NMR Restraints Grid
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NMR Restraints Grid |
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Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
531443 |
2lel   |
17716 | cing | 1-original | 4 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 H1 VAL 1 1H VAL 1 3.328 15.879 -11.794
2 H2 VAL 1 2H VAL 1 1.696 16.267 -12.057
3 HA VAL 1 HA VAL 1 2.887 14.424 -10.114
4 HB VAL 1 HB VAL 1 0.411 16.151 -9.935
5 HG11 VAL 1 2HG1 VAL 1 2.365 15.027 -7.906
6 HG12 VAL 1 3HG1 VAL 1 0.697 14.510 -8.152
7 HG13 VAL 1 1HG1 VAL 1 1.036 16.118 -7.517
8 HG21 VAL 1 1HG2 VAL 1 2.215 17.624 -10.624
9 HG22 VAL 1 2HG2 VAL 1 3.315 16.890 -9.456
10 HG23 VAL 1 3HG2 VAL 1 1.948 17.855 -8.896
11 H ASP 2 H ASP 2 -0.425 15.106 -11.256
12 HA ASP 2 HA ASP 2 -2.237 13.712 -11.534
13 HB2 ASP 2 2HB ASP 2 -0.217 11.733 -12.590
14 HB3 ASP 2 1HB ASP 2 -1.905 11.921 -13.063
15 H MET 3 H MET 3 -0.193 13.286 -9.158
16 HA MET 3 HA MET 3 -0.446 10.590 -8.344
17 HB2 MET 3 2HB MET 3 1.157 12.324 -7.417
18 HB3 MET 3 1HB MET 3 -0.205 12.972 -6.503
19 HG2 MET 3 2HG MET 3 0.921 11.426 -5.051
20 HG3 MET 3 1HG MET 3 -0.561 10.633 -5.583
21 HE1 MET 3 3HE MET 3 1.738 7.602 -5.397
22 HE2 MET 3 1HE MET 3 0.068 8.161 -5.243
23 HE3 MET 3 2HE MET 3 1.348 8.927 -4.306
24 H SER 4 H SER 4 -2.484 13.428 -7.873
25 HA SER 4 HA SER 4 -4.221 12.420 -5.920
26 HB2 SER 4 2HB SER 4 -4.825 14.325 -8.193
27 HB3 SER 4 1HB SER 4 -5.839 14.078 -6.774
28 HG SER 4 HG SER 4 -3.656 14.545 -5.668
29 H ASN 5 H ASN 5 -4.164 11.987 -9.419
30 HA ASN 5 HA ASN 5 -6.705 10.781 -9.699
31 HB2 ASN 5 2HB ASN 5 -5.365 11.638 -11.598
32 HB3 ASN 5 1HB ASN 5 -4.213 10.325 -11.358
33 HD21 ASN 5 1HD2 ASN 5 -4.681 9.283 -13.403
34 HD22 ASN 5 2HD2 ASN 5 -6.171 8.528 -13.702
35 H VAL 6 H VAL 6 -3.468 9.389 -9.201
36 HA VAL 6 HA VAL 6 -4.331 6.680 -9.208
37 HB VAL 6 HB VAL 6 -1.888 7.849 -7.857
38 HG11 VAL 6 1HG1 VAL 6 -2.340 5.539 -7.218
39 HG12 VAL 6 2HG1 VAL 6 -0.974 5.570 -8.335
40 HG13 VAL 6 3HG1 VAL 6 -2.571 5.086 -8.907
41 HG21 VAL 6 3HG2 VAL 6 -2.321 6.904 -10.709
42 HG22 VAL 6 1HG2 VAL 6 -0.754 7.311 -10.010
43 HG23 VAL 6 2HG2 VAL 6 -1.985 8.559 -10.201
44 H VAL 7 H VAL 7 -5.106 5.405 -7.615
45 HA VAL 7 HA VAL 7 -4.815 6.019 -4.830
46 HB VAL 7 HB VAL 7 -6.559 7.656 -5.398
47 HG11 VAL 7 1HG1 VAL 7 -8.254 5.275 -6.190
48 HG12 VAL 7 2HG1 VAL 7 -7.424 6.300 -7.361
49 HG13 VAL 7 3HG1 VAL 7 -8.675 6.983 -6.321
50 HG21 VAL 7 3HG2 VAL 7 -7.791 5.312 -3.925
51 HG22 VAL 7 1HG2 VAL 7 -8.115 7.029 -3.677
52 HG23 VAL 7 2HG2 VAL 7 -6.555 6.349 -3.211
53 H LYS 8 H LYS 8 -5.178 4.238 -3.591
54 HA LYS 8 HA LYS 8 -6.827 2.046 -4.509
55 HB2 LYS 8 2HB LYS 8 -4.504 1.865 -5.665
56 HB3 LYS 8 1HB LYS 8 -3.912 1.410 -4.070
57 HG2 LYS 8 2HG LYS 8 -4.450 -0.689 -4.922
58 HG3 LYS 8 1HG LYS 8 -5.965 -0.276 -4.122
59 HD2 LYS 8 2HD LYS 8 -6.746 -0.938 -6.223
60 HD3 LYS 8 1HD LYS 8 -6.579 0.798 -6.465
61 HE2 LYS 8 2HE LYS 8 -4.411 0.488 -7.538
62 HE3 LYS 8 1HE LYS 8 -4.446 -1.240 -7.185
63 HZ1 LYS 8 3HZ LYS 8 -5.254 -0.249 -9.483
64 HZ2 LYS 8 1HZ LYS 8 -6.718 -0.129 -8.636
65 HZ3 LYS 8 2HZ LYS 8 -5.955 -1.638 -8.800
66 H THR 9 H THR 9 -7.657 1.006 -2.788
67 HA THR 9 HA THR 9 -6.164 0.807 -0.293
68 HB THR 9 HB THR 9 -8.840 2.216 -0.322
69 HG1 THR 9 1HG THR 9 -7.194 3.923 0.458
70 HG21 THR 9 3HG2 THR 9 -8.242 0.943 1.731
71 HG22 THR 9 1HG2 THR 9 -8.305 2.682 2.014
72 HG23 THR 9 2HG2 THR 9 -6.748 1.873 1.844
73 H TYR 10 H TYR 10 -6.371 -1.302 0.088
74 HA TYR 10 HA TYR 10 -8.970 -2.634 -0.394
75 HB2 TYR 10 2HB TYR 10 -6.338 -3.950 0.236
76 HB3 TYR 10 1HB TYR 10 -7.785 -4.696 -0.409
77 HD1 TYR 10 2HD TYR 10 -8.659 -3.806 -2.680
78 HD2 TYR 10 1HD TYR 10 -4.655 -3.183 -1.244
79 HE1 TYR 10 2HE TYR 10 -7.894 -3.380 -4.997
80 HE2 TYR 10 1HE TYR 10 -3.895 -2.761 -3.563
81 HH TYR 10 HH TYR 10 -4.991 -3.607 -6.041
82 H ASP 11 H ASP 11 -10.234 -2.562 1.375
83 HA ASP 11 HA ASP 11 -9.339 -2.172 4.011
84 HB2 ASP 11 2HB ASP 11 -11.914 -3.300 2.911
85 HB3 ASP 11 1HB ASP 11 -11.645 -2.986 4.626
86 H LEU 12 H LEU 12 -7.778 -3.587 4.683
87 HA LEU 12 HA LEU 12 -7.936 -6.423 4.347
88 HB2 LEU 12 2HB LEU 12 -6.086 -4.475 5.493
89 HB3 LEU 12 1HB LEU 12 -6.221 -5.881 6.538
90 HG LEU 12 HG LEU 12 -5.674 -7.352 4.616
91 HD11 LEU 12 1HD1 LEU 12 -6.433 -6.163 2.699
92 HD12 LEU 12 2HD1 LEU 12 -4.679 -6.125 2.579
93 HD13 LEU 12 3HD1 LEU 12 -5.555 -4.707 3.161
94 HD21 LEU 12 3HD2 LEU 12 -3.816 -5.094 5.368
95 HD22 LEU 12 1HD2 LEU 12 -3.283 -6.362 4.265
96 HD23 LEU 12 2HD2 LEU 12 -3.781 -6.774 5.907
97 H GLN 13 H GLN 13 -8.105 -7.981 6.097
98 HA GLN 13 HA GLN 13 -10.423 -7.453 7.725
99 HB2 GLN 13 2HB GLN 13 -10.121 -9.788 8.478
100 HB3 GLN 13 1HB GLN 13 -10.085 -9.660 6.718
101 HG2 GLN 13 2HG GLN 13 -7.595 -9.611 6.806
102 HG3 GLN 13 1HG GLN 13 -7.678 -9.849 8.552
103 HE21 GLN 13 1HE2 GLN 13 -9.870 -11.410 6.210
104 HE22 GLN 13 2HE2 GLN 13 -9.314 -12.993 6.504
105 H ASP 14 H ASP 14 -7.036 -7.160 8.121
106 HA ASP 14 HA ASP 14 -7.038 -7.448 11.009
107 HB2 ASP 14 2HB ASP 14 -4.916 -6.404 9.118
108 HB3 ASP 14 1HB ASP 14 -4.682 -6.746 10.832
109 H GLY 15 H GLY 15 -8.586 -5.302 9.359
110 HA2 GLY 15 2HA GLY 15 -9.427 -3.236 10.018
111 HA3 GLY 15 1HA GLY 15 -8.226 -3.189 11.311
112 H SER 16 H SER 16 -6.138 -3.871 9.196
113 HA SER 16 HA SER 16 -5.439 -1.137 8.577
114 HB2 SER 16 2HB SER 16 -4.090 -3.757 7.889
115 HB3 SER 16 1HB SER 16 -3.410 -2.162 7.576
116 HG SER 16 HG SER 16 -4.281 -2.351 10.119
117 H LYS 17 H LYS 17 -4.266 -1.156 6.174
118 HA LYS 17 HA LYS 17 -5.912 -2.324 4.123
119 HB2 LYS 17 2HB LYS 17 -6.741 -0.174 3.214
120 HB3 LYS 17 1HB LYS 17 -7.408 -0.521 4.811
121 HG2 LYS 17 2HG LYS 17 -5.412 0.876 5.716
122 HG3 LYS 17 1HG LYS 17 -5.260 1.465 4.060
123 HD2 LYS 17 2HD LYS 17 -7.757 2.028 4.193
124 HD3 LYS 17 1HD LYS 17 -7.615 1.761 5.931
125 HE2 LYS 17 2HE LYS 17 -5.896 3.483 6.096
126 HE3 LYS 17 1HE LYS 17 -5.910 3.703 4.347
127 HZ1 LYS 17 3HZ LYS 17 -7.582 4.882 6.274
128 HZ2 LYS 17 1HZ LYS 17 -8.536 3.930 5.245
129 HZ3 LYS 17 2HZ LYS 17 -7.546 5.150 4.596
130 H VAL 18 H VAL 18 -4.571 -2.707 2.472
131 HA VAL 18 HA VAL 18 -1.970 -1.494 2.394
132 HB VAL 18 HB VAL 18 -2.685 -2.880 -0.095
133 HG11 VAL 18 1HG1 VAL 18 -0.777 -4.286 0.519
134 HG12 VAL 18 2HG1 VAL 18 -0.766 -3.586 2.136
135 HG13 VAL 18 3HG1 VAL 18 -0.386 -2.580 0.738
136 HG21 VAL 18 3HG2 VAL 18 -3.033 -5.115 0.916
137 HG22 VAL 18 1HG2 VAL 18 -4.354 -4.019 1.283
138 HG23 VAL 18 2HG2 VAL 18 -3.140 -4.365 2.508
139 H HIS 19 H HIS 19 -1.106 -0.295 0.610
140 HA HIS 19 HA HIS 19 -3.028 1.131 -1.105
141 HB2 HIS 19 2HB HIS 19 -2.927 2.894 0.371
142 HB3 HIS 19 1HB HIS 19 -1.490 2.264 1.164
143 HD1 HIS 19 1HD HIS 19 -2.596 4.557 -1.578
144 HD2 HIS 19 2HD HIS 19 0.985 3.136 0.019
145 HE1 HIS 19 1HE HIS 19 -0.756 6.005 -2.545
146 HE2 HIS 19 2HE HIS 19 1.434 5.151 -1.583
147 H VAL 20 H VAL 20 -2.292 0.831 -3.125
148 HA VAL 20 HA VAL 20 0.513 0.185 -3.524
149 HB VAL 20 HB VAL 20 -0.049 -0.752 -5.569
150 HG11 VAL 20 1HG1 VAL 20 -2.469 -0.930 -3.776
151 HG12 VAL 20 2HG1 VAL 20 -1.236 -2.136 -4.094
152 HG13 VAL 20 3HG1 VAL 20 -2.422 -1.759 -5.327
153 HG21 VAL 20 3HG2 VAL 20 -2.222 1.323 -5.655
154 HG22 VAL 20 1HG2 VAL 20 -2.294 -0.085 -6.714
155 HG23 VAL 20 2HG2 VAL 20 -0.928 1.023 -6.811
156 H PHE 21 H PHE 21 1.818 1.158 -5.151
157 HA PHE 21 HA PHE 21 1.386 4.072 -5.332
158 HB2 PHE 21 2HB PHE 21 3.848 2.342 -5.657
159 HB3 PHE 21 1HB PHE 21 3.826 4.080 -5.951
160 HD1 PHE 21 1HD PHE 21 3.525 1.441 -3.391
161 HD2 PHE 21 2HD PHE 21 3.596 5.671 -4.128
162 HE1 PHE 21 1HE PHE 21 3.805 1.860 -0.961
163 HE2 PHE 21 2HE PHE 21 3.874 6.091 -1.700
164 HZ PHE 21 HZ PHE 21 3.979 4.184 -0.116
165 H LYS 22 H LYS 22 3.084 4.574 -7.497
166 HA LYS 22 HA LYS 22 1.306 4.078 -9.685
167 HB2 LYS 22 2HB LYS 22 2.655 6.162 -9.400
168 HB3 LYS 22 1HB LYS 22 4.109 5.228 -9.736
169 HG2 LYS 22 2HG LYS 22 1.902 4.969 -11.747
170 HG3 LYS 22 1HG LYS 22 2.691 6.539 -11.673
171 HD2 LYS 22 2HD LYS 22 4.906 5.387 -11.919
172 HD3 LYS 22 1HD LYS 22 4.044 3.865 -12.144
173 HE2 LYS 22 2HE LYS 22 2.923 4.733 -14.118
174 HE3 LYS 22 1HE LYS 22 3.630 6.328 -13.859
175 HZ1 LYS 22 3HZ LYS 22 5.845 5.222 -14.046
176 HZ2 LYS 22 1HZ LYS 22 4.938 5.237 -15.478
177 HZ3 LYS 22 2HZ LYS 22 5.042 3.815 -14.555
178 H ASP 23 H ASP 23 4.283 2.645 -8.525
179 HA ASP 23 HA ASP 23 4.821 1.175 -10.944
180 HB2 ASP 23 2HB ASP 23 6.599 1.835 -9.338
181 HB3 ASP 23 1HB ASP 23 5.903 0.724 -8.155
182 H GLY 24 H GLY 24 2.214 0.894 -9.259
183 HA2 GLY 24 2HA GLY 24 0.669 -0.796 -8.979
184 HA3 GLY 24 1HA GLY 24 1.759 -1.850 -9.878
185 H LYS 25 H LYS 25 3.777 -0.824 -7.656
186 HA LYS 25 HA LYS 25 3.744 -3.193 -6.086
187 HB2 LYS 25 2HB LYS 25 5.081 -0.496 -5.702
188 HB3 LYS 25 1HB LYS 25 5.412 -1.894 -4.690
189 HG2 LYS 25 2HG LYS 25 5.628 -2.162 -7.684
190 HG3 LYS 25 1HG LYS 25 6.941 -1.402 -6.787
191 HD2 LYS 25 2HD LYS 25 7.075 -3.416 -5.327
192 HD3 LYS 25 1HD LYS 25 5.834 -4.186 -6.313
193 HE2 LYS 25 2HE LYS 25 8.496 -3.180 -7.358
194 HE3 LYS 25 1HE LYS 25 8.125 -4.866 -6.997
195 HZ1 LYS 25 3HZ LYS 25 6.063 -4.030 -8.579
196 HZ2 LYS 25 1HZ LYS 25 7.372 -4.992 -9.065
197 HZ3 LYS 25 2HZ LYS 25 7.430 -3.309 -9.284
198 H MET 26 H MET 26 3.044 -3.542 -3.993
199 HA MET 26 HA MET 26 0.808 -1.954 -3.103
200 HB2 MET 26 2HB MET 26 1.991 -4.591 -2.379
201 HB3 MET 26 1HB MET 26 1.045 -3.774 -1.136
202 HG2 MET 26 2HG MET 26 -0.895 -3.724 -2.488
203 HG3 MET 26 1HG MET 26 0.010 -4.115 -3.952
204 HE1 MET 26 3HE MET 26 -1.642 -5.657 -4.571
205 HE2 MET 26 1HE MET 26 -1.617 -7.375 -4.144
206 HE3 MET 26 2HE MET 26 -0.214 -6.635 -4.913
207 H GLY 27 H GLY 27 0.669 -1.708 -0.587
208 HA2 GLY 27 2HA GLY 27 3.173 -0.850 0.652
209 HA3 GLY 27 1HA GLY 27 2.014 0.433 0.310
210 H MET 28 H MET 28 2.968 -1.893 2.540
211 HA MET 28 HA MET 28 0.400 -2.363 3.751
212 HB2 MET 28 2HB MET 28 2.436 -3.921 3.780
213 HB3 MET 28 1HB MET 28 3.089 -2.855 5.018
214 HG2 MET 28 2HG MET 28 1.933 -4.680 6.108
215 HG3 MET 28 1HG MET 28 1.015 -3.198 6.349
216 HE1 MET 28 3HE MET 28 -1.847 -3.849 6.291
217 HE2 MET 28 1HE MET 28 -0.572 -4.647 7.222
218 HE3 MET 28 2HE MET 28 -1.764 -5.607 6.357
219 H GLU 29 H GLU 29 -0.386 -0.280 4.178
220 HA GLU 29 HA GLU 29 1.017 1.244 6.300
221 HB2 GLU 29 2HB GLU 29 -1.271 2.251 4.610
222 HB3 GLU 29 1HB GLU 29 -0.090 3.184 5.530
223 HG2 GLU 29 2HG GLU 29 1.702 2.367 4.014
224 HG3 GLU 29 1HG GLU 29 0.486 1.511 3.069
225 H ASN 30 H ASN 30 0.266 0.750 8.275
226 HA ASN 30 HA ASN 30 -2.308 -0.424 8.711
227 HB2 ASN 30 2HB ASN 30 -1.746 -0.277 11.085
228 HB3 ASN 30 1HB ASN 30 -0.376 -0.903 10.167
229 HD21 ASN 30 1HD2 ASN 30 -1.632 2.379 11.026
230 HD22 ASN 30 2HD2 ASN 30 -0.112 2.987 11.493
231 H LYS 31 H LYS 31 -4.114 0.460 9.725
232 HA LYS 31 HA LYS 31 -4.728 3.137 9.037
233 HB2 LYS 31 2HB LYS 31 -6.871 2.739 9.960
234 HB3 LYS 31 1HB LYS 31 -6.353 1.189 9.302
235 HG2 LYS 31 2HG LYS 31 -6.269 2.034 12.223
236 HG3 LYS 31 1HG LYS 31 -7.327 0.827 11.502
237 HD2 LYS 31 2HD LYS 31 -5.218 -0.427 10.801
238 HD3 LYS 31 1HD LYS 31 -4.330 0.666 11.865
239 HE2 LYS 31 2HE LYS 31 -4.901 -1.380 13.077
240 HE3 LYS 31 1HE LYS 31 -5.796 -0.018 13.751
241 HZ1 LYS 31 3HZ LYS 31 -7.160 -1.316 11.585
242 HZ2 LYS 31 1HZ LYS 31 -7.731 -0.894 13.125
243 HZ3 LYS 31 2HZ LYS 31 -6.882 -2.349 12.903
244 H PHE 32 H PHE 32 -2.837 2.006 11.521
245 HA PHE 32 HA PHE 32 -3.678 3.868 13.569
246 HB2 PHE 32 2HB PHE 32 -2.500 1.567 13.874
247 HB3 PHE 32 1HB PHE 32 -1.015 2.452 13.525
248 HD1 PHE 32 2HD PHE 32 -4.047 2.514 15.716
249 HD2 PHE 32 1HD PHE 32 0.060 3.680 15.234
250 HE1 PHE 32 2HE PHE 32 -4.006 3.340 18.055
251 HE2 PHE 32 1HE PHE 32 0.099 4.507 17.573
252 HZ PHE 32 HZ PHE 32 -1.934 4.336 18.982
253 H GLY 33 H GLY 33 -2.672 4.704 10.777
254 HA2 GLY 33 2HA GLY 33 -1.592 6.556 9.931
255 HA3 GLY 33 1HA GLY 33 -1.425 7.125 11.591
256 H LYS 34 H LYS 34 -0.218 4.000 10.727
257 HA LYS 34 HA LYS 34 2.548 4.995 10.476
258 HB2 LYS 34 2HB LYS 34 1.570 2.939 12.470
259 HB3 LYS 34 1HB LYS 34 3.269 3.172 12.052
260 HG2 LYS 34 2HG LYS 34 3.042 5.581 12.708
261 HG3 LYS 34 1HG LYS 34 1.406 5.233 13.264
262 HD2 LYS 34 2HD LYS 34 2.386 3.455 14.767
263 HD3 LYS 34 1HD LYS 34 3.987 4.054 14.325
264 HE2 LYS 34 2HE LYS 34 3.405 6.286 15.179
265 HE3 LYS 34 1HE LYS 34 1.789 5.714 15.597
266 HZ1 LYS 34 3HZ LYS 34 2.617 5.084 17.534
267 HZ2 LYS 34 1HZ LYS 34 4.200 5.456 17.054
268 HZ3 LYS 34 2HZ LYS 34 3.554 3.919 16.727
269 H SER 35 H SER 35 4.014 2.971 10.050
270 HA SER 35 HA SER 35 2.697 1.387 7.920
271 HB2 SER 35 2HB SER 35 5.660 1.831 8.264
272 HB3 SER 35 1HB SER 35 4.802 1.270 6.832
273 HG SER 35 HG SER 35 3.663 3.456 7.184
274 H MET 36 H MET 36 3.342 -0.825 7.648
275 HA MET 36 HA MET 36 4.538 -2.123 10.023
276 HB2 MET 36 2HB MET 36 1.895 -2.770 8.704
277 HB3 MET 36 1HB MET 36 2.778 -3.954 9.673
278 HG2 MET 36 2HG MET 36 2.054 -1.194 10.693
279 HG3 MET 36 1HG MET 36 1.039 -2.617 10.945
280 HE1 MET 36 3HE MET 36 2.281 -4.976 11.773
281 HE2 MET 36 1HE MET 36 1.162 -4.063 12.794
282 HE3 MET 36 2HE MET 36 2.640 -4.731 13.480
283 H ASN 37 H ASN 37 6.306 -3.080 9.270
284 HA ASN 37 HA ASN 37 6.704 -3.752 6.539
285 HB2 ASN 37 2HB ASN 37 8.567 -3.232 8.072
286 HB3 ASN 37 1HB ASN 37 8.232 -4.716 8.965
287 HD21 ASN 37 1HD2 ASN 37 7.924 -6.679 7.158
288 HD22 ASN 37 2HD2 ASN 37 9.228 -6.778 6.073
289 H MET 38 H MET 38 5.086 -5.128 5.837
290 HA MET 38 HA MET 38 4.714 -7.696 7.183
291 HB2 MET 38 2HB MET 38 2.656 -6.841 6.483
292 HB3 MET 38 1HB MET 38 3.317 -6.204 4.978
293 HG2 MET 38 2HG MET 38 3.419 -8.382 4.008
294 HG3 MET 38 1HG MET 38 3.146 -9.166 5.543
295 HE1 MET 38 3HE MET 38 0.083 -9.994 5.931
296 HE2 MET 38 1HE MET 38 -0.236 -8.398 6.614
297 HE3 MET 38 2HE MET 38 1.330 -9.168 6.862
298 HA PRO 39 HA PRO 39 7.846 -9.345 4.390
299 HB2 PRO 39 2HB PRO 39 7.572 -12.023 4.930
300 HB3 PRO 39 1HB PRO 39 8.406 -10.890 6.014
301 HG2 PRO 39 2HG PRO 39 5.630 -11.975 6.186
302 HG3 PRO 39 1HG PRO 39 6.817 -11.705 7.477
303 HD2 PRO 39 2HD PRO 39 4.747 -9.986 6.988
304 HD3 PRO 39 1HD PRO 39 6.297 -9.448 7.664
305 H GLU 40 H GLU 40 7.727 -9.691 2.266
306 HA GLU 40 HA GLU 40 5.479 -9.861 0.747
307 HB2 GLU 40 2HB GLU 40 7.789 -9.482 -0.110
308 HB3 GLU 40 1HB GLU 40 8.107 -11.207 0.073
309 HG2 GLU 40 2HG GLU 40 5.751 -10.225 -1.543
310 HG3 GLU 40 1HG GLU 40 7.358 -10.349 -2.257
311 H GLY 41 H GLY 41 4.081 -11.386 0.055
312 HA2 GLY 41 2HA GLY 41 3.419 -13.601 -0.508
313 HA3 GLY 41 1HA GLY 41 4.630 -14.231 0.602
314 H LYS 42 H LYS 42 3.506 -11.960 2.501
315 HA LYS 42 HA LYS 42 1.820 -13.743 3.965
316 HB2 LYS 42 2HB LYS 42 3.300 -11.672 4.743
317 HB3 LYS 42 1HB LYS 42 1.798 -10.803 4.533
318 HG2 LYS 42 2HG LYS 42 1.618 -11.477 6.764
319 HG3 LYS 42 1HG LYS 42 0.772 -12.785 5.941
320 HD2 LYS 42 2HD LYS 42 3.162 -13.895 5.864
321 HD3 LYS 42 1HD LYS 42 3.521 -12.757 7.162
322 HE2 LYS 42 2HE LYS 42 2.774 -14.776 8.219
323 HE3 LYS 42 1HE LYS 42 1.443 -13.626 8.342
324 HZ1 LYS 42 3HZ LYS 42 0.165 -15.032 7.239
325 HZ2 LYS 42 1HZ LYS 42 1.439 -16.146 7.138
326 HZ3 LYS 42 2HZ LYS 42 1.219 -14.993 5.908
327 H VAL 43 H VAL 43 0.295 -14.269 2.387
328 HA VAL 43 HA VAL 43 -1.357 -12.775 0.862
329 HB VAL 43 HB VAL 43 -2.384 -15.034 2.577
330 HG11 VAL 43 1HG1 VAL 43 -3.790 -15.450 0.571
331 HG12 VAL 43 2HG1 VAL 43 -3.096 -14.021 -0.192
332 HG13 VAL 43 3HG1 VAL 43 -4.083 -13.852 1.259
333 HG21 VAL 43 3HG2 VAL 43 -0.679 -15.034 0.074
334 HG22 VAL 43 1HG2 VAL 43 -1.621 -16.435 0.586
335 HG23 VAL 43 2HG2 VAL 43 -0.330 -15.817 1.616
336 H MET 44 H MET 44 -2.703 -11.111 1.156
337 HA MET 44 HA MET 44 -3.834 -10.651 3.863
338 HB2 MET 44 2HB MET 44 -3.705 -8.638 1.622
339 HB3 MET 44 1HB MET 44 -3.983 -8.341 3.323
340 HG2 MET 44 2HG MET 44 -1.700 -8.875 3.863
341 HG3 MET 44 1HG MET 44 -1.393 -9.476 2.236
342 HE1 MET 44 3HE MET 44 -0.973 -6.568 0.000
343 HE2 MET 44 1HE MET 44 -2.580 -7.273 0.177
344 HE3 MET 44 2HE MET 44 -1.154 -8.300 0.253
345 H GLU 45 H GLU 45 -6.045 -10.589 4.085
346 HA GLU 45 HA GLU 45 -7.662 -11.073 1.631
347 HB2 GLU 45 2HB GLU 45 -7.470 -13.019 3.200
348 HB3 GLU 45 1HB GLU 45 -8.266 -12.036 4.433
349 HG2 GLU 45 2HG GLU 45 -10.238 -11.785 3.029
350 HG3 GLU 45 1HG GLU 45 -9.440 -12.632 1.702
351 H THR 46 H THR 46 -9.052 -9.519 1.149
352 HA THR 46 HA THR 46 -9.592 -7.370 2.980
353 HB THR 46 HB THR 46 -10.837 -6.385 1.194
354 HG1 THR 46 1HG THR 46 -12.000 -7.624 -0.007
355 HG21 THR 46 3HG2 THR 46 -9.234 -6.502 -0.645
356 HG22 THR 46 1HG2 THR 46 -8.585 -8.015 -0.010
357 HG23 THR 46 2HG2 THR 46 -8.376 -6.519 0.897
358 H ARG 47 H ARG 47 -11.921 -6.640 3.304
359 HA ARG 47 HA ARG 47 -13.307 -8.577 4.813
360 HB2 ARG 47 2HB ARG 47 -15.169 -6.888 4.803
361 HB3 ARG 47 1HB ARG 47 -13.608 -6.240 5.313
362 HG2 ARG 47 2HG ARG 47 -13.226 -5.428 2.985
363 HG3 ARG 47 1HG ARG 47 -14.845 -5.984 2.556
364 HD2 ARG 47 2HD ARG 47 -15.834 -4.482 4.209
365 HD3 ARG 47 1HD ARG 47 -14.235 -3.974 4.741
366 HE ARG 47 HE ARG 47 -14.442 -3.496 1.973
367 HH11 ARG 47 1HH2 ARG 47 -15.765 -2.452 4.995
368 HH12 ARG 47 2HH2 ARG 47 -16.096 -0.842 4.450
369 HH21 ARG 47 1HH1 ARG 47 -14.875 -1.387 1.252
370 HH22 ARG 47 2HH1 ARG 47 -15.593 -0.238 2.332
371 H ASP 48 H ASP 48 -13.683 -7.437 1.496
372 HA ASP 48 HA ASP 48 -16.116 -8.865 0.993
373 HB2 ASP 48 2HB ASP 48 -14.061 -7.790 -0.956
374 HB3 ASP 48 1HB ASP 48 -15.702 -8.306 -1.358
375 H GLY 49 H GLY 49 -12.992 -9.884 1.506
376 HA2 GLY 49 2HA GLY 49 -12.199 -12.078 1.478
377 HA3 GLY 49 1HA GLY 49 -13.582 -12.546 0.490
378 H THR 50 H THR 50 -11.468 -9.839 -0.285
379 HA THR 50 HA THR 50 -10.816 -11.096 -2.846
380 HB THR 50 HB THR 50 -10.015 -8.365 -1.825
381 HG1 THR 50 1HG THR 50 -12.309 -9.280 -3.200
382 HG21 THR 50 3HG2 THR 50 -9.738 -7.866 -4.202
383 HG22 THR 50 1HG2 THR 50 -10.271 -9.494 -4.624
384 HG23 THR 50 2HG2 THR 50 -8.750 -9.260 -3.763
385 H LYS 51 H LYS 51 -9.085 -12.356 -2.998
386 HA LYS 51 HA LYS 51 -7.009 -12.361 -1.011
387 HB2 LYS 51 2HB LYS 51 -7.720 -14.427 -2.142
388 HB3 LYS 51 1HB LYS 51 -7.161 -13.776 -3.685
389 HG2 LYS 51 2HG LYS 51 -4.886 -13.784 -2.983
390 HG3 LYS 51 1HG LYS 51 -5.330 -14.023 -1.293
391 HD2 LYS 51 2HD LYS 51 -4.538 -16.137 -2.211
392 HD3 LYS 51 1HD LYS 51 -6.269 -16.257 -1.897
393 HE2 LYS 51 2HE LYS 51 -6.813 -16.035 -4.198
394 HE3 LYS 51 1HE LYS 51 -5.200 -15.449 -4.605
395 HZ1 LYS 51 3HZ LYS 51 -4.841 -17.573 -5.161
396 HZ2 LYS 51 1HZ LYS 51 -6.147 -18.155 -4.250
397 HZ3 LYS 51 2HZ LYS 51 -4.662 -17.828 -3.491
398 H ILE 52 H ILE 52 -5.467 -10.890 -0.929
399 HA ILE 52 HA ILE 52 -4.136 -10.039 -3.431
400 HB ILE 52 HB ILE 52 -3.886 -7.750 -2.169
401 HG12 ILE 52 2HG1 ILE 52 -6.542 -8.629 -1.020
402 HG13 ILE 52 1HG1 ILE 52 -5.051 -8.793 -0.115
403 HG21 ILE 52 1HG2 ILE 52 -5.927 -6.927 -3.225
404 HG22 ILE 52 2HG2 ILE 52 -6.551 -8.574 -3.340
405 HG23 ILE 52 3HG2 ILE 52 -5.135 -8.100 -4.282
406 HD11 ILE 52 3HD1 ILE 52 -6.088 -6.675 0.460
407 HD12 ILE 52 1HD1 ILE 52 -6.203 -6.236 -1.240
408 HD13 ILE 52 2HD1 ILE 52 -4.625 -6.351 -0.462
409 H ILE 53 H ILE 53 -2.103 -10.630 -3.313
410 HA ILE 53 HA ILE 53 -0.847 -11.216 -0.755
411 HB ILE 53 HB ILE 53 0.273 -11.436 -3.554
412 HG12 ILE 53 2HG1 ILE 53 -0.924 -13.593 -1.788
413 HG13 ILE 53 1HG1 ILE 53 -1.804 -12.804 -3.100
414 HG21 ILE 53 1HG2 ILE 53 2.014 -11.383 -1.855
415 HG22 ILE 53 2HG2 ILE 53 1.831 -13.042 -2.425
416 HG23 ILE 53 3HG2 ILE 53 1.142 -12.561 -0.875
417 HD11 ILE 53 3HD1 ILE 53 -0.006 -13.524 -4.680
418 HD12 ILE 53 1HD1 ILE 53 -0.845 -14.883 -3.931
419 HD13 ILE 53 2HD1 ILE 53 0.755 -14.410 -3.358
420 H MET 54 H MET 54 0.875 -10.166 0.145
421 HA MET 54 HA MET 54 1.171 -7.394 -0.411
422 HB2 MET 54 2HB MET 54 1.569 -8.451 1.826
423 HB3 MET 54 1HB MET 54 3.035 -9.181 1.176
424 HG2 MET 54 2HG MET 54 3.845 -7.213 2.182
425 HG3 MET 54 1HG MET 54 3.676 -6.745 0.507
426 HE1 MET 54 3HE MET 54 3.816 -4.179 1.625
427 HE2 MET 54 1HE MET 54 2.273 -3.445 1.170
428 HE3 MET 54 2HE MET 54 3.074 -4.559 0.072
429 H LYS 55 H LYS 55 1.641 -7.402 -2.680
430 HA LYS 55 HA LYS 55 3.957 -8.645 -3.772
431 HB2 LYS 55 2HB LYS 55 1.944 -7.817 -5.076
432 HB3 LYS 55 1HB LYS 55 2.540 -6.180 -4.817
433 HG2 LYS 55 2HG LYS 55 4.447 -6.520 -6.142
434 HG3 LYS 55 1HG LYS 55 4.360 -8.273 -6.009
435 HD2 LYS 55 2HD LYS 55 3.651 -7.641 -8.239
436 HD3 LYS 55 1HD LYS 55 2.238 -8.211 -7.353
437 HE2 LYS 55 2HE LYS 55 1.816 -6.100 -8.638
438 HE3 LYS 55 1HE LYS 55 1.537 -5.924 -6.907
439 HZ1 LYS 55 3HZ LYS 55 2.836 -4.089 -7.850
440 HZ2 LYS 55 1HZ LYS 55 4.048 -5.183 -8.306
441 HZ3 LYS 55 2HZ LYS 55 3.701 -4.939 -6.660
442 H GLY 56 H GLY 56 3.302 -5.185 -3.392
443 HA2 GLY 56 2HA GLY 56 6.067 -4.468 -3.490
444 HA3 GLY 56 1HA GLY 56 4.717 -3.400 -3.149
445 H ASN 57 H ASN 57 6.789 -5.870 -1.641
446 HA ASN 57 HA ASN 57 5.948 -5.236 1.023
447 HB2 ASN 57 2HB ASN 57 6.934 -7.408 0.544
448 HB3 ASN 57 1HB ASN 57 8.433 -6.641 0.014
449 HD21 ASN 57 1HD2 ASN 57 6.671 -5.328 2.773
450 HD22 ASN 57 2HD2 ASN 57 7.788 -5.833 3.956
451 H GLU 58 H GLU 58 7.770 -3.582 -1.230
452 HA GLU 58 HA GLU 58 9.688 -2.366 0.550
453 HB2 GLU 58 2HB GLU 58 8.785 -1.535 -2.221
454 HB3 GLU 58 1HB GLU 58 10.196 -0.913 -1.363
455 HG2 GLU 58 2HG GLU 58 11.203 -3.137 -1.328
456 HG3 GLU 58 1HG GLU 58 9.767 -3.825 -2.088
457 H ILE 59 H ILE 59 8.069 -1.758 2.187
458 HA ILE 59 HA ILE 59 6.094 0.224 1.626
459 HB ILE 59 HB ILE 59 5.990 0.425 4.119
460 HG12 ILE 59 2HG1 ILE 59 8.115 -1.741 4.077
461 HG13 ILE 59 1HG1 ILE 59 8.471 -0.047 4.423
462 HG21 ILE 59 1HG2 ILE 59 6.099 -2.450 3.160
463 HG22 ILE 59 2HG2 ILE 59 4.778 -1.346 2.771
464 HG23 ILE 59 3HG2 ILE 59 5.092 -1.791 4.449
465 HD11 ILE 59 3HD1 ILE 59 8.026 -1.634 6.430
466 HD12 ILE 59 1HD1 ILE 59 6.331 -1.517 5.963
467 HD13 ILE 59 2HD1 ILE 59 7.219 -0.066 6.420
468 H PHE 60 H PHE 60 9.456 0.360 1.909
469 HA PHE 60 HA PHE 60 10.012 2.730 3.217
470 HB2 PHE 60 2HB PHE 60 11.719 1.192 2.279
471 HB3 PHE 60 1HB PHE 60 11.310 1.760 0.659
472 HD1 PHE 60 2HD PHE 60 12.862 2.650 3.880
473 HD2 PHE 60 1HD PHE 60 11.886 4.017 -0.073
474 HE1 PHE 60 2HE PHE 60 14.381 4.587 4.175
475 HE2 PHE 60 1HE PHE 60 13.406 5.955 0.223
476 HZ PHE 60 HZ PHE 60 14.653 6.240 2.347
477 H ARG 61 H ARG 61 8.523 2.249 0.090
478 HA ARG 61 HA ARG 61 8.912 4.720 -1.115
479 HB2 ARG 61 2HB ARG 61 6.355 3.103 -1.156
480 HB3 ARG 61 1HB ARG 61 6.870 4.283 -2.360
481 HG2 ARG 61 2HG ARG 61 8.434 1.778 -1.668
482 HG3 ARG 61 1HG ARG 61 7.316 1.895 -3.026
483 HD2 ARG 61 2HD ARG 61 8.744 3.985 -3.697
484 HD3 ARG 61 1HD ARG 61 9.955 3.287 -2.626
485 HE ARG 61 HE ARG 61 10.369 1.704 -4.257
486 HH11 ARG 61 1HH2 ARG 61 7.234 3.104 -4.689
487 HH12 ARG 61 2HH2 ARG 61 6.916 2.272 -6.175
488 HH21 ARG 61 1HH1 ARG 61 9.958 0.609 -6.204
489 HH22 ARG 61 2HH1 ARG 61 8.457 0.859 -7.032
490 H LEU 62 H LEU 62 6.348 3.774 1.176
491 HA LEU 62 HA LEU 62 4.894 6.122 1.239
492 HB2 LEU 62 2HB LEU 62 4.134 4.185 2.457
493 HB3 LEU 62 1HB LEU 62 5.565 4.207 3.484
494 HG LEU 62 HG LEU 62 4.870 6.281 4.526
495 HD11 LEU 62 1HD1 LEU 62 2.534 7.181 3.832
496 HD12 LEU 62 2HD1 LEU 62 2.780 6.267 2.346
497 HD13 LEU 62 3HD1 LEU 62 3.900 7.555 2.784
498 HD21 LEU 62 3HD2 LEU 62 2.370 4.594 4.310
499 HD22 LEU 62 1HD2 LEU 62 2.950 5.508 5.703
500 HD23 LEU 62 2HD2 LEU 62 3.796 4.047 5.193
501 H ASP 63 H ASP 63 7.717 5.279 3.247
502 HA ASP 63 HA ASP 63 7.890 7.745 4.606
503 HB2 ASP 63 2HB ASP 63 10.089 5.777 3.938
504 HB3 ASP 63 1HB ASP 63 10.193 7.057 5.143
505 H GLU 64 H GLU 64 7.679 9.468 3.176
506 HA GLU 64 HA GLU 64 8.339 11.056 1.649
507 HB2 GLU 64 2HB GLU 64 11.074 9.993 2.404
508 HB3 GLU 64 1HB GLU 64 10.759 11.523 1.585
509 HG2 GLU 64 2HG GLU 64 9.609 10.796 4.290
510 HG3 GLU 64 1HG GLU 64 11.078 11.745 4.073
511 H ALA 65 H ALA 65 10.224 11.246 -0.259
512 HA ALA 65 HA ALA 65 10.638 8.861 -1.770
513 HB1 ALA 65 1HB ALA 65 8.417 10.704 -2.686
514 HB2 ALA 65 2HB ALA 65 8.232 9.033 -2.156
515 HB3 ALA 65 3HB ALA 65 9.109 9.394 -3.643
516 H LEU 66 H LEU 66 11.528 9.351 -3.949
517 HA LEU 66 HA LEU 66 13.255 11.689 -3.797
518 HB2 LEU 66 2HB LEU 66 14.114 10.662 -6.025
519 HB3 LEU 66 1HB LEU 66 14.440 9.802 -4.522
520 HG LEU 66 HG LEU 66 11.878 9.132 -5.940
521 HD11 LEU 66 1HD1 LEU 66 13.012 7.549 -7.435
522 HD12 LEU 66 2HD1 LEU 66 14.582 8.110 -6.861
523 HD13 LEU 66 3HD1 LEU 66 13.539 9.197 -7.776
524 HD21 LEU 66 3HD2 LEU 66 13.919 7.234 -4.770
525 HD22 LEU 66 1HD2 LEU 66 12.174 7.026 -4.920
526 HD23 LEU 66 2HD2 LEU 66 12.831 8.136 -3.720
527 H ARG 67 H ARG 67 10.185 11.164 -4.869
528 HA ARG 67 HA ARG 67 8.762 12.278 -6.286
529 HB2 ARG 67 2HB ARG 67 9.711 14.223 -5.028
530 HB3 ARG 67 1HB ARG 67 10.918 14.400 -6.300
531 HG2 ARG 67 2HG ARG 67 9.195 14.790 -7.962
532 HG3 ARG 67 1HG ARG 67 7.927 14.446 -6.785
533 HD2 ARG 67 2HD ARG 67 8.148 16.856 -7.009
534 HD3 ARG 67 1HD ARG 67 8.735 16.376 -5.419
535 HE ARG 67 HE ARG 67 10.893 16.412 -7.257
536 HH11 ARG 67 1HH2 ARG 67 8.696 18.481 -5.565
537 HH12 ARG 67 2HH2 ARG 67 9.789 19.822 -5.502
538 HH21 ARG 67 1HH1 ARG 67 12.333 18.167 -7.180
539 HH22 ARG 67 2HH1 ARG 67 11.849 19.645 -6.416
540 H LYS 68 H LYS 68 9.322 10.541 -7.842
541 HA LYS 68 HA LYS 68 11.268 10.891 -9.866
542 HB2 LYS 68 2HB LYS 68 9.854 9.205 -11.116
543 HB3 LYS 68 1HB LYS 68 10.373 8.701 -9.508
544 HG2 LYS 68 2HG LYS 68 8.233 9.141 -8.564
545 HG3 LYS 68 1HG LYS 68 7.712 10.053 -9.982
546 HD2 LYS 68 2HD LYS 68 6.734 7.757 -9.910
547 HD3 LYS 68 1HD LYS 68 7.731 8.024 -11.340
548 HE2 LYS 68 2HE LYS 68 8.086 5.820 -10.030
549 HE3 LYS 68 1HE LYS 68 9.519 6.743 -10.482
550 HZ1 LYS 68 3HZ LYS 68 9.414 7.798 -8.261
551 HZ2 LYS 68 1HZ LYS 68 9.705 6.128 -8.201
552 HZ3 LYS 68 2HZ LYS 68 8.158 6.733 -7.845
553 H GLY 69 H GLY 69 10.437 10.880 -12.275
554 HA2 GLY 69 2HA GLY 69 9.448 13.491 -12.805
555 HA3 GLY 69 1HA GLY 69 9.718 12.226 -14.001
556 H HIS 70 H HIS 70 7.802 10.874 -11.708
