3 TRP 47 -4.697 0.336 -13.425
356 HD1 TRP 47 HD1 TRP 47 -1.201 -0.463 -14.353
357 HE1 TRP 47 HE1 TRP 47 -1.033 -2.499 -15.859
358 HE3 TRP 47 HE3 TRP 47 -6.080 -0.765 -15.859
359 HZ2 TRP 47 HZ2 TRP 47 -2.754 -3.983 -17.664
360 HZ3 TRP 47 HZ3 TRP 47 -6.730 -2.387 -17.631
361 HH2 TRP 47 HH2 TRP 47 -5.064 -3.997 -18.521
362 H GLY 48 H GLY 48 -6.211 3.497 -14.804
363 1HA GLY 48 HA2 GLY 48 -4.786 5.310 -12.949
364 2HA GLY 48 HA3 GLY 48 -5.565 5.911 -14.440
365 H LEU 49 H LEU 49 -5.927 6.339 -11.537
366 HA LEU 49 HA LEU 49 -8.824 5.973 -11.466
367 1HB LEU 49 HB2 LEU 49 -6.909 4.962 -9.347
368 2HB LEU 49 HB3 LEU 49 -8.589 5.223 -8.993
369 HG LEU 49 HG LEU 49 -7.556 3.334 -11.149
370 1HD1 LEU 49 1HD1 LEU 49 -8.169 1.547 -9.640
371 2HD1 LEU 49 2HD1 LEU 49 -7.063 2.688 -8.837
372 3HD1 LEU 49 3HD1 LEU 49 -8.809 2.713 -8.463
373 1HD2 LEU 49 1HD2 LEU 49 -9.844 4.107 -11.747
374 2HD2 LEU 49 2HD2 LEU 49 -9.863 2.430 -11.229
375 3HD2 LEU 49 3HD2 LEU 49 -10.423 3.691 -10.111
376 H GLY 50 H GLY 50 -6.491 8.227 -11.516
377 1HA GLY 50 HA2 GLY 50 -8.208 10.110 -10.080
378 2HA GLY 50 HA3 GLY 50 -6.647 9.803 -9.292
379 H LEU 51 H LEU 51 -4.735 9.952 -10.873
380 HA LEU 51 HA LEU 51 -4.904 12.474 -12.432
381 1HB LEU 51 HB2 LEU 51 -2.614 10.867 -11.206
382 2HB LEU 51 HB3 LEU 51 -2.351 12.133 -12.405
383 HG LEU 51 HG LEU 51 -3.364 13.821 -10.944
384 1HD1 LEU 51 1HD1 LEU 51 -4.860 12.584 -9.529
385 2HD1 LEU 51 2HD1 LEU 51 -3.537 11.569 -8.898
386 3HD1 LEU 51 3HD1 LEU 51 -3.637 13.308 -8.485
387 1HD2 LEU 51 1HD2 LEU 51 -1.447 13.911 -9.343
388 2HD2 LEU 51 2HD2 LEU 51 -1.154 12.186 -9.624
389 3HD2 LEU 51 3HD2 LEU 51 -0.910 13.381 -10.936
390 H ASP 52 H ASP 52 -6.314 10.907 -13.879
391 HA ASP 52 HA ASP 52 -4.928 8.833 -15.294
392 1HB ASP 52 HB2 ASP 52 -7.440 9.014 -14.931
393 2HB ASP 52 HB3 ASP 52 -7.470 10.220 -16.242