557 HA HIS 70 HA HIS 70 5.627 10.103 -11.859
558 HB2 HIS 70 2HB HIS 70 3.985 11.851 -11.514
559 HB3 HIS 70 1HB HIS 70 5.446 12.255 -10.612
560 HD2 HIS 70 2HD HIS 70 6.802 14.563 -11.521
561 HE1 HIS 70 1HE HIS 70 4.103 15.504 -14.629
562 HE2 HIS 70 2HE HIS 70 6.108 16.335 -13.310
563 H SER 71 H SER 71 7.043 10.283 -14.425
564 HA SER 71 HA SER 71 4.800 9.866 -16.152
565 HB2 SER 71 2HB SER 71 6.492 12.336 -16.585
566 HB3 SER 71 1HB SER 71 5.403 11.657 -17.790
567 HG SER 71 HG SER 71 4.862 13.029 -15.438
568 H GLU 72 H GLU 72 7.896 11.233 -17.142
569 HA GLU 72 HA GLU 72 8.468 9.081 -18.900
570 HB2 GLU 72 2HB GLU 72 10.330 11.193 -17.786
571 HB3 GLU 72 1HB GLU 72 10.651 10.169 -19.186
572 HG2 GLU 72 2HG GLU 72 8.278 12.040 -18.972
573 HG3 GLU 72 1HG GLU 72 9.787 12.456 -19.782
574 H GLY 73 H GLY 73 10.101 7.491 -18.771
575 HA2 GLY 73 2HA GLY 73 11.319 5.830 -17.746
576 HA3 GLY 73 1HA GLY 73 11.771 7.039 -16.549
577 H GLY 74 H GLY 74 8.602 5.647 -17.388
578 HA2 GLY 74 2HA GLY 74 7.670 5.493 -14.744
579 HA3 GLY 74 1HA GLY 74 7.015 4.587 -16.104
580 H1 HOH 201 H2 HOH 77 1.293 12.608 -15.285
581 H2 HOH 201 H1 HOH 77 2.335 11.773 -14.573
Start of MODEL 2
1 H1 VAL 1 1H VAL 1 -2.090 15.335 -6.521
2 H2 VAL 1 2H VAL 1 -1.288 14.628 -5.202
3 HA VAL 1 HA VAL 1 -3.511 13.627 -5.928
4 HB VAL 1 HB VAL 1 -3.040 14.464 -3.049
5 HG11 VAL 1 2HG1 VAL 1 -4.629 12.201 -4.297
6 HG12 VAL 1 3HG1 VAL 1 -5.271 13.543 -3.349
7 HG13 VAL 1 1HG1 VAL 1 -4.260 12.322 -2.575
8 HG21 VAL 1 1HG2 VAL 1 -1.060 13.385 -3.898
9 HG22 VAL 1 2HG2 VAL 1 -2.014 12.154 -4.722
10 HG23 VAL 1 3HG2 VAL 1 -1.938 12.176 -2.960
11 H ASP 2 H ASP 2 -4.778 15.163 -7.121
12 HA ASP 2 HA ASP 2 -6.913 16.331 -5.528
13 HB2 ASP 2 2HB ASP 2 -5.443 18.123 -7.463
14 HB3 ASP 2 1HB ASP 2 -6.674 18.568 -6.282
15 H MET 3 H MET 3 -5.724 16.932 -8.831
16 HA MET 3 HA MET 3 -8.262 16.687 -10.033
17 HB2 MET 3 2HB MET 3 -5.510 16.356 -11.254
18 HB3 MET 3 1HB MET 3 -7.009 16.568 -12.163
19 HG2 MET 3 2HG MET 3 -7.370 18.736 -10.966
20 HG3 MET 3 1HG MET 3 -5.792 18.537 -10.203
21 HE1 MET 3 3HE MET 3 -6.362 21.015 -11.483
22 HE2 MET 3 1HE MET 3 -5.173 21.364 -12.746
23 HE3 MET 3 2HE MET 3 -4.647 20.746 -11.182
24 H SER 4 H SER 4 -5.528 14.395 -9.944
25 HA SER 4 HA SER 4 -6.972 12.292 -11.229
26 HB2 SER 4 2HB SER 4 -4.478 12.171 -9.518
27 HB3 SER 4 1HB SER 4 -5.075 10.881 -10.558
28 HG SER 4 HG SER 4 -4.114 11.856 -12.140
29 H ASN 5 H ASN 5 -5.979 12.819 -7.842
30 HA ASN 5 HA ASN 5 -6.777 11.946 -5.870
31 HB2 ASN 5 2HB ASN 5 -8.780 13.224 -6.650
32 HB3 ASN 5 1HB ASN 5 -9.380 11.746 -7.399
33 HD21 ASN 5 1HD2 ASN 5 -8.409 13.097 -4.215
34 HD22 ASN 5 2HD2 ASN 5 -9.403 12.065 -3.307
35 H VAL 6 H VAL 6 -6.228 10.139 -8.455
36 HA VAL 6 HA VAL 6 -7.621 7.710 -7.925
37 HB VAL 6 HB VAL 6 -6.562 8.275 -10.110
38 HG11 VAL 6 1HG1 VAL 6 -4.184 8.168 -10.381
39 HG12 VAL 6 2HG1 VAL 6 -3.960 7.561 -8.739
40 HG13 VAL 6 3HG1 VAL 6 -4.475 9.228 -9.001
41 HG21 VAL 6 3HG2 VAL 6 -7.103 5.918 -9.401
42 HG22 VAL 6 1HG2 VAL 6 -5.435 5.756 -8.850
43 HG23 VAL 6 2HG2 VAL 6 -5.778 6.022 -10.559
44 H VAL 7 H VAL 7 -7.108 6.001 -6.653
45 HA VAL 7 HA VAL 7 -4.529 5.500 -5.573
46 HB VAL 7 HB VAL 7 -4.997 7.463 -4.200
47 HG11 VAL 7 1HG1 VAL 7 -7.443 5.970 -3.216
48 HG12 VAL 7 2HG1 VAL 7 -7.508 7.251 -4.427
49 HG13 VAL 7 3HG1 VAL 7 -6.950 7.609 -2.794
50 HG21 VAL 7 3HG2 VAL 7 -5.468 4.991 -2.516
51 HG22 VAL 7 1HG2 VAL 7 -4.613 6.464 -2.057
52 HG23 VAL 7 2HG2 VAL 7 -3.903 5.364 -3.238
53 H LYS 8 H LYS 8 -4.431 3.524 -4.518
54 HA LYS 8 HA LYS 8 -6.876 1.884 -4.699
55 HB2 LYS 8 2HB LYS 8 -4.748 1.167 -5.842
56 HB3 LYS 8 1HB LYS 8 -4.018 0.996 -4.251
57 HG2 LYS 8 2HG LYS 8 -5.038 -1.017 -3.879
58 HG3 LYS 8 1HG LYS 8 -6.611 -0.400 -4.384
59 HD2 LYS 8 2HD LYS 8 -4.473 -1.071 -6.416
60 HD3 LYS 8 1HD LYS 8 -5.558 -2.305 -5.786
61 HE2 LYS 8 2HE LYS 8 -7.505 -0.912 -6.490
62 HE3 LYS 8 1HE LYS 8 -6.380 0.239 -7.215
63 HZ1 LYS 8 3HZ LYS 8 -5.752 -1.252 -8.828
64 HZ2 LYS 8 1HZ LYS 8 -7.401 -1.615 -8.663
65 HZ3 LYS 8 2HZ LYS 8 -6.234 -2.611 -7.930
66 H THR 9 H THR 9 -7.635 0.683 -2.959
67 HA THR 9 HA THR 9 -6.289 0.827 -0.383
68 HB THR 9 HB THR 9 -9.077 1.961 -0.655
69 HG1 THR 9 1HG THR 9 -8.194 3.838 -0.949
70 HG21 THR 9 3HG2 THR 9 -8.487 0.944 1.524
71 HG22 THR 9 1HG2 THR 9 -8.676 2.693 1.652
72 HG23 THR 9 2HG2 THR 9 -7.062 1.983 1.610
73 H TYR 10 H TYR 10 -6.329 -1.258 0.163
74 HA TYR 10 HA TYR 10 -8.770 -2.850 -0.343
75 HB2 TYR 10 2HB TYR 10 -5.897 -3.628 0.194
76 HB3 TYR 10 1HB TYR 10 -7.217 -4.787 0.240
77 HD1 TYR 10 2HD TYR 10 -8.904 -4.486 -1.921
78 HD2 TYR 10 1HD TYR 10 -4.703 -3.560 -1.818
79 HE1 TYR 10 2HE TYR 10 -8.787 -4.717 -4.382
80 HE2 TYR 10 1HE TYR 10 -4.594 -3.799 -4.278
81 HH TYR 10 HH TYR 10 -7.223 -5.111 -6.116
82 H ASP 11 H ASP 11 -10.129 -2.969 1.327
83 HA ASP 11 HA ASP 11 -9.348 -2.315 4.001
84 HB2 ASP 11 2HB ASP 11 -11.881 -3.450 2.818
85 HB3 ASP 11 1HB ASP 11 -11.687 -3.102 4.536
86 H LEU 12 H LEU 12 -7.780 -3.741 4.683
87 HA LEU 12 HA LEU 12 -8.006 -6.582 4.486
88 HB2 LEU 12 2HB LEU 12 -6.126 -4.611 5.557
89 HB3 LEU 12 1HB LEU 12 -6.250 -6.008 6.619
90 HG LEU 12 HG LEU 12 -5.652 -7.517 4.826
91 HD11 LEU 12 1HD1 LEU 12 -6.241 -5.159 3.100
92 HD12 LEU 12 2HD1 LEU 12 -6.494 -6.877 2.793
93 HD13 LEU 12 3HD1 LEU 12 -4.894 -6.180 2.593
94 HD21 LEU 12 3HD2 LEU 12 -3.403 -6.305 4.074
95 HD22 LEU 12 1HD2 LEU 12 -3.655 -6.767 5.756
96 HD23 LEU 12 2HD2 LEU 12 -3.909 -5.096 5.248
97 H GLN 13 H GLN 13 -8.170 -8.054 6.319
98 HA GLN 13 HA GLN 13 -10.451 -7.385 7.964
99 HB2 GLN 13 2HB GLN 13 -8.734 -9.857 7.690
100 HB3 GLN 13 1HB GLN 13 -10.059 -9.736 8.852
101 HG2 GLN 13 2HG GLN 13 -11.647 -9.294 7.053
102 HG3 GLN 13 1HG GLN 13 -10.342 -9.291 5.867
103 HE21 GLN 13 1HE2 GLN 13 -8.857 -11.551 6.791
104 HE22 GLN 13 2HE2 GLN 13 -9.816 -12.943 6.583
105 H ASP 14 H ASP 14 -7.054 -7.201 8.269
106 HA ASP 14 HA ASP 14 -6.983 -7.430 11.160
107 HB2 ASP 14 2HB ASP 14 -4.885 -6.486 9.190
108 HB3 ASP 14 1HB ASP 14 -4.614 -6.798 10.906
109 H GLY 15 H GLY 15 -8.514 -5.272 9.511
110 HA2 GLY 15 2HA GLY 15 -9.251 -3.150 10.080
111 HA3 GLY 15 1HA GLY 15 -8.108 -3.155 11.424
112 H SER 16 H SER 16 -6.120 -4.008 9.126
113 HA SER 16 HA SER 16 -5.073 -1.350 8.739
114 HB2 SER 16 2HB SER 16 -4.109 -3.888 7.421
115 HB3 SER 16 1HB SER 16 -3.193 -2.414 7.736
116 HG SER 16 HG SER 16 -3.821 -2.918 10.042
117 H LYS 17 H LYS 17 -4.126 -1.059 6.334
118 HA LYS 17 HA LYS 17 -6.090 -1.737 4.284
119 HB2 LYS 17 2HB LYS 17 -5.572 1.108 5.178
120 HB3 LYS 17 1HB LYS 17 -6.337 0.687 3.647
121 HG2 LYS 17 2HG LYS 17 -8.031 -0.652 4.990
122 HG3 LYS 17 1HG LYS 17 -7.351 0.094 6.434
123 HD2 LYS 17 2HD LYS 17 -8.477 1.626 4.072
124 HD3 LYS 17 1HD LYS 17 -9.346 1.322 5.576
125 HE2 LYS 17 2HE LYS 17 -7.298 2.419 6.739
126 HE3 LYS 17 1HE LYS 17 -6.901 3.033 5.134
127 HZ1 LYS 17 3HZ LYS 17 -8.415 4.603 5.388
128 HZ2 LYS 17 1HZ LYS 17 -8.773 4.032 6.944
129 HZ3 LYS 17 2HZ LYS 17 -9.633 3.438 5.604
130 H VAL 18 H VAL 18 -4.983 -2.236 2.511
131 HA VAL 18 HA VAL 18 -2.179 -1.583 2.309
132 HB VAL 18 HB VAL 18 -3.721 -2.769 0.025
133 HG11 VAL 18 1HG1 VAL 18 -1.675 -3.966 -0.365
134 HG12 VAL 18 2HG1 VAL 18 -1.040 -3.503 1.215
135 HG13 VAL 18 3HG1 VAL 18 -1.244 -2.285 -0.045
136 HG21 VAL 18 3HG2 VAL 18 -2.882 -4.341 2.477
137 HG22 VAL 18 1HG2 VAL 18 -3.635 -4.990 1.016
138 HG23 VAL 18 2HG2 VAL 18 -4.549 -3.925 2.081
139 H HIS 19 H HIS 19 -1.207 -0.413 0.587
140 HA HIS 19 HA HIS 19 -2.930 1.309 -1.059
141 HB2 HIS 19 2HB HIS 19 -2.632 2.908 0.594
142 HB3 HIS 19 1HB HIS 19 -1.127 2.192 1.158
143 HD1 HIS 19 1HD HIS 19 -2.495 4.543 -1.449
144 HD2 HIS 19 2HD HIS 19 1.203 3.140 -0.130
145 HE1 HIS 19 1HE HIS 19 -0.741 5.997 -2.557
146 HE2 HIS 19 2HE HIS 19 1.520 5.156 -1.763
147 H VAL 20 H VAL 20 -2.224 0.986 -3.108
148 HA VAL 20 HA VAL 20 0.575 0.191 -3.510
149 HB VAL 20 HB VAL 20 -0.056 -0.861 -5.475
150 HG11 VAL 20 1HG1 VAL 20 -1.711 -2.313 -4.824
151 HG12 VAL 20 2HG1 VAL 20 -2.849 -1.019 -4.479
152 HG13 VAL 20 3HG1 VAL 20 -1.616 -1.428 -3.302
153 HG21 VAL 20 3HG2 VAL 20 -2.308 -0.195 -6.628
154 HG22 VAL 20 1HG2 VAL 20 -0.907 0.859 -6.820
155 HG23 VAL 20 2HG2 VAL 20 -2.173 1.276 -5.663
156 H PHE 21 H PHE 21 1.968 1.210 -4.920
157 HA PHE 21 HA PHE 21 1.519 4.074 -5.214
158 HB2 PHE 21 2HB PHE 21 3.909 2.309 -5.782
159 HB3 PHE 21 1HB PHE 21 3.895 4.060 -5.992
160 HD1 PHE 21 1HD PHE 21 3.537 1.322 -3.509
161 HD2 PHE 21 2HD PHE 21 4.051 5.542 -4.117
162 HE1 PHE 21 1HE PHE 21 4.015 1.612 -1.092
163 HE2 PHE 21 2HE PHE 21 4.527 5.833 -1.701
164 HZ PHE 21 HZ PHE 21 4.510 3.867 -0.189
165 H LYS 22 H LYS 22 2.996 4.663 -7.447
166 HA LYS 22 HA LYS 22 1.109 4.095 -9.549
167 HB2 LYS 22 2HB LYS 22 3.738 5.600 -9.575
168 HB3 LYS 22 1HB LYS 22 2.593 5.540 -10.917
169 HG2 LYS 22 2HG LYS 22 0.923 6.705 -9.687
170 HG3 LYS 22 1HG LYS 22 1.769 6.458 -8.157
171 HD2 LYS 22 2HD LYS 22 2.115 8.756 -8.900
172 HD3 LYS 22 1HD LYS 22 3.639 7.877 -9.010
173 HE2 LYS 22 2HE LYS 22 3.472 7.665 -11.371
174 HE3 LYS 22 1HE LYS 22 1.765 8.109 -11.369
175 HZ1 LYS 22 3HZ LYS 22 2.250 10.276 -11.319
176 HZ2 LYS 22 1HZ LYS 22 3.794 9.809 -11.849
177 HZ3 LYS 22 2HZ LYS 22 3.510 10.084 -10.196
178 H ASP 23 H ASP 23 4.080 2.755 -8.444
179 HA ASP 23 HA ASP 23 4.854 1.553 -10.948
180 HB2 ASP 23 2HB ASP 23 6.501 2.096 -9.180
181 HB3 ASP 23 1HB ASP 23 5.742 0.900 -8.129
182 H GLY 24 H GLY 24 2.307 0.995 -8.975
183 HA2 GLY 24 2HA GLY 24 0.730 -0.718 -9.137
184 HA3 GLY 24 1HA GLY 24 1.900 -1.686 -10.031
185 H LYS 25 H LYS 25 3.830 -0.876 -7.698
186 HA LYS 25 HA LYS 25 3.621 -3.316 -6.246
187 HB2 LYS 25 2HB LYS 25 5.117 -0.727 -5.773
188 HB3 LYS 25 1HB LYS 25 5.277 -2.115 -4.708
189 HG2 LYS 25 2HG LYS 25 5.622 -2.525 -7.662
190 HG3 LYS 25 1HG LYS 25 6.940 -1.793 -6.759
191 HD2 LYS 25 2HD LYS 25 5.672 -4.313 -5.703
192 HD3 LYS 25 1HD LYS 25 6.815 -4.425 -7.038
193 HE2 LYS 25 2HE LYS 25 8.580 -3.483 -5.756
194 HE3 LYS 25 1HE LYS 25 7.475 -2.900 -4.512
195 HZ1 LYS 25 3HZ LYS 25 7.532 -4.851 -3.481
196 HZ2 LYS 25 1HZ LYS 25 8.840 -5.263 -4.479
197 HZ3 LYS 25 2HZ LYS 25 7.263 -5.720 -4.915
198 H MET 26 H MET 26 2.791 -3.727 -4.204
199 HA MET 26 HA MET 26 0.616 -2.040 -3.350
200 HB2 MET 26 2HB MET 26 1.612 -4.757 -2.712
201 HB3 MET 26 1HB MET 26 0.812 -3.930 -1.375
202 HG2 MET 26 2HG MET 26 -1.180 -3.605 -2.660
203 HG3 MET 26 1HG MET 26 -0.387 -4.125 -4.146
204 HE1 MET 26 3HE MET 26 -1.678 -5.880 -4.985
205 HE2 MET 26 1HE MET 26 -1.529 -7.553 -4.426
206 HE3 MET 26 2HE MET 26 -0.089 -6.640 -4.874
207 H GLY 27 H GLY 27 0.538 -2.064 -0.690
208 HA2 GLY 27 2HA GLY 27 3.044 -1.246 0.507
209 HA3 GLY 27 1HA GLY 27 1.940 0.093 0.208
210 H MET 28 H MET 28 2.927 -1.949 2.529
211 HA MET 28 HA MET 28 0.341 -2.535 3.735
212 HB2 MET 28 2HB MET 28 2.377 -4.070 3.793
213 HB3 MET 28 1HB MET 28 3.069 -2.942 4.952
214 HG2 MET 28 2HG MET 28 1.963 -4.697 6.186
215 HG3 MET 28 1HG MET 28 1.026 -3.221 6.361
216 HE1 MET 28 3HE MET 28 -0.612 -4.566 7.330
217 HE2 MET 28 1HE MET 28 -1.929 -5.372 6.471
218 HE3 MET 28 2HE MET 28 -1.714 -3.631 6.322
219 H GLU 29 H GLU 29 -0.331 -0.288 3.965
220 HA GLU 29 HA GLU 29 1.041 1.188 6.143
221 HB2 GLU 29 2HB GLU 29 0.740 2.388 3.987
222 HB3 GLU 29 1HB GLU 29 -1.004 2.181 4.143
223 HG2 GLU 29 2HG GLU 29 -1.022 3.461 6.212
224 HG3 GLU 29 1HG GLU 29 0.737 3.569 6.198
225 H ASN 30 H ASN 30 0.173 0.744 8.076
226 HA ASN 30 HA ASN 30 -2.493 -0.233 8.417
227 HB2 ASN 30 2HB ASN 30 -2.011 -0.230 10.766
228 HB3 ASN 30 1HB ASN 30 -0.541 -0.736 9.933
229 HD21 ASN 30 1HD2 ASN 30 1.271 0.256 10.808
230 HD22 ASN 30 2HD2 ASN 30 1.312 1.837 11.437
231 H LYS 31 H LYS 31 -4.101 0.822 9.838
232 HA LYS 31 HA LYS 31 -4.509 3.578 8.996
233 HB2 LYS 31 2HB LYS 31 -6.745 3.321 9.689
234 HB3 LYS 31 1HB LYS 31 -6.307 1.743 9.038
235 HG2 LYS 31 2HG LYS 31 -6.436 2.525 11.974
236 HG3 LYS 31 1HG LYS 31 -7.500 1.410 11.125
237 HD2 LYS 31 2HD LYS 31 -5.468 -0.010 10.622
238 HD3 LYS 31 1HD LYS 31 -4.559 1.026 11.722
239 HE2 LYS 31 2HE LYS 31 -7.048 -0.546 12.444
240 HE3 LYS 31 1HE LYS 31 -5.398 -0.986 12.883
241 HZ1 LYS 31 3HZ LYS 31 -5.188 0.978 14.181
242 HZ2 LYS 31 1HZ LYS 31 -6.636 0.224 14.640
243 HZ3 LYS 31 2HZ LYS 31 -6.674 1.587 13.626
244 H PHE 32 H PHE 32 -2.779 2.242 11.413
245 HA PHE 32 HA PHE 32 -3.655 3.894 13.618
246 HB2 PHE 32 2HB PHE 32 -2.467 1.562 13.678
247 HB3 PHE 32 1HB PHE 32 -0.983 2.501 13.500
248 HD1 PHE 32 1HD PHE 32 -4.166 2.515 15.493
249 HD2 PHE 32 2HD PHE 32 0.064 3.270 15.456
250 HE1 PHE 32 1HE PHE 32 -4.238 3.051 17.914
251 HE2 PHE 32 2HE PHE 32 -0.009 3.806 17.875
252 HZ PHE 32 HZ PHE 32 -2.161 3.696 19.105
253 H GLY 33 H GLY 33 -2.336 4.797 10.856
254 HA2 GLY 33 2HA GLY 33 -1.384 6.844 10.288
255 HA3 GLY 33 1HA GLY 33 -1.107 7.162 12.000
256 H LYS 34 H LYS 34 -0.049 4.097 10.977
257 HA LYS 34 HA LYS 34 2.703 5.020 10.431
258 HB2 LYS 34 2HB LYS 34 1.836 3.113 12.609
259 HB3 LYS 34 1HB LYS 34 3.477 3.115 11.959
260 HG2 LYS 34 2HG LYS 34 3.872 5.348 12.680
261 HG3 LYS 34 1HG LYS 34 2.159 5.635 12.980
262 HD2 LYS 34 2HD LYS 34 3.293 5.276 15.109
263 HD3 LYS 34 1HD LYS 34 2.218 3.916 14.786
264 HE2 LYS 34 2HE LYS 34 5.114 3.815 13.946
265 HE3 LYS 34 1HE LYS 34 4.637 3.403 15.592
266 HZ1 LYS 34 3HZ LYS 34 3.880 1.451 14.915
267 HZ2 LYS 34 1HZ LYS 34 4.552 1.760 13.389
268 HZ3 LYS 34 2HZ LYS 34 2.929 2.161 13.697
269 H SER 35 H SER 35 4.055 2.864 9.997
270 HA SER 35 HA SER 35 2.525 1.362 7.951
271 HB2 SER 35 2HB SER 35 5.520 1.698 8.208
272 HB3 SER 35 1HB SER 35 4.648 0.973 6.861
273 HG SER 35 HG SER 35 4.612 3.668 7.746
274 H MET 36 H MET 36 3.437 -0.876 7.548
275 HA MET 36 HA MET 36 4.367 -2.245 9.985
276 HB2 MET 36 2HB MET 36 1.772 -2.756 8.530
277 HB3 MET 36 1HB MET 36 2.583 -4.053 9.409
278 HG2 MET 36 2HG MET 36 2.007 -1.381 10.699
279 HG3 MET 36 1HG MET 36 0.827 -2.694 10.708
280 HE1 MET 36 3HE MET 36 2.124 -2.819 14.323
281 HE2 MET 36 1HE MET 36 0.750 -2.623 13.227
282 HE3 MET 36 2HE MET 36 1.974 -1.362 13.343
283 H ASN 37 H ASN 37 6.152 -3.234 9.343
284 HA ASN 37 HA ASN 37 6.745 -3.838 6.631
285 HB2 ASN 37 2HB ASN 37 8.538 -3.367 8.172
286 HB3 ASN 37 1HB ASN 37 8.060 -4.705 9.210
287 HD21 ASN 37 1HD2 ASN 37 7.658 -5.540 5.926
288 HD22 ASN 37 2HD2 ASN 37 9.112 -6.401 5.725
289 H MET 38 H MET 38 5.239 -5.208 5.729
290 HA MET 38 HA MET 38 4.903 -7.880 6.937
291 HB2 MET 38 2HB MET 38 2.811 -6.787 6.425
292 HB3 MET 38 1HB MET 38 3.333 -6.448 4.774
293 HG2 MET 38 2HG MET 38 3.389 -8.831 4.271
294 HG3 MET 38 1HG MET 38 3.053 -9.223 5.948
295 HE1 MET 38 3HE MET 38 0.784 -9.638 6.874
296 HE2 MET 38 1HE MET 38 -0.599 -8.595 6.509
297 HE3 MET 38 2HE MET 38 0.891 -7.900 7.147
298 HA PRO 39 HA PRO 39 7.847 -9.067 3.717
299 HB2 PRO 39 2HB PRO 39 7.866 -11.774 4.105
300 HB3 PRO 39 1HB PRO 39 8.692 -10.639 5.195
301 HG2 PRO 39 2HG PRO 39 6.040 -11.975 5.520
302 HG3 PRO 39 1HG PRO 39 7.321 -11.708 6.718
303 HD2 PRO 39 2HD PRO 39 5.097 -10.126 6.559
304 HD3 PRO 39 1HD PRO 39 6.657 -9.519 7.133
305 H GLU 40 H GLU 40 7.866 -10.208 1.686
306 HA GLU 40 HA GLU 40 5.342 -10.197 0.370
307 HB2 GLU 40 2HB GLU 40 7.350 -9.588 -0.841
308 HB3 GLU 40 1HB GLU 40 8.061 -11.173 -0.526
309 HG2 GLU 40 2HG GLU 40 6.448 -12.275 -1.899
310 HG3 GLU 40 1HG GLU 40 5.443 -10.828 -2.001
311 H GLY 41 H GLY 41 3.863 -11.710 0.804
312 HA2 GLY 41 2HA GLY 41 3.531 -14.133 -0.075
313 HA3 GLY 41 1HA GLY 41 4.701 -14.514 1.186
314 H LYS 42 H LYS 42 3.426 -12.167 2.748
315 HA LYS 42 HA LYS 42 1.640 -13.815 4.268
316 HB2 LYS 42 2HB LYS 42 2.743 -11.063 4.466
317 HB3 LYS 42 1HB LYS 42 1.216 -11.333 5.298
318 HG2 LYS 42 2HG LYS 42 3.456 -13.320 5.668
319 HG3 LYS 42 1HG LYS 42 3.517 -11.792 6.540
320 HD2 LYS 42 2HD LYS 42 1.523 -12.226 7.715
321 HD3 LYS 42 1HD LYS 42 1.029 -13.492 6.589
322 HE2 LYS 42 2HE LYS 42 2.940 -14.886 7.352
323 HE3 LYS 42 1HE LYS 42 3.365 -13.633 8.519
324 HZ1 LYS 42 3HZ LYS 42 0.636 -14.215 8.778
325 HZ2 LYS 42 1HZ LYS 42 1.876 -14.458 9.910
326 HZ3 LYS 42 2HZ LYS 42 1.492 -15.683 8.797
327 H VAL 43 H VAL 43 0.225 -14.348 2.508
328 HA VAL 43 HA VAL 43 -1.351 -12.794 0.945
329 HB VAL 43 HB VAL 43 -2.394 -15.137 2.544
330 HG11 VAL 43 1HG1 VAL 43 -3.788 -15.450 0.483
331 HG12 VAL 43 2HG1 VAL 43 -3.161 -13.918 -0.125
332 HG13 VAL 43 3HG1 VAL 43 -4.142 -13.949 1.339
333 HG21 VAL 43 3HG2 VAL 43 -1.626 -16.452 0.534
334 HG22 VAL 43 1HG2 VAL 43 -0.305 -15.780 1.489
335 HG23 VAL 43 2HG2 VAL 43 -0.781 -15.008 -0.023
336 H MET 44 H MET 44 -2.708 -11.155 1.247
337 HA MET 44 HA MET 44 -3.902 -10.751 3.935
338 HB2 MET 44 2HB MET 44 -3.695 -8.700 1.732
339 HB3 MET 44 1HB MET 44 -4.020 -8.432 3.429
340 HG2 MET 44 2HG MET 44 -1.768 -8.970 4.030
341 HG3 MET 44 1HG MET 44 -1.417 -9.602 2.424
342 HE1 MET 44 3HE MET 44 -1.556 -8.461 0.398
343 HE2 MET 44 1HE MET 44 -0.967 -6.819 0.122
344 HE3 MET 44 2HE MET 44 -2.680 -7.106 0.384
345 H GLU 45 H GLU 45 -6.103 -10.677 4.133
346 HA GLU 45 HA GLU 45 -7.695 -11.151 1.662
347 HB2 GLU 45 2HB GLU 45 -7.580 -13.070 3.255
348 HB3 GLU 45 1HB GLU 45 -8.332 -12.047 4.481
349 HG2 GLU 45 2HG GLU 45 -10.318 -11.772 3.127
350 HG3 GLU 45 1HG GLU 45 -9.558 -12.598 1.765
351 H THR 46 H THR 46 -9.046 -9.577 1.129
352 HA THR 46 HA THR 46 -9.596 -7.417 2.974
353 HB THR 46 HB THR 46 -10.629 -6.319 1.130
354 HG1 THR 46 1HG THR 46 -11.922 -7.710 0.164
355 HG21 THR 46 3HG2 THR 46 -8.108 -6.773 1.063
356 HG22 THR 46 1HG2 THR 46 -8.867 -6.319 -0.462
357 HG23 THR 46 2HG2 THR 46 -8.474 -8.007 -0.141
358 H ARG 47 H ARG 47 -11.790 -6.658 3.416
359 HA ARG 47 HA ARG 47 -13.402 -8.571 4.636
360 HB2 ARG 47 2HB ARG 47 -14.034 -5.799 3.615
361 HB3 ARG 47 1HB ARG 47 -15.195 -6.770 4.526
362 HG2 ARG 47 2HG ARG 47 -13.565 -6.965 6.380
363 HG3 ARG 47 1HG ARG 47 -12.431 -5.957 5.477
364 HD2 ARG 47 2HD ARG 47 -13.899 -4.065 5.578
365 HD3 ARG 47 1HD ARG 47 -15.230 -5.049 6.182
366 HE ARG 47 HE ARG 47 -14.358 -4.770 8.305
367 HH11 ARG 47 1HH2 ARG 47 -11.910 -4.262 5.912
368 HH12 ARG 47 2HH2 ARG 47 -10.697 -3.787 7.054
369 HH21 ARG 47 1HH1 ARG 47 -12.773 -4.150 9.809
370 HH22 ARG 47 2HH1 ARG 47 -11.185 -3.724 9.261
371 H ASP 48 H ASP 48 -13.538 -7.240 1.369
372 HA ASP 48 HA ASP 48 -15.998 -8.481 0.633
373 HB2 ASP 48 2HB ASP 48 -15.054 -6.547 -0.580
374 HB3 ASP 48 1HB ASP 48 -13.711 -7.556 -1.124
375 H GLY 49 H GLY 49 -13.031 -9.784 1.371
376 HA2 GLY 49 2HA GLY 49 -12.384 -12.017 1.322
377 HA3 GLY 49 1HA GLY 49 -13.765 -12.369 0.284
378 H THR 50 H THR 50 -11.413 -9.838 -0.382
379 HA THR 50 HA THR 50 -10.734 -11.165 -2.916
380 HB THR 50 HB THR 50 -9.878 -8.427 -1.968
381 HG1 THR 50 1HG THR 50 -12.155 -8.625 -1.976
382 HG21 THR 50 3HG2 THR 50 -8.624 -9.287 -3.861
383 HG22 THR 50 1HG2 THR 50 -9.733 -8.040 -4.429
384 HG23 THR 50 2HG2 THR 50 -10.116 -9.744 -4.683
385 H LYS 51 H LYS 51 -9.016 -12.460 -2.961
386 HA LYS 51 HA LYS 51 -7.001 -12.390 -0.903
387 HB2 LYS 51 2HB LYS 51 -7.794 -14.484 -2.053
388 HB3 LYS 51 1HB LYS 51 -6.942 -13.939 -3.500
389 HG2 LYS 51 2HG LYS 51 -4.842 -13.786 -2.120
390 HG3 LYS 51 1HG LYS 51 -5.724 -14.524 -0.784
391 HD2 LYS 51 2HD LYS 51 -5.254 -15.755 -3.517
392 HD3 LYS 51 1HD LYS 51 -4.481 -16.243 -2.009
393 HE2 LYS 51 2HE LYS 51 -6.214 -17.802 -2.166
394 HE3 LYS 51 1HE LYS 51 -6.966 -16.556 -1.172
395 HZ1 LYS 51 3HZ LYS 51 -8.477 -16.220 -2.738
396 HZ2 LYS 51 1HZ LYS 51 -7.829 -17.512 -3.627
397 HZ3 LYS 51 2HZ LYS 51 -7.279 -15.929 -3.907
398 H ILE 52 H ILE 52 -5.402 -10.989 -0.863
399 HA ILE 52 HA ILE 52 -4.067 -10.214 -3.390
400 HB ILE 52 HB ILE 52 -3.742 -7.929 -2.120
401 HG12 ILE 52 2HG1 ILE 52 -6.387 -8.830 -0.959
402 HG13 ILE 52 1HG1 ILE 52 -4.884 -8.895 -0.064
403 HG21 ILE 52 1HG2 ILE 52 -5.024 -8.258 -4.237
404 HG22 ILE 52 2HG2 ILE 52 -5.743 -7.040 -3.180
405 HG23 ILE 52 3HG2 ILE 52 -6.447 -8.656 -3.269
406 HD11 ILE 52 3HD1 ILE 52 -6.336 -6.482 -1.112
407 HD12 ILE 52 1HD1 ILE 52 -4.631 -6.393 -0.674
408 HD13 ILE 52 2HD1 ILE 52 -5.832 -6.816 0.543
409 H ILE 53 H ILE 53 -1.977 -10.647 -3.316
410 HA ILE 53 HA ILE 53 -0.723 -11.408 -0.799
411 HB ILE 53 HB ILE 53 0.430 -11.360 -3.595
412 HG12 ILE 53 2HG1 ILE 53 -0.730 -13.693 -2.039
413 HG13 ILE 53 1HG1 ILE 53 -1.613 -12.817 -3.293
414 HG21 ILE 53 1HG2 ILE 53 2.146 -11.406 -1.865
415 HG22 ILE 53 2HG2 ILE 53 2.021 -13.009 -2.588
416 HG23 ILE 53 3HG2 ILE 53 1.295 -12.695 -1.012
417 HD11 ILE 53 3HD1 ILE 53 1.012 -14.295 -3.659
418 HD12 ILE 53 1HD1 ILE 53 0.192 -13.363 -4.912
419 HD13 ILE 53 2HD1 ILE 53 -0.566 -14.814 -4.255
420 H MET 54 H MET 54 1.045 -10.402 0.146
421 HA MET 54 HA MET 54 1.216 -7.569 -0.208
422 HB2 MET 54 2HB MET 54 1.618 -8.745 1.965
423 HB3 MET 54 1HB MET 54 3.113 -9.398 1.291
424 HG2 MET 54 2HG MET 54 3.765 -7.453 2.504
425 HG3 MET 54 1HG MET 54 3.791 -6.977 0.817
426 HE1 MET 54 3HE MET 54 2.216 -3.711 1.189
427 HE2 MET 54 1HE MET 54 3.008 -4.881 0.122
428 HE3 MET 54 2HE MET 54 3.767 -4.415 1.642
429 H LYS 55 H LYS 55 1.708 -7.436 -2.474
430 HA LYS 55 HA LYS 55 4.128 -8.530 -3.547
431 HB2 LYS 55 2HB LYS 55 2.006 -7.821 -4.827
432 HB3 LYS 55 1HB LYS 55 2.615 -6.175 -4.683
433 HG2 LYS 55 2HG LYS 55 3.557 -6.787 -6.722
434 HG3 LYS 55 1HG LYS 55 4.852 -7.243 -5.623
435 HD2 LYS 55 2HD LYS 55 4.658 -9.189 -6.896
436 HD3 LYS 55 1HD LYS 55 3.578 -9.569 -5.558
437 HE2 LYS 55 2HE LYS 55 1.641 -8.854 -6.883
438 HE3 LYS 55 1HE LYS 55 2.701 -8.382 -8.209
439 HZ1 LYS 55 3HZ LYS 55 3.412 -10.960 -7.623
440 HZ2 LYS 55 1HZ LYS 55 2.477 -10.450 -8.942
441 HZ3 LYS 55 2HZ LYS 55 1.716 -10.964 -7.513
442 H GLY 56 H GLY 56 3.207 -5.125 -3.299
443 HA2 GLY 56 2HA GLY 56 5.857 -4.153 -3.384
444 HA3 GLY 56 1HA GLY 56 4.432 -3.230 -2.934
445 H ASN 57 H ASN 57 6.796 -5.558 -1.663
446 HA ASN 57 HA ASN 57 6.057 -5.097 1.078
447 HB2 ASN 57 2HB ASN 57 7.067 -7.217 0.458
448 HB3 ASN 57 1HB ASN 57 8.502 -6.392 -0.152
449 HD21 ASN 57 1HD2 ASN 57 6.871 -5.317 2.806
450 HD22 ASN 57 2HD2 ASN 57 8.109 -5.803 3.869
451 H GLU 58 H GLU 58 7.590 -3.209 -1.160
452 HA GLU 58 HA GLU 58 9.606 -2.040 0.578
453 HB2 GLU 58 2HB GLU 58 8.590 -1.144 -2.130
454 HB3 GLU 58 1HB GLU 58 10.019 -0.525 -1.302
455 HG2 GLU 58 2HG GLU 58 11.031 -2.769 -1.350
456 HG3 GLU 58 1HG GLU 58 9.600 -3.404 -2.159
457 H ILE 59 H ILE 59 7.857 -1.616 2.239
458 HA ILE 59 HA ILE 59 5.902 0.400 1.797
459 HB ILE 59 HB ILE 59 5.924 0.519 4.342
460 HG12 ILE 59 2HG1 ILE 59 7.813 -1.832 4.038
461 HG13 ILE 59 1HG1 ILE 59 8.357 -0.208 4.468
462 HG21 ILE 59 1HG2 ILE 59 5.122 -1.913 4.521
463 HG22 ILE 59 2HG2 ILE 59 5.558 -2.069 2.819
464 HG23 ILE 59 3HG2 ILE 59 4.321 -0.912 3.312
465 HD11 ILE 59 3HD1 ILE 59 7.898 -1.802 6.422
466 HD12 ILE 59 1HD1 ILE 59 6.190 -1.641 6.014
467 HD13 ILE 59 2HD1 ILE 59 7.116 -0.223 6.503
468 H PHE 60 H PHE 60 9.297 0.493 2.428
469 HA PHE 60 HA PHE 60 9.630 2.949 3.681
470 HB2 PHE 60 2HB PHE 60 11.471 1.364 3.200
471 HB3 PHE 60 1HB PHE 60 11.362 1.781 1.490
472 HD1 PHE 60 2HD PHE 60 12.291 2.992 4.847
473 HD2 PHE 60 1HD PHE 60 12.104 3.948 0.664
474 HE1 PHE 60 2HE PHE 60 13.748 4.962 5.232
475 HE2 PHE 60 1HE PHE 60 13.562 5.918 1.049
476 HZ PHE 60 HZ PHE 60 14.383 6.425 3.333
477 H ARG 61 H ARG 61 8.740 2.219 0.387
478 HA ARG 61 HA ARG 61 9.349 4.600 -0.911
479 HB2 ARG 61 2HB ARG 61 8.404 2.509 -1.955
480 HB3 ARG 61 1HB ARG 61 6.822 2.995 -1.340
481 HG2 ARG 61 2HG ARG 61 6.875 5.041 -2.626
482 HG3 ARG 61 1HG ARG 61 8.547 4.750 -3.109
483 HD2 ARG 61 2HD ARG 61 6.303 2.835 -3.769
484 HD3 ARG 61 1HD ARG 61 6.775 4.150 -4.841
485 HE ARG 61 HE ARG 61 9.121 2.819 -4.302
486 HH11 ARG 61 1HH2 ARG 61 5.989 1.994 -5.520
487 HH12 ARG 61 2HH2 ARG 61 6.566 0.707 -6.525
488 HH21 ARG 61 1HH1 ARG 61 9.886 1.132 -5.617
489 HH22 ARG 61 2HH1 ARG 61 8.771 0.218 -6.580
490 H LEU 62 H LEU 62 6.541 3.790 1.098
491 HA LEU 62 HA LEU 62 4.944 6.005 0.675
492 HB2 LEU 62 2HB LEU 62 4.455 3.997 2.155
493 HB3 LEU 62 1HB LEU 62 5.432 4.778 3.394
494 HG LEU 62 HG LEU 62 3.870 6.855 2.944
495 HD11 LEU 62 1HD1 LEU 62 2.661 6.008 1.020
496 HD12 LEU 62 2HD1 LEU 62 1.539 6.091 2.374
497 HD13 LEU 62 3HD1 LEU 62 2.217 4.539 1.889
498 HD21 LEU 62 3HD2 LEU 62 2.269 5.993 4.639
499 HD22 LEU 62 1HD2 LEU 62 3.940 5.626 5.066
500 HD23 LEU 62 2HD2 LEU 62 2.905 4.368 4.391
501 H ASP 63 H ASP 63 7.559 5.671 3.078
502 HA ASP 63 HA ASP 63 8.776 7.243 4.230
503 HB2 ASP 63 2HB ASP 63 9.553 7.807 1.977
504 HB3 ASP 63 1HB ASP 63 8.169 8.877 1.755
505 H GLU 64 H GLU 64 6.724 9.605 2.594
506 HA GLU 64 HA GLU 64 5.097 10.041 4.978
507 HB2 GLU 64 2HB GLU 64 6.985 12.154 3.904
508 HB3 GLU 64 1HB GLU 64 5.704 12.453 5.079
509 HG2 GLU 64 2HG GLU 64 6.785 10.615 6.500
510 HG3 GLU 64 1HG GLU 64 8.166 10.733 5.412
511 H ALA 65 H ALA 65 5.549 9.997 1.677
512 HA ALA 65 HA ALA 65 4.317 10.708 -0.136
513 HB1 ALA 65 1HB ALA 65 2.745 9.162 1.105
514 HB2 ALA 65 2HB ALA 65 1.958 10.350 0.067
515 HB3 ALA 65 3HB ALA 65 2.007 10.599 1.812
516 H LEU 66 H LEU 66 5.166 12.739 2.087
517 HA LEU 66 HA LEU 66 3.266 14.858 1.961
518 HB2 LEU 66 2HB LEU 66 5.256 14.439 3.625
519 HB3 LEU 66 1HB LEU 66 6.201 15.330 2.437
520 HG LEU 66 HG LEU 66 3.676 16.317 3.803
521 HD11 LEU 66 1HD1 LEU 66 5.182 17.901 4.916
522 HD12 LEU 66 2HD1 LEU 66 6.563 17.216 4.058
523 HD13 LEU 66 3HD1 LEU 66 5.694 16.247 5.251
524 HD21 LEU 66 3HD2 LEU 66 3.677 17.345 1.674
525 HD22 LEU 66 1HD2 LEU 66 5.437 17.460 1.628
526 HD23 LEU 66 2HD2 LEU 66 4.508 18.519 2.689
527 H ARG 67 H ARG 67 6.555 14.757 0.568
528 HA ARG 67 HA ARG 67 5.895 16.801 -1.355
529 HB2 ARG 67 2HB ARG 67 8.352 15.042 -1.154
530 HB3 ARG 67 1HB ARG 67 8.195 16.501 -2.133
531 HG2 ARG 67 2HG ARG 67 7.857 17.855 -0.129
532 HG3 ARG 67 1HG ARG 67 7.895 16.412 0.882
533 HD2 ARG 67 2HD ARG 67 10.176 17.426 -0.837
534 HD3 ARG 67 1HD ARG 67 10.075 17.555 0.916
535 HE ARG 67 HE ARG 67 9.790 14.847 0.250
536 HH11 ARG 67 1HH2 ARG 67 12.114 17.402 0.048
537 HH12 ARG 67 2HH2 ARG 67 13.485 16.350 0.161
538 HH21 ARG 67 1HH1 ARG 67 11.583 13.461 0.398
539 HH22 ARG 67 2HH1 ARG 67 13.184 14.120 0.359
540 H LYS 68 H LYS 68 6.731 13.341 -1.548
541 HA LYS 68 HA LYS 68 6.532 12.994 -4.296
542 HB2 LYS 68 2HB LYS 68 5.766 11.079 -2.079
543 HB3 LYS 68 1HB LYS 68 5.977 10.624 -3.771
544 HG2 LYS 68 2HG LYS 68 8.313 11.484 -3.679
545 HG3 LYS 68 1HG LYS 68 8.093 11.826 -1.962
546 HD2 LYS 68 2HD LYS 68 7.625 9.439 -1.544
547 HD3 LYS 68 1HD LYS 68 7.842 9.095 -3.261
548 HE2 LYS 68 2HE LYS 68 10.170 9.920 -3.126
549 HE3 LYS 68 1HE LYS 68 9.952 10.239 -1.405
550 HZ1 LYS 68 3HZ LYS 68 9.176 7.726 -1.484
551 HZ2 LYS 68 1HZ LYS 68 10.801 8.163 -1.270
552 HZ3 LYS 68 2HZ LYS 68 10.243 7.698 -2.805
553 H GLY 69 H GLY 69 4.020 13.413 -1.916
554 HA2 GLY 69 2HA GLY 69 1.811 12.364 -3.275
555 HA3 GLY 69 1HA GLY 69 1.745 13.691 -2.119
556 H HIS 70 H HIS 70 3.103 15.691 -3.317
557 HA HIS 70 HA HIS 70 2.598 16.110 -6.059
558 HB2 HIS 70 2HB HIS 70 0.721 17.808 -5.747
559 HB3 HIS 70 1HB HIS 70 0.261 16.111 -5.603
560 HD2 HIS 70 2HD HIS 70 1.533 18.763 -2.888
561 HE1 HIS 70 1HE HIS 70 -1.689 16.547 -1.298
562 HE2 HIS 70 2HE HIS 70 -0.009 18.389 -0.815
563 H SER 71 H SER 71 2.415 18.683 -6.414
564 HA SER 71 HA SER 71 3.595 20.651 -6.314
565 HB2 SER 71 2HB SER 71 3.601 20.071 -3.345
566 HB3 SER 71 1HB SER 71 3.886 21.636 -4.100
567 HG SER 71 HG SER 71 1.604 20.707 -3.357
568 H GLU 72 H GLU 72 5.715 21.649 -5.522
569 HA GLU 72 HA GLU 72 8.010 21.555 -5.539
570 HB2 GLU 72 2HB GLU 72 7.476 20.561 -3.270
571 HB3 GLU 72 1HB GLU 72 7.676 18.972 -4.009
572 HG2 GLU 72 2HG GLU 72 9.796 19.550 -3.045
573 HG3 GLU 72 1HG GLU 72 9.964 19.741 -4.790
574 H GLY 73 H GLY 73 7.822 21.134 -7.877
575 HA2 GLY 73 2HA GLY 73 7.857 18.559 -9.015
576 HA3 GLY 73 1HA GLY 73 8.467 20.022 -9.786
577 H GLY 74 H GLY 74 9.310 17.424 -7.537
578 HA2 GLY 74 2HA GLY 74 11.860 16.976 -8.622
579 HA3 GLY 74 1HA GLY 74 12.044 18.035 -7.227
580 H1 HOH 201 H2 HOH 77 -3.096 19.228 -3.551
581 H2 HOH 201 H1 HOH 77 -1.639 19.458 -3.897
Start of MODEL 3
1 H1 VAL 1 1H VAL 1 -3.988 15.463 -1.600
2 H2 VAL 1 2H VAL 1 -3.041 16.134 -2.841
3 HA VAL 1 HA VAL 1 -5.115 14.856 -3.521
4 HB VAL 1 HB VAL 1 -2.419 14.062 -4.662
5 HG11 VAL 1 2HG1 VAL 1 -3.752 13.898 -6.783
6 HG12 VAL 1 3HG1 VAL 1 -5.216 14.137 -5.830
7 HG13 VAL 1 1HG1 VAL 1 -4.219 12.705 -5.571
8 HG21 VAL 1 1HG2 VAL 1 -2.522 16.464 -4.546
9 HG22 VAL 1 2HG2 VAL 1 -4.196 16.476 -5.099
10 HG23 VAL 1 3HG2 VAL 1 -2.903 16.018 -6.209
11 H ASP 2 H ASP 2 -5.772 13.453 -1.767
12 HA ASP 2 HA ASP 2 -5.148 10.664 -2.315
13 HB2 ASP 2 2HB ASP 2 -4.799 11.666 0.510
14 HB3 ASP 2 1HB ASP 2 -4.376 10.086 -0.149
15 H MET 3 H MET 3 -6.638 12.683 0.232
16 HA MET 3 HA MET 3 -8.770 10.911 0.759
17 HB2 MET 3 2HB MET 3 -8.655 13.911 1.160
18 HB3 MET 3 1HB MET 3 -9.802 12.809 1.923
19 HG2 MET 3 2HG MET 3 -8.028 11.673 3.106
20 HG3 MET 3 1HG MET 3 -6.796 12.564 2.213
21 HE1 MET 3 3HE MET 3 -9.416 13.928 5.686
22 HE2 MET 3 1HE MET 3 -8.971 12.285 5.199
23 HE3 MET 3 2HE MET 3 -10.108 13.219 4.229
24 H SER 4 H SER 4 -8.422 13.600 -1.499
25 HA SER 4 HA SER 4 -11.089 13.892 -2.290
26 HB2 SER 4 2HB SER 4 -8.623 14.174 -4.021
27 HB3 SER 4 1HB SER 4 -10.206 14.878 -4.338
28 HG SER 4 HG SER 4 -8.340 16.047 -3.082
29 H ASN 5 H ASN 5 -8.603 11.622 -3.371
30 HA ASN 5 HA ASN 5 -10.553 9.711 -4.222
31 HB2 ASN 5 2HB ASN 5 -10.662 11.293 -6.132
32 HB3 ASN 5 1HB ASN 5 -8.935 11.059 -6.396
33 HD21 ASN 5 1HD2 ASN 5 -8.267 8.682 -6.784
34 HD22 ASN 5 2HD2 ASN 5 -9.354 7.701 -7.643
35 H VAL 6 H VAL 6 -9.399 8.274 -2.958
36 HA VAL 6 HA VAL 6 -6.598 7.939 -3.001
37 HB VAL 6 HB VAL 6 -7.072 5.729 -1.964
38 HG11 VAL 6 1HG1 VAL 6 -7.052 7.779 -0.593
39 HG12 VAL 6 2HG1 VAL 6 -8.251 6.635 0.011
40 HG13 VAL 6 3HG1 VAL 6 -8.764 8.031 -0.938
41 HG21 VAL 6 3HG2 VAL 6 -9.476 5.179 -1.532
42 HG22 VAL 6 1HG2 VAL 6 -9.057 5.112 -3.243
43 HG23 VAL 6 2HG2 VAL 6 -9.937 6.502 -2.605
44 H VAL 7 H VAL 7 -5.255 6.665 -4.197
45 HA VAL 7 HA VAL 7 -6.118 5.911 -6.818
46 HB VAL 7 HB VAL 7 -3.809 5.096 -7.094
47 HG11 VAL 7 1HG1 VAL 7 -4.015 7.732 -5.607
48 HG12 VAL 7 2HG1 VAL 7 -4.283 7.502 -7.335
49 HG13 VAL 7 3HG1 VAL 7 -2.678 7.248 -6.649
50 HG21 VAL 7 3HG2 VAL 7 -3.391 4.100 -4.939
51 HG22 VAL 7 1HG2 VAL 7 -3.695 5.628 -4.111
52 HG23 VAL 7 2HG2 VAL 7 -2.257 5.439 -5.114
53 H LYS 8 H LYS 8 -5.349 4.139 -3.850
54 HA LYS 8 HA LYS 8 -6.952 1.903 -4.697
55 HB2 LYS 8 2HB LYS 8 -4.607 1.678 -5.813
56 HB3 LYS 8 1HB LYS 8 -4.052 1.255 -4.197
57 HG2 LYS 8 2HG LYS 8 -4.598 -0.858 -5.003
58 HG3 LYS 8 1HG LYS 8 -6.127 -0.405 -4.254
59 HD2 LYS 8 2HD LYS 8 -6.853 -1.119 -6.361
60 HD3 LYS 8 1HD LYS 8 -6.679 0.612 -6.628
61 HE2 LYS 8 2HE LYS 8 -4.526 0.302 -7.687
62 HE3 LYS 8 1HE LYS 8 -4.497 -1.407 -7.245
63 HZ1 LYS 8 3HZ LYS 8 -6.879 -0.936 -8.596
64 HZ2 LYS 8 1HZ LYS 8 -5.547 -1.846 -9.121
65 HZ3 LYS 8 2HZ LYS 8 -5.649 -0.194 -9.504
66 H THR 9 H THR 9 -7.767 0.888 -2.949
67 HA THR 9 HA THR 9 -6.310 0.822 -0.429
68 HB THR 9 HB THR 9 -9.000 2.200 -0.584
69 HG1 THR 9 1HG THR 9 -7.715 4.039 -0.010
70 HG21 THR 9 3HG2 THR 9 -8.452 2.767 1.787
71 HG22 THR 9 1HG2 THR 9 -7.028 1.733 1.669
72 HG23 THR 9 2HG2 THR 9 -8.641 1.034 1.522
73 H TYR 10 H TYR 10 -6.478 -1.278 0.027
74 HA TYR 10 HA TYR 10 -9.033 -2.684 -0.455
75 HB2 TYR 10 2HB TYR 10 -6.369 -3.897 0.259
76 HB3 TYR 10 1HB TYR 10 -7.791 -4.722 -0.356
77 HD1 TYR 10 2HD TYR 10 -8.749 -3.513 -2.620
78 HD2 TYR 10 1HD TYR 10 -4.655 -3.574 -1.309
79 HE1 TYR 10 2HE TYR 10 -7.996 -3.129 -4.950
80 HE2 TYR 10 1HE TYR 10 -3.906 -3.192 -3.640
81 HH TYR 10 HH TYR 10 -5.283 -3.781 -6.131
82 H ASP 11 H ASP 11 -10.347 -2.911 1.234
83 HA ASP 11 HA ASP 11 -9.556 -2.269 3.898
84 HB2 ASP 11 2HB ASP 11 -12.053 -3.494 2.725
85 HB3 ASP 11 1HB ASP 11 -11.861 -3.175 4.449
86 H LEU 12 H LEU 12 -7.989 -3.604 4.695
87 HA LEU 12 HA LEU 12 -8.053 -6.455 4.430
88 HB2 LEU 12 2HB LEU 12 -6.263 -4.429 5.490
89 HB3 LEU 12 1HB LEU 12 -6.405 -5.741 6.651
90 HG LEU 12 HG LEU 12 -5.782 -7.368 4.913
91 HD11 LEU 12 1HD1 LEU 12 -5.976 -4.949 3.147
92 HD12 LEU 12 2HD1 LEU 12 -6.457 -6.615 2.826
93 HD13 LEU 12 3HD1 LEU 12 -4.758 -6.166 2.759
94 HD21 LEU 12 3HD2 LEU 12 -3.993 -4.993 5.429
95 HD22 LEU 12 1HD2 LEU 12 -3.419 -6.331 4.438
96 HD23 LEU 12 2HD2 LEU 12 -3.904 -6.618 6.109
97 H GLN 13 H GLN 13 -8.394 -8.001 6.086
98 HA GLN 13 HA GLN 13 -10.633 -7.349 7.795
99 HB2 GLN 13 2HB GLN 13 -9.065 -9.877 7.269
100 HB3 GLN 13 1HB GLN 13 -10.336 -9.794 8.493
101 HG2 GLN 13 2HG GLN 13 -11.921 -8.994 6.738
102 HG3 GLN 13 1HG GLN 13 -10.650 -9.209 5.532
103 HE21 GLN 13 1HE2 GLN 13 -10.769 -11.507 8.175
104 HE22 GLN 13 2HE2 GLN 13 -11.414 -12.798 7.273
105 H ASP 14 H ASP 14 -7.300 -7.110 8.073
106 HA ASP 14 HA ASP 14 -7.119 -7.728 10.907
107 HB2 ASP 14 2HB ASP 14 -5.218 -8.122 9.352
108 HB3 ASP 14 1HB ASP 14 -5.111 -6.381 9.089
109 H GLY 15 H GLY 15 -8.638 -5.355 9.396
110 HA2 GLY 15 2HA GLY 15 -9.533 -3.420 10.382
111 HA3 GLY 15 1HA GLY 15 -8.254 -3.462 11.594
112 H SER 16 H SER 16 -6.331 -3.926 9.234
113 HA SER 16 HA SER 16 -5.818 -1.084 8.743
114 HB2 SER 16 2HB SER 16 -4.188 -3.547 8.077
115 HB3 SER 16 1HB SER 16 -3.665 -1.879 7.842
116 HG SER 16 HG SER 16 -3.717 -3.395 10.097
117 H LYS 17 H LYS 17 -4.494 -1.163 6.350
118 HA LYS 17 HA LYS 17 -6.061 -2.430 4.295
119 HB2 LYS 17 2HB LYS 17 -6.870 -0.322 3.273
120 HB3 LYS 17 1HB LYS 17 -7.599 -0.618 4.852
121 HG2 LYS 17 2HG LYS 17 -5.714 0.831 5.819
122 HG3 LYS 17 1HG LYS 17 -5.387 1.319 4.157
123 HD2 LYS 17 2HD LYS 17 -7.661 2.164 3.910
124 HD3 LYS 17 1HD LYS 17 -8.083 1.578 5.520
125 HE2 LYS 17 2HE LYS 17 -7.616 3.896 5.803
126 HE3 LYS 17 1HE LYS 17 -6.179 3.058 6.391
127 HZ1 LYS 17 3HZ LYS 17 -4.942 3.949 4.794
128 HZ2 LYS 17 1HZ LYS 17 -6.235 5.001 4.481
129 HZ3 LYS 17 2HZ LYS 17 -6.070 3.570 3.581
130 H VAL 18 H VAL 18 -4.902 -2.571 2.430
131 HA VAL 18 HA VAL 18 -2.209 -1.439 2.464
132 HB VAL 18 HB VAL 18 -2.920 -2.926 0.020
133 HG11 VAL 18 1HG1 VAL 18 -0.914 -3.463 2.222
134 HG12 VAL 18 2HG1 VAL 18 -0.616 -2.502 0.774
135 HG13 VAL 18 3HG1 VAL 18 -0.942 -4.229 0.633
136 HG21 VAL 18 3HG2 VAL 18 -3.184 -4.379 2.669
137 HG22 VAL 18 1HG2 VAL 18 -3.212 -5.119 1.068
138 HG23 VAL 18 2HG2 VAL 18 -4.511 -4.044 1.562
139 H HIS 19 H HIS 19 -1.344 -0.319 0.623
140 HA HIS 19 HA HIS 19 -3.263 1.025 -1.151
141 HB2 HIS 19 2HB HIS 19 -3.216 2.837 0.269
142 HB3 HIS 19 1HB HIS 19 -1.768 2.266 1.090
143 HD1 HIS 19 1HD HIS 19 -2.897 4.355 -1.821
144 HD2 HIS 19 2HD HIS 19 0.676 3.231 0.013
145 HE1 HIS 19 1HE HIS 19 -1.091 5.834 -2.807
146 HE2 HIS 19 2HE HIS 19 1.095 5.162 -1.700
147 H VAL 20 H VAL 20 -2.503 0.668 -3.140
148 HA VAL 20 HA VAL 20 0.333 0.091 -3.494
149 HB VAL 20 HB VAL 20 -0.194 -1.040 -5.431
150 HG11 VAL 20 1HG1 VAL 20 -1.459 -2.281 -3.888
151 HG12 VAL 20 2HG1 VAL 20 -2.574 -2.019 -5.213
152 HG13 VAL 20 3HG1 VAL 20 -2.704 -1.053 -3.752
153 HG21 VAL 20 3HG2 VAL 20 -1.005 0.663 -6.836
154 HG22 VAL 20 1HG2 VAL 20 -2.379 1.003 -5.788
155 HG23 VAL 20 2HG2 VAL 20 -2.349 -0.473 -6.750
156 H PHE 21 H PHE 21 1.654 1.111 -5.041
157 HA PHE 21 HA PHE 21 1.072 3.971 -5.351
158 HB2 PHE 21 2HB PHE 21 3.565 2.305 -5.736
159 HB3 PHE 21 1HB PHE 21 3.477 4.018 -6.144
160 HD1 PHE 21 1HD PHE 21 3.278 1.555 -3.385
161 HD2 PHE 21 2HD PHE 21 3.403 5.718 -4.436
162 HE1 PHE 21 1HE PHE 21 3.672 2.144 -1.008
163 HE2 PHE 21 2HE PHE 21 3.797 6.306 -2.059
164 HZ PHE 21 HZ PHE 21 3.932 4.518 -0.346
165 H LYS 22 H LYS 22 2.539 4.588 -7.580
166 HA LYS 22 HA LYS 22 0.725 3.823 -9.687
167 HB2 LYS 22 2HB LYS 22 3.240 5.510 -9.726
168 HB3 LYS 22 1HB LYS 22 2.129 5.323 -11.083
169 HG2 LYS 22 2HG LYS 22 0.291 6.229 -9.700
170 HG3 LYS 22 1HG LYS 22 1.413 6.437 -8.354
171 HD2 LYS 22 2HD LYS 22 2.782 7.964 -9.745
172 HD3 LYS 22 1HD LYS 22 1.627 7.780 -11.066
173 HE2 LYS 22 2HE LYS 22 -0.162 8.695 -9.631
174 HE3 LYS 22 1HE LYS 22 0.995 8.887 -8.313
175 HZ1 LYS 22 3HZ LYS 22 2.126 10.545 -9.434
176 HZ2 LYS 22 1HZ LYS 22 0.510 10.886 -9.820
177 HZ3 LYS 22 2HZ LYS 22 1.505 10.102 -10.952
178 H ASP 23 H ASP 23 3.628 2.574 -8.434
179 HA ASP 23 HA ASP 23 4.555 1.386 -10.924
180 HB2 ASP 23 2HB ASP 23 5.488 0.976 -8.073
181 HB3 ASP 23 1HB ASP 23 6.303 0.383 -9.521
182 H GLY 24 H GLY 24 2.050 0.722 -8.919
183 HA2 GLY 24 2HA GLY 24 0.619 -1.129 -9.018
184 HA3 GLY 24 1HA GLY 24 1.889 -2.045 -9.827
185 H LYS 25 H LYS 25 3.720 -0.966 -7.569
186 HA LYS 25 HA LYS 25 3.669 -3.294 -5.945
187 HB2 LYS 25 2HB LYS 25 5.006 -0.594 -5.656
188 HB3 LYS 25 1HB LYS 25 5.256 -1.898 -4.502
189 HG2 LYS 25 2HG LYS 25 5.626 -2.482 -7.429
190 HG3 LYS 25 1HG LYS 25 6.890 -1.600 -6.580
191 HD2 LYS 25 2HD LYS 25 7.242 -3.390 -5.038
192 HD3 LYS 25 1HD LYS 25 5.768 -4.213 -5.547
193 HE2 LYS 25 2HE LYS 25 7.730 -5.299 -6.547
194 HE3 LYS 25 1HE LYS 25 6.746 -4.544 -7.801
195 HZ1 LYS 25 3HZ LYS 25 9.112 -3.272 -6.539
196 HZ2 LYS 25 1HZ LYS 25 8.219 -2.679 -7.853
197 HZ3 LYS 25 2HZ LYS 25 9.146 -4.093 -8.026
198 H MET 26 H MET 26 2.943 -3.599 -3.852
199 HA MET 26 HA MET 26 0.655 -2.039 -3.060
200 HB2 MET 26 2HB MET 26 1.908 -4.608 -2.219
201 HB3 MET 26 1HB MET 26 0.925 -3.776 -1.016
202 HG2 MET 26 2HG MET 26 -1.012 -3.893 -2.332
203 HG3 MET 26 1HG MET 26 -0.106 -4.180 -3.820
204 HE1 MET 26 3HE MET 26 -1.570 -5.865 -4.526
205 HE2 MET 26 1HE MET 26 -1.341 -7.583 -4.165
206 HE3 MET 26 2HE MET 26 -0.018 -6.639 -4.850
207 H GLY 27 H GLY 27 0.522 -1.809 -0.489
208 HA2 GLY 27 2HA GLY 27 2.965 -0.804 0.722
209 HA3 GLY 27 1HA GLY 27 1.792 0.444 0.308
210 H MET 28 H MET 28 2.744 -1.783 2.639
211 HA MET 28 HA MET 28 0.162 -2.195 3.864
212 HB2 MET 28 2HB MET 28 2.159 -3.791 3.931
213 HB3 MET 28 1HB MET 28 2.857 -2.694 5.114
214 HG2 MET 28 2HG MET 28 1.684 -4.400 6.333
215 HG3 MET 28 1HG MET 28 0.745 -2.917 6.453
216 HE1 MET 28 3HE MET 28 -1.995 -5.370 6.590
217 HE2 MET 28 1HE MET 28 -2.080 -3.611 6.438
218 HE3 MET 28 2HE MET 28 -0.815 -4.358 7.411
219 H GLU 29 H GLU 29 -0.596 -0.090 4.291
220 HA GLU 29 HA GLU 29 0.927 1.501 6.270
221 HB2 GLU 29 2HB GLU 29 0.130 2.581 4.126
222 HB3 GLU 29 1HB GLU 29 -1.520 2.332 4.698
223 HG2 GLU 29 2HG GLU 29 -0.915 3.589 6.789
224 HG3 GLU 29 1HG GLU 29 0.647 3.955 6.059
225 H ASN 30 H ASN 30 0.424 0.756 8.268
226 HA ASN 30 HA ASN 30 -2.138 -0.300 8.964
227 HB2 ASN 30 2HB ASN 30 -1.249 -0.161 11.308
228 HB3 ASN 30 1HB ASN 30 -0.211 -1.048 10.192
229 HD21 ASN 30 1HD2 ASN 30 -0.654 2.390 11.232
230 HD22 ASN 30 2HD2 ASN 30 1.013 2.713 11.343
231 H LYS 31 H LYS 31 -3.859 0.644 9.933
232 HA LYS 31 HA LYS 31 -4.369 3.360 9.584
233 HB2 LYS 31 2HB LYS 31 -6.392 3.017 10.771
234 HB3 LYS 31 1HB LYS 31 -6.050 1.487 9.965
235 HG2 LYS 31 2HG LYS 31 -5.551 2.152 12.889
236 HG3 LYS 31 1HG LYS 31 -6.733 1.017 12.244
237 HD2 LYS 31 2HD LYS 31 -4.750 -0.227 11.198
238 HD3 LYS 31 1HD LYS 31 -3.723 0.758 12.240
239 HE2 LYS 31 2HE LYS 31 -4.229 -1.373 13.340
240 HE3 LYS 31 1HE LYS 31 -4.991 -0.046 14.217
241 HZ1 LYS 31 3HZ LYS 31 -6.713 -0.974 12.183
242 HZ2 LYS 31 1HZ LYS 31 -6.970 -0.940 13.859
243 HZ3 LYS 31 2HZ LYS 31 -6.219 -2.285 13.144
244 H PHE 32 H PHE 32 -2.196 2.067 11.712
245 HA PHE 32 HA PHE 32 -2.695 3.813 13.963
246 HB2 PHE 32 2HB PHE 32 -1.495 1.463 13.879
247 HB3 PHE 32 1HB PHE 32 -0.064 2.422 13.505
248 HD1 PHE 32 1HD PHE 32 -2.667 1.718 16.027
249 HD2 PHE 32 2HD PHE 32 0.917 3.919 15.154
250 HE1 PHE 32 1HE PHE 32 -2.423 2.277 18.432
251 HE2 PHE 32 2HE PHE 32 1.159 4.479 17.558
252 HZ PHE 32 HZ PHE 32 -0.511 3.657 19.196
253 H GLY 33 H GLY 33 -1.753 4.510 10.958
254 HA2 GLY 33 2HA GLY 33 -0.841 6.441 10.069
255 HA3 GLY 33 1HA GLY 33 -0.534 7.001 11.713
256 H LYS 34 H LYS 34 0.624 3.882 10.698
257 HA LYS 34 HA LYS 34 3.347 4.928 10.236
258 HB2 LYS 34 2HB LYS 34 2.549 2.863 12.294
259 HB3 LYS 34 1HB LYS 34 4.200 3.034 11.695
260 HG2 LYS 34 2HG LYS 34 4.305 5.330 12.472
261 HG3 LYS 34 1HG LYS 34 2.601 5.298 12.920
262 HD2 LYS 34 2HD LYS 34 3.902 4.971 14.936
263 HD3 LYS 34 1HD LYS 34 3.126 3.441 14.534
264 HE2 LYS 34 2HE LYS 34 5.134 2.482 13.760
265 HE3 LYS 34 1HE LYS 34 5.916 4.051 13.556
266 HZ1 LYS 34 3HZ LYS 34 5.361 2.572 16.046
267 HZ2 LYS 34 1HZ LYS 34 5.589 4.252 16.073
268 HZ3 LYS 34 2HZ LYS 34 6.828 3.237 15.503
269 H SER 35 H SER 35 4.807 3.199 9.400
270 HA SER 35 HA SER 35 3.369 1.592 7.406
271 HB2 SER 35 2HB SER 35 6.355 1.953 7.643
272 HB3 SER 35 1HB SER 35 5.422 1.483 6.224
273 HG SER 35 HG SER 35 5.001 3.511 5.851
274 H MET 36 H MET 36 2.994 -0.501 7.751
275 HA MET 36 HA MET 36 4.443 -1.911 9.878
276 HB2 MET 36 2HB MET 36 1.840 -1.885 9.433
277 HB3 MET 36 1HB MET 36 2.225 -3.135 8.251
278 HG2 MET 36 2HG MET 36 2.937 -3.193 11.202
279 HG3 MET 36 1HG MET 36 1.670 -4.143 10.423
280 HE1 MET 36 3HE MET 36 2.880 -6.281 11.597
281 HE2 MET 36 1HE MET 36 4.047 -5.118 12.239
282 HE3 MET 36 2HE MET 36 4.608 -6.585 11.441
283 H ASN 37 H ASN 37 6.087 -3.245 9.442
284 HA ASN 37 HA ASN 37 6.834 -3.800 6.709
285 HB2 ASN 37 2HB ASN 37 8.582 -3.375 8.337
286 HB3 ASN 37 1HB ASN 37 8.016 -4.705 9.344
287 HD21 ASN 37 1HD2 ASN 37 7.661 -5.549 6.078
288 HD22 ASN 37 2HD2 ASN 37 9.100 -6.438 5.899
289 H MET 38 H MET 38 5.110 -5.065 5.910
290 HA MET 38 HA MET 38 4.571 -7.645 7.183
291 HB2 MET 38 2HB MET 38 2.638 -6.469 6.421
292 HB3 MET 38 1HB MET 38 3.331 -6.239 4.814
293 HG2 MET 38 2HG MET 38 3.156 -8.559 4.311
294 HG3 MET 38 1HG MET 38 2.906 -8.984 5.994
295 HE1 MET 38 3HE MET 38 0.863 -9.482 6.975
296 HE2 MET 38 1HE MET 38 -0.693 -8.687 6.690
297 HE3 MET 38 2HE MET 38 0.658 -7.773 7.356
298 HA PRO 39 HA PRO 39 7.886 -9.424 4.580
299 HB2 PRO 39 2HB PRO 39 6.312 -11.898 5.246
300 HB3 PRO 39 1HB PRO 39 8.069 -11.635 5.295
301 HG2 PRO 39 2HG PRO 39 6.624 -11.655 7.528
302 HG3 PRO 39 1HG PRO 39 7.980 -10.531 7.321
303 HD2 PRO 39 2HD PRO 39 5.046 -9.965 7.248
304 HD3 PRO 39 1HD PRO 39 6.384 -8.917 7.745
305 H GLU 40 H GLU 40 7.967 -10.138 2.431
306 HA GLU 40 HA GLU 40 5.607 -9.741 0.871
307 HB2 GLU 40 2HB GLU 40 6.981 -10.131 -1.033
308 HB3 GLU 40 1HB GLU 40 7.999 -9.286 0.134
309 HG2 GLU 40 2HG GLU 40 8.673 -11.709 0.901
310 HG3 GLU 40 1HG GLU 40 8.058 -12.185 -0.683
311 H GLY 41 H GLY 41 4.001 -11.147 0.742
312 HA2 GLY 41 2HA GLY 41 3.425 -13.365 -0.279
313 HA3 GLY 41 1HA GLY 41 4.598 -14.059 0.838
314 H LYS 42 H LYS 42 3.563 -11.880 2.820
315 HA LYS 42 HA LYS 42 1.803 -13.602 4.234
316 HB2 LYS 42 2HB LYS 42 2.887 -10.858 4.590
317 HB3 LYS 42 1HB LYS 42 1.365 -11.171 5.418
318 HG2 LYS 42 2HG LYS 42 3.630 -13.155 5.644
319 HG3 LYS 42 1HG LYS 42 3.642 -11.699 6.633
320 HD2 LYS 42 2HD LYS 42 1.637 -12.278 7.736
321 HD3 LYS 42 1HD LYS 42 1.209 -13.476 6.515
322 HE2 LYS 42 2HE LYS 42 3.103 -14.885 7.218
323 HE3 LYS 42 1HE LYS 42 3.558 -13.680 8.423
324 HZ1 LYS 42 3HZ LYS 42 2.273 -15.391 9.467
325 HZ2 LYS 42 1HZ LYS 42 1.026 -15.226 8.329
326 HZ3 LYS 42 2HZ LYS 42 1.345 -13.969 9.428
327 H VAL 43 H VAL 43 0.348 -14.064 2.516
328 HA VAL 43 HA VAL 43 -1.297 -12.517 1.048
329 HB VAL 43 HB VAL 43 -2.339 -14.867 2.625
330 HG11 VAL 43 1HG1 VAL 43 -4.031 -13.678 1.328
331 HG12 VAL 43 2HG1 VAL 43 -3.657 -15.204 0.525
332 HG13 VAL 43 3HG1 VAL 43 -2.992 -13.693 -0.096
333 HG21 VAL 43 3HG2 VAL 43 -1.507 -16.162 0.587
334 HG22 VAL 43 1HG2 VAL 43 -0.255 -15.592 1.690
335 HG23 VAL 43 2HG2 VAL 43 -0.558 -14.734 0.179
336 H MET 44 H MET 44 -2.808 -11.021 1.322
337 HA MET 44 HA MET 44 -3.952 -10.613 4.032
338 HB2 MET 44 2HB MET 44 -3.794 -8.567 1.824
339 HB3 MET 44 1HB MET 44 -4.167 -8.298 3.505
340 HG2 MET 44 2HG MET 44 -1.921 -8.727 4.175
341 HG3 MET 44 1HG MET 44 -1.501 -9.392 2.599
342 HE1 MET 44 3HE MET 44 -0.974 -6.586 0.268
343 HE2 MET 44 1HE MET 44 -2.601 -7.265 0.378
344 HE3 MET 44 2HE MET 44 -1.196 -8.305 0.575
345 H GLU 45 H GLU 45 -6.167 -10.569 4.222
346 HA GLU 45 HA GLU 45 -7.715 -11.206 1.765
347 HB2 GLU 45 2HB GLU 45 -7.648 -12.958 3.540
348 HB3 GLU 45 1HB GLU 45 -8.420 -11.816 4.644
349 HG2 GLU 45 2HG GLU 45 -10.381 -11.678 3.245
350 HG3 GLU 45 1HG GLU 45 -9.595 -12.606 1.965
351 H THR 46 H THR 46 -9.053 -9.695 1.042
352 HA THR 46 HA THR 46 -9.655 -7.359 2.635
353 HB THR 46 HB THR 46 -10.679 -6.484 0.664
354 HG1 THR 46 1HG THR 46 -11.813 -7.824 -0.458
355 HG21 THR 46 3HG2 THR 46 -8.410 -8.256 -0.251
356 HG22 THR 46 1HG2 THR 46 -8.180 -6.775 0.672
357 HG23 THR 46 2HG2 THR 46 -8.894 -6.707 -0.940
358 H ARG 47 H ARG 47 -12.033 -6.558 2.518
359 HA ARG 47 HA ARG 47 -13.619 -8.360 4.047
360 HB2 ARG 47 2HB ARG 47 -14.371 -5.772 2.663
361 HB3 ARG 47 1HB ARG 47 -15.373 -6.621 3.844
362 HG2 ARG 47 2HG ARG 47 -13.569 -6.401 5.524
363 HG3 ARG 47 1HG ARG 47 -12.590 -5.524 4.347
364 HD2 ARG 47 2HD ARG 47 -14.366 -3.801 4.180
365 HD3 ARG 47 1HD ARG 47 -15.298 -4.662 5.401
366 HE ARG 47 HE ARG 47 -12.745 -4.161 6.459
367 HH11 ARG 47 1HH2 ARG 47 -15.565 -2.474 5.374
368 HH12 ARG 47 2HH2 ARG 47 -15.345 -1.134 6.448
369 HH21 ARG 47 1HH1 ARG 47 -12.450 -2.406 7.868
370 HH22 ARG 47 2HH1 ARG 47 -13.581 -1.095 7.861
371 H ASP 48 H ASP 48 -13.619 -7.363 0.661
372 HA ASP 48 HA ASP 48 -16.029 -8.757 -0.023
373 HB2 ASP 48 2HB ASP 48 -13.767 -7.690 -1.728
374 HB3 ASP 48 1HB ASP 48 -15.273 -8.354 -2.368
375 H GLY 49 H GLY 49 -13.063 -9.862 0.902
376 HA2 GLY 49 2HA GLY 49 -12.283 -12.051 0.980
377 HA3 GLY 49 1HA GLY 49 -13.598 -12.527 -0.094
378 H THR 50 H THR 50 -11.273 -9.942 -0.715
379 HA THR 50 HA THR 50 -10.493 -11.266 -3.215
380 HB THR 50 HB THR 50 -9.691 -8.537 -2.185
381 HG1 THR 50 1HG THR 50 -11.982 -8.847 -2.420
382 HG21 THR 50 3HG2 THR 50 -9.795 -9.656 -4.996
383 HG22 THR 50 1HG2 THR 50 -8.326 -9.561 -4.025
384 HG23 THR 50 2HG2 THR 50 -9.161 -8.085 -4.504
385 H LYS 51 H LYS 51 -8.680 -12.417 -3.384
386 HA LYS 51 HA LYS 51 -6.788 -12.493 -1.184
387 HB2 LYS 51 2HB LYS 51 -7.483 -14.551 -2.389
388 HB3 LYS 51 1HB LYS 51 -6.700 -13.933 -3.846
389 HG2 LYS 51 2HG LYS 51 -4.540 -13.845 -2.649
390 HG3 LYS 51 1HG LYS 51 -5.321 -14.459 -1.193
391 HD2 LYS 51 2HD LYS 51 -5.208 -15.918 -3.851
392 HD3 LYS 51 1HD LYS 51 -4.161 -16.252 -2.472
393 HE2 LYS 51 2HE LYS 51 -5.821 -17.834 -2.102
394 HE3 LYS 51 1HE LYS 51 -6.505 -16.483 -1.200
395 HZ1 LYS 51 3HZ LYS 51 -7.712 -17.823 -3.236
396 HZ2 LYS 51 1HZ LYS 51 -7.160 -16.408 -3.989
397 HZ3 LYS 51 2HZ LYS 51 -8.180 -16.305 -2.632
398 H ILE 52 H ILE 52 -5.385 -10.878 -1.028
399 HA ILE 52 HA ILE 52 -3.888 -10.035 -3.453
400 HB ILE 52 HB ILE 52 -3.666 -7.814 -2.080
401 HG12 ILE 52 2HG1 ILE 52 -6.283 -8.845 -0.978
402 HG13 ILE 52 1HG1 ILE 52 -4.781 -8.917 -0.082
403 HG21 ILE 52 1HG2 ILE 52 -6.356 -8.554 -3.263
404 HG22 ILE 52 2HG2 ILE 52 -4.943 -8.100 -4.222
405 HG23 ILE 52 3HG2 ILE 52 -5.680 -6.931 -3.123
406 HD11 ILE 52 3HD1 ILE 52 -5.845 -6.890 0.601
407 HD12 ILE 52 1HD1 ILE 52 -6.242 -6.465 -1.061
408 HD13 ILE 52 2HD1 ILE 52 -4.570 -6.398 -0.508
409 H ILE 53 H ILE 53 -1.800 -10.479 -3.312
410 HA ILE 53 HA ILE 53 -0.629 -11.246 -0.742
411 HB ILE 53 HB ILE 53 0.621 -11.319 -3.491
412 HG12 ILE 53 2HG1 ILE 53 -0.796 -13.538 -1.979
413 HG13 ILE 53 1HG1 ILE 53 -1.503 -12.653 -3.334
414 HG21 ILE 53 1HG2 ILE 53 1.251 -12.751 -0.892
415 HG22 ILE 53 2HG2 ILE 53 2.193 -11.435 -1.594
416 HG23 ILE 53 3HG2 ILE 53 2.096 -12.991 -2.421
417 HD11 ILE 53 3HD1 ILE 53 -0.508 -14.753 -4.127
418 HD12 ILE 53 1HD1 ILE 53 1.044 -14.301 -3.420
419 HD13 ILE 53 2HD1 ILE 53 0.387 -13.376 -4.770
420 H MET 54 H MET 54 0.808 -10.066 0.378
421 HA MET 54 HA MET 54 1.200 -7.333 -0.151
422 HB2 MET 54 2HB MET 54 1.466 -8.444 2.089
423 HB3 MET 54 1HB MET 54 2.996 -9.112 1.517
424 HG2 MET 54 2HG MET 54 3.627 -7.128 2.649
425 HG3 MET 54 1HG MET 54 3.639 -6.674 0.957
426 HE1 MET 54 3HE MET 54 3.579 -4.093 1.864
427 HE2 MET 54 1HE MET 54 2.030 -3.424 1.327
428 HE3 MET 54 2HE MET 54 2.903 -4.562 0.306
429 H LYS 55 H LYS 55 1.784 -7.384 -2.405
430 HA LYS 55 HA LYS 55 4.227 -8.540 -3.322
431 HB2 LYS 55 2HB LYS 55 2.286 -7.968 -4.794
432 HB3 LYS 55 1HB LYS 55 2.637 -6.260 -4.528
433 HG2 LYS 55 2HG LYS 55 4.708 -6.388 -5.661
434 HG3 LYS 55 1HG LYS 55 4.757 -8.147 -5.562
435 HD2 LYS 55 2HD LYS 55 4.159 -7.351 -7.844
436 HD3 LYS 55 1HD LYS 55 2.873 -8.316 -7.118
437 HE2 LYS 55 2HE LYS 55 1.572 -6.387 -6.610
438 HE3 LYS 55 1HE LYS 55 2.928 -5.301 -6.912
439 HZ1 LYS 55 3HZ LYS 55 2.194 -7.017 -9.128
440 HZ2 LYS 55 1HZ LYS 55 2.608 -5.372 -9.118
441 HZ3 LYS 55 2HZ LYS 55 1.032 -5.852 -8.705
442 H GLY 56 H GLY 56 3.323 -5.119 -3.110
443 HA2 GLY 56 2HA GLY 56 5.983 -4.155 -3.216
444 HA3 GLY 56 1HA GLY 56 4.560 -3.224 -2.767
445 H ASN 57 H ASN 57 6.516 -5.879 -1.364
446 HA ASN 57 HA ASN 57 5.921 -5.190 1.322
447 HB2 ASN 57 2HB ASN 57 6.741 -7.410 0.770
448 HB3 ASN 57 1HB ASN 57 8.252 -6.733 0.154
449 HD21 ASN 57 1HD2 ASN 57 6.700 -5.418 3.054
450 HD22 ASN 57 2HD2 ASN 57 7.876 -5.984 4.148
451 H GLU 58 H GLU 58 7.618 -3.522 -0.962
452 HA GLU 58 HA GLU 58 9.714 -2.463 0.760
453 HB2 GLU 58 2HB GLU 58 10.132 -0.962 -1.230
454 HB3 GLU 58 1HB GLU 58 10.278 -2.687 -1.561
455 HG2 GLU 58 2HG GLU 58 8.065 -2.753 -2.539
456 HG3 GLU 58 1HG GLU 58 7.754 -1.086 -2.053
457 H ILE 59 H ILE 59 7.495 -2.016 2.114
458 HA ILE 59 HA ILE 59 5.852 0.129 1.655
459 HB ILE 59 HB ILE 59 5.936 0.462 4.182
460 HG12 ILE 59 2HG1 ILE 59 7.751 -1.962 4.018
461 HG13 ILE 59 1HG1 ILE 59 8.339 -0.327 4.338
462 HG21 ILE 59 1HG2 ILE 59 5.511 -2.297 2.999
463 HG22 ILE 59 2HG2 ILE 59 4.301 -1.024 3.172
464 HG23 ILE 59 3HG2 ILE 59 4.963 -1.814 4.603
465 HD11 ILE 59 3HD1 ILE 59 6.187 -1.657 6.002
466 HD12 ILE 59 1HD1 ILE 59 7.074 -0.178 6.372
467 HD13 ILE 59 2HD1 ILE 59 7.902 -1.735 6.406
468 H PHE 60 H PHE 60 9.237 0.204 1.919
469 HA PHE 60 HA PHE 60 9.851 2.612 3.109
470 HB2 PHE 60 2HB PHE 60 11.051 1.324 0.651
471 HB3 PHE 60 1HB PHE 60 11.755 2.723 1.460
472 HD1 PHE 60 1HD PHE 60 12.486 2.545 3.856
473 HD2 PHE 60 2HD PHE 60 11.255 -0.877 1.570
474 HE1 PHE 60 1HE PHE 60 13.561 1.048 5.517
475 HE2 PHE 60 2HE PHE 60 12.329 -2.373 3.230
476 HZ PHE 60 HZ PHE 60 13.483 -1.410 5.204
477 H ARG 61 H ARG 61 8.290 2.032 0.041
478 HA ARG 61 HA ARG 61 8.668 4.450 -1.267
479 HB2 ARG 61 2HB ARG 61 6.261 2.625 -1.180
480 HB3 ARG 61 1HB ARG 61 6.387 4.007 -2.269
481 HG2 ARG 61 2HG ARG 61 8.539 3.047 -3.139
482 HG3 ARG 61 1HG ARG 61 8.241 1.613 -2.157
483 HD2 ARG 61 2HD ARG 61 7.444 1.237 -4.443
484 HD3 ARG 61 1HD ARG 61 6.083 1.276 -3.327
485 HE ARG 61 HE ARG 61 5.316 3.146 -4.451
486 HH11 ARG 61 1HH2 ARG 61 8.698 2.688 -5.018
487 HH12 ARG 61 2HH2 ARG 61 8.823 3.980 -6.163
488 HH21 ARG 61 1HH1 ARG 61 5.471 4.843 -5.953
489 HH22 ARG 61 2HH1 ARG 61 6.996 5.200 -6.693
490 H LEU 62 H LEU 62 6.097 3.606 1.061
491 HA LEU 62 HA LEU 62 4.860 6.144 1.065
492 HB2 LEU 62 2HB LEU 62 4.137 3.787 2.071
493 HB3 LEU 62 1HB LEU 62 4.854 4.440 3.541
494 HG LEU 62 HG LEU 62 2.610 5.667 1.908
495 HD11 LEU 62 1HD1 LEU 62 2.640 4.797 4.806
496 HD12 LEU 62 2HD1 LEU 62 2.137 3.728 3.497
497 HD13 LEU 62 3HD1 LEU 62 1.240 5.212 3.817
498 HD21 LEU 62 3HD2 LEU 62 2.626 7.320 3.904
499 HD22 LEU 62 1HD2 LEU 62 3.868 7.527 2.673
500 HD23 LEU 62 2HD2 LEU 62 4.264 6.743 4.201
501 H ASP 63 H ASP 63 7.225 4.705 3.317
502 HA ASP 63 HA ASP 63 7.532 6.951 4.979
503 HB2 ASP 63 2HB ASP 63 9.587 4.835 4.298
504 HB3 ASP 63 1HB ASP 63 9.625 5.906 5.695
505 H GLU 64 H GLU 64 9.217 8.514 5.079
506 HA GLU 64 HA GLU 64 10.484 10.201 4.166
507 HB2 GLU 64 2HB GLU 64 11.489 7.933 2.430
508 HB3 GLU 64 1HB GLU 64 12.286 9.490 2.658
509 HG2 GLU 64 2HG GLU 64 11.633 7.596 4.929
510 HG3 GLU 64 1HG GLU 64 13.194 7.637 4.113
511 H ALA 65 H ALA 65 11.378 10.686 1.589
512 HA ALA 65 HA ALA 65 9.391 10.363 -0.409
513 HB1 ALA 65 1HB ALA 65 9.384 13.007 1.065
514 HB2 ALA 65 2HB ALA 65 8.059 11.845 0.989
515 HB3 ALA 65 3HB ALA 65 8.562 12.707 -0.466
516 H LEU 66 H LEU 66 10.704 10.294 -2.111
517 HA LEU 66 HA LEU 66 13.217 11.664 -2.210
518 HB2 LEU 66 2HB LEU 66 11.626 10.041 -4.194
519 HB3 LEU 66 1HB LEU 66 13.118 10.857 -4.664
520 HG LEU 66 HG LEU 66 14.383 9.640 -2.996
521 HD11 LEU 66 1HD1 LEU 66 13.112 7.808 -1.692
522 HD12 LEU 66 2HD1 LEU 66 11.648 8.697 -2.117
523 HD13 LEU 66 3HD1 LEU 66 12.904 9.472 -1.148
524 HD21 LEU 66 3HD2 LEU 66 14.014 7.308 -3.800
525 HD22 LEU 66 1HD2 LEU 66 14.022 8.477 -5.119
526 HD23 LEU 66 2HD2 LEU 66 12.493 7.825 -4.529
527 H ARG 67 H ARG 67 10.560 11.861 -4.577
528 HA ARG 67 HA ARG 67 11.348 14.381 -5.579
529 HB2 ARG 67 2HB ARG 67 8.601 13.109 -5.679
530 HB3 ARG 67 1HB ARG 67 9.205 14.385 -6.738
531 HG2 ARG 67 2HG ARG 67 11.001 12.850 -7.520
532 HG3 ARG 67 1HG ARG 67 10.314 11.571 -6.518
533 HD2 ARG 67 2HD ARG 67 8.870 13.012 -8.759
534 HD3 ARG 67 1HD ARG 67 9.538 11.384 -8.853
535 HE ARG 67 HE ARG 67 7.788 11.489 -6.652
536 HH11 ARG 67 1HH2 ARG 67 7.779 11.711 -10.106
537 HH12 ARG 67 2HH2 ARG 67 6.177 11.074 -10.280
538 HH21 ARG 67 1HH1 ARG 67 5.687 10.653 -6.873
539 HH22 ARG 67 2HH1 ARG 67 4.993 10.475 -8.450
540 H LYS 68 H LYS 68 9.378 16.119 -5.649
541 HA LYS 68 HA LYS 68 9.443 17.428 -3.168
542 HB2 LYS 68 2HB LYS 68 8.999 18.518 -5.377
543 HB3 LYS 68 1HB LYS 68 7.385 17.806 -5.355
544 HG2 LYS 68 2HG LYS 68 6.842 18.989 -3.295
545 HG3 LYS 68 1HG LYS 68 8.485 19.619 -3.189
546 HD2 LYS 68 2HD LYS 68 8.160 20.812 -5.334
547 HD3 LYS 68 1HD LYS 68 6.506 20.207 -5.410
548 HE2 LYS 68 2HE LYS 68 7.638 21.958 -3.208
549 HE3 LYS 68 1HE LYS 68 6.559 22.497 -4.494
550 HZ1 LYS 68 3HZ LYS 68 5.979 20.627 -2.280
551 HZ2 LYS 68 1HZ LYS 68 5.004 20.694 -3.667
552 HZ3 LYS 68 2HZ LYS 68 5.176 22.069 -2.682
553 H GLY 69 H GLY 69 6.488 16.181 -4.730
554 HA2 GLY 69 2HA GLY 69 5.593 14.550 -2.650
555 HA3 GLY 69 1HA GLY 69 4.972 16.168 -2.334
556 H HIS 70 H HIS 70 3.531 17.133 -3.845
557 HA HIS 70 HA HIS 70 2.625 15.756 -6.182
558 HB2 HIS 70 2HB HIS 70 0.367 15.195 -5.386
559 HB3 HIS 70 1HB HIS 70 1.592 14.299 -4.490
560 HD2 HIS 70 2HD HIS 70 1.900 17.596 -2.902
561 HE1 HIS 70 1HE HIS 70 -1.390 15.883 -0.884
562 HE2 HIS 70 2HE HIS 70 0.327 17.754 -0.823
563 H SER 71 H SER 71 0.239 16.751 -6.675
564 HA SER 71 HA SER 71 -0.847 18.652 -7.368
565 HB2 SER 71 2HB SER 71 0.170 19.823 -4.772
566 HB3 SER 71 1HB SER 71 -1.228 20.354 -5.702
567 HG SER 71 HG SER 71 -2.024 18.143 -5.366
568 H GLU 72 H GLU 72 2.094 18.268 -7.908
569 HA GLU 72 HA GLU 72 3.447 20.734 -7.848
570 HB2 GLU 72 2HB GLU 72 4.857 19.763 -9.643
571 HB3 GLU 72 1HB GLU 72 4.608 18.637 -8.308
572 HG2 GLU 72 2HG GLU 72 2.725 17.606 -9.599
573 HG3 GLU 72 1HG GLU 72 3.133 18.654 -10.956
574 H GLY 73 H GLY 73 4.188 21.672 -10.140
575 HA2 GLY 73 2HA GLY 73 2.330 21.831 -12.248
576 HA3 GLY 73 1HA GLY 73 2.022 23.160 -11.133
577 H GLY 74 H GLY 74 2.658 24.714 -12.672
578 HA2 GLY 74 2HA GLY 74 4.147 26.187 -13.627
579 HA3 GLY 74 1HA GLY 74 5.378 25.486 -12.578
580 H1 HOH 201 H2 HOH 77 0.516 12.835 -1.817
581 H2 HOH 201 H1 HOH 77 -0.341 12.191 -0.749
Start of MODEL 4
1 H1 VAL 1 1H VAL 1 -3.305 14.000 -4.851
2 H2 VAL 1 2H VAL 1 -1.621 14.079 -4.641
3 HA VAL 1 HA VAL 1 -2.293 13.551 -6.946
4 HB VAL 1 HB VAL 1 -0.845 11.273 -5.572
5 HG11 VAL 1 2HG1 VAL 1 0.481 11.349 -7.703
6 HG12 VAL 1 3HG1 VAL 1 -0.651 12.557 -8.312
7 HG13 VAL 1 1HG1 VAL 1 -1.214 10.926 -7.948
8 HG21 VAL 1 1HG2 VAL 1 0.118 14.056 -6.305
9 HG22 VAL 1 2HG2 VAL 1 1.192 12.719 -5.890
10 HG23 VAL 1 3HG2 VAL 1 0.062 13.347 -4.690
11 H ASP 2 H ASP 2 -4.722 13.179 -6.431
12 HA ASP 2 HA ASP 2 -5.370 10.480 -7.313
13 HB2 ASP 2 2HB ASP 2 -6.766 11.526 -4.853
14 HB3 ASP 2 1HB ASP 2 -6.783 9.892 -5.517
15 H MET 3 H MET 3 -6.958 10.579 -8.772
16 HA MET 3 HA MET 3 -8.236 13.092 -9.349
17 HB2 MET 3 2HB MET 3 -8.752 10.347 -10.522
18 HB3 MET 3 1HB MET 3 -9.286 11.888 -11.197
19 HG2 MET 3 2HG MET 3 -7.023 12.585 -11.609
20 HG3 MET 3 1HG MET 3 -6.376 11.227 -10.688
21 HE1 MET 3 3HE MET 3 -8.930 12.002 -13.541
22 HE2 MET 3 1HE MET 3 -8.063 11.314 -14.922
23 HE3 MET 3 2HE MET 3 -7.345 12.626 -13.994
24 H SER 4 H SER 4 -9.411 9.879 -8.332
25 HA SER 4 HA SER 4 -12.073 10.906 -7.811
26 HB2 SER 4 2HB SER 4 -10.863 8.197 -7.212
27 HB3 SER 4 1HB SER 4 -12.572 8.611 -7.108
28 HG SER 4 HG SER 4 -12.239 7.725 -9.108
29 H ASN 5 H ASN 5 -9.469 9.453 -5.848
30 HA ASN 5 HA ASN 5 -9.740 11.273 -3.708
31 HB2 ASN 5 2HB ASN 5 -10.709 9.627 -2.038
32 HB3 ASN 5 1HB ASN 5 -11.854 10.289 -3.203
33 HD21 ASN 5 1HD2 ASN 5 -11.976 7.647 -1.774
34 HD22 ASN 5 2HD2 ASN 5 -12.045 6.477 -3.001
35 H VAL 6 H VAL 6 -9.246 7.752 -4.073
36 HA VAL 6 HA VAL 6 -6.463 8.096 -3.103
37 HB VAL 6 HB VAL 6 -6.722 5.948 -1.879
38 HG11 VAL 6 1HG1 VAL 6 -8.665 8.155 -1.132
39 HG12 VAL 6 2HG1 VAL 6 -6.967 8.060 -0.668
40 HG13 VAL 6 3HG1 VAL 6 -8.120 6.883 -0.039
41 HG21 VAL 6 3HG2 VAL 6 -9.089 5.195 -1.446
42 HG22 VAL 6 1HG2 VAL 6 -8.562 4.962 -3.112
43 HG23 VAL 6 2HG2 VAL 6 -9.618 6.314 -2.702
44 H VAL 7 H VAL 7 -4.941 6.874 -4.125
45 HA VAL 7 HA VAL 7 -5.414 5.948 -6.722
46 HB VAL 7 HB VAL 7 -3.170 4.921 -6.560
47 HG11 VAL 7 1HG1 VAL 7 -1.965 6.978 -6.161
48 HG12 VAL 7 2HG1 VAL 7 -3.273 7.606 -5.156
49 HG13 VAL 7 3HG1 VAL 7 -3.514 7.400 -6.891
50 HG21 VAL 7 3HG2 VAL 7 -1.973 5.283 -4.331
51 HG22 VAL 7 1HG2 VAL 7 -3.186 4.002 -4.346
52 HG23 VAL 7 2HG2 VAL 7 -3.566 5.569 -3.628
53 H LYS 8 H LYS 8 -5.282 4.204 -3.644
54 HA LYS 8 HA LYS 8 -7.016 2.144 -4.552
55 HB2 LYS 8 2HB LYS 8 -4.843 1.555 -5.740
56 HB3 LYS 8 1HB LYS 8 -4.156 1.259 -4.147
57 HG2 LYS 8 2HG LYS 8 -4.908 -0.886 -4.634
58 HG3 LYS 8 1HG LYS 8 -6.347 -0.244 -3.850
59 HD2 LYS 8 2HD LYS 8 -7.101 -1.282 -5.874
60 HD3 LYS 8 1HD LYS 8 -7.178 0.453 -6.149
61 HE2 LYS 8 2HE LYS 8 -4.604 -0.857 -6.914
62 HE3 LYS 8 1HE LYS 8 -6.008 -1.257 -7.903
63 HZ1 LYS 8 3HZ LYS 8 -5.420 0.630 -8.941
64 HZ2 LYS 8 1HZ LYS 8 -4.621 1.276 -7.592
65 HZ3 LYS 8 2HZ LYS 8 -6.313 1.363 -7.695
66 H THR 9 H THR 9 -7.796 0.947 -2.853
67 HA THR 9 HA THR 9 -6.380 0.882 -0.315
68 HB THR 9 HB THR 9 -9.122 2.144 -0.423
69 HG1 THR 9 1HG THR 9 -7.774 3.613 -1.328
70 HG21 THR 9 3HG2 THR 9 -8.410 0.968 1.672
71 HG22 THR 9 1HG2 THR 9 -8.661 2.699 1.894
72 HG23 THR 9 2HG2 THR 9 -7.025 2.056 1.761
73 H TYR 10 H TYR 10 -6.501 -1.233 0.107
74 HA TYR 10 HA TYR 10 -9.041 -2.675 -0.391
75 HB2 TYR 10 2HB TYR 10 -6.319 -3.835 0.255
76 HB3 TYR 10 1HB TYR 10 -7.750 -4.717 -0.248
77 HD1 TYR 10 2HD TYR 10 -8.835 -3.399 -2.533
78 HD2 TYR 10 1HD TYR 10 -4.692 -3.798 -1.428
79 HE1 TYR 10 2HE TYR 10 -8.171 -3.125 -4.897
80 HE2 TYR 10 1HE TYR 10 -4.042 -3.527 -3.798
81 HH TYR 10 HH TYR 10 -5.865 -3.991 -6.271
82 H ASP 11 H ASP 11 -10.323 -3.031 1.294
83 HA ASP 11 HA ASP 11 -9.480 -2.413 3.968
84 HB2 ASP 11 2HB ASP 11 -12.034 -3.509 2.800
85 HB3 ASP 11 1HB ASP 11 -11.809 -3.245 4.529
86 H LEU 12 H LEU 12 -7.946 -3.824 4.700
87 HA LEU 12 HA LEU 12 -8.079 -6.657 4.377
88 HB2 LEU 12 2HB LEU 12 -6.307 -4.693 5.611
89 HB3 LEU 12 1HB LEU 12 -6.473 -6.106 6.646
90 HG LEU 12 HG LEU 12 -5.749 -7.580 4.858
91 HD11 LEU 12 1HD1 LEU 12 -6.216 -5.172 3.160
92 HD12 LEU 12 2HD1 LEU 12 -6.448 -6.880 2.790
93 HD13 LEU 12 3HD1 LEU 12 -4.836 -6.185 2.725
94 HD21 LEU 12 3HD2 LEU 12 -3.457 -6.366 4.322
95 HD22 LEU 12 1HD2 LEU 12 -3.847 -6.824 5.978
96 HD23 LEU 12 2HD2 LEU 12 -4.059 -5.156 5.448
97 H GLN 13 H GLN 13 -8.243 -8.191 6.206
98 HA GLN 13 HA GLN 13 -10.677 -7.692 7.678
99 HB2 GLN 13 2HB GLN 13 -10.388 -10.004 8.475
100 HB3 GLN 13 1HB GLN 13 -10.215 -9.908 6.719
101 HG2 GLN 13 2HG GLN 13 -7.729 -9.769 7.036
102 HG3 GLN 13 1HG GLN 13 -7.977 -10.057 8.759
103 HE21 GLN 13 1HE2 GLN 13 -10.184 -11.968 8.418
104 HE22 GLN 13 2HE2 GLN 13 -9.503 -13.389 7.772
105 H ASP 14 H ASP 14 -7.317 -7.334 8.250
106 HA ASP 14 HA ASP 14 -7.492 -7.538 11.144
107 HB2 ASP 14 2HB ASP 14 -5.439 -8.178 9.870
108 HB3 ASP 14 1HB ASP 14 -5.230 -6.481 9.438
109 H GLY 15 H GLY 15 -8.955 -5.459 9.368
110 HA2 GLY 15 2HA GLY 15 -9.778 -3.343 9.819
111 HA3 GLY 15 1HA GLY 15 -8.757 -3.298 11.257
112 H SER 16 H SER 16 -6.569 -4.136 9.127
113 HA SER 16 HA SER 16 -5.509 -1.481 8.835
114 HB2 SER 16 2HB SER 16 -4.154 -3.604 9.184
115 HB3 SER 16 1HB SER 16 -4.495 -3.994 7.499
116 HG SER 16 HG SER 16 -2.517 -2.646 8.201
117 H LYS 17 H LYS 17 -4.443 -1.112 6.497
118 HA LYS 17 HA LYS 17 -6.296 -1.731 4.325
119 HB2 LYS 17 2HB LYS 17 -5.830 1.083 5.338
120 HB3 LYS 17 1HB LYS 17 -6.497 0.717 3.747
121 HG2 LYS 17 2HG LYS 17 -8.284 -0.644 4.915
122 HG3 LYS 17 1HG LYS 17 -7.685 0.008 6.439
123 HD2 LYS 17 2HD LYS 17 -8.062 2.311 5.563
124 HD3 LYS 17 1HD LYS 17 -8.765 1.610 4.104
125 HE2 LYS 17 2HE LYS 17 -10.519 2.241 5.733
126 HE3 LYS 17 1HE LYS 17 -10.495 0.499 5.455
127 HZ1 LYS 17 3HZ LYS 17 -10.244 1.822 7.874
128 HZ2 LYS 17 1HZ LYS 17 -8.710 1.181 7.537
129 HZ3 LYS 17 2HZ LYS 17 -10.066 0.157 7.585
130 H VAL 18 H VAL 18 -5.109 -2.148 2.572
131 HA VAL 18 HA VAL 18 -2.299 -1.399 2.532
132 HB VAL 18 HB VAL 18 -3.513 -2.695 0.133
133 HG11 VAL 18 1HG1 VAL 18 -1.102 -2.387 0.287
134 HG12 VAL 18 2HG1 VAL 18 -1.484 -4.107 0.344
135 HG13 VAL 18 3HG1 VAL 18 -1.065 -3.249 1.826
136 HG21 VAL 18 3HG2 VAL 18 -3.226 -4.189 2.754
137 HG22 VAL 18 1HG2 VAL 18 -3.638 -4.898 1.190
138 HG23 VAL 18 2HG2 VAL 18 -4.757 -3.790 1.979
139 H HIS 19 H HIS 19 -1.321 -0.287 0.747
140 HA HIS 19 HA HIS 19 -3.075 1.324 -0.978
141 HB2 HIS 19 2HB HIS 19 -2.846 3.048 0.543
142 HB3 HIS 19 1HB HIS 19 -1.421 2.335 1.287
143 HD1 HIS 19 1HD HIS 19 -2.476 4.574 -1.550
144 HD2 HIS 19 2HD HIS 19 1.052 3.184 0.187
145 HE1 HIS 19 1HE HIS 19 -0.597 5.947 -2.549
146 HE2 HIS 19 2HE HIS 19 1.560 5.112 -1.501
147 H VAL 20 H VAL 20 -2.355 0.984 -2.971
148 HA VAL 20 HA VAL 20 0.455 0.220 -3.365
149 HB VAL 20 HB VAL 20 -0.222 -1.009 -5.194
150 HG11 VAL 20 1HG1 VAL 20 -2.351 -2.071 -4.738
151 HG12 VAL 20 2HG1 VAL 20 -2.878 -0.670 -3.807
152 HG13 VAL 20 3HG1 VAL 20 -1.593 -1.677 -3.200
153 HG21 VAL 20 3HG2 VAL 20 -0.976 0.712 -6.662
154 HG22 VAL 20 1HG2 VAL 20 -2.331 1.121 -5.609
155 HG23 VAL 20 2HG2 VAL 20 -2.340 -0.394 -6.512
156 H PHE 21 H PHE 21 1.758 1.166 -4.964
157 HA PHE 21 HA PHE 21 1.227 4.025 -5.357
158 HB2 PHE 21 2HB PHE 21 3.719 2.397 -5.911
159 HB3 PHE 21 1HB PHE 21 3.592 4.155 -5.934
160 HD1 PHE 21 1HD PHE 21 3.471 1.146 -3.785
161 HD2 PHE 21 2HD PHE 21 3.506 5.441 -3.893
162 HE1 PHE 21 1HE PHE 21 3.869 1.205 -1.338
163 HE2 PHE 21 2HE PHE 21 3.904 5.498 -1.444
164 HZ PHE 21 HZ PHE 21 4.084 3.380 -0.168
165 H LYS 22 H LYS 22 2.515 4.715 -7.551
166 HA LYS 22 HA LYS 22 0.785 3.887 -9.667
167 HB2 LYS 22 2HB LYS 22 1.805 6.170 -9.453
168 HB3 LYS 22 1HB LYS 22 3.361 5.459 -9.883
169 HG2 LYS 22 2HG LYS 22 2.469 4.702 -12.026
170 HG3 LYS 22 1HG LYS 22 0.864 5.298 -11.597
171 HD2 LYS 22 2HD LYS 22 1.729 7.595 -11.477
172 HD3 LYS 22 1HD LYS 22 3.348 7.015 -11.871
173 HE2 LYS 22 2HE LYS 22 2.256 7.884 -13.889
174 HE3 LYS 22 1HE LYS 22 2.492 6.142 -14.031
175 HZ1 LYS 22 3HZ LYS 22 0.189 7.245 -14.549
176 HZ2 LYS 22 1HZ LYS 22 -0.015 7.115 -12.870
177 HZ3 LYS 22 2HZ LYS 22 0.281 5.723 -13.799
178 H ASP 23 H ASP 23 3.804 2.767 -8.453
179 HA ASP 23 HA ASP 23 4.696 1.511 -10.891
180 HB2 ASP 23 2HB ASP 23 5.554 1.067 -8.021
181 HB3 ASP 23 1HB ASP 23 6.389 0.456 -9.451
182 H GLY 24 H GLY 24 2.150 0.908 -8.931
183 HA2 GLY 24 2HA GLY 24 0.658 -0.879 -9.030
184 HA3 GLY 24 1HA GLY 24 1.872 -1.819 -9.893
185 H LYS 25 H LYS 25 3.739 -0.826 -7.553
186 HA LYS 25 HA LYS 25 3.613 -3.249 -6.053
187 HB2 LYS 25 2HB LYS 25 5.059 -0.622 -5.676
188 HB3 LYS 25 1HB LYS 25 5.191 -1.925 -4.500
189 HG2 LYS 25 2HG LYS 25 5.911 -3.454 -6.360
190 HG3 LYS 25 1HG LYS 25 5.932 -2.054 -7.433
191 HD2 LYS 25 2HD LYS 25 7.523 -0.947 -5.811
192 HD3 LYS 25 1HD LYS 25 7.620 -2.486 -4.958
193 HE2 LYS 25 2HE LYS 25 8.508 -3.594 -6.911
194 HE3 LYS 25 1HE LYS 25 8.231 -2.165 -7.906
195 HZ1 LYS 25 3HZ LYS 25 10.521 -2.767 -6.546
196 HZ2 LYS 25 1HZ LYS 25 9.785 -1.578 -5.587
197 HZ3 LYS 25 2HZ LYS 25 10.121 -1.260 -7.222
198 H MET 26 H MET 26 2.827 -3.632 -3.985
199 HA MET 26 HA MET 26 0.597 -2.006 -3.191
200 HB2 MET 26 2HB MET 26 1.491 -4.721 -2.772
201 HB3 MET 26 1HB MET 26 1.108 -4.002 -1.211
202 HG2 MET 26 2HG MET 26 -1.115 -3.494 -1.889
203 HG3 MET 26 1HG MET 26 -0.761 -3.817 -3.586
204 HE1 MET 26 3HE MET 26 -1.589 -5.704 -4.661
205 HE2 MET 26 1HE MET 26 -1.262 -7.373 -4.173
206 HE3 MET 26 2HE MET 26 0.073 -6.254 -4.443
207 H GLY 27 H GLY 27 0.497 -2.043 -0.509
208 HA2 GLY 27 2HA GLY 27 2.945 -1.121 0.711
209 HA3 GLY 27 1HA GLY 27 1.826 0.193 0.355
210 H MET 28 H MET 28 2.788 -1.823 2.737
211 HA MET 28 HA MET 28 0.182 -2.373 3.912
212 HB2 MET 28 2HB MET 28 2.247 -3.901 4.019
213 HB3 MET 28 1HB MET 28 2.872 -2.775 5.217
214 HG2 MET 28 2HG MET 28 1.730 -4.556 6.384
215 HG3 MET 28 1HG MET 28 0.770 -3.091 6.530
216 HE1 MET 28 3HE MET 28 -0.824 -4.519 7.433
217 HE2 MET 28 1HE MET 28 -2.033 -5.465 6.558
218 HE3 MET 28 2HE MET 28 -2.024 -3.709 6.428
219 H GLU 29 H GLU 29 -0.598 -0.238 4.243
220 HA GLU 29 HA GLU 29 0.831 1.358 6.296
221 HB2 GLU 29 2HB GLU 29 -1.472 2.291 4.582
222 HB3 GLU 29 1HB GLU 29 -0.302 3.267 5.471
223 HG2 GLU 29 2HG GLU 29 1.501 2.331 3.990
224 HG3 GLU 29 1HG GLU 29 0.243 1.549 3.037
225 H ASN 30 H ASN 30 0.137 0.665 8.251
226 HA ASN 30 HA ASN 30 -2.462 -0.352 8.771
227 HB2 ASN 30 2HB ASN 30 -1.825 -0.336 11.090
228 HB3 ASN 30 1HB ASN 30 -0.415 -0.817 10.146
229 HD21 ASN 30 1HD2 ASN 30 -0.382 2.243 9.299
230 HD22 ASN 30 2HD2 ASN 30 0.457 2.957 10.596
231 H LYS 31 H LYS 31 -3.672 0.749 10.771
232 HA LYS 31 HA LYS 31 -4.675 3.253 9.729
233 HB2 LYS 31 2HB LYS 31 -6.310 3.076 11.584
234 HB3 LYS 31 1HB LYS 31 -6.245 1.618 10.594
235 HG2 LYS 31 2HG LYS 31 -6.061 0.549 12.624
236 HG3 LYS 31 1HG LYS 31 -4.360 0.984 12.482
237 HD2 LYS 31 2HD LYS 31 -4.723 2.987 13.834
238 HD3 LYS 31 1HD LYS 31 -6.458 2.680 13.879
239 HE2 LYS 31 2HE LYS 31 -4.363 0.782 14.969
240 HE3 LYS 31 1HE LYS 31 -5.273 1.928 15.952
241 HZ1 LYS 31 3HZ LYS 31 -7.081 0.518 14.355
242 HZ2 LYS 31 1HZ LYS 31 -6.927 0.484 16.043
243 HZ3 LYS 31 2HZ LYS 31 -6.052 -0.618 15.088
244 H PHE 32 H PHE 32 -2.212 2.389 11.866
245 HA PHE 32 HA PHE 32 -2.480 4.641 13.661
246 HB2 PHE 32 2HB PHE 32 -1.302 2.268 13.988
247 HB3 PHE 32 1HB PHE 32 0.104 3.136 13.377
248 HD1 PHE 32 1HD PHE 32 -2.348 2.873 16.110
249 HD2 PHE 32 2HD PHE 32 1.091 4.988 14.645
250 HE1 PHE 32 1HE PHE 32 -2.018 3.887 18.350
251 HE2 PHE 32 2HE PHE 32 1.421 6.002 16.885
252 HZ PHE 32 HZ PHE 32 -0.132 5.452 18.737
253 H GLY 33 H GLY 33 -1.963 4.733 10.554
254 HA2 GLY 33 2HA GLY 33 -1.062 6.328 9.153
255 HA3 GLY 33 1HA GLY 33 -0.561 7.220 10.589
256 H LYS 34 H LYS 34 0.584 4.138 10.909
257 HA LYS 34 HA LYS 34 3.273 4.915 9.958
258 HB2 LYS 34 2HB LYS 34 2.444 2.712 11.864
259 HB3 LYS 34 1HB LYS 34 4.098 3.173 11.470
260 HG2 LYS 34 2HG LYS 34 2.155 5.209 12.568
261 HG3 LYS 34 1HG LYS 34 3.027 4.127 13.649
262 HD2 LYS 34 2HD LYS 34 5.175 4.906 12.572
263 HD3 LYS 34 1HD LYS 34 4.229 6.113 11.701
264 HE2 LYS 34 2HE LYS 34 3.417 7.015 13.862
265 HE3 LYS 34 1HE LYS 34 4.413 5.835 14.713
266 HZ1 LYS 34 3HZ LYS 34 5.448 8.062 14.465
267 HZ2 LYS 34 1HZ LYS 34 5.488 7.818 12.786
268 HZ3 LYS 34 2HZ LYS 34 6.375 6.795 13.813
269 H SER 35 H SER 35 4.580 2.716 9.514
270 HA SER 35 HA SER 35 3.040 1.222 7.456
271 HB2 SER 35 2HB SER 35 6.023 1.666 7.429
272 HB3 SER 35 1HB SER 35 4.984 1.130 6.113
273 HG SER 35 HG SER 35 3.975 3.391 6.870
274 H MET 36 H MET 36 2.736 -0.845 7.950
275 HA MET 36 HA MET 36 4.389 -2.130 10.003
276 HB2 MET 36 2HB MET 36 1.813 -2.879 8.615
277 HB3 MET 36 1HB MET 36 2.686 -4.009 9.652
278 HG2 MET 36 2HG MET 36 1.872 -1.235 10.554
279 HG3 MET 36 1HG MET 36 0.872 -2.666 10.816
280 HE1 MET 36 3HE MET 36 0.908 -2.004 13.317
281 HE2 MET 36 1HE MET 36 2.052 -0.678 13.073
282 HE3 MET 36 2HE MET 36 2.348 -1.882 14.324
283 H ASN 37 H ASN 37 6.170 -3.161 9.402
284 HA ASN 37 HA ASN 37 6.788 -3.849 6.722
285 HB2 ASN 37 2HB ASN 37 8.551 -3.399 8.326
286 HB3 ASN 37 1HB ASN 37 8.029 -4.750 9.329
287 HD21 ASN 37 1HD2 ASN 37 7.640 -5.566 6.058
288 HD22 ASN 37 2HD2 ASN 37 9.096 -6.424 5.848
289 H MET 38 H MET 38 5.174 -5.168 5.871
290 HA MET 38 HA MET 38 4.699 -7.781 7.135
291 HB2 MET 38 2HB MET 38 2.704 -6.621 6.484
292 HB3 MET 38 1HB MET 38 3.323 -6.358 4.850
293 HG2 MET 38 2HG MET 38 3.237 -8.708 4.366
294 HG3 MET 38 1HG MET 38 2.951 -9.106 6.052
295 HE1 MET 38 3HE MET 38 0.854 -7.937 7.361
296 HE2 MET 38 1HE MET 38 0.716 -9.650 6.937
297 HE3 MET 38 2HE MET 38 -0.660 -8.571 6.717
298 HA PRO 39 HA PRO 39 7.960 -9.422 4.394
299 HB2 PRO 39 2HB PRO 39 6.345 -11.913 4.880
300 HB3 PRO 39 1HB PRO 39 8.108 -11.686 4.930
301 HG2 PRO 39 2HG PRO 39 6.676 -11.837 7.172
302 HG3 PRO 39 1HG PRO 39 8.060 -10.736 7.033
303 HD2 PRO 39 2HD PRO 39 5.146 -10.088 7.058
304 HD3 PRO 39 1HD PRO 39 6.525 -9.102 7.574
305 H GLU 40 H GLU 40 8.053 -10.257 2.236
306 HA GLU 40 HA GLU 40 5.729 -9.638 0.638
307 HB2 GLU 40 2HB GLU 40 7.969 -9.035 -0.151
308 HB3 GLU 40 1HB GLU 40 8.443 -10.735 -0.129
309 HG2 GLU 40 2HG GLU 40 6.872 -11.284 -1.855
310 HG3 GLU 40 1HG GLU 40 6.114 -9.693 -1.754
311 H GLY 41 H GLY 41 4.224 -11.233 1.312
312 HA2 GLY 41 2HA GLY 41 3.692 -13.360 -0.211
313 HA3 GLY 41 1HA GLY 41 4.871 -14.054 0.899
314 H LYS 42 H LYS 42 3.564 -11.849 2.809
315 HA LYS 42 HA LYS 42 1.889 -13.736 4.174
316 HB2 LYS 42 2HB LYS 42 2.874 -10.972 4.645
317 HB3 LYS 42 1HB LYS 42 1.384 -11.404 5.474
318 HG2 LYS 42 2HG LYS 42 3.710 -13.319 5.585
319 HG3 LYS 42 1HG LYS 42 3.756 -11.878 6.594
320 HD2 LYS 42 2HD LYS 42 1.815 -12.487 7.785
321 HD3 LYS 42 1HD LYS 42 1.330 -13.667 6.565
322 HE2 LYS 42 2HE LYS 42 3.281 -15.068 7.145
323 HE3 LYS 42 1HE LYS 42 3.760 -13.893 8.368
324 HZ1 LYS 42 3HZ LYS 42 1.127 -15.259 8.343
325 HZ2 LYS 42 1HZ LYS 42 1.777 -14.301 9.583
326 HZ3 LYS 42 2HZ LYS 42 2.466 -15.813 9.231
327 H VAL 43 H VAL 43 0.441 -14.172 2.466
328 HA VAL 43 HA VAL 43 -1.213 -12.676 0.982
329 HB VAL 43 HB VAL 43 -2.314 -14.925 2.662
330 HG11 VAL 43 1HG1 VAL 43 -3.765 -15.302 0.821
331 HG12 VAL 43 2HG1 VAL 43 -2.798 -14.293 -0.251
332 HG13 VAL 43 3HG1 VAL 43 -3.752 -13.550 1.030
333 HG21 VAL 43 3HG2 VAL 43 -1.421 -16.350 0.702
334 HG22 VAL 43 1HG2 VAL 43 -0.247 -15.806 1.898
335 HG23 VAL 43 2HG2 VAL 43 -0.372 -14.980 0.347
336 H MET 44 H MET 44 -2.727 -11.147 1.228
337 HA MET 44 HA MET 44 -3.888 -10.708 3.931
338 HB2 MET 44 2HB MET 44 -3.669 -8.646 1.744
339 HB3 MET 44 1HB MET 44 -4.045 -8.390 3.433
340 HG2 MET 44 2HG MET 44 -1.798 -8.881 4.089
341 HG3 MET 44 1HG MET 44 -1.393 -9.502 2.490
342 HE1 MET 44 3HE MET 44 -1.495 -8.367 0.463
343 HE2 MET 44 1HE MET 44 -0.940 -6.708 0.206
344 HE3 MET 44 2HE MET 44 -2.652 -7.040 0.414
345 H GLU 45 H GLU 45 -6.094 -10.794 4.072
346 HA GLU 45 HA GLU 45 -7.603 -11.190 1.542
347 HB2 GLU 45 2HB GLU 45 -7.420 -13.125 3.185
348 HB3 GLU 45 1HB GLU 45 -8.410 -12.158 4.283
349 HG2 GLU 45 2HG GLU 45 -9.967 -13.492 3.107
350 HG3 GLU 45 1HG GLU 45 -10.055 -11.922 2.312
351 H THR 46 H THR 46 -8.985 -9.644 1.022
352 HA THR 46 HA THR 46 -9.639 -7.538 2.877
353 HB THR 46 HB THR 46 -10.726 -6.485 1.044
354 HG1 THR 46 1HG THR 46 -11.935 -8.334 0.412
355 HG21 THR 46 3HG2 THR 46 -9.031 -6.618 -0.713
356 HG22 THR 46 1HG2 THR 46 -8.461 -8.157 -0.069
357 HG23 THR 46 2HG2 THR 46 -8.261 -6.683 0.874
358 H ARG 47 H ARG 47 -12.003 -6.825 3.028
359 HA ARG 47 HA ARG 47 -13.476 -8.845 4.368
360 HB2 ARG 47 2HB ARG 47 -14.327 -6.120 3.361
361 HB3 ARG 47 1HB ARG 47 -15.289 -7.139 4.435
362 HG2 ARG 47 2HG ARG 47 -13.493 -7.101 6.110
363 HG3 ARG 47 1HG ARG 47 -12.493 -6.125 5.033
364 HD2 ARG 47 2HD ARG 47 -14.263 -4.364 5.054
365 HD3 ARG 47 1HD ARG 47 -15.163 -5.325 6.224
366 HE ARG 47 HE ARG 47 -12.881 -3.677 6.773
367 HH11 ARG 47 1HH2 ARG 47 -14.553 -6.581 7.637
368 HH12 ARG 47 2HH2 ARG 47 -13.966 -6.598 9.266
369 HH21 ARG 47 1HH1 ARG 47 -12.107 -3.693 8.908
370 HH22 ARG 47 2HH1 ARG 47 -12.581 -4.962 9.986
371 H ASP 48 H ASP 48 -13.681 -7.450 1.128
372 HA ASP 48 HA ASP 48 -16.102 -8.779 0.397
373 HB2 ASP 48 2HB ASP 48 -13.900 -7.629 -1.334
374 HB3 ASP 48 1HB ASP 48 -15.496 -8.120 -1.903
375 H GLY 49 H GLY 49 -13.139 -10.014 1.118
376 HA2 GLY 49 2HA GLY 49 -12.393 -12.208 0.950
377 HA3 GLY 49 1HA GLY 49 -13.744 -12.554 -0.129
378 H THR 50 H THR 50 -11.265 -10.036 -0.461
379 HA THR 50 HA THR 50 -10.566 -11.133 -3.114
380 HB THR 50 HB THR 50 -9.789 -8.449 -1.966
381 HG1 THR 50 1HG THR 50 -11.819 -8.002 -2.177
382 HG21 THR 50 3HG2 THR 50 -9.976 -9.545 -4.783
383 HG22 THR 50 1HG2 THR 50 -8.488 -9.223 -3.892
384 HG23 THR 50 2HG2 THR 50 -9.540 -7.887 -4.361
385 H LYS 51 H LYS 51 -8.781 -12.306 -3.276
386 HA LYS 51 HA LYS 51 -6.844 -12.389 -1.127
387 HB2 LYS 51 2HB LYS 51 -7.464 -14.456 -2.243
388 HB3 LYS 51 1HB LYS 51 -6.958 -13.800 -3.802
389 HG2 LYS 51 2HG LYS 51 -4.665 -13.774 -3.165
390 HG3 LYS 51 1HG LYS 51 -5.056 -14.011 -1.461
391 HD2 LYS 51 2HD LYS 51 -5.707 -16.272 -1.814
392 HD3 LYS 51 1HD LYS 51 -5.780 -16.060 -3.563
393 HE2 LYS 51 2HE LYS 51 -3.344 -15.724 -3.637
394 HE3 LYS 51 1HE LYS 51 -3.258 -15.911 -1.885
395 HZ1 LYS 51 3HZ LYS 51 -4.459 -18.134 -2.375
396 HZ2 LYS 51 1HZ LYS 51 -2.784 -18.020 -2.618
397 HZ3 LYS 51 2HZ LYS 51 -3.841 -17.929 -3.944
398 H ILE 52 H ILE 52 -5.429 -10.762 -0.968
399 HA ILE 52 HA ILE 52 -3.947 -9.937 -3.406
400 HB ILE 52 HB ILE 52 -3.702 -7.692 -2.064
401 HG12 ILE 52 2HG1 ILE 52 -6.365 -8.647 -0.995
402 HG13 ILE 52 1HG1 ILE 52 -4.888 -8.716 -0.059
403 HG21 ILE 52 1HG2 ILE 52 -6.354 -8.439 -3.313
404 HG22 ILE 52 2HG2 ILE 52 -4.912 -7.966 -4.217
405 HG23 ILE 52 3HG2 ILE 52 -5.702 -6.810 -3.141
406 HD11 ILE 52 3HD1 ILE 52 -6.255 -6.265 -1.168
407 HD12 ILE 52 1HD1 ILE 52 -4.612 -6.225 -0.533
408 HD13 ILE 52 2HD1 ILE 52 -5.952 -6.652 0.525
409 H ILE 53 H ILE 53 -1.851 -10.300 -3.277
410 HA ILE 53 HA ILE 53 -0.665 -11.148 -0.744
411 HB ILE 53 HB ILE 53 0.806 -10.960 -3.369
412 HG12 ILE 53 2HG1 ILE 53 -1.274 -12.016 -3.968
413 HG13 ILE 53 1HG1 ILE 53 -0.050 -13.280 -3.838
414 HG21 ILE 53 1HG2 ILE 53 1.911 -12.986 -2.460
415 HG22 ILE 53 2HG2 ILE 53 0.895 -12.885 -1.022
416 HG23 ILE 53 3HG2 ILE 53 2.066 -11.612 -1.366
417 HD11 ILE 53 3HD1 ILE 53 -2.320 -12.641 -1.964
418 HD12 ILE 53 1HD1 ILE 53 -0.893 -13.488 -1.368
419 HD13 ILE 53 2HD1 ILE 53 -1.860 -14.194 -2.659
420 H MET 54 H MET 54 1.071 -10.172 0.252
421 HA MET 54 HA MET 54 1.287 -7.332 -0.034
422 HB2 MET 54 2HB MET 54 1.630 -8.571 2.126
423 HB3 MET 54 1HB MET 54 3.147 -9.191 1.469
424 HG2 MET 54 2HG MET 54 3.746 -7.254 2.728
425 HG3 MET 54 1HG MET 54 3.799 -6.755 1.049
426 HE1 MET 54 3HE MET 54 2.118 -3.547 1.341
427 HE2 MET 54 1HE MET 54 2.903 -4.721 0.278
428 HE3 MET 54 2HE MET 54 3.694 -4.209 1.768
429 H LYS 55 H LYS 55 1.779 -7.321 -2.323
430 HA LYS 55 HA LYS 55 4.224 -8.375 -3.353
431 HB2 LYS 55 2HB LYS 55 2.121 -7.778 -4.660
432 HB3 LYS 55 1HB LYS 55 2.626 -6.093 -4.517
433 HG2 LYS 55 2HG LYS 55 4.805 -6.690 -5.554
434 HG3 LYS 55 1HG LYS 55 4.228 -8.338 -5.782
435 HD2 LYS 55 2HD LYS 55 2.645 -6.001 -6.859
436 HD3 LYS 55 1HD LYS 55 4.014 -6.642 -7.762
437 HE2 LYS 55 2HE LYS 55 1.576 -8.213 -6.870
438 HE3 LYS 55 1HE LYS 55 1.952 -7.719 -8.518
439 HZ1 LYS 55 3HZ LYS 55 4.149 -8.978 -8.072
440 HZ2 LYS 55 1HZ LYS 55 2.751 -9.855 -8.461
441 HZ3 LYS 55 2HZ LYS 55 3.264 -9.750 -6.844
442 H GLY 56 H GLY 56 3.205 -4.995 -2.925
443 HA2 GLY 56 2HA GLY 56 5.830 -3.944 -3.209
444 HA3 GLY 56 1HA GLY 56 4.411 -3.067 -2.652
445 H ASN 57 H ASN 57 6.122 -5.890 -1.279
446 HA ASN 57 HA ASN 57 5.806 -5.162 1.389
447 HB2 ASN 57 2HB ASN 57 6.577 -7.384 0.758
448 HB3 ASN 57 1HB ASN 57 8.072 -6.707 0.105
449 HD21 ASN 57 1HD2 ASN 57 6.677 -5.375 3.058
450 HD22 ASN 57 2HD2 ASN 57 7.862 -5.996 4.111
451 H GLU 58 H GLU 58 7.644 -3.648 -1.002
452 HA GLU 58 HA GLU 58 9.734 -2.606 0.694
453 HB2 GLU 58 2HB GLU 58 8.825 -1.716 -2.055
454 HB3 GLU 58 1HB GLU 58 10.329 -1.254 -1.258
455 HG2 GLU 58 2HG GLU 58 9.618 -4.152 -1.735
456 HG3 GLU 58 1HG GLU 58 10.449 -3.191 -2.954
457 H ILE 59 H ILE 59 7.515 -2.075 2.071
458 HA ILE 59 HA ILE 59 6.017 0.189 1.595
459 HB ILE 59 HB ILE 59 5.954 0.435 4.102
460 HG12 ILE 59 2HG1 ILE 59 7.756 -2.004 4.030
461 HG13 ILE 59 1HG1 ILE 59 8.334 -0.376 4.399
462 HG21 ILE 59 1HG2 ILE 59 4.846 -1.740 4.451
463 HG22 ILE 59 2HG2 ILE 59 5.606 -2.365 2.988
464 HG23 ILE 59 3HG2 ILE 59 4.418 -1.067 2.878
465 HD11 ILE 59 3HD1 ILE 59 7.786 -1.744 6.440
466 HD12 ILE 59 1HD1 ILE 59 6.102 -1.755 5.916
467 HD13 ILE 59 2HD1 ILE 59 6.885 -0.231 6.333
468 H PHE 60 H PHE 60 9.373 0.000 1.940
469 HA PHE 60 HA PHE 60 10.152 2.288 3.262
470 HB2 PHE 60 2HB PHE 60 11.687 0.593 2.262
471 HB3 PHE 60 1HB PHE 60 11.352 1.283 0.673
472 HD1 PHE 60 1HD PHE 60 12.923 1.875 3.960
473 HD2 PHE 60 2HD PHE 60 12.208 3.465 0.034
474 HE1 PHE 60 1HE PHE 60 14.636 3.624 4.357
475 HE2 PHE 60 2HE PHE 60 13.921 5.214 0.431
476 HZ PHE 60 HZ PHE 60 15.136 5.294 2.592
477 H ARG 61 H ARG 61 8.615 2.000 0.138
478 HA ARG 61 HA ARG 61 9.230 4.449 -1.018
479 HB2 ARG 61 2HB ARG 61 7.893 2.548 -2.034
480 HB3 ARG 61 1HB ARG 61 6.508 3.145 -1.128
481 HG2 ARG 61 2HG ARG 61 6.210 4.269 -3.150
482 HG3 ARG 61 1HG ARG 61 7.142 5.463 -2.252
483 HD2 ARG 61 2HD ARG 61 8.020 5.125 -4.549
484 HD3 ARG 61 1HD ARG 61 9.208 4.693 -3.326
485 HE ARG 61 HE ARG 61 9.057 2.478 -4.029
486 HH11 ARG 61 1HH2 ARG 61 6.462 4.389 -5.292
487 HH12 ARG 61 2HH2 ARG 61 5.893 3.155 -6.365
488 HH21 ARG 61 1HH1 ARG 61 8.315 0.855 -5.433
489 HH22 ARG 61 2HH1 ARG 61 6.942 1.154 -6.445
490 H LEU 62 H LEU 62 6.504 3.698 1.177
491 HA LEU 62 HA LEU 62 5.525 6.353 1.262
492 HB2 LEU 62 2HB LEU 62 4.477 4.036 2.044
493 HB3 LEU 62 1HB LEU 62 5.161 4.498 3.595
494 HG LEU 62 HG LEU 62 2.892 5.305 3.534
495 HD11 LEU 62 1HD1 LEU 62 4.779 6.820 4.389
496 HD12 LEU 62 2HD1 LEU 62 3.232 7.590 4.043
497 HD13 LEU 62 3HD1 LEU 62 4.561 7.736 2.896
498 HD21 LEU 62 3HD2 LEU 62 3.014 5.377 0.858
499 HD22 LEU 62 1HD2 LEU 62 3.355 7.083 1.155
500 HD23 LEU 62 2HD2 LEU 62 1.864 6.363 1.751
501 H ASP 63 H ASP 63 7.552 4.525 3.559
502 HA ASP 63 HA ASP 63 8.117 6.947 5.089
503 HB2 ASP 63 2HB ASP 63 9.425 5.427 6.532
504 HB3 ASP 63 1HB ASP 63 7.776 4.851 6.294
505 H GLU 64 H GLU 64 9.410 8.299 3.930
506 HA GLU 64 HA GLU 64 12.180 7.695 3.735
507 HB2 GLU 64 2HB GLU 64 12.457 7.716 1.322
508 HB3 GLU 64 1HB GLU 64 11.361 6.406 1.766
509 HG2 GLU 64 2HG GLU 64 9.445 8.017 1.331
510 HG3 GLU 64 1HG GLU 64 10.632 9.110 0.624
511 H ALA 65 H ALA 65 9.497 9.686 2.571
512 HA ALA 65 HA ALA 65 11.153 12.017 2.169
513 HB1 ALA 65 1HB ALA 65 9.094 13.152 1.627
514 HB2 ALA 65 2HB ALA 65 8.138 11.862 2.355
515 HB3 ALA 65 3HB ALA 65 9.051 11.555 0.878
516 H LEU 66 H LEU 66 9.053 13.795 3.327
517 HA LEU 66 HA LEU 66 8.878 13.414 6.119
518 HB2 LEU 66 2HB LEU 66 10.516 15.197 6.809
519 HB3 LEU 66 1HB LEU 66 11.241 13.700 6.239
520 HG LEU 66 HG LEU 66 11.217 14.972 3.882
521 HD11 LEU 66 1HD1 LEU 66 11.156 17.210 5.927
522 HD12 LEU 66 2HD1 LEU 66 10.125 17.013 4.511
523 HD13 LEU 66 3HD1 LEU 66 11.827 17.404 4.309
524 HD21 LEU 66 3HD2 LEU 66 13.253 14.171 4.922
525 HD22 LEU 66 1HD2 LEU 66 13.196 15.460 6.125
526 HD23 LEU 66 2HD2 LEU 66 13.511 15.846 4.433
527 H ARG 67 H ARG 67 8.579 15.269 3.276
528 HA ARG 67 HA ARG 67 7.431 17.613 4.514
529 HB2 ARG 67 2HB ARG 67 8.636 17.518 2.252
530 HB3 ARG 67 1HB ARG 67 7.161 16.795 1.621
531 HG2 ARG 67 2HG ARG 67 6.737 19.048 1.202
532 HG3 ARG 67 1HG ARG 67 5.994 18.872 2.788
533 HD2 ARG 67 2HD ARG 67 8.003 19.765 3.863
534 HD3 ARG 67 1HD ARG 67 8.828 19.845 2.310
535 HE ARG 67 HE ARG 67 6.893 21.725 3.325
536 HH11 ARG 67 1HH2 ARG 67 8.296 20.275 0.513
537 HH12 ARG 67 2HH2 ARG 67 7.939 21.616 -0.524
538 HH21 ARG 67 1HH1 ARG 67 6.423 23.487 1.972
539 HH22 ARG 67 2HH1 ARG 67 6.880 23.433 0.301
540 H LYS 68 H LYS 68 6.152 14.955 2.504
541 HA LYS 68 HA LYS 68 3.650 14.989 4.000
542 HB2 LYS 68 2HB LYS 68 3.759 15.609 1.037
543 HB3 LYS 68 1HB LYS 68 2.288 15.208 1.923
544 HG2 LYS 68 2HG LYS 68 2.887 17.144 3.495
545 HG3 LYS 68 1HG LYS 68 4.073 17.622 2.279
546 HD2 LYS 68 2HD LYS 68 2.281 17.741 0.581
547 HD3 LYS 68 1HD LYS 68 1.095 17.290 1.806
548 HE2 LYS 68 2HE LYS 68 1.503 19.306 3.056
549 HE3 LYS 68 1HE LYS 68 2.897 19.711 2.053
550 HZ1 LYS 68 3HZ LYS 68 0.114 20.174 1.575
551 HZ2 LYS 68 1HZ LYS 68 0.863 19.393 0.269
552 HZ3 LYS 68 2HZ LYS 68 1.471 20.876 0.832
553 H GLY 69 H GLY 69 2.103 13.313 2.847
554 HA2 GLY 69 2HA GLY 69 3.572 10.828 2.782
555 HA3 GLY 69 1HA GLY 69 1.825 11.016 2.653
556 H HIS 70 H HIS 70 2.380 13.084 0.463
557 HA HIS 70 HA HIS 70 3.543 11.605 -1.710
558 HB2 HIS 70 2HB HIS 70 1.504 11.297 -3.017
559 HB3 HIS 70 1HB HIS 70 1.371 10.435 -1.483
560 HD2 HIS 70 2HD HIS 70 0.264 12.706 0.509
561 HE1 HIS 70 1HE HIS 70 -2.632 13.565 -2.439
562 HE2 HIS 70 2HE HIS 70 -2.023 13.861 0.009
563 H SER 71 H SER 71 2.143 12.824 -3.810
564 HA SER 71 HA SER 71 2.149 14.758 -5.049
565 HB2 SER 71 2HB SER 71 1.751 16.211 -2.434
566 HB3 SER 71 1HB SER 71 1.234 16.712 -4.041
567 HG SER 71 HG SER 71 -0.325 15.192 -4.021
568 H GLU 72 H GLU 72 4.474 14.291 -5.349
569 HA GLU 72 HA GLU 72 6.043 16.626 -4.885
570 HB2 GLU 72 2HB GLU 72 6.171 15.508 -2.633
571 HB3 GLU 72 1HB GLU 72 6.969 14.148 -3.420
572 HG2 GLU 72 2HG GLU 72 8.769 15.604 -4.197
573 HG3 GLU 72 1HG GLU 72 7.953 17.013 -3.520
574 H GLY 73 H GLY 73 5.889 13.224 -5.766
575 HA2 GLY 73 2HA GLY 73 6.865 12.036 -7.476
576 HA3 GLY 73 1HA GLY 73 7.062 13.583 -8.292
577 H GLY 74 H GLY 74 8.576 11.185 -6.269
578 HA2 GLY 74 2HA GLY 74 11.182 11.752 -7.168
579 HA3 GLY 74 1HA GLY 74 10.957 12.520 -5.599
580 H1 HOH 201 H2 HOH 77 -2.761 9.632 -2.275
581 H2 HOH 201 H1 HOH 77 -3.458 10.613 -1.356
Start of MODEL 5
1 H1 VAL 1 1H VAL 1 2.496 11.967 -5.203
2 H2 VAL 1 2H VAL 1 3.858 12.910 -4.849
3 HA VAL 1 HA VAL 1 2.336 14.106 -6.268
4 HB VAL 1 HB VAL 1 4.635 14.700 -6.496
5 HG11 VAL 1 2HG1 VAL 1 6.061 12.937 -6.790
6 HG12 VAL 1 3HG1 VAL 1 5.848 13.255 -8.505
7 HG13 VAL 1 1HG1 VAL 1 4.894 12.004 -7.715
8 HG21 VAL 1 1HG2 VAL 1 4.097 14.296 -9.409
9 HG22 VAL 1 2HG2 VAL 1 4.467 15.771 -8.528
10 HG23 VAL 1 3HG2 VAL 1 2.830 15.121 -8.497
11 H ASP 2 H ASP 2 3.801 12.598 -8.988
12 HA ASP 2 HA ASP 2 2.927 11.499 -10.801
13 HB2 ASP 2 2HB ASP 2 0.866 10.314 -8.951
14 HB3 ASP 2 1HB ASP 2 1.609 9.593 -10.379
15 H MET 3 H MET 3 1.553 12.050 -12.405
16 HA MET 3 HA MET 3 -0.411 14.102 -11.880
17 HB2 MET 3 2HB MET 3 0.321 12.665 -14.445
18 HB3 MET 3 1HB MET 3 -0.721 14.086 -14.329
19 HG2 MET 3 2HG MET 3 1.152 15.352 -13.299
20 HG3 MET 3 1HG MET 3 2.192 13.939 -13.495
21 HE1 MET 3 3HE MET 3 3.997 15.341 -15.008
22 HE2 MET 3 1HE MET 3 2.948 16.627 -14.395
23 HE3 MET 3 2HE MET 3 3.400 16.591 -16.097
24 H SER 4 H SER 4 -0.514 10.812 -13.260
25 HA SER 4 HA SER 4 -3.200 10.524 -13.720
26 HB2 SER 4 2HB SER 4 -2.847 8.087 -13.083
27 HB3 SER 4 1HB SER 4 -1.751 8.729 -14.302
28 HG SER 4 HG SER 4 -0.139 8.693 -12.891
29 H ASN 5 H ASN 5 -1.567 10.701 -10.648
30 HA ASN 5 HA ASN 5 -2.334 10.715 -8.482
31 HB2 ASN 5 2HB ASN 5 -4.910 11.525 -9.850
32 HB3 ASN 5 1HB ASN 5 -4.564 11.700 -8.130
33 HD21 ASN 5 1HD2 ASN 5 -2.053 12.751 -7.998
34 HD22 ASN 5 2HD2 ASN 5 -1.945 14.208 -8.862
35 H VAL 6 H VAL 6 -2.286 8.196 -9.698
36 HA VAL 6 HA VAL 6 -4.643 6.697 -9.538
37 HB VAL 6 HB VAL 6 -3.115 4.743 -9.191
38 HG11 VAL 6 1HG1 VAL 6 -2.100 6.683 -11.285
39 HG12 VAL 6 2HG1 VAL 6 -3.613 5.788 -11.443
40 HG13 VAL 6 3HG1 VAL 6 -2.079 4.921 -11.361
41 HG21 VAL 6 3HG2 VAL 6 -1.434 5.809 -7.784
42 HG22 VAL 6 1HG2 VAL 6 -1.042 6.956 -9.064
43 HG23 VAL 6 2HG2 VAL 6 -0.661 5.247 -9.266
44 H VAL 7 H VAL 7 -5.343 5.188 -7.893
45 HA VAL 7 HA VAL 7 -4.369 5.586 -5.169
46 HB VAL 7 HB VAL 7 -6.647 6.126 -4.326
47 HG11 VAL 7 1HG1 VAL 7 -5.768 8.155 -6.391
48 HG12 VAL 7 2HG1 VAL 7 -4.855 7.863 -4.909
49 HG13 VAL 7 3HG1 VAL 7 -6.515 8.456 -4.821
50 HG21 VAL 7 3HG2 VAL 7 -7.234 6.438 -7.288
51 HG22 VAL 7 1HG2 VAL 7 -8.308 6.960 -5.990
52 HG23 VAL 7 2HG2 VAL 7 -7.952 5.245 -6.204
53 H LYS 8 H LYS 8 -5.188 4.024 -3.682
54 HA LYS 8 HA LYS 8 -6.937 1.913 -4.553
55 HB2 LYS 8 2HB LYS 8 -4.727 1.375 -5.684
56 HB3 LYS 8 1HB LYS 8 -4.043 1.185 -4.074
57 HG2 LYS 8 2HG LYS 8 -4.712 -1.000 -4.224
58 HG3 LYS 8 1HG LYS 8 -6.332 -0.390 -3.900
59 HD2 LYS 8 2HD LYS 8 -5.140 -0.702 -6.676
60 HD3 LYS 8 1HD LYS 8 -6.225 -1.865 -5.915
61 HE2 LYS 8 2HE LYS 8 -7.876 0.058 -5.627
62 HE3 LYS 8 1HE LYS 8 -6.834 0.991 -6.704
63 HZ1 LYS 8 3HZ LYS 8 -8.804 -0.762 -7.450
64 HZ2 LYS 8 1HZ LYS 8 -7.363 -1.606 -7.742
65 HZ3 LYS 8 2HZ LYS 8 -7.617 -0.086 -8.458
66 H THR 9 H THR 9 -7.670 0.689 -2.830
67 HA THR 9 HA THR 9 -6.316 0.820 -0.255
68 HB THR 9 HB THR 9 -9.123 1.914 -0.536
69 HG1 THR 9 1HG THR 9 -7.489 3.716 0.392
70 HG21 THR 9 3HG2 THR 9 -8.769 2.558 1.826
71 HG22 THR 9 1HG2 THR 9 -7.189 1.775 1.795
72 HG23 THR 9 2HG2 THR 9 -8.654 0.811 1.610
73 H TYR 10 H TYR 10 -6.290 -1.274 0.237
74 HA TYR 10 HA TYR 10 -8.664 -2.945 -0.308
75 HB2 TYR 10 2HB TYR 10 -5.771 -3.594 0.272
76 HB3 TYR 10 1HB TYR 10 -7.031 -4.816 0.294
77 HD1 TYR 10 2HD TYR 10 -8.689 -4.649 -1.858
78 HD2 TYR 10 1HD TYR 10 -4.588 -3.362 -1.739
79 HE1 TYR 10 2HE TYR 10 -8.555 -4.842 -4.322
80 HE2 TYR 10 1HE TYR 10 -4.460 -3.558 -4.206
81 HH TYR 10 HH TYR 10 -7.322 -4.363 -6.139
82 H ASP 11 H ASP 11 -10.058 -2.776 1.369
83 HA ASP 11 HA ASP 11 -9.285 -2.243 4.044
84 HB2 ASP 11 2HB ASP 11 -11.851 -3.301 2.863
85 HB3 ASP 11 1HB ASP 11 -11.641 -2.907 4.569
86 H LEU 12 H LEU 12 -7.688 -3.797 4.508
87 HA LEU 12 HA LEU 12 -8.001 -6.587 4.389
88 HB2 LEU 12 2HB LEU 12 -6.172 -4.659 5.645
89 HB3 LEU 12 1HB LEU 12 -6.349 -6.123 6.605
90 HG LEU 12 HG LEU 12 -5.622 -7.514 4.783
91 HD11 LEU 12 1HD1 LEU 12 -6.422 -6.805 2.751
92 HD12 LEU 12 2HD1 LEU 12 -4.830 -6.077 2.633
93 HD13 LEU 12 3HD1 LEU 12 -6.208 -5.097 3.133
94 HD21 LEU 12 3HD2 LEU 12 -3.378 -6.358 4.207
95 HD22 LEU 12 1HD2 LEU 12 -3.739 -6.624 5.911
96 HD23 LEU 12 2HD2 LEU 12 -3.953 -5.025 5.199
97 H GLN 13 H GLN 13 -8.285 -8.082 6.183
98 HA GLN 13 HA GLN 13 -10.652 -7.427 7.696
99 HB2 GLN 13 2HB GLN 13 -10.483 -9.752 8.506
100 HB3 GLN 13 1HB GLN 13 -10.358 -9.668 6.746
101 HG2 GLN 13 2HG GLN 13 -7.861 -9.686 6.981
102 HG3 GLN 13 1HG GLN 13 -8.069 -9.943 8.715
103 HE21 GLN 13 1HE2 GLN 13 -10.110 -11.381 6.153
104 HE22 GLN 13 2HE2 GLN 13 -9.659 -12.989 6.481
105 H ASP 14 H ASP 14 -7.268 -7.293 8.229
106 HA ASP 14 HA ASP 14 -7.388 -7.517 11.112
107 HB2 ASP 14 2HB ASP 14 -5.380 -8.157 9.758
108 HB3 ASP 14 1HB ASP 14 -5.144 -6.448 9.390
109 H GLY 15 H GLY 15 -8.764 -5.324 9.324
110 HA2 GLY 15 2HA GLY 15 -9.566 -3.219 9.892
111 HA3 GLY 15 1HA GLY 15 -8.507 -3.230 11.301
112 H SER 16 H SER 16 -6.366 -4.049 9.138
113 HA SER 16 HA SER 16 -5.291 -1.401 8.853
114 HB2 SER 16 2HB SER 16 -3.528 -2.637 7.492
115 HB3 SER 16 1HB SER 16 -3.711 -3.150 9.169
116 HG SER 16 HG SER 16 -3.746 -4.993 7.980
117 H LYS 17 H LYS 17 -4.253 -1.026 6.497
118 HA LYS 17 HA LYS 17 -6.154 -1.601 4.354
119 HB2 LYS 17 2HB LYS 17 -5.613 1.203 5.360
120 HB3 LYS 17 1HB LYS 17 -6.343 0.845 3.795
121 HG2 LYS 17 2HG LYS 17 -8.102 -0.493 5.040
122 HG3 LYS 17 1HG LYS 17 -7.441 0.171 6.533
123 HD2 LYS 17 2HD LYS 17 -7.850 2.461 5.690
124 HD3 LYS 17 1HD LYS 17 -8.541 1.784 4.214
125 HE2 LYS 17 2HE LYS 17 -9.592 1.219 7.002
126 HE3 LYS 17 1HE LYS 17 -10.275 2.423 5.908
127 HZ1 LYS 17 3HZ LYS 17 -11.524 0.458 5.629
128 HZ2 LYS 17 1HZ LYS 17 -10.136 -0.510 5.513
129 HZ3 LYS 17 2HZ LYS 17 -10.520 0.572 4.262
130 H VAL 18 H VAL 18 -4.989 -2.075 2.611
131 HA VAL 18 HA VAL 18 -2.174 -1.396 2.502
132 HB VAL 18 HB VAL 18 -3.649 -2.625 0.192
133 HG11 VAL 18 1HG1 VAL 18 -1.566 -3.849 -0.078
134 HG12 VAL 18 2HG1 VAL 18 -0.961 -3.214 1.451
135 HG13 VAL 18 3HG1 VAL 18 -1.208 -2.129 0.083
136 HG21 VAL 18 3HG2 VAL 18 -3.501 -4.831 1.216
137 HG22 VAL 18 1HG2 VAL 18 -4.504 -3.785 2.219
138 HG23 VAL 18 2HG2 VAL 18 -2.840 -4.128 2.695
139 H HIS 19 H HIS 19 -1.184 -0.266 0.739
140 HA HIS 19 HA HIS 19 -2.910 1.447 -0.912
141 HB2 HIS 19 2HB HIS 19 -2.603 3.105 0.664
142 HB3 HIS 19 1HB HIS 19 -1.170 2.338 1.336
143 HD1 HIS 19 1HD HIS 19 -2.246 4.552 -1.547
144 HD2 HIS 19 2HD HIS 19 1.259 3.303 0.337
145 HE1 HIS 19 1HE HIS 19 -0.374 5.951 -2.521
146 HE2 HIS 19 2HE HIS 19 1.771 5.204 -1.383
147 H VAL 20 H VAL 20 -2.227 1.110 -2.948
148 HA VAL 20 HA VAL 20 0.520 0.231 -3.393
149 HB VAL 20 HB VAL 20 -0.140 -0.652 -5.438
150 HG11 VAL 20 1HG1 VAL 20 -2.518 -0.695 -3.585
151 HG12 VAL 20 2HG1 VAL 20 -1.412 -1.990 -4.002
152 HG13 VAL 20 3HG1 VAL 20 -2.611 -1.460 -5.166
153 HG21 VAL 20 3HG2 VAL 20 -2.301 0.168 -6.586
154 HG22 VAL 20 1HG2 VAL 20 -0.899 1.238 -6.614
155 HG23 VAL 20 2HG2 VAL 20 -2.211 1.538 -5.476
156 H PHE 21 H PHE 21 1.857 1.159 -5.042
157 HA PHE 21 HA PHE 21 1.581 4.095 -5.159
158 HB2 PHE 21 2HB PHE 21 3.954 2.284 -5.676
159 HB3 PHE 21 1HB PHE 21 3.982 4.045 -5.768
160 HD1 PHE 21 2HD PHE 21 3.623 5.422 -3.737
161 HD2 PHE 21 1HD PHE 21 3.888 1.138 -3.551
162 HE1 PHE 21 2HE PHE 21 3.975 5.551 -1.287
163 HE2 PHE 21 1HE PHE 21 4.241 1.267 -1.100
164 HZ PHE 21 HZ PHE 21 4.286 3.473 0.033
165 H LYS 22 H LYS 22 3.276 4.535 -7.345
166 HA LYS 22 HA LYS 22 1.422 4.194 -9.512
167 HB2 LYS 22 2HB LYS 22 2.822 6.219 -9.260
168 HB3 LYS 22 1HB LYS 22 4.261 5.243 -9.550
169 HG2 LYS 22 2HG LYS 22 3.476 4.657 -11.777
170 HG3 LYS 22 1HG LYS 22 1.943 5.482 -11.491
171 HD2 LYS 22 2HD LYS 22 3.124 7.626 -11.257
172 HD3 LYS 22 1HD LYS 22 4.669 6.812 -11.508
173 HE2 LYS 22 2HE LYS 22 2.393 6.828 -13.513
174 HE3 LYS 22 1HE LYS 22 3.800 7.890 -13.588
175 HZ1 LYS 22 3HZ LYS 22 3.844 4.922 -13.660
176 HZ2 LYS 22 1HZ LYS 22 5.215 5.918 -13.673
177 HZ3 LYS 22 2HZ LYS 22 4.125 5.959 -14.975
178 H ASP 23 H ASP 23 4.349 2.607 -8.441
179 HA ASP 23 HA ASP 23 4.787 1.182 -10.909
180 HB2 ASP 23 2HB ASP 23 6.623 1.713 -9.320
181 HB3 ASP 23 1HB ASP 23 5.888 0.622 -8.145
182 H GLY 24 H GLY 24 2.200 1.000 -9.202
183 HA2 GLY 24 2HA GLY 24 0.571 -0.603 -8.917
184 HA3 GLY 24 1HA GLY 24 1.578 -1.696 -9.863
185 H LYS 25 H LYS 25 3.676 -0.788 -7.631
186 HA LYS 25 HA LYS 25 3.569 -3.201 -6.138
187 HB2 LYS 25 2HB LYS 25 5.039 -0.583 -5.788
188 HB3 LYS 25 1HB LYS 25 5.247 -1.918 -4.667
189 HG2 LYS 25 2HG LYS 25 5.527 -2.462 -7.609
190 HG3 LYS 25 1HG LYS 25 6.853 -1.663 -6.771
191 HD2 LYS 25 2HD LYS 25 7.156 -3.501 -5.285
192 HD3 LYS 25 1HD LYS 25 5.619 -4.229 -5.746
193 HE2 LYS 25 2HE LYS 25 6.478 -4.622 -8.023
194 HE3 LYS 25 1HE LYS 25 8.016 -3.886 -7.571
195 HZ1 LYS 25 3HZ LYS 25 8.472 -6.076 -7.207
196 HZ2 LYS 25 1HZ LYS 25 6.881 -6.465 -6.766
197 HZ3 LYS 25 2HZ LYS 25 7.890 -5.650 -5.669
198 H MET 26 H MET 26 2.869 -3.595 -4.055
199 HA MET 26 HA MET 26 0.699 -1.962 -3.103
200 HB2 MET 26 2HB MET 26 1.725 -4.677 -2.556
201 HB3 MET 26 1HB MET 26 1.004 -3.881 -1.163
202 HG2 MET 26 2HG MET 26 -1.059 -3.532 -2.336
203 HG3 MET 26 1HG MET 26 -0.349 -4.057 -3.863
204 HE1 MET 26 3HE MET 26 -1.969 -7.306 -3.952
205 HE2 MET 26 1HE MET 26 -0.514 -6.603 -4.678
206 HE3 MET 26 2HE MET 26 -1.965 -5.619 -4.465
207 H GLY 27 H GLY 27 0.583 -1.819 -0.580
208 HA2 GLY 27 2HA GLY 27 3.099 -1.041 0.681
209 HA3 GLY 27 1HA GLY 27 1.946 0.265 0.404
210 H MET 28 H MET 28 2.984 -1.693 2.750
211 HA MET 28 HA MET 28 0.376 -2.440 3.854
212 HB2 MET 28 2HB MET 28 2.402 -3.958 3.880
213 HB3 MET 28 1HB MET 28 3.105 -2.865 5.064
214 HG2 MET 28 2HG MET 28 2.009 -4.655 6.258
215 HG3 MET 28 1HG MET 28 1.074 -3.187 6.486
216 HE1 MET 28 3HE MET 28 -0.631 -4.511 7.407
217 HE2 MET 28 1HE MET 28 -1.978 -5.197 6.488
218 HE3 MET 28 2HE MET 28 -1.630 -3.473 6.392
219 H GLU 29 H GLU 29 -0.408 -0.292 4.243
220 HA GLU 29 HA GLU 29 0.870 1.104 6.534
221 HB2 GLU 29 2HB GLU 29 0.617 2.442 4.448
222 HB3 GLU 29 1HB GLU 29 -1.125 2.180 4.524
223 HG2 GLU 29 2HG GLU 29 -1.243 3.304 6.684
224 HG3 GLU 29 1HG GLU 29 0.510 3.481 6.718
225 H ASN 30 H ASN 30 -0.065 0.413 8.381
226 HA ASN 30 HA ASN 30 -2.607 -0.759 8.568
227 HB2 ASN 30 2HB ASN 30 -2.233 -0.886 10.861
228 HB3 ASN 30 1HB ASN 30 -0.591 -0.758 10.239
229 HD21 ASN 30 1HD2 ASN 30 -1.160 2.228 9.626
230 HD22 ASN 30 2HD2 ASN 30 -1.012 2.978 11.146
231 H LYS 31 H LYS 31 -3.940 0.491 10.648
232 HA LYS 31 HA LYS 31 -5.287 2.602 9.199
233 HB2 LYS 31 2HB LYS 31 -7.026 2.414 10.765
234 HB3 LYS 31 1HB LYS 31 -6.436 0.772 10.572
235 HG2 LYS 31 2HG LYS 31 -5.666 2.641 12.853
236 HG3 LYS 31 1HG LYS 31 -6.866 1.367 12.954
237 HD2 LYS 31 2HD LYS 31 -3.916 0.963 12.367
238 HD3 LYS 31 1HD LYS 31 -4.727 0.612 13.885
239 HE2 LYS 31 2HE LYS 31 -4.919 -0.848 11.267
240 HE3 LYS 31 1HE LYS 31 -4.727 -1.496 12.893
241 HZ1 LYS 31 3HZ LYS 31 -6.970 -1.815 11.907
242 HZ2 LYS 31 1HZ LYS 31 -7.186 -0.134 11.949
243 HZ3 LYS 31 2HZ LYS 31 -6.975 -0.999 13.396
244 H PHE 32 H PHE 32 -2.984 2.382 11.792
245 HA PHE 32 HA PHE 32 -3.448 5.103 12.713
246 HB2 PHE 32 2HB PHE 32 -2.678 3.166 14.184
247 HB3 PHE 32 1HB PHE 32 -1.104 3.324 13.398
248 HD1 PHE 32 2HD PHE 32 -3.647 5.140 15.422
249 HD2 PHE 32 1HD PHE 32 0.396 5.090 13.973
250 HE1 PHE 32 2HE PHE 32 -3.081 7.022 16.934
251 HE2 PHE 32 1HE PHE 32 0.963 6.970 15.486
252 HZ PHE 32 HZ PHE 32 -0.776 7.937 16.967
253 H GLY 33 H GLY 33 -2.484 4.323 9.890
254 HA2 GLY 33 2HA GLY 33 -1.168 5.327 8.287
255 HA3 GLY 33 1HA GLY 33 -0.813 6.582 9.473
256 H LYS 34 H LYS 34 -0.102 3.692 10.883
257 HA LYS 34 HA LYS 34 2.752 4.103 10.619
258 HB2 LYS 34 2HB LYS 34 1.513 3.422 12.756
259 HB3 LYS 34 1HB LYS 34 1.390 1.817 12.042
260 HG2 LYS 34 2HG LYS 34 3.923 1.937 11.689
261 HG3 LYS 34 1HG LYS 34 3.901 3.341 12.755
262 HD2 LYS 34 2HD LYS 34 2.947 0.544 13.438
263 HD3 LYS 34 1HD LYS 34 4.377 1.351 14.080
264 HE2 LYS 34 2HE LYS 34 1.476 1.977 14.605
265 HE3 LYS 34 1HE LYS 34 2.765 1.673 15.769
266 HZ1 LYS 34 3HZ LYS 34 3.755 3.781 14.511
267 HZ2 LYS 34 1HZ LYS 34 2.763 3.908 15.880
268 HZ3 LYS 34 2HZ LYS 34 2.097 4.110 14.329
269 H SER 35 H SER 35 4.122 2.970 9.373
270 HA SER 35 HA SER 35 3.029 1.104 7.440
271 HB2 SER 35 2HB SER 35 4.627 2.533 6.498
272 HB3 SER 35 1HB SER 35 5.709 2.388 7.881
273 HG SER 35 HG SER 35 5.792 0.074 7.235
274 H MET 36 H MET 36 2.711 -0.950 8.003
275 HA MET 36 HA MET 36 4.435 -2.231 10.012
276 HB2 MET 36 2HB MET 36 1.835 -3.024 8.688
277 HB3 MET 36 1HB MET 36 2.756 -4.124 9.717
278 HG2 MET 36 2HG MET 36 2.647 -2.468 11.559
279 HG3 MET 36 1HG MET 36 1.686 -1.404 10.530
280 HE1 MET 36 3HE MET 36 0.474 -5.198 12.722
281 HE2 MET 36 1HE MET 36 1.750 -4.031 13.101
282 HE3 MET 36 2HE MET 36 1.929 -5.127 11.733
283 H ASN 37 H ASN 37 6.250 -3.127 9.259
284 HA ASN 37 HA ASN 37 6.714 -3.763 6.548
285 HB2 ASN 37 2HB ASN 37 8.500 -3.260 8.202
286 HB3 ASN 37 1HB ASN 37 8.197 -4.824 8.956
287 HD21 ASN 37 1HD2 ASN 37 7.995 -6.621 6.954
288 HD22 ASN 37 2HD2 ASN 37 9.353 -6.590 5.928
289 H MET 38 H MET 38 5.138 -5.135 5.754
290 HA MET 38 HA MET 38 4.902 -7.814 6.949
291 HB2 MET 38 2HB MET 38 2.792 -6.762 6.469
292 HB3 MET 38 1HB MET 38 3.287 -6.389 4.816
293 HG2 MET 38 2HG MET 38 3.372 -8.776 4.289
294 HG3 MET 38 1HG MET 38 3.025 -9.178 5.961
295 HE1 MET 38 3HE MET 38 0.733 -7.675 7.092
296 HE2 MET 38 1HE MET 38 0.900 -9.432 6.972
297 HE3 MET 38 2HE MET 38 -0.610 -8.653 6.506
298 HA PRO 39 HA PRO 39 7.834 -8.999 3.724
299 HB2 PRO 39 2HB PRO 39 7.806 -11.719 4.070
300 HB3 PRO 39 1HB PRO 39 8.662 -10.611 5.164
301 HG2 PRO 39 2HG PRO 39 5.992 -11.908 5.498
302 HG3 PRO 39 1HG PRO 39 7.284 -11.666 6.688
303 HD2 PRO 39 2HD PRO 39 5.081 -10.057 6.562
304 HD3 PRO 39 1HD PRO 39 6.655 -9.470 7.121
305 H GLU 40 H GLU 40 7.852 -10.093 1.671
306 HA GLU 40 HA GLU 40 5.325 -10.052 0.353
307 HB2 GLU 40 2HB GLU 40 7.342 -9.394 -0.831
308 HB3 GLU 40 1HB GLU 40 8.043 -10.994 -0.577
309 HG2 GLU 40 2HG GLU 40 6.421 -12.033 -1.985
310 HG3 GLU 40 1HG GLU 40 5.423 -10.579 -2.028
311 H GLY 41 H GLY 41 3.909 -11.589 1.002
312 HA2 GLY 41 2HA GLY 41 3.608 -14.010 -0.032
313 HA3 GLY 41 1HA GLY 41 4.759 -14.379 1.249
314 H LYS 42 H LYS 42 3.435 -12.074 2.815
315 HA LYS 42 HA LYS 42 1.633 -13.753 4.283
316 HB2 LYS 42 2HB LYS 42 2.691 -10.984 4.516
317 HB3 LYS 42 1HB LYS 42 1.172 -11.301 5.344
318 HG2 LYS 42 2HG LYS 42 3.441 -13.255 5.693
319 HG3 LYS 42 1HG LYS 42 3.503 -11.728 6.564
320 HD2 LYS 42 2HD LYS 42 1.529 -12.175 7.764
321 HD3 LYS 42 1HD LYS 42 1.023 -13.438 6.641
322 HE2 LYS 42 2HE LYS 42 2.931 -14.839 7.378
323 HE3 LYS 42 1HE LYS 42 3.399 -13.583 8.523
324 HZ1 LYS 42 3HZ LYS 42 2.091 -15.250 9.632
325 HZ2 LYS 42 1HZ LYS 42 0.837 -15.086 8.501
326 HZ3 LYS 42 2HZ LYS 42 1.199 -13.806 9.557
327 H VAL 43 H VAL 43 0.138 -14.329 2.709
328 HA VAL 43 HA VAL 43 -1.382 -12.825 1.020
329 HB VAL 43 HB VAL 43 -2.613 -14.976 2.741
330 HG11 VAL 43 1HG1 VAL 43 -2.939 -14.454 -0.218
331 HG12 VAL 43 2HG1 VAL 43 -3.929 -13.628 0.984
332 HG13 VAL 43 3HG1 VAL 43 -3.991 -15.385 0.848
333 HG21 VAL 43 3HG2 VAL 43 -1.680 -16.515 0.899
334 HG22 VAL 43 1HG2 VAL 43 -0.534 -15.940 2.109
335 HG23 VAL 43 2HG2 VAL 43 -0.581 -15.191 0.514
336 H MET 44 H MET 44 -2.685 -11.133 1.235
337 HA MET 44 HA MET 44 -3.859 -10.529 3.888
338 HB2 MET 44 2HB MET 44 -3.550 -8.733 1.470
339 HB3 MET 44 1HB MET 44 -4.075 -8.249 3.077
340 HG2 MET 44 2HG MET 44 -1.883 -8.845 3.991
341 HG3 MET 44 1HG MET 44 -1.364 -9.438 2.414
342 HE1 MET 44 3HE MET 44 -0.880 -6.565 0.195
343 HE2 MET 44 1HE MET 44 -2.603 -6.899 0.375
344 HE3 MET 44 2HE MET 44 -1.441 -8.223 0.386
345 H GLU 45 H GLU 45 -6.125 -9.942 3.962
346 HA GLU 45 HA GLU 45 -7.709 -10.724 1.582
347 HB2 GLU 45 2HB GLU 45 -7.549 -12.664 3.121
348 HB3 GLU 45 1HB GLU 45 -8.259 -11.677 4.401
349 HG2 GLU 45 2HG GLU 45 -10.301 -11.390 3.135
350 HG3 GLU 45 1HG GLU 45 -9.589 -12.176 1.725
351 H THR 46 H THR 46 -9.203 -9.295 1.087
352 HA THR 46 HA THR 46 -9.719 -7.044 2.789
353 HB THR 46 HB THR 46 -11.439 -6.513 0.955
354 HG1 THR 46 1HG THR 46 -10.072 -8.641 -0.307
355 HG21 THR 46 3HG2 THR 46 -8.517 -6.467 0.889
356 HG22 THR 46 1HG2 THR 46 -9.656 -5.271 0.274
357 HG23 THR 46 2HG2 THR 46 -9.183 -6.638 -0.731
358 H ARG 47 H ARG 47 -11.982 -6.348 3.291
359 HA ARG 47 HA ARG 47 -13.253 -8.133 5.003
360 HB2 ARG 47 2HB ARG 47 -15.223 -6.558 4.812
361 HB3 ARG 47 1HB ARG 47 -13.689 -5.789 5.227
362 HG2 ARG 47 2HG ARG 47 -13.356 -5.222 2.825
363 HG3 ARG 47 1HG ARG 47 -14.938 -5.916 2.465
364 HD2 ARG 47 2HD ARG 47 -15.972 -4.304 4.056
365 HD3 ARG 47 1HD ARG 47 -14.389 -3.573 4.307
366 HE ARG 47 HE ARG 47 -14.622 -2.508 2.257
367 HH11 ARG 47 1HH2 ARG 47 -16.860 -5.131 2.555
368 HH12 ARG 47 2HH2 ARG 47 -17.711 -4.753 1.095
369 HH21 ARG 47 1HH1 ARG 47 -15.732 -2.007 0.340
370 HH22 ARG 47 2HH1 ARG 47 -17.073 -2.984 -0.160
371 H ASP 48 H ASP 48 -13.843 -7.461 1.587
372 HA ASP 48 HA ASP 48 -16.212 -9.026 1.365
373 HB2 ASP 48 2HB ASP 48 -14.208 -8.281 -0.780
374 HB3 ASP 48 1HB ASP 48 -15.858 -8.851 -1.047
375 H GLY 49 H GLY 49 -12.781 -9.675 0.715
376 HA2 GLY 49 2HA GLY 49 -12.061 -11.970 1.472
377 HA3 GLY 49 1HA GLY 49 -13.402 -12.575 0.501
378 H THR 50 H THR 50 -11.306 -9.879 -0.405
379 HA THR 50 HA THR 50 -10.642 -11.240 -2.897
380 HB THR 50 HB THR 50 -9.579 -8.555 -2.022
381 HG1 THR 50 1HG THR 50 -12.063 -9.086 -3.277
382 HG21 THR 50 3HG2 THR 50 -9.702 -8.136 -4.466
383 HG22 THR 50 1HG2 THR 50 -10.295 -9.780 -4.700
384 HG23 THR 50 2HG2 THR 50 -8.666 -9.510 -4.081
385 H LYS 51 H LYS 51 -8.716 -12.125 -3.414
386 HA LYS 51 HA LYS 51 -6.761 -12.471 -1.271
387 HB2 LYS 51 2HB LYS 51 -7.434 -14.431 -2.556
388 HB3 LYS 51 1HB LYS 51 -6.923 -13.650 -4.056
389 HG2 LYS 51 2HG LYS 51 -4.622 -13.656 -3.372
390 HG3 LYS 51 1HG LYS 51 -5.048 -14.141 -1.730
391 HD2 LYS 51 2HD LYS 51 -5.919 -16.289 -2.595
392 HD3 LYS 51 1HD LYS 51 -5.465 -15.809 -4.231
393 HE2 LYS 51 2HE LYS 51 -3.134 -15.803 -3.679
394 HE3 LYS 51 1HE LYS 51 -3.476 -15.940 -1.955
395 HZ1 LYS 51 3HZ LYS 51 -4.571 -18.112 -2.507
396 HZ2 LYS 51 1HZ LYS 51 -2.886 -18.080 -2.690
397 HZ3 LYS 51 2HZ LYS 51 -3.890 -17.983 -4.057
398 H ILE 52 H ILE 52 -5.348 -10.873 -1.015
399 HA ILE 52 HA ILE 52 -3.895 -9.854 -3.396
400 HB ILE 52 HB ILE 52 -3.641 -7.709 -1.973
401 HG12 ILE 52 2HG1 ILE 52 -5.067 -9.230 -0.095
402 HG13 ILE 52 1HG1 ILE 52 -4.818 -7.490 -0.024
403 HG21 ILE 52 1HG2 ILE 52 -5.829 -6.840 -2.829
404 HG22 ILE 52 2HG2 ILE 52 -6.267 -8.495 -3.255
405 HG23 ILE 52 3HG2 ILE 52 -4.884 -7.722 -4.031
406 HD11 ILE 52 3HD1 ILE 52 -7.198 -8.234 0.225
407 HD12 ILE 52 1HD1 ILE 52 -7.144 -8.792 -1.446
408 HD13 ILE 52 2HD1 ILE 52 -6.925 -7.078 -1.080
409 H ILE 53 H ILE 53 -1.860 -10.444 -3.282
410 HA ILE 53 HA ILE 53 -0.657 -11.268 -0.758
411 HB ILE 53 HB ILE 53 0.723 -11.105 -3.438
412 HG12 ILE 53 2HG1 ILE 53 -1.318 -12.309 -3.856
413 HG13 ILE 53 1HG1 ILE 53 -0.023 -13.499 -3.718
414 HG21 ILE 53 1HG2 ILE 53 1.976 -13.035 -2.479
415 HG22 ILE 53 2HG2 ILE 53 1.058 -12.857 -0.984
416 HG23 ILE 53 3HG2 ILE 53 2.147 -11.573 -1.509
417 HD11 ILE 53 3HD1 ILE 53 -0.699 -13.635 -1.219
418 HD12 ILE 53 1HD1 ILE 53 -1.766 -14.396 -2.395
419 HD13 ILE 53 2HD1 ILE 53 -2.179 -12.822 -1.720
420 H MET 54 H MET 54 1.096 -10.272 0.235
421 HA MET 54 HA MET 54 1.254 -7.437 -0.053
422 HB2 MET 54 2HB MET 54 1.735 -8.670 2.080
423 HB3 MET 54 1HB MET 54 3.228 -9.261 1.346
424 HG2 MET 54 2HG MET 54 3.815 -7.308 2.618
425 HG3 MET 54 1HG MET 54 3.858 -6.842 0.929
426 HE1 MET 54 3HE MET 54 3.154 -4.686 0.316
427 HE2 MET 54 1HE MET 54 3.830 -4.305 1.906
428 HE3 MET 54 2HE MET 54 2.317 -3.564 1.387
429 H LYS 55 H LYS 55 1.607 -7.441 -2.370
430 HA LYS 55 HA LYS 55 3.935 -8.432 -3.609
431 HB2 LYS 55 2HB LYS 55 1.795 -7.637 -4.729
432 HB3 LYS 55 1HB LYS 55 2.362 -5.992 -4.460
433 HG2 LYS 55 2HG LYS 55 3.194 -6.374 -6.599
434 HG3 LYS 55 1HG LYS 55 4.565 -6.879 -5.622
435 HD2 LYS 55 2HD LYS 55 4.367 -8.706 -7.059
436 HD3 LYS 55 1HD LYS 55 3.375 -9.251 -5.710
437 HE2 LYS 55 2HE LYS 55 2.227 -9.603 -7.872
438 HE3 LYS 55 1HE LYS 55 1.347 -8.457 -6.865
439 HZ1 LYS 55 3HZ LYS 55 2.394 -8.063 -9.429
440 HZ2 LYS 55 1HZ LYS 55 3.233 -7.041 -8.367
441 HZ3 LYS 55 2HZ LYS 55 1.539 -6.960 -8.461
442 H GLY 56 H GLY 56 3.218 -5.003 -3.243
443 HA2 GLY 56 2HA GLY 56 5.902 -4.168 -3.426
444 HA3 GLY 56 1HA GLY 56 4.545 -3.179 -2.909
445 H ASN 57 H ASN 57 6.850 -5.627 -1.735
446 HA ASN 57 HA ASN 57 6.255 -5.169 1.028
447 HB2 ASN 57 2HB ASN 57 7.308 -7.256 0.335
448 HB3 ASN 57 1HB ASN 57 8.700 -6.372 -0.296
449 HD21 ASN 57 1HD2 ASN 57 7.151 -5.316 2.695
450 HD22 ASN 57 2HD2 ASN 57 8.410 -5.806 3.731
451 H GLU 58 H GLU 58 7.602 -3.254 -1.278
452 HA GLU 58 HA GLU 58 9.676 -1.990 0.310
453 HB2 GLU 58 2HB GLU 58 8.414 -1.178 -2.322
454 HB3 GLU 58 1HB GLU 58 9.851 -0.449 -1.605
455 HG2 GLU 58 2HG GLU 58 10.925 -2.728 -1.632
456 HG3 GLU 58 1HG GLU 58 9.534 -3.313 -2.541
457 H ILE 59 H ILE 59 8.139 -1.580 2.118
458 HA ILE 59 HA ILE 59 6.037 0.333 1.794
459 HB ILE 59 HB ILE 59 6.161 0.390 4.334
460 HG12 ILE 59 2HG1 ILE 59 8.086 -1.913 3.939
461 HG13 ILE 59 1HG1 ILE 59 8.642 -0.275 4.289
462 HG21 ILE 59 1HG2 ILE 59 5.973 -2.343 3.029
463 HG22 ILE 59 2HG2 ILE 59 4.683 -1.138 3.021
464 HG23 ILE 59 3HG2 ILE 59 5.215 -1.850 4.544
465 HD11 ILE 59 3HD1 ILE 59 6.525 -1.487 6.046
466 HD12 ILE 59 1HD1 ILE 59 7.758 -0.286 6.438
467 HD13 ILE 59 2HD1 ILE 59 8.205 -1.980 6.260
468 H PHE 60 H PHE 60 9.459 0.539 2.579
469 HA PHE 60 HA PHE 60 9.632 3.010 3.777
470 HB2 PHE 60 2HB PHE 60 11.874 3.187 2.816
471 HB3 PHE 60 1HB PHE 60 11.571 1.552 3.389
472 HD1 PHE 60 1HD PHE 60 11.587 3.699 0.337
473 HD2 PHE 60 2HD PHE 60 11.656 -0.301 1.905
474 HE1 PHE 60 1HE PHE 60 12.077 2.818 -1.928
475 HE2 PHE 60 2HE PHE 60 12.146 -1.180 -0.360
476 HZ PHE 60 HZ PHE 60 12.356 0.380 -2.277
477 H ARG 61 H ARG 61 8.865 2.259 0.457
478 HA ARG 61 HA ARG 61 9.388 4.680 -0.801
479 HB2 ARG 61 2HB ARG 61 8.660 2.734 -2.056
480 HB3 ARG 61 1HB ARG 61 7.103 2.740 -1.233
481 HG2 ARG 61 2HG ARG 61 7.008 3.746 -3.524
482 HG3 ARG 61 1HG ARG 61 6.510 4.868 -2.263
483 HD2 ARG 61 2HD ARG 61 8.496 6.114 -2.415
484 HD3 ARG 61 1HD ARG 61 9.381 4.796 -3.175
485 HE ARG 61 HE ARG 61 7.801 6.776 -4.514
486 HH11 ARG 61 1HH2 ARG 61 8.824 3.470 -4.552
487 HH12 ARG 61 2HH2 ARG 61 8.671 3.298 -6.269
488 HH21 ARG 61 1HH1 ARG 61 7.594 6.556 -6.765
489 HH22 ARG 61 2HH1 ARG 61 7.972 5.044 -7.522
490 H LEU 62 H LEU 62 6.699 3.747 1.278
491 HA LEU 62 HA LEU 62 4.911 5.806 0.845
492 HB2 LEU 62 2HB LEU 62 4.357 3.990 2.333
493 HB3 LEU 62 1HB LEU 62 5.669 4.419 3.424
494 HG LEU 62 HG LEU 62 4.571 6.489 4.043
495 HD11 LEU 62 1HD1 LEU 62 2.191 6.854 3.059
496 HD12 LEU 62 2HD1 LEU 62 2.714 5.769 1.770
497 HD13 LEU 62 3HD1 LEU 62 3.573 7.284 2.052
498 HD21 LEU 62 3HD2 LEU 62 2.618 4.167 3.971
499 HD22 LEU 62 1HD2 LEU 62 2.463 5.585 5.009
500 HD23 LEU 62 2HD2 LEU 62 3.819 4.478 5.225
501 H ASP 63 H ASP 63 7.646 5.788 3.142
502 HA ASP 63 HA ASP 63 8.295 8.509 2.684
503 HB2 ASP 63 2HB ASP 63 7.621 9.386 4.934
504 HB3 ASP 63 1HB ASP 63 6.262 9.030 3.870
505 H GLU 64 H GLU 64 8.496 8.055 5.971
506 HA GLU 64 HA GLU 64 10.442 7.956 7.250
507 HB2 GLU 64 2HB GLU 64 11.217 5.476 7.278
508 HB3 GLU 64 1HB GLU 64 9.569 5.851 7.771
509 HG2 GLU 64 2HG GLU 64 8.723 5.250 5.567
510 HG3 GLU 64 1HG GLU 64 10.363 4.986 4.976
511 H ALA 65 H ALA 65 12.044 9.229 6.447
512 HA ALA 65 HA ALA 65 14.037 9.785 5.457
513 HB1 ALA 65 1HB ALA 65 14.453 6.792 5.286
514 HB2 ALA 65 2HB ALA 65 14.779 7.763 6.720
515 HB3 ALA 65 3HB ALA 65 15.700 8.038 5.242
516 H LEU 66 H LEU 66 11.549 8.929 3.845
517 HA LEU 66 HA LEU 66 10.930 8.779 1.646
518 HB2 LEU 66 2HB LEU 66 12.042 10.898 1.420
519 HB3 LEU 66 1HB LEU 66 13.625 10.127 1.371
520 HG LEU 66 HG LEU 66 13.169 9.147 -0.784
521 HD11 LEU 66 1HD1 LEU 66 10.907 8.456 -0.668
522 HD12 LEU 66 2HD1 LEU 66 10.897 9.734 -1.881
523 HD13 LEU 66 3HD1 LEU 66 10.345 10.072 -0.240
524 HD21 LEU 66 3HD2 LEU 66 12.195 12.018 -0.667
525 HD22 LEU 66 1HD2 LEU 66 12.705 11.189 -2.138
526 HD23 LEU 66 2HD2 LEU 66 13.868 11.488 -0.847
527 H ARG 67 H ARG 67 14.397 8.351 1.052
528 HA ARG 67 HA ARG 67 15.575 6.635 0.079
529 HB2 ARG 67 2HB ARG 67 13.452 4.814 1.223
530 HB3 ARG 67 1HB ARG 67 15.127 4.412 0.840
531 HG2 ARG 67 2HG ARG 67 15.828 6.148 2.547
532 HG3 ARG 67 1HG ARG 67 14.134 6.253 3.029
533 HD2 ARG 67 2HD ARG 67 14.102 3.902 3.625
534 HD3 ARG 67 1HD ARG 67 15.728 3.676 2.987
535 HE ARG 67 HE ARG 67 15.861 5.675 4.946
536 HH11 ARG 67 1HH2 ARG 67 15.098 2.316 4.631
537 HH12 ARG 67 2HH2 ARG 67 15.616 1.907 6.233
538 HH21 ARG 67 1HH1 ARG 67 16.542 5.147 7.047
539 HH22 ARG 67 2HH1 ARG 67 16.434 3.509 7.601
540 H LYS 68 H LYS 68 15.038 7.360 -2.037
541 HA LYS 68 HA LYS 68 14.256 7.098 -4.178
542 HB2 LYS 68 2HB LYS 68 15.069 4.740 -3.681
543 HB3 LYS 68 1HB LYS 68 13.398 4.338 -3.294
544 HG2 LYS 68 2HG LYS 68 13.482 3.750 -5.552
545 HG3 LYS 68 1HG LYS 68 12.883 5.404 -5.657
546 HD2 LYS 68 2HD LYS 68 15.118 6.234 -6.153
547 HD3 LYS 68 1HD LYS 68 15.813 4.637 -5.881
548 HE2 LYS 68 2HE LYS 68 14.480 3.745 -7.763
549 HE3 LYS 68 1HE LYS 68 13.815 5.354 -8.047
550 HZ1 LYS 68 3HZ LYS 68 16.638 4.491 -8.302
551 HZ2 LYS 68 1HZ LYS 68 16.169 6.121 -8.296
552 HZ3 LYS 68 2HZ LYS 68 15.617 5.083 -9.523
553 H GLY 69 H GLY 69 12.547 8.335 -4.634
554 HA2 GLY 69 2HA GLY 69 9.970 7.470 -4.939
555 HA3 GLY 69 1HA GLY 69 10.021 8.065 -3.283
556 H HIS 70 H HIS 70 8.725 9.040 -5.871
557 HA HIS 70 HA HIS 70 8.313 11.032 -6.950
558 HB2 HIS 70 2HB HIS 70 9.262 12.214 -4.330
559 HB3 HIS 70 1HB HIS 70 8.192 12.974 -5.511
560 HD2 HIS 70 2HD HIS 70 7.930 10.659 -2.456
561 HE1 HIS 70 1HE HIS 70 4.196 10.466 -4.415
562 HE2 HIS 70 2HE HIS 70 5.451 9.854 -2.294
563 H SER 71 H SER 71 11.262 9.951 -6.572
564 HA SER 71 HA SER 71 12.897 12.280 -6.919
565 HB2 SER 71 2HB SER 71 14.672 10.670 -7.468
566 HB3 SER 71 1HB SER 71 13.807 10.186 -6.012
567 HG SER 71 HG SER 71 12.720 8.658 -7.177
568 H GLU 72 H GLU 72 10.719 12.365 -8.701
569 HA GLU 72 HA GLU 72 11.180 11.421 -11.282
570 HB2 GLU 72 2HB GLU 72 9.902 14.035 -10.440
571 HB3 GLU 72 1HB GLU 72 9.746 13.285 -12.030
572 HG2 GLU 72 2HG GLU 72 8.768 11.267 -10.946
573 HG3 GLU 72 1HG GLU 72 8.842 12.096 -9.391
574 H GLY 73 H GLY 73 13.446 11.557 -11.659
575 HA2 GLY 73 2HA GLY 73 14.283 13.745 -13.196
576 HA3 GLY 73 1HA GLY 73 14.949 13.945 -11.577
577 H GLY 74 H GLY 74 16.336 13.422 -14.119
578 HA2 GLY 74 2HA GLY 74 18.118 12.182 -14.880
579 HA3 GLY 74 1HA GLY 74 18.277 11.594 -13.226
580 H1 HOH 201 H2 HOH 77 6.774 9.591 -6.932
581 H2 HOH 201 H1 HOH 77 5.756 9.267 -8.005
Start of MODEL 6
1 H1 VAL 1 1H VAL 1 -1.769 14.530 -12.433
2 H2 VAL 1 2H VAL 1 -0.317 15.146 -13.060
3 HA VAL 1 HA VAL 1 -1.484 13.402 -14.443
4 HB VAL 1 HB VAL 1 1.346 12.745 -13.588
5 HG11 VAL 1 2HG1 VAL 1 0.373 11.216 -15.224
6 HG12 VAL 1 3HG1 VAL 1 1.564 12.240 -16.025
7 HG13 VAL 1 1HG1 VAL 1 -0.157 12.574 -16.218
8 HG21 VAL 1 1HG2 VAL 1 1.318 15.126 -13.856
9 HG22 VAL 1 2HG2 VAL 1 0.270 15.020 -15.272
10 HG23 VAL 1 3HG2 VAL 1 1.944 14.475 -15.372
11 H ASP 2 H ASP 2 -2.922 12.521 -12.560
12 HA ASP 2 HA ASP 2 -2.588 9.714 -12.471
13 HB2 ASP 2 2HB ASP 2 -2.322 9.551 -9.947
14 HB3 ASP 2 1HB ASP 2 -0.878 10.018 -10.844
15 H MET 3 H MET 3 -4.262 12.558 -11.984
16 HA MET 3 HA MET 3 -6.321 11.843 -10.214
17 HB2 MET 3 2HB MET 3 -7.655 13.580 -11.431
18 HB3 MET 3 1HB MET 3 -6.060 14.138 -10.924
19 HG2 MET 3 2HG MET 3 -5.193 13.595 -13.204
20 HG3 MET 3 1HG MET 3 -6.834 13.179 -13.693
21 HE1 MET 3 3HE MET 3 -6.659 14.913 -15.669
22 HE2 MET 3 1HE MET 3 -5.004 15.226 -15.130
23 HE3 MET 3 2HE MET 3 -6.094 16.569 -15.465
24 H SER 4 H SER 4 -5.796 11.095 -13.597
25 HA SER 4 HA SER 4 -8.434 10.135 -14.132
26 HB2 SER 4 2HB SER 4 -6.925 10.831 -15.938
27 HB3 SER 4 1HB SER 4 -5.811 9.532 -15.522
28 HG SER 4 HG SER 4 -6.993 8.456 -16.901
29 H ASN 5 H ASN 5 -5.409 8.627 -13.087
30 HA ASN 5 HA ASN 5 -6.420 5.946 -13.194
31 HB2 ASN 5 2HB ASN 5 -3.999 6.508 -13.318
32 HB3 ASN 5 1HB ASN 5 -4.063 7.030 -11.635
33 HD21 ASN 5 1HD2 ASN 5 -3.346 4.370 -13.565
34 HD22 ASN 5 2HD2 ASN 5 -3.553 3.148 -12.405
35 H VAL 6 H VAL 6 -7.715 4.964 -11.787
36 HA VAL 6 HA VAL 6 -8.644 6.302 -9.428
37 HB VAL 6 HB VAL 6 -9.072 3.412 -10.211
38 HG11 VAL 6 1HG1 VAL 6 -11.182 3.750 -8.930
39 HG12 VAL 6 2HG1 VAL 6 -10.637 5.371 -8.502
40 HG13 VAL 6 3HG1 VAL 6 -9.750 3.961 -7.925
41 HG21 VAL 6 3HG2 VAL 6 -10.654 5.890 -10.974
42 HG22 VAL 6 1HG2 VAL 6 -11.102 4.225 -11.353
43 HG23 VAL 6 2HG2 VAL 6 -9.656 4.936 -12.072
44 H VAL 7 H VAL 7 -7.911 6.163 -7.400
45 HA VAL 7 HA VAL 7 -5.466 4.852 -6.799
46 HB VAL 7 HB VAL 7 -6.196 6.873 -5.613
47 HG11 VAL 7 1HG1 VAL 7 -8.053 6.835 -4.074
48 HG12 VAL 7 2HG1 VAL 7 -8.273 5.101 -4.302
49 HG13 VAL 7 3HG1 VAL 7 -8.638 6.216 -5.619
50 HG21 VAL 7 3HG2 VAL 7 -5.552 6.175 -3.396
51 HG22 VAL 7 1HG2 VAL 7 -4.672 5.156 -4.537
52 HG23 VAL 7 2HG2 VAL 7 -6.091 4.523 -3.702
53 H LYS 8 H LYS 8 -5.069 3.095 -5.394
54 HA LYS 8 HA LYS 8 -7.204 1.060 -5.404
55 HB2 LYS 8 2HB LYS 8 -4.852 0.649 -6.357
56 HB3 LYS 8 1HB LYS 8 -4.307 0.625 -4.682
57 HG2 LYS 8 2HG LYS 8 -4.768 -1.636 -4.982
58 HG3 LYS 8 1HG LYS 8 -6.328 -1.082 -4.377
59 HD2 LYS 8 2HD LYS 8 -6.988 -2.285 -6.266
60 HD3 LYS 8 1HD LYS 8 -6.849 -0.664 -6.939
61 HE2 LYS 8 2HE LYS 8 -5.746 -2.356 -8.381
62 HE3 LYS 8 1HE LYS 8 -4.586 -1.178 -7.760
63 HZ1 LYS 8 3HZ LYS 8 -3.450 -2.859 -6.912
64 HZ2 LYS 8 1HZ LYS 8 -4.634 -3.974 -7.394
65 HZ3 LYS 8 2HZ LYS 8 -4.755 -3.210 -5.881
66 H THR 9 H THR 9 -7.915 0.064 -3.549
67 HA THR 9 HA THR 9 -6.697 0.676 -0.976
68 HB THR 9 HB THR 9 -9.479 1.628 -1.697
69 HG1 THR 9 1HG THR 9 -7.823 3.063 -2.199
70 HG21 THR 9 3HG2 THR 9 -9.344 2.438 0.776
71 HG22 THR 9 1HG2 THR 9 -8.131 1.171 0.960
72 HG23 THR 9 2HG2 THR 9 -9.772 0.757 0.465
73 H TYR 10 H TYR 10 -6.543 -1.310 -0.162
74 HA TYR 10 HA TYR 10 -8.805 -3.199 -0.482
75 HB2 TYR 10 2HB TYR 10 -5.885 -3.690 0.165
76 HB3 TYR 10 1HB TYR 10 -7.122 -4.939 0.129
77 HD1 TYR 10 2HD TYR 10 -8.670 -4.772 -2.145
78 HD2 TYR 10 1HD TYR 10 -4.568 -3.535 -1.763
79 HE1 TYR 10 2HE TYR 10 -8.368 -5.013 -4.587
80 HE2 TYR 10 1HE TYR 10 -4.271 -3.787 -4.209
81 HH TYR 10 HH TYR 10 -6.392 -5.448 -6.158
82 H ASP 11 H ASP 11 -10.143 -2.933 1.226
83 HA ASP 11 HA ASP 11 -9.255 -2.133 3.820
84 HB2 ASP 11 2HB ASP 11 -11.869 -3.282 2.834
85 HB3 ASP 11 1HB ASP 11 -11.588 -2.758 4.494
86 H LEU 12 H LEU 12 -7.638 -3.653 4.325
87 HA LEU 12 HA LEU 12 -7.911 -6.437 4.405
88 HB2 LEU 12 2HB LEU 12 -6.096 -4.403 5.480
89 HB3 LEU 12 1HB LEU 12 -6.226 -5.790 6.554
90 HG LEU 12 HG LEU 12 -5.517 -7.308 4.829
91 HD11 LEU 12 1HD1 LEU 12 -4.801 -5.998 2.551
92 HD12 LEU 12 2HD1 LEU 12 -6.224 -5.063 3.009
93 HD13 LEU 12 3HD1 LEU 12 -6.351 -6.802 2.761
94 HD21 LEU 12 3HD2 LEU 12 -3.311 -6.118 4.087
95 HD22 LEU 12 1HD2 LEU 12 -3.607 -6.357 5.808
96 HD23 LEU 12 2HD2 LEU 12 -3.887 -4.778 5.070
97 H GLN 13 H GLN 13 -8.070 -7.826 6.306
98 HA GLN 13 HA GLN 13 -10.433 -7.164 7.835
99 HB2 GLN 13 2HB GLN 13 -8.625 -9.580 7.712
100 HB3 GLN 13 1HB GLN 13 -9.960 -9.461 8.861
101 HG2 GLN 13 2HG GLN 13 -10.376 -8.994 5.904
102 HG3 GLN 13 1HG GLN 13 -10.447 -10.612 6.603
103 HE21 GLN 13 1HE2 GLN 13 -11.469 -8.378 8.934
104 HE22 GLN 13 2HE2 GLN 13 -13.147 -8.511 8.682
105 H ASP 14 H ASP 14 -7.036 -6.919 8.268
106 HA ASP 14 HA ASP 14 -7.061 -7.004 11.153
107 HB2 ASP 14 2HB ASP 14 -4.947 -5.969 9.248
108 HB3 ASP 14 1HB ASP 14 -4.726 -6.285 10.970
109 H GLY 15 H GLY 15 -8.629 -4.977 9.357
110 HA2 GLY 15 2HA GLY 15 -9.492 -2.873 9.791
111 HA3 GLY 15 1HA GLY 15 -8.474 -2.801 11.230
112 H SER 16 H SER 16 -6.333 -3.629 8.990
113 HA SER 16 HA SER 16 -5.244 -0.982 8.761
114 HB2 SER 16 2HB SER 16 -3.484 -2.126 7.406
115 HB3 SER 16 1HB SER 16 -3.738 -2.866 8.986
116 HG SER 16 HG SER 16 -4.661 -3.730 6.449
117 H LYS 17 H LYS 17 -4.179 -0.859 6.252
118 HA LYS 17 HA LYS 17 -6.210 -1.237 4.232
119 HB2 LYS 17 2HB LYS 17 -6.945 0.826 5.491
120 HB3 LYS 17 1HB LYS 17 -5.447 1.596 4.969
121 HG2 LYS 17 2HG LYS 17 -6.151 0.959 2.576
122 HG3 LYS 17 1HG LYS 17 -7.744 0.629 3.259
123 HD2 LYS 17 2HD LYS 17 -6.243 3.260 3.415
124 HD3 LYS 17 1HD LYS 17 -7.662 2.933 2.423
125 HE2 LYS 17 2HE LYS 17 -7.479 3.109 5.429
126 HE3 LYS 17 1HE LYS 17 -8.541 4.001 4.341
127 HZ1 LYS 17 3HZ LYS 17 -8.760 1.247 5.310
128 HZ2 LYS 17 1HZ LYS 17 -9.344 1.593 3.755
129 HZ3 LYS 17 2HZ LYS 17 -9.969 2.421 5.100
130 H VAL 18 H VAL 18 -5.118 -1.736 2.443
131 HA VAL 18 HA VAL 18 -2.310 -0.916 2.183
132 HB VAL 18 HB VAL 18 -3.666 -2.706 0.190
133 HG11 VAL 18 1HG1 VAL 18 -1.524 -3.688 0.005
134 HG12 VAL 18 2HG1 VAL 18 -1.000 -3.052 1.563
135 HG13 VAL 18 3HG1 VAL 18 -1.195 -1.966 0.187
136 HG21 VAL 18 3HG2 VAL 18 -3.088 -4.626 1.810
137 HG22 VAL 18 1HG2 VAL 18 -4.557 -3.706 2.128
138 HG23 VAL 18 2HG2 VAL 18 -3.101 -3.391 3.074
139 H HIS 19 H HIS 19 -1.497 0.112 0.342
140 HA HIS 19 HA HIS 19 -3.374 1.112 -1.683
141 HB2 HIS 19 2HB HIS 19 -1.974 3.395 -1.358
142 HB3 HIS 19 1HB HIS 19 -3.476 3.089 -0.494
143 HD1 HIS 19 1HD HIS 19 -3.278 3.638 1.896
144 HD2 HIS 19 2HD HIS 19 0.334 2.188 0.396
145 HE1 HIS 19 1HE HIS 19 -1.635 3.680 3.817
146 HE2 HIS 19 2HE HIS 19 0.565 2.778 2.926
147 H VAL 20 H VAL 20 -2.523 0.604 -3.576
148 HA VAL 20 HA VAL 20 0.304 -0.030 -3.761
149 HB VAL 20 HB VAL 20 -0.167 -1.208 -5.694
150 HG11 VAL 20 1HG1 VAL 20 -2.546 -2.156 -5.508
151 HG12 VAL 20 2HG1 VAL 20 -2.740 -1.100 -4.116
152 HG13 VAL 20 3HG1 VAL 20 -1.502 -2.338 -4.112
153 HG21 VAL 20 3HG2 VAL 20 -2.227 -0.672 -7.122
154 HG22 VAL 20 1HG2 VAL 20 -0.922 0.512 -7.148
155 HG23 VAL 20 2HG2 VAL 20 -2.364 0.811 -6.177
156 H PHE 21 H PHE 21 1.689 0.784 -5.417
157 HA PHE 21 HA PHE 21 1.268 3.662 -5.900
158 HB2 PHE 21 2HB PHE 21 3.742 1.922 -6.010
159 HB3 PHE 21 1HB PHE 21 3.716 3.644 -6.391
160 HD1 PHE 21 1HD PHE 21 3.199 5.317 -4.638
161 HD2 PHE 21 2HD PHE 21 3.535 1.130 -3.737
162 HE1 PHE 21 1HE PHE 21 3.367 5.850 -2.221
163 HE2 PHE 21 2HE PHE 21 3.704 1.663 -1.322
164 HZ PHE 21 HZ PHE 21 3.621 4.022 -0.563
165 H LYS 22 H LYS 22 3.025 3.999 -8.021
166 HA LYS 22 HA LYS 22 1.354 3.246 -10.233
167 HB2 LYS 22 2HB LYS 22 4.120 4.421 -10.467
168 HB3 LYS 22 1HB LYS 22 2.740 4.630 -11.545
169 HG2 LYS 22 2HG LYS 22 2.991 5.700 -8.720
170 HG3 LYS 22 1HG LYS 22 3.024 6.649 -10.204
171 HD2 LYS 22 2HD LYS 22 0.702 5.661 -10.696
172 HD3 LYS 22 1HD LYS 22 0.696 5.135 -9.012
173 HE2 LYS 22 2HE LYS 22 -0.408 7.315 -9.205
174 HE3 LYS 22 1HE LYS 22 1.095 7.479 -8.296
175 HZ1 LYS 22 3HZ LYS 22 1.784 7.796 -10.943
176 HZ2 LYS 22 1HZ LYS 22 1.686 9.011 -9.763
177 HZ3 LYS 22 2HZ LYS 22 0.347 8.682 -10.755
178 H ASP 23 H ASP 23 4.195 1.960 -8.724
179 HA ASP 23 HA ASP 23 5.018 0.363 -10.991
180 HB2 ASP 23 2HB ASP 23 5.832 0.212 -8.079
181 HB3 ASP 23 1HB ASP 23 6.627 -0.620 -9.417
182 H GLY 24 H GLY 24 2.289 0.168 -9.434
183 HA2 GLY 24 2HA GLY 24 0.738 -1.519 -9.174
184 HA3 GLY 24 1HA GLY 24 1.891 -2.614 -9.932
185 H LYS 25 H LYS 25 3.765 -1.438 -7.665
186 HA LYS 25 HA LYS 25 3.578 -3.704 -5.939
187 HB2 LYS 25 2HB LYS 25 5.150 -1.148 -6.030
188 HB3 LYS 25 1HB LYS 25 5.120 -2.028 -4.509
189 HG2 LYS 25 2HG LYS 25 5.846 -4.089 -5.765
190 HG3 LYS 25 1HG LYS 25 6.044 -3.080 -7.196
191 HD2 LYS 25 2HD LYS 25 7.413 -2.512 -4.553
192 HD3 LYS 25 1HD LYS 25 8.159 -3.452 -5.842
193 HE2 LYS 25 2HE LYS 25 7.636 -1.414 -7.360
194 HE3 LYS 25 1HE LYS 25 7.394 -0.534 -5.852
195 HZ1 LYS 25 3HZ LYS 25 9.748 -0.749 -7.014
196 HZ2 LYS 25 1HZ LYS 25 9.806 -2.151 -6.063
197 HZ3 LYS 25 2HZ LYS 25 9.571 -0.637 -5.328
198 H MET 26 H MET 26 2.811 -3.859 -3.862
199 HA MET 26 HA MET 26 0.579 -2.170 -3.193
200 HB2 MET 26 2HB MET 26 1.668 -4.779 -2.299
201 HB3 MET 26 1HB MET 26 0.812 -3.865 -1.058
202 HG2 MET 26 2HG MET 26 -1.178 -3.771 -2.363
203 HG3 MET 26 1HG MET 26 -0.343 -4.344 -3.811
204 HE1 MET 26 3HE MET 26 -2.014 -7.576 -3.724
205 HE2 MET 26 1HE MET 26 -0.581 -6.914 -4.524
206 HE3 MET 26 2HE MET 26 -2.013 -5.911 -4.305
207 H GLY 27 H GLY 27 0.509 -2.021 -0.534
208 HA2 GLY 27 2HA GLY 27 2.959 -0.889 0.552
209 HA3 GLY 27 1HA GLY 27 1.672 0.276 0.253
210 H MET 28 H MET 28 2.951 -1.855 2.497
211 HA MET 28 HA MET 28 0.465 -2.542 3.816
212 HB2 MET 28 2HB MET 28 2.556 -3.990 3.736
213 HB3 MET 28 1HB MET 28 3.264 -2.865 4.884
214 HG2 MET 28 2HG MET 28 2.304 -4.703 6.112
215 HG3 MET 28 1HG MET 28 1.349 -3.262 6.405
216 HE1 MET 28 3HE MET 28 -0.586 -4.191 7.254
217 HE2 MET 28 1HE MET 28 -1.910 -4.858 6.299
218 HE3 MET 28 2HE MET 28 -1.344 -3.222 5.989
219 H GLU 29 H GLU 29 -0.596 -0.987 4.849
220 HA GLU 29 HA GLU 29 0.874 0.683 6.799
221 HB2 GLU 29 2HB GLU 29 0.329 1.941 4.649
222 HB3 GLU 29 1HB GLU 29 -1.370 1.748 5.086
223 HG2 GLU 29 2HG GLU 29 -0.683 3.879 5.951
224 HG3 GLU 29 1HG GLU 29 -0.797 2.788 7.331
225 H ASN 30 H ASN 30 0.007 0.526 8.759
226 HA ASN 30 HA ASN 30 -2.526 -0.849 9.127
227 HB2 ASN 30 2HB ASN 30 -1.969 -0.883 11.456
228 HB3 ASN 30 1HB ASN 30 -0.495 -1.245 10.558
229 HD21 ASN 30 1HD2 ASN 30 0.045 -0.340 13.034
230 HD22 ASN 30 2HD2 ASN 30 0.507 1.298 13.030
231 H LYS 31 H LYS 31 -3.997 0.091 10.910
232 HA LYS 31 HA LYS 31 -4.828 2.729 10.013
233 HB2 LYS 31 2HB LYS 31 -6.908 2.269 10.951
234 HB3 LYS 31 1HB LYS 31 -6.356 0.667 10.480
235 HG2 LYS 31 2HG LYS 31 -6.216 1.854 13.282
236 HG3 LYS 31 1HG LYS 31 -7.331 0.615 12.732
237 HD2 LYS 31 2HD LYS 31 -4.316 0.291 12.738
238 HD3 LYS 31 1HD LYS 31 -5.383 -0.308 13.999
239 HE2 LYS 31 2HE LYS 31 -6.647 -1.503 12.056
240 HE3 LYS 31 1HE LYS 31 -5.170 -1.224 11.137
241 HZ1 LYS 31 3HZ LYS 31 -3.978 -2.628 12.436
242 HZ2 LYS 31 1HZ LYS 31 -5.498 -3.363 12.601
243 HZ3 LYS 31 2HZ LYS 31 -4.913 -2.340 13.825
244 H PHE 32 H PHE 32 -2.764 1.577 12.368
245 HA PHE 32 HA PHE 32 -3.431 3.479 14.443
246 HB2 PHE 32 2HB PHE 32 -2.254 1.139 14.651
247 HB3 PHE 32 1HB PHE 32 -0.787 2.045 14.281
248 HD1 PHE 32 1HD PHE 32 0.063 3.754 15.823
249 HD2 PHE 32 2HD PHE 32 -3.496 1.520 16.716
250 HE1 PHE 32 1HE PHE 32 0.169 4.529 18.176
251 HE2 PHE 32 2HE PHE 32 -3.390 2.296 19.069
252 HZ PHE 32 HZ PHE 32 -1.558 3.800 19.800
253 H GLY 33 H GLY 33 -1.992 3.772 11.473
254 HA2 GLY 33 2HA GLY 33 -1.068 5.690 10.523
255 HA3 GLY 33 1HA GLY 33 -0.909 6.385 12.135
256 H LYS 34 H LYS 34 0.288 3.185 11.431
257 HA LYS 34 HA LYS 34 3.062 4.171 11.200
258 HB2 LYS 34 2HB LYS 34 2.144 2.062 13.173
259 HB3 LYS 34 1HB LYS 34 3.816 2.534 12.871
260 HG2 LYS 34 2HG LYS 34 3.066 4.928 13.457
261 HG3 LYS 34 1HG LYS 34 1.606 4.181 14.107
262 HD2 LYS 34 2HD LYS 34 4.461 3.646 14.975
263 HD3 LYS 34 1HD LYS 34 3.198 4.437 15.919
264 HE2 LYS 34 2HE LYS 34 1.856 2.256 15.628
265 HE3 LYS 34 1HE LYS 34 3.377 1.536 15.101
266 HZ1 LYS 34 3HZ LYS 34 2.956 1.280 17.498
267 HZ2 LYS 34 1HZ LYS 34 2.999 2.966 17.674
268 HZ3 LYS 34 2HZ LYS 34 4.390 2.131 17.170
269 H SER 35 H SER 35 3.989 3.241 9.507
270 HA SER 35 HA SER 35 2.835 1.254 7.928
271 HB2 SER 35 2HB SER 35 5.800 1.793 8.147
272 HB3 SER 35 1HB SER 35 4.927 1.155 6.757
273 HG SER 35 HG SER 35 5.181 3.742 7.681
274 H MET 36 H MET 36 3.072 -0.951 7.765
275 HA MET 36 HA MET 36 4.469 -2.309 10.015
276 HB2 MET 36 2HB MET 36 1.830 -2.857 8.666
277 HB3 MET 36 1HB MET 36 2.725 -4.180 9.418
278 HG2 MET 36 2HG MET 36 2.801 -2.865 11.542
279 HG3 MET 36 1HG MET 36 1.802 -1.627 10.776
280 HE1 MET 36 3HE MET 36 2.037 -5.510 11.360
281 HE2 MET 36 1HE MET 36 0.641 -5.686 12.431
282 HE3 MET 36 2HE MET 36 1.965 -4.611 12.872
283 H ASN 37 H ASN 37 6.277 -3.188 9.302
284 HA ASN 37 HA ASN 37 6.821 -3.745 6.573
285 HB2 ASN 37 2HB ASN 37 8.653 -3.240 8.029
286 HB3 ASN 37 1HB ASN 37 8.217 -4.540 9.133
287 HD21 ASN 37 1HD2 ASN 37 7.796 -5.478 5.859
288 HD22 ASN 37 2HD2 ASN 37 9.247 -6.350 5.688
289 H MET 38 H MET 38 5.162 -5.118 5.819
290 HA MET 38 HA MET 38 4.943 -7.790 6.999
291 HB2 MET 38 2HB MET 38 2.842 -6.852 6.388
292 HB3 MET 38 1HB MET 38 3.426 -6.375 4.789
293 HG2 MET 38 2HG MET 38 3.626 -8.724 4.148
294 HG3 MET 38 1HG MET 38 3.218 -9.223 5.778
295 HE1 MET 38 3HE MET 38 -0.441 -8.856 6.184
296 HE2 MET 38 1HE MET 38 0.634 -7.544 6.689
297 HE3 MET 38 2HE MET 38 1.151 -9.226 6.845
298 HA PRO 39 HA PRO 39 8.057 -9.013 3.959
299 HB2 PRO 39 2HB PRO 39 8.139 -11.696 4.458
300 HB3 PRO 39 1HB PRO 39 8.867 -10.495 5.548
301 HG2 PRO 39 2HG PRO 39 6.244 -11.908 5.775
302 HG3 PRO 39 1HG PRO 39 7.446 -11.556 7.032
303 HD2 PRO 39 2HD PRO 39 5.183 -10.054 6.681
304 HD3 PRO 39 1HD PRO 39 6.685 -9.382 7.334
305 H GLU 40 H GLU 40 7.922 -9.523 1.842
306 HA GLU 40 HA GLU 40 5.565 -9.853 0.481
307 HB2 GLU 40 2HB GLU 40 6.903 -10.632 -1.421
308 HB3 GLU 40 1HB GLU 40 7.699 -9.285 -0.602
309 HG2 GLU 40 2HG GLU 40 8.959 -11.089 0.749
310 HG3 GLU 40 1HG GLU 40 8.387 -12.225 -0.477
311 H GLY 41 H GLY 41 4.131 -11.434 0.221
312 HA2 GLY 41 2HA GLY 41 3.771 -13.799 -0.400
313 HA3 GLY 41 1HA GLY 41 4.938 -14.227 0.845
314 H LYS 42 H LYS 42 3.687 -11.974 2.544
315 HA LYS 42 HA LYS 42 1.870 -13.687 3.950
316 HB2 LYS 42 2HB LYS 42 3.005 -10.972 4.308
317 HB3 LYS 42 1HB LYS 42 1.453 -11.237 5.087
318 HG2 LYS 42 2HG LYS 42 3.647 -13.283 5.425
319 HG3 LYS 42 1HG LYS 42 3.696 -11.801 6.374
320 HD2 LYS 42 2HD LYS 42 1.666 -12.270 7.465
321 HD3 LYS 42 1HD LYS 42 1.180 -13.457 6.253
322 HE2 LYS 42 2HE LYS 42 3.468 -13.767 8.223
323 HE3 LYS 42 1HE LYS 42 1.907 -14.585 8.315
324 HZ1 LYS 42 3HZ LYS 42 4.151 -15.054 6.507
325 HZ2 LYS 42 1HZ LYS 42 2.592 -15.257 5.871
326 HZ3 LYS 42 2HZ LYS 42 3.081 -16.164 7.222
327 H VAL 43 H VAL 43 0.243 -14.211 2.590
328 HA VAL 43 HA VAL 43 -1.245 -12.523 0.946
329 HB VAL 43 HB VAL 43 -2.264 -14.972 2.399
330 HG11 VAL 43 1HG1 VAL 43 -4.008 -13.662 1.277
331 HG12 VAL 43 2HG1 VAL 43 -3.712 -15.156 0.389
332 HG13 VAL 43 3HG1 VAL 43 -3.054 -13.633 -0.206
333 HG21 VAL 43 3HG2 VAL 43 -1.479 -16.195 0.386
334 HG22 VAL 43 1HG2 VAL 43 -0.138 -15.444 1.251
335 HG23 VAL 43 2HG2 VAL 43 -0.760 -14.704 -0.225
336 H MET 44 H MET 44 -2.622 -10.946 1.341
337 HA MET 44 HA MET 44 -3.824 -10.691 4.041
338 HB2 MET 44 2HB MET 44 -3.832 -8.398 2.112
339 HB3 MET 44 1HB MET 44 -3.673 -8.387 3.844
340 HG2 MET 44 2HG MET 44 -1.366 -9.075 3.729
341 HG3 MET 44 1HG MET 44 -1.484 -9.387 2.001
342 HE1 MET 44 3HE MET 44 -2.324 -7.891 0.425
343 HE2 MET 44 1HE MET 44 -0.711 -7.229 0.173
344 HE3 MET 44 2HE MET 44 -2.088 -6.150 0.349
345 H GLU 45 H GLU 45 -6.103 -10.091 4.122
346 HA GLU 45 HA GLU 45 -7.604 -10.591 1.612
347 HB2 GLU 45 2HB GLU 45 -7.447 -12.679 2.999
348 HB3 GLU 45 1HB GLU 45 -8.318 -11.827 4.277
349 HG2 GLU 45 2HG GLU 45 -10.223 -11.470 2.810
350 HG3 GLU 45 1HG GLU 45 -9.347 -12.172 1.447
351 H THR 46 H THR 46 -9.214 -9.214 1.261
352 HA THR 46 HA THR 46 -9.787 -7.183 3.257
353 HB THR 46 HB THR 46 -10.724 -5.933 1.532
354 HG1 THR 46 1HG THR 46 -11.895 -6.800 -0.021
355 HG21 THR 46 3HG2 THR 46 -8.293 -6.666 1.147
356 HG22 THR 46 1HG2 THR 46 -9.164 -6.031 -0.248
357 HG23 THR 46 2HG2 THR 46 -8.947 -7.769 -0.060
358 H ARG 47 H ARG 47 -12.135 -6.450 3.404
359 HA ARG 47 HA ARG 47 -13.646 -8.500 4.649
360 HB2 ARG 47 2HB ARG 47 -14.694 -5.833 3.689
361 HB3 ARG 47 1HB ARG 47 -15.298 -6.813 5.028
362 HG2 ARG 47 2HG ARG 47 -13.099 -6.516 6.180
363 HG3 ARG 47 1HG ARG 47 -12.606 -5.427 4.881
364 HD2 ARG 47 2HD ARG 47 -13.501 -4.202 6.856
365 HD3 ARG 47 1HD ARG 47 -14.446 -3.913 5.397
366 HE ARG 47 HE ARG 47 -15.535 -6.099 6.856
367 HH11 ARG 47 1HH2 ARG 47 -15.178 -2.657 6.876
368 HH12 ARG 47 2HH2 ARG 47 -16.634 -2.373 7.768
369 HH21 ARG 47 1HH1 ARG 47 -17.447 -5.734 8.025
370 HH22 ARG 47 2HH1 ARG 47 -17.920 -4.116 8.419
371 H ASP 48 H ASP 48 -13.796 -6.955 1.477
372 HA ASP 48 HA ASP 48 -16.232 -8.142 0.631
373 HB2 ASP 48 2HB ASP 48 -15.254 -6.190 -0.502
374 HB3 ASP 48 1HB ASP 48 -13.880 -7.172 -1.014
375 H GLY 49 H GLY 49 -13.211 -9.460 1.275
376 HA2 GLY 49 2HA GLY 49 -12.592 -11.704 1.188
377 HA3 GLY 49 1HA GLY 49 -13.995 -12.031 0.171
378 H THR 50 H THR 50 -11.289 -9.733 -0.245
379 HA THR 50 HA THR 50 -10.734 -10.991 -2.880
380 HB THR 50 HB THR 50 -10.294 -8.161 -1.901
381 HG1 THR 50 1HG THR 50 -11.783 -9.155 -4.087
382 HG21 THR 50 3HG2 THR 50 -9.389 -9.579 -4.411
383 HG22 THR 50 1HG2 THR 50 -8.404 -8.668 -3.268
384 HG23 THR 50 2HG2 THR 50 -9.542 -7.824 -4.319
385 H LYS 51 H LYS 51 -8.734 -11.742 -3.315
386 HA LYS 51 HA LYS 51 -6.841 -11.915 -1.089
387 HB2 LYS 51 2HB LYS 51 -7.404 -13.956 -2.322
388 HB3 LYS 51 1HB LYS 51 -6.838 -13.219 -3.823
389 HG2 LYS 51 2HG LYS 51 -4.577 -13.097 -3.004
390 HG3 LYS 51 1HG LYS 51 -5.083 -13.557 -1.377
391 HD2 LYS 51 2HD LYS 51 -5.594 -15.782 -2.049
392 HD3 LYS 51 1HD LYS 51 -5.541 -15.359 -3.762
393 HE2 LYS 51 2HE LYS 51 -3.158 -15.268 -1.888
394 HE3 LYS 51 1HE LYS 51 -3.495 -16.574 -3.025
395 HZ1 LYS 51 3HZ LYS 51 -2.795 -13.764 -3.605
396 HZ2 LYS 51 1HZ LYS 51 -3.562 -14.734 -4.765
397 HZ3 LYS 51 2HZ LYS 51 -2.040 -15.180 -4.158
398 H ILE 52 H ILE 52 -5.039 -10.775 -0.929
399 HA ILE 52 HA ILE 52 -3.846 -9.526 -3.327
400 HB ILE 52 HB ILE 52 -3.383 -7.502 -1.770
401 HG12 ILE 52 2HG1 ILE 52 -4.548 -9.033 0.144
402 HG13 ILE 52 1HG1 ILE 52 -4.539 -7.274 0.206
403 HG21 ILE 52 1HG2 ILE 52 -4.778 -7.219 -3.685
404 HG22 ILE 52 2HG2 ILE 52 -5.679 -6.545 -2.325
405 HG23 ILE 52 3HG2 ILE 52 -6.094 -8.141 -2.952
406 HD11 ILE 52 3HD1 ILE 52 -6.756 -7.137 -0.609
407 HD12 ILE 52 1HD1 ILE 52 -6.782 -8.418 0.603
408 HD13 ILE 52 2HD1 ILE 52 -6.762 -8.829 -1.113
409 H ILE 53 H ILE 53 -1.770 -10.064 -3.429
410 HA ILE 53 HA ILE 53 -0.411 -11.148 -1.065
411 HB ILE 53 HB ILE 53 0.668 -10.903 -3.880
412 HG12 ILE 53 2HG1 ILE 53 -0.991 -13.105 -2.606
413 HG13 ILE 53 1HG1 ILE 53 -1.442 -12.119 -4.000
414 HG21 ILE 53 1HG2 ILE 53 2.197 -12.612 -3.186
415 HG22 ILE 53 2HG2 ILE 53 1.292 -12.912 -1.702
416 HG23 ILE 53 3HG2 ILE 53 2.192 -11.408 -1.899
417 HD11 ILE 53 3HD1 ILE 53 0.677 -13.020 -5.128
418 HD12 ILE 53 1HD1 ILE 53 -0.645 -14.167 -4.916
419 HD13 ILE 53 2HD1 ILE 53 0.739 -14.205 -3.824
420 H MET 54 H MET 54 1.222 -10.126 0.006
421 HA MET 54 HA MET 54 1.542 -7.326 -0.321
422 HB2 MET 54 2HB MET 54 1.894 -8.631 1.815
423 HB3 MET 54 1HB MET 54 3.434 -9.171 1.143
424 HG2 MET 54 2HG MET 54 3.932 -7.232 2.458
425 HG3 MET 54 1HG MET 54 3.996 -6.720 0.779
426 HE1 MET 54 3HE MET 54 3.159 -4.643 0.113
427 HE2 MET 54 1HE MET 54 3.807 -4.172 1.691
428 HE3 MET 54 2HE MET 54 2.252 -3.545 1.150
429 H LYS 55 H LYS 55 2.024 -7.212 -2.587
430 HA LYS 55 HA LYS 55 4.464 -8.262 -3.669
431 HB2 LYS 55 2HB LYS 55 2.505 -6.165 -4.623
432 HB3 LYS 55 1HB LYS 55 3.943 -6.615 -5.543
433 HG2 LYS 55 2HG LYS 55 3.196 -8.894 -5.725
434 HG3 LYS 55 1HG LYS 55 1.856 -8.598 -4.618
435 HD2 LYS 55 2HD LYS 55 0.993 -6.888 -6.265
436 HD3 LYS 55 1HD LYS 55 2.228 -7.446 -7.392
437 HE2 LYS 55 2HE LYS 55 1.302 -9.755 -7.210
438 HE3 LYS 55 1HE LYS 55 0.017 -9.127 -6.178
439 HZ1 LYS 55 3HZ LYS 55 0.540 -8.011 -8.864
440 HZ2 LYS 55 1HZ LYS 55 -0.857 -7.861 -7.914
441 HZ3 LYS 55 2HZ LYS 55 -0.480 -9.350 -8.640
442 H GLY 56 H GLY 56 3.375 -5.024 -2.736
443 HA2 GLY 56 2HA GLY 56 5.988 -3.866 -3.127
444 HA3 GLY 56 1HA GLY 56 4.550 -3.050 -2.536
445 H ASN 57 H ASN 57 7.192 -5.198 -1.572
446 HA ASN 57 HA ASN 57 6.595 -4.927 1.248
447 HB2 ASN 57 2HB ASN 57 7.715 -6.951 0.329
448 HB3 ASN 57 1HB ASN 57 9.110 -5.955 -0.093
449 HD21 ASN 57 1HD2 ASN 57 7.545 -4.906 2.788
450 HD22 ASN 57 2HD2 ASN 57 8.630 -5.609 3.896
451 H GLU 58 H GLU 58 7.809 -2.908 -1.048
452 HA GLU 58 HA GLU 58 9.858 -1.613 0.578
453 HB2 GLU 58 2HB GLU 58 8.697 -0.945 -2.137
454 HB3 GLU 58 1HB GLU 58 10.003 -0.049 -1.359
455 HG2 GLU 58 2HG GLU 58 11.348 -2.132 -1.258
456 HG3 GLU 58 1HG GLU 58 10.054 -2.991 -2.092
457 H ILE 59 H ILE 59 7.608 -1.575 2.016
458 HA ILE 59 HA ILE 59 5.687 0.353 1.727
459 HB ILE 59 HB ILE 59 5.772 0.531 4.254
460 HG12 ILE 59 2HG1 ILE 59 7.982 -1.524 3.933
461 HG13 ILE 59 1HG1 ILE 59 8.280 0.170 4.332
462 HG21 ILE 59 1HG2 ILE 59 5.379 -2.028 4.504
463 HG22 ILE 59 2HG2 ILE 59 5.682 -2.103 2.771
464 HG23 ILE 59 3HG2 ILE 59 4.340 -1.142 3.392
465 HD11 ILE 59 3HD1 ILE 59 6.382 -1.522 5.963
466 HD12 ILE 59 1HD1 ILE 59 7.166 -0.008 6.415
467 HD13 ILE 59 2HD1 ILE 59 8.112 -1.493 6.299
468 H PHE 60 H PHE 60 9.075 0.813 2.261
469 HA PHE 60 HA PHE 60 9.229 3.314 3.422
470 HB2 PHE 60 2HB PHE 60 10.912 2.232 1.150
471 HB3 PHE 60 1HB PHE 60 11.345 3.596 2.183
472 HD1 PHE 60 1HD PHE 60 10.885 -0.056 2.025
473 HD2 PHE 60 2HD PHE 60 11.966 3.269 4.521
474 HE1 PHE 60 1HE PHE 60 11.806 -1.623 3.713
475 HE2 PHE 60 2HE PHE 60 12.887 1.701 6.210
476 HZ PHE 60 HZ PHE 60 12.807 -0.744 5.806
477 H ARG 61 H ARG 61 8.186 2.451 0.206
478 HA ARG 61 HA ARG 61 8.473 4.844 -1.161
479 HB2 ARG 61 2HB ARG 61 7.609 2.625 -2.055
480 HB3 ARG 61 1HB ARG 61 6.044 3.063 -1.376
481 HG2 ARG 61 2HG ARG 61 5.814 3.894 -3.542
482 HG3 ARG 61 1HG ARG 61 6.426 5.322 -2.712
483 HD2 ARG 61 2HD ARG 61 7.618 4.901 -4.848
484 HD3 ARG 61 1HD ARG 61 8.704 4.814 -3.468
485 HE ARG 61 HE ARG 61 7.700 2.228 -4.036
486 HH11 ARG 61 1HH2 ARG 61 9.796 4.684 -5.278
487 HH12 ARG 61 2HH2 ARG 61 10.832 3.573 -6.109
488 HH21 ARG 61 1HH1 ARG 61 9.056 0.765 -5.120
489 HH22 ARG 61 2HH1 ARG 61 10.415 1.354 -6.018
490 H LEU 62 H LEU 62 5.687 3.814 0.843
491 HA LEU 62 HA LEU 62 4.081 6.043 0.535
492 HB2 LEU 62 2HB LEU 62 3.285 4.130 1.769
493 HB3 LEU 62 1HB LEU 62 4.549 4.320 2.981
494 HG LEU 62 HG LEU 62 3.574 6.398 3.766
495 HD11 LEU 62 1HD1 LEU 62 2.776 7.483 1.823
496 HD12 LEU 62 2HD1 LEU 62 1.302 7.066 2.696
497 HD13 LEU 62 3HD1 LEU 62 1.823 6.085 1.325
498 HD21 LEU 62 3HD2 LEU 62 1.263 4.500 3.329
499 HD22 LEU 62 1HD2 LEU 62 1.558 5.550 4.715
500 HD23 LEU 62 2HD2 LEU 62 2.578 4.136 4.446
501 H ASP 63 H ASP 63 6.633 5.543 2.976
502 HA ASP 63 HA ASP 63 7.780 7.028 4.305
503 HB2 ASP 63 2HB ASP 63 8.713 7.678 2.143
504 HB3 ASP 63 1HB ASP 63 7.363 8.779 1.871
505 H GLU 64 H GLU 64 6.504 9.903 3.010
506 HA GLU 64 HA GLU 64 4.144 10.163 4.570
507 HB2 GLU 64 2HB GLU 64 5.834 10.135 6.407
508 HB3 GLU 64 1HB GLU 64 6.580 11.565 5.692
509 HG2 GLU 64 2HG GLU 64 4.552 12.852 5.999
510 HG3 GLU 64 1HG GLU 64 3.673 11.420 6.532
511 H ALA 65 H ALA 65 3.769 10.868 2.306
512 HA ALA 65 HA ALA 65 3.656 13.703 2.144
513 HB1 ALA 65 1HB ALA 65 5.636 12.351 0.294
514 HB2 ALA 65 2HB ALA 65 6.047 13.457 1.606
515 HB3 ALA 65 3HB ALA 65 5.137 14.041 0.212
516 H LEU 66 H LEU 66 2.299 14.398 0.494
517 HA LEU 66 HA LEU 66 0.535 12.416 -0.586
518 HB2 LEU 66 2HB LEU 66 0.767 15.409 -0.882
519 HB3 LEU 66 1HB LEU 66 -0.403 14.484 -1.819
520 HG LEU 66 HG LEU 66 -1.448 13.643 0.201
521 HD11 LEU 66 1HD1 LEU 66 0.356 13.316 1.704
522 HD12 LEU 66 2HD1 LEU 66 -0.583 14.617 2.432
523 HD13 LEU 66 3HD1 LEU 66 0.898 14.987 1.551
524 HD21 LEU 66 3HD2 LEU 66 -2.254 15.765 1.171
525 HD22 LEU 66 1HD2 LEU 66 -2.139 15.885 -0.584
526 HD23 LEU 66 2HD2 LEU 66 -0.900 16.621 0.433
527 H ARG 67 H ARG 67 3.312 14.170 -1.763
528 HA ARG 67 HA ARG 67 3.570 12.440 -4.030
529 HB2 ARG 67 2HB ARG 67 3.381 14.206 -5.762
530 HB3 ARG 67 1HB ARG 67 1.844 13.905 -4.948
531 HG2 ARG 67 2HG ARG 67 2.309 15.833 -3.434
532 HG3 ARG 67 1HG ARG 67 3.776 16.167 -4.358
533 HD2 ARG 67 2HD ARG 67 2.412 16.450 -6.404
534 HD3 ARG 67 1HD ARG 67 0.954 16.146 -5.465
535 HE ARG 67 HE ARG 67 2.313 18.247 -4.219
536 HH11 ARG 67 1HH2 ARG 67 0.797 17.511 -7.241
537 HH12 ARG 67 2HH2 ARG 67 0.330 19.148 -7.562
538 HH21 ARG 67 1HH1 ARG 67 1.703 20.395 -4.632
539 HH22 ARG 67 2HH1 ARG 67 0.843 20.781 -6.085
540 H LYS 68 H LYS 68 5.239 13.833 -5.634
541 HA LYS 68 HA LYS 68 7.163 15.422 -4.254
542 HB2 LYS 68 2HB LYS 68 7.536 13.112 -3.253
543 HB3 LYS 68 1HB LYS 68 8.079 12.608 -4.855
544 HG2 LYS 68 2HG LYS 68 9.681 14.618 -4.762
545 HG3 LYS 68 1HG LYS 68 9.304 14.691 -3.040
546 HD2 LYS 68 2HD LYS 68 10.506 12.345 -4.536
547 HD3 LYS 68 1HD LYS 68 11.307 13.350 -3.328
548 HE2 LYS 68 2HE LYS 68 10.655 11.436 -2.110
549 HE3 LYS 68 1HE LYS 68 9.391 12.608 -1.741
550 HZ1 LYS 68 3HZ LYS 68 8.839 11.126 -4.121
551 HZ2 LYS 68 1HZ LYS 68 7.873 11.357 -2.745
552 HZ3 LYS 68 2HZ LYS 68 9.026 10.108 -2.773
553 H GLY 69 H GLY 69 6.266 13.371 -6.938
554 HA2 GLY 69 2HA GLY 69 7.108 15.211 -8.899
555 HA3 GLY 69 1HA GLY 69 8.344 13.966 -8.732
556 H HIS 70 H HIS 70 5.732 14.801 -10.501
557 HA HIS 70 HA HIS 70 4.187 12.465 -10.724
558 HB2 HIS 70 2HB HIS 70 4.834 14.523 -12.849
559 HB3 HIS 70 1HB HIS 70 3.519 13.348 -12.925
560 HD2 HIS 70 2HD HIS 70 4.529 16.383 -10.545
561 HE1 HIS 70 1HE HIS 70 0.347 15.829 -10.395
562 HE2 HIS 70 2HE HIS 70 2.270 17.280 -9.593
563 H SER 71 H SER 71 6.385 13.543 -13.300
564 HA SER 71 HA SER 71 6.711 10.971 -14.403
565 HB2 SER 71 2HB SER 71 7.146 12.993 -15.699
566 HB3 SER 71 1HB SER 71 8.482 13.416 -14.634
567 HG SER 71 HG SER 71 8.292 11.461 -16.607
568 H GLU 72 H GLU 72 7.519 9.330 -13.235
569 HA GLU 72 HA GLU 72 8.949 8.087 -11.932
570 HB2 GLU 72 2HB GLU 72 10.482 8.522 -13.788
571 HB3 GLU 72 1HB GLU 72 10.954 10.057 -13.059
572 HG2 GLU 72 2HG GLU 72 11.954 8.959 -11.180
573 HG3 GLU 72 1HG GLU 72 11.252 7.407 -11.632
574 H GLY 73 H GLY 73 10.796 11.069 -11.557
575 HA2 GLY 73 2HA GLY 73 11.268 12.367 -9.715
576 HA3 GLY 73 1HA GLY 73 9.701 11.882 -9.074
577 H GLY 74 H GLY 74 9.571 9.789 -7.976
578 HA2 GLY 74 2HA GLY 74 11.563 9.458 -6.023
579 HA3 GLY 74 1HA GLY 74 10.280 8.302 -6.369
580 H1 HOH 201 H2 HOH 77 1.139 12.130 -9.086
581 H2 HOH 201 H1 HOH 77 0.806 13.453 -8.426
Start of MODEL 7
1 H1 VAL 1 1H VAL 1 -2.592 13.301 -5.401
2 H2 VAL 1 2H VAL 1 -1.254 13.615 -6.400
3 HA VAL 1 HA VAL 1 -1.297 14.211 -3.820
4 HB VAL 1 HB VAL 1 0.009 15.832 -6.026
5 HG11 VAL 1 2HG1 VAL 1 0.570 15.535 -3.068
6 HG12 VAL 1 3HG1 VAL 1 0.265 17.021 -3.965
7 HG13 VAL 1 1HG1 VAL 1 1.773 16.139 -4.208
8 HG21 VAL 1 1HG2 VAL 1 1.936 14.242 -5.473
9 HG22 VAL 1 2HG2 VAL 1 0.572 13.526 -6.331
10 HG23 VAL 1 3HG2 VAL 1 0.755 13.271 -4.596
11 H ASP 2 H ASP 2 -3.355 15.026 -3.166
12 HA ASP 2 HA ASP 2 -3.458 17.818 -2.793
13 HB2 ASP 2 2HB ASP 2 -5.585 18.201 -4.153
14 HB3 ASP 2 1HB ASP 2 -4.081 18.089 -5.066
15 H MET 3 H MET 3 -6.044 18.341 -2.327
16 HA MET 3 HA MET 3 -6.624 17.104 0.085
17 HB2 MET 3 2HB MET 3 -8.905 18.034 -0.178
18 HB3 MET 3 1HB MET 3 -7.659 19.213 -0.587
19 HG2 MET 3 2HG MET 3 -7.929 18.566 -2.999
20 HG3 MET 3 1HG MET 3 -9.293 17.554 -2.525
21 HE1 MET 3 3HE MET 3 -11.428 20.232 -4.047
22 HE2 MET 3 1HE MET 3 -11.154 18.512 -3.746
23 HE3 MET 3 2HE MET 3 -9.978 19.446 -4.665
24 H SER 4 H SER 4 -7.404 16.105 -3.173
25 HA SER 4 HA SER 4 -9.351 14.134 -2.418
26 HB2 SER 4 2HB SER 4 -7.744 14.310 -4.974
27 HB3 SER 4 1HB SER 4 -9.247 13.426 -4.729
28 HG SER 4 HG SER 4 -9.795 15.814 -3.941
29 H ASN 5 H ASN 5 -5.914 14.042 -3.329
30 HA ASN 5 HA ASN 5 -4.320 12.399 -3.104
31 HB2 ASN 5 2HB ASN 5 -4.794 12.924 -0.715
32 HB3 ASN 5 1HB ASN 5 -5.994 11.632 -0.702
33 HD21 ASN 5 1HD2 ASN 5 -2.509 12.147 -1.488
34 HD22 ASN 5 2HD2 ASN 5 -2.017 10.613 -0.953
35 H VAL 6 H VAL 6 -5.876 11.661 -5.071
36 HA VAL 6 HA VAL 6 -7.382 9.290 -4.762
37 HB VAL 6 HB VAL 6 -5.891 10.228 -7.224
38 HG11 VAL 6 1HG1 VAL 6 -6.695 7.968 -7.482
39 HG12 VAL 6 2HG1 VAL 6 -7.808 9.024 -8.351
40 HG13 VAL 6 3HG1 VAL 6 -8.253 8.385 -6.768
41 HG21 VAL 6 3HG2 VAL 6 -7.287 12.036 -6.409
42 HG22 VAL 6 1HG2 VAL 6 -8.633 10.932 -6.133
43 HG23 VAL 6 2HG2 VAL 6 -8.108 11.290 -7.778
44 H VAL 7 H VAL 7 -6.685 7.344 -4.185
45 HA VAL 7 HA VAL 7 -4.237 6.244 -5.327
46 HB VAL 7 HB VAL 7 -3.365 5.577 -3.090
47 HG11 VAL 7 1HG1 VAL 7 -2.303 7.664 -2.644
48 HG12 VAL 7 2HG1 VAL 7 -3.679 8.581 -3.254
49 HG13 VAL 7 3HG1 VAL 7 -2.654 7.682 -4.372
50 HG21 VAL 7 3HG2 VAL 7 -4.248 6.855 -1.120
51 HG22 VAL 7 1HG2 VAL 7 -5.424 5.728 -1.798
52 HG23 VAL 7 2HG2 VAL 7 -5.555 7.453 -2.143
53 H LYS 8 H LYS 8 -3.947 3.956 -4.040
54 HA LYS 8 HA LYS 8 -6.522 2.578 -4.459
55 HB2 LYS 8 2HB LYS 8 -4.610 1.773 -5.758
56 HB3 LYS 8 1HB LYS 8 -3.693 1.507 -4.278
57 HG2 LYS 8 2HG LYS 8 -4.787 -0.453 -3.792
58 HG3 LYS 8 1HG LYS 8 -6.359 0.186 -4.281
59 HD2 LYS 8 2HD LYS 8 -4.273 -0.462 -6.367
60 HD3 LYS 8 1HD LYS 8 -5.286 -1.736 -5.694
61 HE2 LYS 8 2HE LYS 8 -7.309 -0.447 -6.336
62 HE3 LYS 8 1HE LYS 8 -6.274 0.784 -7.062
63 HZ1 LYS 8 3HZ LYS 8 -6.512 -0.457 -8.893
64 HZ2 LYS 8 1HZ LYS 8 -6.977 -1.845 -8.035
65 HZ3 LYS 8 2HZ LYS 8 -5.330 -1.455 -8.188
66 H THR 9 H THR 9 -7.324 1.086 -2.949
67 HA THR 9 HA THR 9 -6.043 0.893 -0.330
68 HB THR 9 HB THR 9 -7.577 2.972 -0.420
69 HG1 THR 9 1HG THR 9 -7.845 2.675 1.668
70 HG21 THR 9 3HG2 THR 9 -9.924 2.634 -0.262
71 HG22 THR 9 1HG2 THR 9 -9.733 0.894 -0.038
72 HG23 THR 9 2HG2 THR 9 -9.411 1.622 -1.613
73 H TYR 10 H TYR 10 -6.737 -0.861 0.885
74 HA TYR 10 HA TYR 10 -8.756 -2.658 -0.299
75 HB2 TYR 10 2HB TYR 10 -5.896 -3.326 0.378
76 HB3 TYR 10 1HB TYR 10 -7.141 -4.564 0.313
77 HD1 TYR 10 2HD TYR 10 -8.722 -4.338 -1.889
78 HD2 TYR 10 1HD TYR 10 -4.647 -3.003 -1.570
79 HE1 TYR 10 2HE TYR 10 -8.489 -4.448 -4.354
80 HE2 TYR 10 1HE TYR 10 -4.417 -3.119 -4.032
81 HH TYR 10 HH TYR 10 -6.881 -4.559 -6.044
82 H ASP 11 H ASP 11 -10.213 -2.287 1.363
83 HA ASP 11 HA ASP 11 -9.698 -2.008 4.062
84 HB2 ASP 11 2HB ASP 11 -12.043 -3.314 2.680
85 HB3 ASP 11 1HB ASP 11 -11.991 -2.947 4.404
86 H LEU 12 H LEU 12 -7.995 -3.373 4.645
87 HA LEU 12 HA LEU 12 -8.063 -6.201 4.367
88 HB2 LEU 12 2HB LEU 12 -6.239 -4.212 5.313
89 HB3 LEU 12 1HB LEU 12 -6.417 -5.382 6.610
90 HG LEU 12 HG LEU 12 -5.752 -7.201 5.135
91 HD11 LEU 12 1HD1 LEU 12 -6.407 -6.912 2.959
92 HD12 LEU 12 2HD1 LEU 12 -4.797 -6.228 2.777
93 HD13 LEU 12 3HD1 LEU 12 -6.186 -5.164 3.002
94 HD21 LEU 12 3HD2 LEU 12 -3.934 -6.060 6.193
95 HD22 LEU 12 1HD2 LEU 12 -3.989 -4.743 5.021
96 HD23 LEU 12 2HD2 LEU 12 -3.435 -6.339 4.525
97 H GLN 13 H GLN 13 -8.368 -7.798 5.974
98 HA GLN 13 HA GLN 13 -10.581 -7.212 7.736
99 HB2 GLN 13 2HB GLN 13 -10.533 -9.604 8.239
100 HB3 GLN 13 1HB GLN 13 -10.463 -9.334 6.497
101 HG2 GLN 13 2HG GLN 13 -8.778 -10.923 6.826
102 HG3 GLN 13 1HG GLN 13 -7.869 -9.415 6.827
103 HE21 GLN 13 1HE2 GLN 13 -6.771 -8.836 8.761
104 HE22 GLN 13 2HE2 GLN 13 -6.817 -9.777 10.180
105 H ASP 14 H ASP 14 -7.279 -6.874 7.982
106 HA ASP 14 HA ASP 14 -7.102 -7.546 10.833
107 HB2 ASP 14 2HB ASP 14 -5.218 -8.144 9.379
108 HB3 ASP 14 1HB ASP 14 -5.034 -6.452 8.911
109 H GLY 15 H GLY 15 -8.501 -5.130 9.309
110 HA2 GLY 15 2HA GLY 15 -9.213 -3.083 10.177
111 HA3 GLY 15 1HA GLY 15 -8.005 -3.228 11.455
112 H SER 16 H SER 16 -6.080 -3.929 9.126
113 HA SER 16 HA SER 16 -5.116 -1.213 8.762
114 HB2 SER 16 2HB SER 16 -4.007 -3.828 7.722
115 HB3 SER 16 1HB SER 16 -3.175 -2.273 7.741
116 HG SER 16 HG SER 16 -3.695 -4.066 9.787
117 H LYS 17 H LYS 17 -4.003 -1.122 6.336
118 HA LYS 17 HA LYS 17 -5.884 -1.919 4.265
119 HB2 LYS 17 2HB LYS 17 -5.469 0.990 4.996
120 HB3 LYS 17 1HB LYS 17 -6.193 0.445 3.484
121 HG2 LYS 17 2HG LYS 17 -7.856 -0.866 4.933
122 HG3 LYS 17 1HG LYS 17 -7.251 0.082 6.288
123 HD2 LYS 17 2HD LYS 17 -7.786 2.166 5.005
124 HD3 LYS 17 1HD LYS 17 -8.527 1.158 3.761
125 HE2 LYS 17 2HE LYS 17 -9.359 1.073 6.671
126 HE3 LYS 17 1HE LYS 17 -10.146 2.098 5.471
127 HZ1 LYS 17 3HZ LYS 17 -9.941 -0.862 5.443
128 HZ2 LYS 17 1HZ LYS 17 -10.526 0.055 4.142
129 HZ3 LYS 17 2HZ LYS 17 -11.351 0.067 5.627
130 H VAL 18 H VAL 18 -4.794 -2.324 2.444
131 HA VAL 18 HA VAL 18 -1.989 -1.470 2.269
132 HB VAL 18 HB VAL 18 -3.066 -3.148 0.067
133 HG11 VAL 18 1HG1 VAL 18 -0.637 -2.625 0.572
134 HG12 VAL 18 2HG1 VAL 18 -1.018 -4.332 0.352
135 HG13 VAL 18 3HG1 VAL 18 -0.789 -3.683 1.975
136 HG21 VAL 18 3HG2 VAL 18 -2.910 -4.309 2.862
137 HG22 VAL 18 1HG2 VAL 18 -3.253 -5.192 1.372
138 HG23 VAL 18 2HG2 VAL 18 -4.409 -4.015 1.985
139 H HIS 19 H HIS 19 -1.210 -0.122 0.647
140 HA HIS 19 HA HIS 19 -3.156 0.920 -1.330
141 HB2 HIS 19 2HB HIS 19 -2.824 3.140 -0.756
142 HB3 HIS 19 1HB HIS 19 -2.687 2.393 0.829
143 HD1 HIS 19 1HD HIS 19 -1.052 4.813 -1.137
144 HD2 HIS 19 2HD HIS 19 0.351 1.665 1.211
145 HE1 HIS 19 1HE HIS 19 1.369 5.331 -0.614
146 HE2 HIS 19 2HE HIS 19 2.238 3.418 0.814
147 H VAL 20 H VAL 20 -2.366 0.646 -3.336
148 HA VAL 20 HA VAL 20 0.503 0.217 -3.653
149 HB VAL 20 HB VAL 20 0.051 -0.983 -5.557
150 HG11 VAL 20 1HG1 VAL 20 -2.807 -1.178 -4.692
151 HG12 VAL 20 2HG1 VAL 20 -1.576 -1.610 -3.518
152 HG13 VAL 20 3HG1 VAL 20 -1.658 -2.457 -5.060
153 HG21 VAL 20 3HG2 VAL 20 -0.787 0.731 -6.986
154 HG22 VAL 20 1HG2 VAL 20 -2.251 0.928 -6.022
155 HG23 VAL 20 2HG2 VAL 20 -2.019 -0.527 -6.990
156 H PHE 21 H PHE 21 1.733 1.213 -5.315
157 HA PHE 21 HA PHE 21 1.045 4.060 -5.663
158 HB2 PHE 21 2HB PHE 21 3.668 2.573 -5.956
159 HB3 PHE 21 1HB PHE 21 3.455 4.309 -6.169
160 HD1 PHE 21 1HD PHE 21 3.241 1.524 -3.728
161 HD2 PHE 21 2HD PHE 21 3.236 5.783 -4.285
162 HE1 PHE 21 1HE PHE 21 3.455 1.844 -1.279
163 HE2 PHE 21 2HE PHE 21 3.452 6.104 -1.834
164 HZ PHE 21 HZ PHE 21 3.560 4.132 -0.332
165 H LYS 22 H LYS 22 2.723 4.630 -7.796
166 HA LYS 22 HA LYS 22 1.090 3.775 -10.015
167 HB2 LYS 22 2HB LYS 22 2.095 6.082 -9.757
168 HB3 LYS 22 1HB LYS 22 3.662 5.359 -10.122
169 HG2 LYS 22 2HG LYS 22 2.852 4.584 -12.284
170 HG3 LYS 22 1HG LYS 22 1.228 5.166 -11.919
171 HD2 LYS 22 2HD LYS 22 2.079 7.477 -11.783
172 HD3 LYS 22 1HD LYS 22 3.706 6.900 -12.146
173 HE2 LYS 22 2HE LYS 22 2.866 5.988 -14.308
174 HE3 LYS 22 1HE LYS 22 1.282 6.679 -13.953
175 HZ1 LYS 22 3HZ LYS 22 2.585 8.849 -13.657
176 HZ2 LYS 22 1HZ LYS 22 2.296 8.295 -15.233
177 HZ3 LYS 22 2HZ LYS 22 3.821 8.067 -14.521
178 H ASP 23 H ASP 23 3.949 2.672 -8.502
179 HA ASP 23 HA ASP 23 5.108 1.404 -10.821
180 HB2 ASP 23 2HB ASP 23 6.432 2.153 -8.827
181 HB3 ASP 23 1HB ASP 23 5.673 0.858 -7.901
182 H GLY 24 H GLY 24 2.410 0.770 -9.012
183 HA2 GLY 24 2HA GLY 24 0.940 -1.026 -9.208
184 HA3 GLY 24 1HA GLY 24 2.187 -1.921 -10.073
185 H LYS 25 H LYS 25 3.771 -0.789 -7.474
186 HA LYS 25 HA LYS 25 3.631 -3.340 -6.082
187 HB2 LYS 25 2HB LYS 25 5.280 -0.831 -5.846
188 HB3 LYS 25 1HB LYS 25 5.286 -1.997 -4.532
189 HG2 LYS 25 2HG LYS 25 5.880 -3.780 -6.233
190 HG3 LYS 25 1HG LYS 25 6.092 -2.480 -7.408
191 HD2 LYS 25 2HD LYS 25 7.797 -1.443 -5.983
192 HD3 LYS 25 1HD LYS 25 7.560 -2.694 -4.764
193 HE2 LYS 25 2HE LYS 25 8.305 -3.393 -7.605
194 HE3 LYS 25 1HE LYS 25 9.532 -3.003 -6.400
195 HZ1 LYS 25 3HZ LYS 25 9.236 -5.331 -6.358
196 HZ2 LYS 25 1HZ LYS 25 7.545 -5.199 -6.313
197 HZ3 LYS 25 2HZ LYS 25 8.468 -4.732 -4.966
198 H MET 26 H MET 26 2.857 -3.667 -3.996
199 HA MET 26 HA MET 26 0.702 -1.939 -3.178
200 HB2 MET 26 2HB MET 26 1.816 -4.545 -2.190
201 HB3 MET 26 1HB MET 26 0.673 -3.640 -1.196
202 HG2 MET 26 2HG MET 26 -1.013 -3.736 -2.857
203 HG3 MET 26 1HG MET 26 0.123 -4.259 -4.100
204 HE1 MET 26 3HE MET 26 -1.420 -7.556 -4.241
205 HE2 MET 26 1HE MET 26 0.063 -6.797 -4.843
206 HE3 MET 26 2HE MET 26 -1.448 -5.886 -4.804
207 H GLY 27 H GLY 27 0.624 -1.820 -0.562
208 HA2 GLY 27 2HA GLY 27 3.120 -0.981 0.637
209 HA3 GLY 27 1HA GLY 27 2.043 0.358 0.251
210 H MET 28 H MET 28 2.864 -1.897 2.579
211 HA MET 28 HA MET 28 0.278 -2.278 3.761
212 HB2 MET 28 2HB MET 28 2.304 -3.827 3.945
213 HB3 MET 28 1HB MET 28 2.945 -2.675 5.109
214 HG2 MET 28 2HG MET 28 1.761 -4.401 6.326
215 HG3 MET 28 1HG MET 28 0.842 -2.904 6.421
216 HE1 MET 28 3HE MET 28 -0.848 -4.091 7.332
217 HE2 MET 28 1HE MET 28 -1.762 -5.444 6.666
218 HE3 MET 28 2HE MET 28 -2.198 -3.792 6.243
219 H GLU 29 H GLU 29 -0.638 -1.259 5.468
220 HA GLU 29 HA GLU 29 0.792 0.740 7.007
221 HB2 GLU 29 2HB GLU 29 0.195 2.071 5.055
222 HB3 GLU 29 1HB GLU 29 -1.479 1.529 5.163
223 HG2 GLU 29 2HG GLU 29 -1.811 2.672 7.240
224 HG3 GLU 29 1HG GLU 29 -0.086 2.979 7.422
225 H ASN 30 H ASN 30 0.154 0.282 9.016
226 HA ASN 30 HA ASN 30 -2.259 -1.137 9.579
227 HB2 ASN 30 2HB ASN 30 -1.592 -1.046 11.868
228 HB3 ASN 30 1HB ASN 30 -0.121 -1.249 10.921
229 HD21 ASN 30 1HD2 ASN 30 -0.304 1.677 10.037
230 HD22 ASN 30 2HD2 ASN 30 0.253 2.550 11.387
231 H LYS 31 H LYS 31 -3.973 -0.403 10.994
232 HA LYS 31 HA LYS 31 -5.360 1.787 10.110
233 HB2 LYS 31 2HB LYS 31 -6.732 1.597 12.105
234 HB3 LYS 31 1HB LYS 31 -6.296 -0.010 11.529
235 HG2 LYS 31 2HG LYS 31 -5.662 -0.380 13.706
236 HG3 LYS 31 1HG LYS 31 -4.200 0.491 13.250
237 HD2 LYS 31 2HD LYS 31 -5.136 2.582 14.098
238 HD3 LYS 31 1HD LYS 31 -6.676 1.793 14.431
239 HE2 LYS 31 2HE LYS 31 -5.377 1.959 16.493
240 HE3 LYS 31 1HE LYS 31 -5.523 0.267 16.015
241 HZ1 LYS 31 3HZ LYS 31 -3.185 1.877 16.271
242 HZ2 LYS 31 1HZ LYS 31 -3.281 1.172 14.732
243 HZ3 LYS 31 2HZ LYS 31 -3.321 0.191 16.117
244 H PHE 32 H PHE 32 -2.656 1.771 12.263
245 HA PHE 32 HA PHE 32 -3.211 4.367 13.412
246 HB2 PHE 32 2HB PHE 32 -1.816 2.402 14.420
247 HB3 PHE 32 1HB PHE 32 -0.502 3.044 13.433
248 HD1 PHE 32 1HD PHE 32 -2.849 3.781 16.198
249 HD2 PHE 32 2HD PHE 32 0.549 5.158 13.959
250 HE1 PHE 32 1HE PHE 32 -2.438 5.538 17.901
251 HE2 PHE 32 2HE PHE 32 0.960 6.914 15.661
252 HZ PHE 32 HZ PHE 32 -0.533 7.104 17.633
253 H GLY 33 H GLY 33 -2.663 3.691 10.373
254 HA2 GLY 33 2HA GLY 33 -1.891 4.911 8.577
255 HA3 GLY 33 1HA GLY 33 -1.633 6.249 9.696
256 H LYS 34 H LYS 34 -0.053 3.631 10.934
257 HA LYS 34 HA LYS 34 2.548 4.648 10.069
258 HB2 LYS 34 2HB LYS 34 2.011 4.084 12.476
259 HB3 LYS 34 1HB LYS 34 1.976 2.388 11.994
260 HG2 LYS 34 2HG LYS 34 4.285 2.534 11.198
261 HG3 LYS 34 1HG LYS 34 4.331 4.253 11.588
262 HD2 LYS 34 2HD LYS 34 4.080 3.795 13.947
263 HD3 LYS 34 1HD LYS 34 3.789 2.085 13.632
264 HE2 LYS 34 2HE LYS 34 6.099 2.379 14.353
265 HE3 LYS 34 1HE LYS 34 6.079 1.917 12.650
266 HZ1 LYS 34 3HZ LYS 34 7.497 3.932 13.475
267 HZ2 LYS 34 1HZ LYS 34 6.025 4.767 13.334
268 HZ3 LYS 34 2HZ LYS 34 6.694 3.991 11.978
269 H SER 35 H SER 35 4.057 3.495 8.919
270 HA SER 35 HA SER 35 3.036 1.382 7.222
271 HB2 SER 35 2HB SER 35 5.875 2.395 7.351
272 HB3 SER 35 1HB SER 35 5.059 1.618 5.997
273 HG SER 35 HG SER 35 3.670 3.766 6.830
274 H MET 36 H MET 36 3.087 -0.702 7.743
275 HA MET 36 HA MET 36 5.063 -1.653 9.743
276 HB2 MET 36 2HB MET 36 2.305 -2.586 8.953
277 HB3 MET 36 1HB MET 36 3.426 -3.679 9.769
278 HG2 MET 36 2HG MET 36 2.721 -0.931 10.834
279 HG3 MET 36 1HG MET 36 1.872 -2.404 11.311
280 HE1 MET 36 3HE MET 36 3.821 -1.970 14.503
281 HE2 MET 36 1HE MET 36 2.270 -2.068 13.658
282 HE3 MET 36 2HE MET 36 3.250 -0.609 13.540
283 H ASN 37 H ASN 37 6.498 -3.210 9.230
284 HA ASN 37 HA ASN 37 6.896 -3.820 6.437
285 HB2 ASN 37 2HB ASN 37 8.835 -3.395 7.815
286 HB3 ASN 37 1HB ASN 37 8.374 -4.676 8.933
287 HD21 ASN 37 1HD2 ASN 37 7.635 -5.606 5.745
288 HD22 ASN 37 2HD2 ASN 37 9.024 -6.541 5.442
289 H MET 38 H MET 38 5.191 -5.110 5.767
290 HA MET 38 HA MET 38 4.651 -7.620 7.169
291 HB2 MET 38 2HB MET 38 2.707 -6.481 6.413
292 HB3 MET 38 1HB MET 38 3.374 -6.265 4.794
293 HG2 MET 38 2HG MET 38 3.188 -8.594 4.315
294 HG3 MET 38 1HG MET 38 2.939 -8.996 6.005
295 HE1 MET 38 3HE MET 38 0.851 -9.541 6.936
296 HE2 MET 38 1HE MET 38 -0.644 -8.616 6.727
297 HE3 MET 38 2HE MET 38 0.797 -7.837 7.381
298 HA PRO 39 HA PRO 39 7.894 -9.519 4.563
299 HB2 PRO 39 2HB PRO 39 6.375 -11.983 5.363
300 HB3 PRO 39 1HB PRO 39 8.126 -11.683 5.383
301 HG2 PRO 39 2HG PRO 39 6.691 -11.639 7.630
302 HG3 PRO 39 1HG PRO 39 8.039 -10.516 7.371
303 HD2 PRO 39 2HD PRO 39 5.100 -9.968 7.302
304 HD3 PRO 39 1HD PRO 39 6.439 -8.897 7.746
305 H GLU 40 H GLU 40 7.906 -10.102 2.424
306 HA GLU 40 HA GLU 40 5.566 -9.851 0.880
307 HB2 GLU 40 2HB GLU 40 7.894 -9.480 0.044
308 HB3 GLU 40 1HB GLU 40 8.150 -11.225 0.099
309 HG2 GLU 40 2HG GLU 40 5.826 -10.037 -1.420
310 HG3 GLU 40 1HG GLU 40 7.418 -10.183 -2.155
311 H GLY 41 H GLY 41 3.993 -11.257 0.460
312 HA2 GLY 41 2HA GLY 41 3.307 -13.463 -0.303
313 HA3 GLY 41 1HA GLY 41 4.519 -14.164 0.765
314 H LYS 42 H LYS 42 3.548 -11.924 2.755
315 HA LYS 42 HA LYS 42 1.829 -13.645 4.240
316 HB2 LYS 42 2HB LYS 42 2.917 -10.884 4.574
317 HB3 LYS 42 1HB LYS 42 1.460 -11.266 5.485
318 HG2 LYS 42 2HG LYS 42 3.779 -13.194 5.523
319 HG3 LYS 42 1HG LYS 42 3.832 -11.755 6.536
320 HD2 LYS 42 2HD LYS 42 1.900 -12.392 7.752
321 HD3 LYS 42 1HD LYS 42 1.442 -13.599 6.551
322 HE2 LYS 42 2HE LYS 42 2.419 -14.689 8.526
323 HE3 LYS 42 1HE LYS 42 3.460 -14.919 7.121
324 HZ1 LYS 42 3HZ LYS 42 4.932 -13.271 7.870
325 HZ2 LYS 42 1HZ LYS 42 4.590 -14.211 9.239
326 HZ3 LYS 42 2HZ LYS 42 3.843 -12.698 9.041
327 H VAL 43 H VAL 43 0.398 -14.016 2.419
328 HA VAL 43 HA VAL 43 -1.275 -12.462 1.051
329 HB VAL 43 HB VAL 43 -2.271 -14.852 2.596
330 HG11 VAL 43 1HG1 VAL 43 -3.052 -13.632 -0.072
331 HG12 VAL 43 2HG1 VAL 43 -4.010 -13.585 1.408
332 HG13 VAL 43 3HG1 VAL 43 -3.716 -15.123 0.596
333 HG21 VAL 43 3HG2 VAL 43 -0.598 -14.617 0.084
334 HG22 VAL 43 1HG2 VAL 43 -1.536 -16.061 0.461
335 HG23 VAL 43 2HG2 VAL 43 -0.241 -15.546 1.539
336 H MET 44 H MET 44 -2.790 -10.980 1.338
337 HA MET 44 HA MET 44 -3.964 -10.622 4.046
338 HB2 MET 44 2HB MET 44 -3.783 -8.505 1.907
339 HB3 MET 44 1HB MET 44 -4.134 -8.299 3.604
340 HG2 MET 44 2HG MET 44 -1.885 -8.695 4.229
341 HG3 MET 44 1HG MET 44 -1.482 -9.399 2.668
342 HE1 MET 44 3HE MET 44 -2.610 -7.231 0.416
343 HE2 MET 44 1HE MET 44 -1.273 -8.367 0.607
344 HE3 MET 44 2HE MET 44 -0.954 -6.672 0.265
345 H GLU 45 H GLU 45 -6.225 -10.300 4.138
346 HA GLU 45 HA GLU 45 -7.708 -10.764 1.601
347 HB2 GLU 45 2HB GLU 45 -7.592 -12.840 2.949
348 HB3 GLU 45 1HB GLU 45 -8.343 -11.983 4.298
349 HG2 GLU 45 2HG GLU 45 -10.356 -11.597 3.029
350 HG3 GLU 45 1HG GLU 45 -9.602 -12.199 1.551
351 H THR 46 H THR 46 -9.107 -9.199 1.183
352 HA THR 46 HA THR 46 -9.797 -7.265 3.221
353 HB THR 46 HB THR 46 -10.745 -5.981 1.480
354 HG1 THR 46 1HG THR 46 -10.588 -8.106 -0.333
355 HG21 THR 46 3HG2 THR 46 -8.990 -5.926 -0.185
356 HG22 THR 46 1HG2 THR 46 -8.535 -7.591 0.178
357 HG23 THR 46 2HG2 THR 46 -8.262 -6.322 1.372
358 H ARG 47 H ARG 47 -12.110 -6.552 3.438
359 HA ARG 47 HA ARG 47 -13.677 -8.556 4.559
360 HB2 ARG 47 2HB ARG 47 -14.442 -5.855 3.436
361 HB3 ARG 47 1HB ARG 47 -15.567 -6.890 4.318
362 HG2 ARG 47 2HG ARG 47 -14.011 -6.907 6.249
363 HG3 ARG 47 1HG ARG 47 -12.928 -5.828 5.371
364 HD2 ARG 47 2HD ARG 47 -14.579 -4.077 5.333
365 HD3 ARG 47 1HD ARG 47 -15.821 -5.160 5.957
366 HE ARG 47 HE ARG 47 -15.024 -4.710 8.080
367 HH11 ARG 47 1HH2 ARG 47 -12.588 -4.061 5.709
368 HH12 ARG 47 2HH2 ARG 47 -11.451 -3.425 6.851
369 HH21 ARG 47 1HH1 ARG 47 -13.538 -3.877 9.582
370 HH22 ARG 47 2HH1 ARG 47 -11.991 -3.320 9.043
371 H ASP 48 H ASP 48 -13.675 -7.272 1.265
372 HA ASP 48 HA ASP 48 -15.981 -8.732 0.406
373 HB2 ASP 48 2HB ASP 48 -13.719 -7.548 -1.223
374 HB3 ASP 48 1HB ASP 48 -15.280 -8.081 -1.853
375 H GLY 49 H GLY 49 -13.085 -9.826 1.430
376 HA2 GLY 49 2HA GLY 49 -12.108 -11.914 1.330
377 HA3 GLY 49 1HA GLY 49 -13.446 -12.431 0.306
378 H THR 50 H THR 50 -11.245 -9.734 -0.313
379 HA THR 50 HA THR 50 -10.583 -10.883 -2.922
380 HB THR 50 HB THR 50 -9.585 -8.263 -1.804
381 HG1 THR 50 1HG THR 50 -12.106 -9.022 -2.716
382 HG21 THR 50 3HG2 THR 50 -9.536 -7.659 -4.194
383 HG22 THR 50 1HG2 THR 50 -10.150 -9.261 -4.608
384 HG23 THR 50 2HG2 THR 50 -8.553 -9.089 -3.878
385 H LYS 51 H LYS 51 -8.880 -12.170 -3.144
386 HA LYS 51 HA LYS 51 -6.852 -12.368 -1.109
387 HB2 LYS 51 2HB LYS 51 -7.530 -14.371 -2.296
388 HB3 LYS 51 1HB LYS 51 -7.096 -13.643 -3.845
389 HG2 LYS 51 2HG LYS 51 -4.766 -13.631 -3.287
390 HG3 LYS 51 1HG LYS 51 -5.100 -14.031 -1.602
391 HD2 LYS 51 2HD LYS 51 -5.908 -16.234 -2.228
392 HD3 LYS 51 1HD LYS 51 -5.766 -15.839 -3.941
393 HE2 LYS 51 2HE LYS 51 -3.815 -17.109 -3.409
394 HE3 LYS 51 1HE LYS 51 -3.281 -15.431 -3.500
395 HZ1 LYS 51 3HZ LYS 51 -2.673 -15.490 -1.385
396 HZ2 LYS 51 1HZ LYS 51 -2.998 -17.154 -1.366
397 HZ3 LYS 51 2HZ LYS 51 -4.200 -16.049 -0.893
398 H ILE 52 H ILE 52 -5.411 -10.785 -0.913
399 HA ILE 52 HA ILE 52 -3.978 -9.857 -3.340
400 HB ILE 52 HB ILE 52 -3.737 -7.659 -1.903
401 HG12 ILE 52 2HG1 ILE 52 -6.407 -8.661 -0.897
402 HG13 ILE 52 1HG1 ILE 52 -4.933 -8.788 0.047
403 HG21 ILE 52 1HG2 ILE 52 -6.386 -8.358 -3.195
404 HG22 ILE 52 2HG2 ILE 52 -4.941 -7.861 -4.080
405 HG23 ILE 52 3HG2 ILE 52 -5.725 -6.738 -2.968
406 HD11 ILE 52 3HD1 ILE 52 -6.208 -6.257 -1.010
407 HD12 ILE 52 1HD1 ILE 52 -4.628 -6.301 -0.236
408 HD13 ILE 52 2HD1 ILE 52 -6.067 -6.739 0.677
409 H ILE 53 H ILE 53 -1.904 -10.314 -3.241
410 HA ILE 53 HA ILE 53 -0.692 -11.139 -0.711
411 HB ILE 53 HB ILE 53 0.475 -11.178 -3.497
412 HG12 ILE 53 2HG1 ILE 53 -0.843 -13.425 -1.940
413 HG13 ILE 53 1HG1 ILE 53 -1.639 -12.526 -3.234
414 HG21 ILE 53 1HG2 ILE 53 1.977 -12.882 -2.470
415 HG22 ILE 53 2HG2 ILE 53 1.230 -12.560 -0.904
416 HG23 ILE 53 3HG2 ILE 53 2.150 -11.296 -1.721
417 HD11 ILE 53 3HD1 ILE 53 0.912 -14.148 -3.500
418 HD12 ILE 53 1HD1 ILE 53 0.171 -13.202 -4.792
419 HD13 ILE 53 2HD1 ILE 53 -0.676 -14.597 -4.126
420 H MET 54 H MET 54 0.853 -10.053 0.373
421 HA MET 54 HA MET 54 1.256 -7.299 -0.091
422 HB2 MET 54 2HB MET 54 1.560 -8.481 2.113
423 HB3 MET 54 1HB MET 54 3.074 -9.137 1.483
424 HG2 MET 54 2HG MET 54 3.708 -7.169 2.666
425 HG3 MET 54 1HG MET 54 3.732 -6.711 0.974
426 HE1 MET 54 3HE MET 54 2.889 -4.671 0.211
427 HE2 MET 54 1HE MET 54 3.644 -4.123 1.715
428 HE3 MET 54 2HE MET 54 2.076 -3.487 1.227
429 H LYS 55 H LYS 55 1.773 -7.307 -2.355
430 HA LYS 55 HA LYS 55 4.189 -8.487 -3.343
431 HB2 LYS 55 2HB LYS 55 2.139 -7.884 -4.709
432 HB3 LYS 55 1HB LYS 55 2.638 -6.198 -4.565
433 HG2 LYS 55 2HG LYS 55 4.886 -6.901 -5.503
434 HG3 LYS 55 1HG LYS 55 4.160 -8.463 -5.873
435 HD2 LYS 55 2HD LYS 55 3.094 -5.796 -6.850
436 HD3 LYS 55 1HD LYS 55 4.098 -6.881 -7.811
437 HE2 LYS 55 2HE LYS 55 2.304 -8.680 -7.283
438 HE3 LYS 55 1HE LYS 55 1.285 -7.320 -6.811
439 HZ1 LYS 55 3HZ LYS 55 1.999 -8.215 -9.415
440 HZ2 LYS 55 1HZ LYS 55 2.405 -6.582 -9.203
441 HZ3 LYS 55 2HZ LYS 55 0.806 -7.098 -8.948
442 H GLY 56 H GLY 56 3.255 -5.075 -3.034
443 HA2 GLY 56 2HA GLY 56 5.897 -4.078 -3.289
444 HA3 GLY 56 1HA GLY 56 4.493 -3.172 -2.743
445 H ASN 57 H ASN 57 6.503 -5.854 -1.464
446 HA ASN 57 HA ASN 57 6.058 -5.213 1.245
447 HB2 ASN 57 2HB ASN 57 6.973 -7.381 0.538
448 HB3 ASN 57 1HB ASN 57 8.452 -6.587 -0.005
449 HD21 ASN 57 1HD2 ASN 57 6.913 -5.323 2.870
450 HD22 ASN 57 2HD2 ASN 57 8.033 -5.957 3.985
451 H GLU 58 H GLU 58 7.559 -3.422 -1.085
452 HA GLU 58 HA GLU 58 9.669 -2.279 0.565
453 HB2 GLU 58 2HB GLU 58 8.637 -1.601 -2.198
454 HB3 GLU 58 1HB GLU 58 9.976 -0.767 -1.409
455 HG2 GLU 58 2HG GLU 58 11.193 -2.907 -1.210
456 HG3 GLU 58 1HG GLU 58 9.860 -3.736 -2.012
457 H ILE 59 H ILE 59 7.504 -1.949 2.022
458 HA ILE 59 HA ILE 59 5.732 0.115 1.643
459 HB ILE 59 HB ILE 59 5.914 0.424 4.180
460 HG12 ILE 59 2HG1 ILE 59 7.764 -1.961 3.910
461 HG13 ILE 59 1HG1 ILE 59 8.350 -0.317 4.187
462 HG21 ILE 59 1HG2 ILE 59 5.121 -1.993 4.564
463 HG22 ILE 59 2HG2 ILE 59 5.425 -2.244 2.845
464 HG23 ILE 59 3HG2 ILE 59 4.238 -1.050 3.365
465 HD11 ILE 59 3HD1 ILE 59 6.278 -1.608 5.971
466 HD12 ILE 59 1HD1 ILE 59 7.252 -0.173 6.295
467 HD13 ILE 59 2HD1 ILE 59 8.009 -1.766 6.274
468 H PHE 60 H PHE 60 9.105 0.361 1.732
469 HA PHE 60 HA PHE 60 9.676 2.750 2.974
470 HB2 PHE 60 2HB PHE 60 11.286 1.188 1.778
471 HB3 PHE 60 1HB PHE 60 10.812 1.989 0.280
472 HD1 PHE 60 1HD PHE 60 12.343 2.521 3.623
473 HD2 PHE 60 2HD PHE 60 11.596 4.186 -0.266
474 HE1 PHE 60 1HE PHE 60 13.918 4.372 4.113
475 HE2 PHE 60 2HE PHE 60 13.171 6.037 0.225
476 HZ PHE 60 HZ PHE 60 14.332 6.130 2.414
477 H ARG 61 H ARG 61 7.944 2.220 -0.018
478 HA ARG 61 HA ARG 61 8.135 4.784 -1.146
479 HB2 ARG 61 2HB ARG 61 5.933 2.717 -1.267
480 HB3 ARG 61 1HB ARG 61 5.934 4.194 -2.231
481 HG2 ARG 61 2HG ARG 61 8.163 3.540 -3.155
482 HG3 ARG 61 1HG ARG 61 8.044 2.019 -2.271
483 HD2 ARG 61 2HD ARG 61 6.167 1.302 -3.542
484 HD3 ARG 61 1HD ARG 61 5.895 2.915 -4.194
485 HE ARG 61 HE ARG 61 7.428 2.410 -5.849
486 HH11 ARG 61 1HH2 ARG 61 7.921 0.391 -3.083
487 HH12 ARG 61 2HH2 ARG 61 9.156 -0.567 -3.831
488 HH21 ARG 61 1HH1 ARG 61 9.047 1.160 -6.835
489 HH22 ARG 61 2HH1 ARG 61 9.793 -0.130 -5.955
490 H LEU 62 H LEU 62 5.651 3.449 1.054
491 HA LEU 62 HA LEU 62 4.088 5.759 1.275
492 HB2 LEU 62 2HB LEU 62 3.783 3.293 2.203
493 HB3 LEU 62 1HB LEU 62 4.494 3.974 3.662
494 HG LEU 62 HG LEU 62 2.010 4.974 2.231
495 HD11 LEU 62 1HD1 LEU 62 2.276 3.875 5.036
496 HD12 LEU 62 2HD1 LEU 62 1.902 2.848 3.652
497 HD13 LEU 62 3HD1 LEU 62 0.798 4.146 4.112
498 HD21 LEU 62 3HD2 LEU 62 1.904 6.411 4.405
499 HD22 LEU 62 1HD2 LEU 62 2.998 6.924 3.122
500 HD23 LEU 62 2HD2 LEU 62 3.631 6.075 4.533
501 H ASP 63 H ASP 63 6.762 4.639 3.356
502 HA ASP 63 HA ASP 63 6.851 6.670 5.208
503 HB2 ASP 63 2HB ASP 63 8.336 4.691 5.228
504 HB3 ASP 63 1HB ASP 63 9.242 5.376 3.881
505 H GLU 64 H GLU 64 8.196 6.672 1.926
506 HA GLU 64 HA GLU 64 9.445 9.216 2.106
507 HB2 GLU 64 2HB GLU 64 8.476 7.602 -0.260
508 HB3 GLU 64 1HB GLU 64 9.375 9.111 -0.413
509 HG2 GLU 64 2HG GLU 64 11.263 8.174 0.790
510 HG3 GLU 64 1HG GLU 64 10.360 6.700 1.134
511 H ALA 65 H ALA 65 8.699 11.243 1.718
512 HA ALA 65 HA ALA 65 5.859 11.678 1.817
513 HB1 ALA 65 1HB ALA 65 7.440 13.181 2.964
514 HB2 ALA 65 2HB ALA 65 6.451 14.060 1.796
515 HB3 ALA 65 3HB ALA 65 8.121 13.648 1.405
516 H LEU 66 H LEU 66 4.533 12.579 0.243
517 HA LEU 66 HA LEU 66 5.113 11.862 -2.453
518 HB2 LEU 66 2HB LEU 66 2.889 13.413 -1.129
519 HB3 LEU 66 1HB LEU 66 2.967 13.240 -2.883
520 HG LEU 66 HG LEU 66 2.898 10.823 -2.708
521 HD11 LEU 66 1HD1 LEU 66 3.172 11.383 0.249
522 HD12 LEU 66 2HD1 LEU 66 4.168 10.339 -0.764
523 HD13 LEU 66 3HD1 LEU 66 2.527 9.853 -0.343
524 HD21 LEU 66 3HD2 LEU 66 0.853 12.192 -0.933
525 HD22 LEU 66 1HD2 LEU 66 0.679 10.552 -1.560
526 HD23 LEU 66 2HD2 LEU 66 0.728 11.921 -2.671
527 H ARG 67 H ARG 67 3.918 15.078 -1.656
528 HA ARG 67 HA ARG 67 4.499 17.143 -2.490
529 HB2 ARG 67 2HB ARG 67 7.318 16.105 -2.120
530 HB3 ARG 67 1HB ARG 67 6.797 17.790 -2.127
531 HG2 ARG 67 2HG ARG 67 5.310 17.225 -0.147
532 HG3 ARG 67 1HG ARG 67 6.137 15.670 -0.071
533 HD2 ARG 67 2HD ARG 67 7.158 17.337 1.460
534 HD3 ARG 67 1HD ARG 67 8.290 16.794 0.225
535 HE ARG 67 HE ARG 67 7.008 19.089 -0.750
536 HH11 ARG 67 1HH2 ARG 67 9.116 18.105 1.811
537 HH12 ARG 67 2HH2 ARG 67 9.916 19.638 1.927
538 HH21 ARG 67 1HH1 ARG 67 8.050 21.101 -0.603
539 HH22 ARG 67 2HH1 ARG 67 9.312 21.334 0.561
540 H LYS 68 H LYS 68 7.177 17.494 -3.880
541 HA LYS 68 HA LYS 68 7.962 17.586 -6.032
542 HB2 LYS 68 2HB LYS 68 7.926 15.050 -5.637
543 HB3 LYS 68 1HB LYS 68 6.424 15.042 -6.559
544 HG2 LYS 68 2HG LYS 68 7.514 15.891 -8.518
545 HG3 LYS 68 1HG LYS 68 8.985 16.262 -7.620
546 HD2 LYS 68 2HD LYS 68 9.319 14.201 -8.875
547 HD3 LYS 68 1HD LYS 68 9.271 13.829 -7.152
548 HE2 LYS 68 2HE LYS 68 7.094 12.922 -7.287
549 HE3 LYS 68 1HE LYS 68 6.773 13.691 -8.841
550 HZ1 LYS 68 3HZ LYS 68 8.996 11.790 -8.633
551 HZ2 LYS 68 1HZ LYS 68 8.012 12.155 -9.965
552 HZ3 LYS 68 2HZ LYS 68 7.410 11.183 -8.707
553 H GLY 69 H GLY 69 4.804 17.902 -5.215
554 HA2 GLY 69 2HA GLY 69 3.113 19.121 -6.221
555 HA3 GLY 69 1HA GLY 69 4.155 19.328 -7.626
556 H HIS 70 H HIS 70 1.371 18.758 -7.744
557 HA HIS 70 HA HIS 70 0.875 15.991 -8.204
558 HB2 HIS 70 2HB HIS 70 -0.874 17.747 -7.746
559 HB3 HIS 70 1HB HIS 70 -0.626 18.334 -9.391
560 HD2 HIS 70 2HD HIS 70 -2.034 16.910 -11.316
561 HE1 HIS 70 1HE HIS 70 -3.129 13.622 -8.906
562 HE2 HIS 70 2HE HIS 70 -3.411 14.696 -11.189
563 H SER 71 H SER 71 -0.073 15.398 -10.497
564 HA SER 71 HA SER 71 0.489 14.778 -12.637
565 HB2 SER 71 2HB SER 71 0.860 16.554 -14.170
566 HB3 SER 71 1HB SER 71 -0.149 17.235 -12.898
567 HG SER 71 HG SER 71 2.506 17.720 -13.550
568 H GLU 72 H GLU 72 2.506 15.289 -14.339
569 HA GLU 72 HA GLU 72 5.088 15.372 -13.115
570 HB2 GLU 72 2HB GLU 72 5.686 12.988 -13.701
571 HB3 GLU 72 1HB GLU 72 4.592 13.162 -12.328
572 HG2 GLU 72 2HG GLU 72 3.571 12.737 -15.140
573 HG3 GLU 72 1HG GLU 72 3.968 11.389 -14.078
574 H GLY 73 H GLY 73 6.803 15.194 -14.664
575 HA2 GLY 73 2HA GLY 73 6.465 14.585 -17.388
576 HA3 GLY 73 1HA GLY 73 6.223 16.317 -17.176
577 H GLY 74 H GLY 74 8.469 13.910 -15.789
578 HA2 GLY 74 2HA GLY 74 10.762 13.897 -15.605
579 HA3 GLY 74 1HA GLY 74 10.785 14.855 -17.082
580 H1 HOH 201 H2 HOH 77 -3.898 17.454 -8.256
581 H2 HOH 201 H1 HOH 77 -5.152 16.833 -7.675
Start of MODEL 8
1 H1 VAL 1 1H VAL 1 1.610 14.065 -9.258
2 H2 VAL 1 2H VAL 1 1.616 14.600 -7.646
3 HA VAL 1 HA VAL 1 -0.788 13.623 -9.081
4 HB VAL 1 HB VAL 1 0.778 11.784 -8.783
5 HG11 VAL 1 2HG1 VAL 1 1.992 13.055 -6.843
6 HG12 VAL 1 3HG1 VAL 1 1.921 11.297 -6.795
7 HG13 VAL 1 1HG1 VAL 1 0.820 12.248 -5.803
8 HG21 VAL 1 1HG2 VAL 1 -1.685 11.505 -8.241
9 HG22 VAL 1 2HG2 VAL 1 -1.251 11.660 -6.538
10 HG23 VAL 1 3HG2 VAL 1 -0.620 10.317 -7.492
11 H ASP 2 H ASP 2 -2.394 14.791 -8.251
12 HA ASP 2 HA ASP 2 -3.092 14.663 -5.516
13 HB2 ASP 2 2HB ASP 2 -2.820 17.224 -5.151
14 HB3 ASP 2 1HB ASP 2 -1.404 16.191 -4.956
15 H MET 3 H MET 3 -3.451 15.883 -8.712
16 HA MET 3 HA MET 3 -5.842 17.392 -8.321
17 HB2 MET 3 2HB MET 3 -4.349 17.647 -10.297
18 HB3 MET 3 1HB MET 3 -4.839 16.045 -10.842
19 HG2 MET 3 2HG MET 3 -6.917 18.150 -10.252
20 HG3 MET 3 1HG MET 3 -6.086 18.121 -11.807
21 HE1 MET 3 3HE MET 3 -9.242 17.818 -11.377
22 HE2 MET 3 1HE MET 3 -9.551 16.632 -12.653
23 HE3 MET 3 2HE MET 3 -8.386 17.928 -12.911
24 H SER 4 H SER 4 -5.236 14.113 -9.591
25 HA SER 4 HA SER 4 -7.996 13.435 -9.807
26 HB2 SER 4 2HB SER 4 -5.562 11.646 -9.623
27 HB3 SER 4 1HB SER 4 -7.174 11.131 -10.107
28 HG SER 4 HG SER 4 -6.800 13.098 -11.638
29 H ASN 5 H ASN 5 -5.637 13.265 -7.239
30 HA ASN 5 HA ASN 5 -5.785 12.621 -5.038
31 HB2 ASN 5 2HB ASN 5 -8.733 13.123 -5.507
32 HB3 ASN 5 1HB ASN 5 -7.941 13.013 -3.937
33 HD21 ASN 5 1HD2 ASN 5 -8.678 15.148 -6.564
34 HD22 ASN 5 2HD2 ASN 5 -7.796 16.484 -5.998
35 H VAL 6 H VAL 6 -6.655 10.727 -7.451
36 HA VAL 6 HA VAL 6 -8.261 8.710 -6.244
37 HB VAL 6 HB VAL 6 -7.975 8.977 -8.701
38 HG11 VAL 6 1HG1 VAL 6 -5.257 7.716 -8.259
39 HG12 VAL 6 2HG1 VAL 6 -5.486 9.447 -8.514
40 HG13 VAL 6 3HG1 VAL 6 -5.935 8.302 -9.778
41 HG21 VAL 6 3HG2 VAL 6 -8.670 6.805 -7.582
42 HG22 VAL 6 1HG2 VAL 6 -6.997 6.274 -7.738
43 HG23 VAL 6 2HG2 VAL 6 -7.951 6.616 -9.181
44 H VAL 7 H VAL 7 -7.683 6.761 -5.302
45 HA VAL 7 HA VAL 7 -4.873 6.106 -4.884
46 HB VAL 7 HB VAL 7 -5.153 6.009 -2.407
47 HG11 VAL 7 1HG1 VAL 7 -4.718 8.325 -2.055
48 HG12 VAL 7 2HG1 VAL 7 -5.713 8.799 -3.433
49 HG13 VAL 7 3HG1 VAL 7 -4.166 7.994 -3.697
50 HG21 VAL 7 3HG2 VAL 7 -7.608 5.893 -2.346
51 HG22 VAL 7 1HG2 VAL 7 -7.716 7.512 -3.035
52 HG23 VAL 7 2HG2 VAL 7 -7.044 7.283 -1.421
53 H LYS 8 H LYS 8 -4.574 3.985 -4.002
54 HA LYS 8 HA LYS 8 -6.860 2.199 -4.542
55 HB2 LYS 8 2HB LYS 8 -4.551 1.923 -5.646
56 HB3 LYS 8 1HB LYS 8 -3.995 1.367 -4.068
57 HG2 LYS 8 2HG LYS 8 -4.625 -0.657 -5.030
58 HG3 LYS 8 1HG LYS 8 -6.117 -0.214 -4.206
59 HD2 LYS 8 2HD LYS 8 -6.993 -0.679 -6.304
60 HD3 LYS 8 1HD LYS 8 -6.616 1.023 -6.542
61 HE2 LYS 8 2HE LYS 8 -4.738 -1.250 -7.269
62 HE3 LYS 8 1HE LYS 8 -5.823 -0.453 -8.410
63 HZ1 LYS 8 3HZ LYS 8 -3.555 0.740 -6.926
64 HZ2 LYS 8 1HZ LYS 8 -4.727 1.678 -7.717
65 HZ3 LYS 8 2HZ LYS 8 -3.751 0.609 -8.607
66 H THR 9 H THR 9 -7.700 0.849 -3.013
67 HA THR 9 HA THR 9 -6.394 0.574 -0.413
68 HB THR 9 HB THR 9 -8.776 1.180 0.603
69 HG1 THR 9 1HG THR 9 -8.640 2.776 -1.735
70 HG21 THR 9 3HG2 THR 9 -6.854 3.324 -0.342
71 HG22 THR 9 1HG2 THR 9 -6.634 2.334 1.101
72 HG23 THR 9 2HG2 THR 9 -7.990 3.456 0.999
73 H TYR 10 H TYR 10 -7.072 -1.163 0.775
74 HA TYR 10 HA TYR 10 -9.218 -2.881 -0.261
75 HB2 TYR 10 2HB TYR 10 -6.457 -3.977 0.297
76 HB3 TYR 10 1HB TYR 10 -7.848 -4.848 -0.330
77 HD1 TYR 10 2HD TYR 10 -8.949 -3.419 -2.476
78 HD2 TYR 10 1HD TYR 10 -4.807 -3.607 -1.324
79 HE1 TYR 10 2HE TYR 10 -8.277 -2.856 -4.789
80 HE2 TYR 10 1HE TYR 10 -4.145 -3.045 -3.641
81 HH TYR 10 HH TYR 10 -6.507 -2.872 -6.242
82 H ASP 11 H ASP 11 -10.434 -2.596 1.563
83 HA ASP 11 HA ASP 11 -9.631 -2.370 4.182
84 HB2 ASP 11 2HB ASP 11 -12.098 -3.680 3.039
85 HB3 ASP 11 1HB ASP 11 -11.871 -3.342 4.754
86 H LEU 12 H LEU 12 -7.963 -3.681 4.833
87 HA LEU 12 HA LEU 12 -7.942 -6.516 4.459
88 HB2 LEU 12 2HB LEU 12 -6.178 -4.481 5.482
89 HB3 LEU 12 1HB LEU 12 -6.279 -5.756 6.689
90 HG LEU 12 HG LEU 12 -5.628 -7.432 5.024
91 HD11 LEU 12 1HD1 LEU 12 -4.701 -6.218 2.780
92 HD12 LEU 12 2HD1 LEU 12 -6.077 -5.175 3.131
93 HD13 LEU 12 3HD1 LEU 12 -6.315 -6.906 2.904
94 HD21 LEU 12 3HD2 LEU 12 -3.324 -6.244 4.372
95 HD22 LEU 12 1HD2 LEU 12 -3.696 -6.652 6.045
96 HD23 LEU 12 2HD2 LEU 12 -3.914 -5.000 5.466
97 H GLN 13 H GLN 13 -8.444 -8.154 5.885
98 HA GLN 13 HA GLN 13 -10.598 -7.685 7.675
99 HB2 GLN 13 2HB GLN 13 -8.817 -10.068 7.165
100 HB3 GLN 13 1HB GLN 13 -10.101 -10.100 8.377
101 HG2 GLN 13 2HG GLN 13 -11.742 -9.460 6.629
102 HG3 GLN 13 1HG GLN 13 -10.453 -9.500 5.424
103 HE21 GLN 13 1HE2 GLN 13 -12.946 -11.267 5.815
104 HE22 GLN 13 2HE2 GLN 13 -12.325 -12.853 5.807
105 H ASP 14 H ASP 14 -7.288 -7.200 8.006
106 HA ASP 14 HA ASP 14 -7.191 -7.714 10.887
107 HB2 ASP 14 2HB ASP 14 -5.121 -6.657 8.947
108 HB3 ASP 14 1HB ASP 14 -4.833 -6.953 10.663
109 H GLY 15 H GLY 15 -8.707 -5.466 9.285
110 HA2 GLY 15 2HA GLY 15 -9.517 -3.409 10.002
111 HA3 GLY 15 1HA GLY 15 -8.372 -3.461 11.343
112 H SER 16 H SER 16 -6.259 -4.106 9.186
113 HA SER 16 HA SER 16 -5.377 -1.387 8.848
114 HB2 SER 16 2HB SER 16 -3.460 -2.449 7.658
115 HB3 SER 16 1HB SER 16 -3.734 -3.118 9.265
116 HG SER 16 HG SER 16 -4.805 -4.215 6.876
117 H LYS 17 H LYS 17 -4.324 -1.022 6.492
118 HA LYS 17 HA LYS 17 -6.175 -1.775 4.350
119 HB2 LYS 17 2HB LYS 17 -5.756 1.080 5.271
120 HB3 LYS 17 1HB LYS 17 -6.425 0.649 3.698
121 HG2 LYS 17 2HG LYS 17 -8.199 -0.674 4.886
122 HG3 LYS 17 1HG LYS 17 -7.576 -0.053 6.411
123 HD2 LYS 17 2HD LYS 17 -9.446 1.336 5.726
124 HD3 LYS 17 1HD LYS 17 -7.962 2.274 5.577
125 HE2 LYS 17 2HE LYS 17 -8.034 2.270 3.253
126 HE3 LYS 17 1HE LYS 17 -8.906 0.738 3.172
127 HZ1 LYS 17 3HZ LYS 17 -10.591 2.147 2.695
128 HZ2 LYS 17 1HZ LYS 17 -9.925 3.443 3.562
129 HZ3 LYS 17 2HZ LYS 17 -10.721 2.191 4.390
130 H VAL 18 H VAL 18 -4.994 -2.204 2.580
131 HA VAL 18 HA VAL 18 -2.202 -1.378 2.502
132 HB VAL 18 HB VAL 18 -3.286 -2.764 0.113
133 HG11 VAL 18 1HG1 VAL 18 -0.902 -2.556 0.410
134 HG12 VAL 18 2HG1 VAL 18 -1.337 -4.256 0.579
135 HG13 VAL 18 3HG1 VAL 18 -0.990 -3.291 2.012
136 HG21 VAL 18 3HG2 VAL 18 -3.536 -4.939 1.227
137 HG22 VAL 18 1HG2 VAL 18 -4.722 -3.786 1.831
138 HG23 VAL 18 2HG2 VAL 18 -3.299 -4.168 2.798
139 H HIS 19 H HIS 19 -1.269 -0.265 0.715
140 HA HIS 19 HA HIS 19 -3.073 1.225 -1.066
141 HB2 HIS 19 2HB HIS 19 -2.930 3.014 0.380
142 HB3 HIS 19 1HB HIS 19 -1.521 2.358 1.201
143 HD1 HIS 19 1HD HIS 19 -2.528 4.599 -1.621
144 HD2 HIS 19 2HD HIS 19 0.992 3.117 0.055
145 HE1 HIS 19 1HE HIS 19 -0.634 5.961 -2.612
146 HE2 HIS 19 2HE HIS 19 1.518 5.070 -1.600
147 H VAL 20 H VAL 20 -2.329 0.853 -3.027
148 HA VAL 20 HA VAL 20 0.494 0.147 -3.397
149 HB VAL 20 HB VAL 20 -0.166 -1.098 -5.224
150 HG11 VAL 20 1HG1 VAL 20 -1.495 -1.770 -3.197
151 HG12 VAL 20 2HG1 VAL 20 -2.249 -2.215 -4.720
152 HG13 VAL 20 3HG1 VAL 20 -2.820 -0.816 -3.814
153 HG21 VAL 20 3HG2 VAL 20 -2.340 -0.528 -6.500
154 HG22 VAL 20 1HG2 VAL 20 -0.974 0.567 -6.711
155 HG23 VAL 20 2HG2 VAL 20 -2.298 1.007 -5.631
156 H PHE 21 H PHE 21 1.882 1.209 -4.739
157 HA PHE 21 HA PHE 21 1.314 4.008 -5.211
158 HB2 PHE 21 2HB PHE 21 3.759 2.319 -5.796
159 HB3 PHE 21 1HB PHE 21 3.670 4.069 -5.998
160 HD1 PHE 21 1HD PHE 21 3.551 1.306 -3.533
161 HD2 PHE 21 2HD PHE 21 3.723 5.558 -4.107
162 HE1 PHE 21 1HE PHE 21 4.063 1.608 -1.126
163 HE2 PHE 21 2HE PHE 21 4.236 5.861 -1.699
164 HZ PHE 21 HZ PHE 21 4.406 3.886 -0.209
165 H LYS 22 H LYS 22 2.669 4.613 -7.479
166 HA LYS 22 HA LYS 22 0.788 3.848 -9.526
167 HB2 LYS 22 2HB LYS 22 3.337 5.399 -9.968
168 HB3 LYS 22 1HB LYS 22 1.823 5.494 -10.868
169 HG2 LYS 22 2HG LYS 22 2.271 6.383 -8.003
170 HG3 LYS 22 1HG LYS 22 2.002 7.432 -9.396
171 HD2 LYS 22 2HD LYS 22 -0.217 6.160 -9.710
172 HD3 LYS 22 1HD LYS 22 0.049 5.535 -8.083
173 HE2 LYS 22 2HE LYS 22 0.173 7.830 -7.205
174 HE3 LYS 22 1HE LYS 22 -0.058 8.472 -8.832
175 HZ1 LYS 22 3HZ LYS 22 -1.979 7.213 -7.039
176 HZ2 LYS 22 1HZ LYS 22 -2.140 6.864 -8.690
177 HZ3 LYS 22 2HZ LYS 22 -2.198 8.475 -8.154
178 H ASP 23 H ASP 23 3.845 2.731 -8.431
179 HA ASP 23 HA ASP 23 4.678 1.532 -10.919
180 HB2 ASP 23 2HB ASP 23 5.616 1.039 -8.082
181 HB3 ASP 23 1HB ASP 23 6.413 0.453 -9.544
182 H GLY 24 H GLY 24 2.167 0.872 -8.955
183 HA2 GLY 24 2HA GLY 24 0.694 -0.931 -9.074
184 HA3 GLY 24 1HA GLY 24 1.924 -1.856 -9.933
185 H LYS 25 H LYS 25 3.797 -0.884 -7.624
186 HA LYS 25 HA LYS 25 3.697 -3.288 -6.108
187 HB2 LYS 25 2HB LYS 25 5.104 -0.638 -5.745
188 HB3 LYS 25 1HB LYS 25 5.263 -1.935 -4.566
189 HG2 LYS 25 2HG LYS 25 6.013 -3.458 -6.401
190 HG3 LYS 25 1HG LYS 25 5.965 -2.086 -7.509
191 HD2 LYS 25 2HD LYS 25 7.537 -0.892 -5.898
192 HD3 LYS 25 1HD LYS 25 7.739 -2.445 -5.087
193 HE2 LYS 25 2HE LYS 25 9.530 -2.316 -6.655
194 HE3 LYS 25 1HE LYS 25 8.345 -3.401 -7.382
195 HZ1 LYS 25 3HZ LYS 25 8.059 -0.560 -7.959
196 HZ2 LYS 25 1HZ LYS 25 7.799 -1.902 -8.963
197 HZ3 LYS 25 2HZ LYS 25 9.381 -1.352 -8.676
198 H MET 26 H MET 26 2.924 -3.681 -4.043
199 HA MET 26 HA MET 26 0.679 -2.090 -3.231
200 HB2 MET 26 2HB MET 26 1.585 -4.795 -2.854
201 HB3 MET 26 1HB MET 26 1.260 -4.101 -1.270
202 HG2 MET 26 2HG MET 26 -0.988 -3.571 -1.873
203 HG3 MET 26 1HG MET 26 -0.691 -3.910 -3.577
204 HE1 MET 26 3HE MET 26 0.162 -6.351 -4.413
205 HE2 MET 26 1HE MET 26 -1.516 -5.824 -4.619
206 HE3 MET 26 2HE MET 26 -1.161 -7.477 -4.118
207 H GLY 27 H GLY 27 0.531 -2.004 -0.598
208 HA2 GLY 27 2HA GLY 27 3.008 -1.096 0.624
209 HA3 GLY 27 1HA GLY 27 1.870 0.200 0.271
210 H MET 28 H MET 28 2.865 -1.871 2.623
211 HA MET 28 HA MET 28 0.295 -2.452 3.825
212 HB2 MET 28 2HB MET 28 2.389 -3.907 3.971
213 HB3 MET 28 1HB MET 28 3.011 -2.723 5.110
214 HG2 MET 28 2HG MET 28 1.942 -4.503 6.358
215 HG3 MET 28 1HG MET 28 0.969 -3.045 6.495
216 HE1 MET 28 3HE MET 28 -1.907 -5.299 6.640
217 HE2 MET 28 1HE MET 28 -1.799 -3.549 6.422
218 HE3 MET 28 2HE MET 28 -0.656 -4.385 7.471
219 H GLU 29 H GLU 29 -0.567 -0.338 4.100
220 HA GLU 29 HA GLU 29 0.745 1.320 6.184
221 HB2 GLU 29 2HB GLU 29 0.264 2.392 3.962
222 HB3 GLU 29 1HB GLU 29 -1.453 2.122 4.263
223 HG2 GLU 29 2HG GLU 29 -1.260 3.425 6.373
224 HG3 GLU 29 1HG GLU 29 0.429 3.749 5.995
225 H ASN 30 H ASN 30 -0.023 0.613 8.114
226 HA ASN 30 HA ASN 30 -2.679 -0.393 8.476
227 HB2 ASN 30 2HB ASN 30 -2.121 -0.508 10.826
228 HB3 ASN 30 1HB ASN 30 -0.729 -1.054 9.888
229 HD21 ASN 30 1HD2 ASN 30 0.164 -0.330 12.238
230 HD22 ASN 30 2HD2 ASN 30 0.763 1.262 12.289
231 H LYS 31 H LYS 31 -4.347 0.547 9.771
232 HA LYS 31 HA LYS 31 -4.886 3.250 9.133
233 HB2 LYS 31 2HB LYS 31 -6.936 2.973 10.289
234 HB3 LYS 31 1HB LYS 31 -6.578 1.396 9.590
235 HG2 LYS 31 2HG LYS 31 -6.120 2.238 12.478
236 HG3 LYS 31 1HG LYS 31 -7.324 1.096 11.889
237 HD2 LYS 31 2HD LYS 31 -5.382 -0.277 10.960
238 HD3 LYS 31 1HD LYS 31 -4.321 0.756 11.920
239 HE2 LYS 31 2HE LYS 31 -5.556 0.139 13.961
240 HE3 LYS 31 1HE LYS 31 -6.622 -0.892 13.005
241 HZ1 LYS 31 3HZ LYS 31 -3.807 -1.385 12.606
242 HZ2 LYS 31 1HZ LYS 31 -5.078 -2.482 12.850
243 HZ3 LYS 31 2HZ LYS 31 -4.351 -1.714 14.182
244 H PHE 32 H PHE 32 -2.803 2.017 11.402
245 HA PHE 32 HA PHE 32 -3.300 3.921 13.521
246 HB2 PHE 32 2HB PHE 32 -2.231 1.555 13.700
247 HB3 PHE 32 1HB PHE 32 -0.745 2.354 13.183
248 HD1 PHE 32 2HD PHE 32 -3.498 2.561 15.706
249 HD2 PHE 32 1HD PHE 32 0.576 3.534 14.751
250 HE1 PHE 32 2HE PHE 32 -3.148 3.376 18.023
251 HE2 PHE 32 1HE PHE 32 0.926 4.350 17.066
252 HZ PHE 32 HZ PHE 32 -0.936 4.271 18.703
253 H GLY 33 H GLY 33 -1.982 4.181 10.488
254 HA2 GLY 33 2HA GLY 33 -0.978 6.022 9.487
255 HA3 GLY 33 1HA GLY 33 -0.823 6.763 11.081
256 H LYS 34 H LYS 34 0.324 3.526 10.579
257 HA LYS 34 HA LYS 34 3.117 4.442 10.277
258 HB2 LYS 34 2HB LYS 34 2.091 2.582 12.436
259 HB3 LYS 34 1HB LYS 34 3.796 2.826 12.055
260 HG2 LYS 34 2HG LYS 34 3.412 5.309 12.439
261 HG3 LYS 34 1HG LYS 34 1.829 4.880 13.087
262 HD2 LYS 34 2HD LYS 34 2.921 3.407 14.754
263 HD3 LYS 34 1HD LYS 34 4.499 3.883 14.125
264 HE2 LYS 34 2HE LYS 34 3.840 5.186 16.150
265 HE3 LYS 34 1HE LYS 34 4.088 6.208 14.735
266 HZ1 LYS 34 3HZ LYS 34 2.003 6.893 14.863
267 HZ2 LYS 34 1HZ LYS 34 1.807 6.011 16.298
268 HZ3 LYS 34 2HZ LYS 34 1.419 5.300 14.805
269 H SER 35 H SER 35 4.024 3.373 8.657
270 HA SER 35 HA SER 35 2.805 1.232 7.298
271 HB2 SER 35 2HB SER 35 4.716 1.204 5.927
272 HB3 SER 35 1HB SER 35 4.611 2.875 6.473
273 HG SER 35 HG SER 35 6.722 1.753 6.655
274 H MET 36 H MET 36 2.635 -0.839 7.834
275 HA MET 36 HA MET 36 4.363 -1.949 9.942
276 HB2 MET 36 2HB MET 36 1.778 -2.854 8.670
277 HB3 MET 36 1HB MET 36 2.722 -3.900 9.733
278 HG2 MET 36 2HG MET 36 2.614 -2.157 11.504
279 HG3 MET 36 1HG MET 36 1.602 -1.171 10.443
280 HE1 MET 36 3HE MET 36 0.972 -1.692 13.120
281 HE2 MET 36 1HE MET 36 1.164 -3.406 13.513
282 HE3 MET 36 2HE MET 36 -0.443 -2.687 13.454
283 H ASN 37 H ASN 37 6.174 -2.904 9.310
284 HA ASN 37 HA ASN 37 6.769 -3.659 6.665
285 HB2 ASN 37 2HB ASN 37 8.535 -3.158 8.239
286 HB3 ASN 37 1HB ASN 37 8.042 -4.494 9.278
287 HD21 ASN 37 1HD2 ASN 37 7.666 -5.373 6.013
288 HD22 ASN 37 2HD2 ASN 37 9.131 -6.221 5.825
289 H MET 38 H MET 38 5.334 -5.060 5.740
290 HA MET 38 HA MET 38 4.968 -7.709 7.006
291 HB2 MET 38 2HB MET 38 2.869 -6.590 6.506
292 HB3 MET 38 1HB MET 38 3.368 -6.320 4.834
293 HG2 MET 38 2HG MET 38 3.407 -8.724 4.429
294 HG3 MET 38 1HG MET 38 3.089 -9.044 6.124
295 HE1 MET 38 3HE MET 38 -0.533 -8.471 6.711
296 HE2 MET 38 1HE MET 38 0.986 -7.804 7.331
297 HE3 MET 38 2HE MET 38 0.841 -9.533 7.020
298 HA PRO 39 HA PRO 39 7.850 -8.920 3.742
299 HB2 PRO 39 2HB PRO 39 7.892 -11.621 4.161
300 HB3 PRO 39 1HB PRO 39 8.727 -10.468 5.226
301 HG2 PRO 39 2HG PRO 39 6.090 -11.821 5.604
302 HG3 PRO 39 1HG PRO 39 7.385 -11.530 6.780
303 HD2 PRO 39 2HD PRO 39 5.144 -9.967 6.630
304 HD3 PRO 39 1HD PRO 39 6.705 -9.347 7.187
305 H GLU 40 H GLU 40 7.857 -10.214 1.760
306 HA GLU 40 HA GLU 40 5.305 -10.186 0.471
307 HB2 GLU 40 2HB GLU 40 7.299 -9.604 -0.781
308 HB3 GLU 40 1HB GLU 40 8.007 -11.188 -0.451
309 HG2 GLU 40 2HG GLU 40 6.364 -12.304 -1.777
310 HG3 GLU 40 1HG GLU 40 5.361 -10.855 -1.881
311 H GLY 41 H GLY 41 3.824 -11.688 0.856
312 HA2 GLY 41 2HA GLY 41 3.458 -14.113 0.069
313 HA3 GLY 41 1HA GLY 41 4.660 -14.492 1.303
314 H LYS 42 H LYS 42 3.398 -12.076 2.828
315 HA LYS 42 HA LYS 42 1.650 -13.706 4.427
316 HB2 LYS 42 2HB LYS 42 2.778 -10.957 4.563
317 HB3 LYS 42 1HB LYS 42 1.263 -11.201 5.422
318 HG2 LYS 42 2HG LYS 42 3.489 -13.202 5.793
319 HG3 LYS 42 1HG LYS 42 3.580 -11.659 6.633
320 HD2 LYS 42 2HD LYS 42 1.597 -12.049 7.845
321 HD3 LYS 42 1HD LYS 42 1.079 -13.336 6.756
322 HE2 LYS 42 2HE LYS 42 3.007 -14.719 7.521
323 HE3 LYS 42 1HE LYS 42 3.434 -13.448 8.666
324 HZ1 LYS 42 3HZ LYS 42 1.994 -15.363 9.493
325 HZ2 LYS 42 1HZ LYS 42 0.729 -14.633 8.629
326 HZ3 LYS 42 2HZ LYS 42 1.501 -13.785 9.884
327 H VAL 43 H VAL 43 0.277 -14.203 2.553
328 HA VAL 43 HA VAL 43 -1.332 -12.659 1.048
329 HB VAL 43 HB VAL 43 -2.473 -14.957 2.635
330 HG11 VAL 43 1HG1 VAL 43 -4.053 -13.758 1.201
331 HG12 VAL 43 2HG1 VAL 43 -3.694 -15.332 0.493
332 HG13 VAL 43 3HG1 VAL 43 -2.942 -13.878 -0.162
333 HG21 VAL 43 3HG2 VAL 43 -1.564 -16.324 0.662
334 HG22 VAL 43 1HG2 VAL 43 -0.377 -15.783 1.849
335 HG23 VAL 43 2HG2 VAL 43 -0.536 -14.935 0.311
336 H MET 44 H MET 44 -2.664 -11.004 1.373
337 HA MET 44 HA MET 44 -3.842 -10.617 4.068
338 HB2 MET 44 2HB MET 44 -3.657 -8.563 1.870
339 HB3 MET 44 1HB MET 44 -3.971 -8.297 3.567
340 HG2 MET 44 2HG MET 44 -1.716 -8.848 4.157
341 HG3 MET 44 1HG MET 44 -1.374 -9.470 2.545
342 HE1 MET 44 3HE MET 44 -0.847 -6.622 0.291
343 HE2 MET 44 1HE MET 44 -2.528 -7.131 0.462
344 HE3 MET 44 2HE MET 44 -1.232 -8.321 0.535
345 H GLU 45 H GLU 45 -6.036 -10.552 4.301
346 HA GLU 45 HA GLU 45 -7.652 -11.143 1.884
347 HB2 GLU 45 2HB GLU 45 -7.673 -12.834 3.703
348 HB3 GLU 45 1HB GLU 45 -8.324 -11.611 4.798
349 HG2 GLU 45 2HG GLU 45 -10.313 -11.359 3.441
350 HG3 GLU 45 1HG GLU 45 -9.644 -12.412 2.191
351 H THR 46 H THR 46 -8.910 -9.580 1.119
352 HA THR 46 HA THR 46 -9.284 -7.119 2.537
353 HB THR 46 HB THR 46 -10.436 -6.363 0.604
354 HG1 THR 46 1HG THR 46 -11.365 -7.752 -0.832
355 HG21 THR 46 3HG2 THR 46 -8.548 -8.436 -0.504
356 HG22 THR 46 1HG2 THR 46 -7.962 -7.043 0.394
357 HG23 THR 46 2HG2 THR 46 -8.859 -6.812 -1.106
358 H ARG 47 H ARG 47 -11.682 -6.212 2.443
359 HA ARG 47 HA ARG 47 -13.165 -7.756 4.352
360 HB2 ARG 47 2HB ARG 47 -13.132 -5.291 4.410
361 HB3 ARG 47 1HB ARG 47 -13.951 -5.249 2.845
362 HG2 ARG 47 2HG ARG 47 -15.904 -6.342 3.767
363 HG3 ARG 47 1HG ARG 47 -15.081 -6.619 5.303
364 HD2 ARG 47 2HD ARG 47 -14.846 -4.123 5.537
365 HD3 ARG 47 1HD ARG 47 -15.862 -3.946 4.110
366 HE ARG 47 HE ARG 47 -17.203 -5.602 5.951
367 HH11 ARG 47 1HH2 ARG 47 -16.096 -2.347 5.567
368 HH12 ARG 47 2HH2 ARG 47 -17.346 -1.660 6.549
369 HH21 ARG 47 1HH1 ARG 47 -18.845 -4.708 7.240
370 HH22 ARG 47 2HH1 ARG 47 -18.903 -2.996 7.496
371 H ASP 48 H ASP 48 -13.474 -7.021 0.914
372 HA ASP 48 HA ASP 48 -16.041 -8.249 0.599
373 HB2 ASP 48 2HB ASP 48 -15.562 -8.080 -1.818
374 HB3 ASP 48 1HB ASP 48 -15.245 -6.558 -0.979
375 H GLY 49 H GLY 49 -12.960 -9.489 1.127
376 HA2 GLY 49 2HA GLY 49 -12.439 -11.760 1.424
377 HA3 GLY 49 1HA GLY 49 -13.861 -12.198 0.480
378 H THR 50 H THR 50 -11.253 -9.946 -0.387
379 HA THR 50 HA THR 50 -10.723 -11.573 -2.804
380 HB THR 50 HB THR 50 -10.158 -8.665 -2.170
381 HG1 THR 50 1HG THR 50 -11.736 -9.829 -4.202
382 HG21 THR 50 3HG2 THR 50 -9.400 -10.382 -4.541
383 HG22 THR 50 1HG2 THR 50 -8.329 -9.435 -3.509
384 HG23 THR 50 2HG2 THR 50 -9.443 -8.620 -4.605
385 H LYS 51 H LYS 51 -8.640 -12.215 -3.326
386 HA LYS 51 HA LYS 51 -6.772 -12.332 -1.060
387 HB2 LYS 51 2HB LYS 51 -7.451 -14.382 -2.390
388 HB3 LYS 51 1HB LYS 51 -6.521 -13.712 -3.736
389 HG2 LYS 51 2HG LYS 51 -4.550 -13.543 -2.132
390 HG3 LYS 51 1HG LYS 51 -5.496 -14.508 -1.000
391 HD2 LYS 51 2HD LYS 51 -4.818 -15.354 -3.833
392 HD3 LYS 51 1HD LYS 51 -3.956 -15.896 -2.393
393 HE2 LYS 51 2HE LYS 51 -6.278 -16.652 -1.528
394 HE3 LYS 51 1HE LYS 51 -6.804 -16.479 -3.202
395 HZ1 LYS 51 3HZ LYS 51 -4.762 -18.299 -2.094
396 HZ2 LYS 51 1HZ LYS 51 -4.779 -17.902 -3.743
397 HZ3 LYS 51 2HZ LYS 51 -6.120 -18.676 -3.043
398 H ILE 52 H ILE 52 -5.143 -10.965 -0.905
399 HA ILE 52 HA ILE 52 -3.795 -9.986 -3.343
400 HB ILE 52 HB ILE 52 -3.578 -7.743 -2.004
401 HG12 ILE 52 2HG1 ILE 52 -6.229 -8.714 -0.922
402 HG13 ILE 52 1HG1 ILE 52 -4.741 -8.823 -0.004
403 HG21 ILE 52 1HG2 ILE 52 -6.229 -8.514 -3.237
404 HG22 ILE 52 2HG2 ILE 52 -4.801 -8.027 -4.150
405 HG23 ILE 52 3HG2 ILE 52 -5.594 -6.878 -3.069
406 HD11 ILE 52 3HD1 ILE 52 -5.676 -6.763 0.677
407 HD12 ILE 52 1HD1 ILE 52 -6.177 -6.360 -0.963
408 HD13 ILE 52 2HD1 ILE 52 -4.473 -6.292 -0.515
409 H ILE 53 H ILE 53 -1.757 -10.582 -3.190
410 HA ILE 53 HA ILE 53 -0.553 -11.281 -0.654
411 HB ILE 53 HB ILE 53 0.425 -11.314 -3.515
412 HG12 ILE 53 2HG1 ILE 53 0.333 -13.733 -3.213
413 HG13 ILE 53 1HG1 ILE 53 -0.159 -13.540 -1.535
414 HG21 ILE 53 1HG2 ILE 53 1.860 -11.988 -0.939
415 HG22 ILE 53 2HG2 ILE 53 2.400 -10.920 -2.235
416 HG23 ILE 53 3HG2 ILE 53 2.352 -12.663 -2.493
417 HD11 ILE 53 3HD1 ILE 53 -2.297 -12.776 -2.132
418 HD12 ILE 53 1HD1 ILE 53 -1.977 -14.013 -3.344
419 HD13 ILE 53 2HD1 ILE 53 -1.784 -12.312 -3.757
420 H MET 54 H MET 54 1.181 -10.252 0.342
421 HA MET 54 HA MET 54 1.330 -7.415 0.013
422 HB2 MET 54 2HB MET 54 1.734 -8.608 2.179
423 HB3 MET 54 1HB MET 54 3.245 -9.228 1.506
424 HG2 MET 54 2HG MET 54 3.834 -7.269 2.745
425 HG3 MET 54 1HG MET 54 3.893 -6.806 1.058
426 HE1 MET 54 3HE MET 54 2.194 -3.591 1.267
427 HE2 MET 54 1HE MET 54 2.942 -4.796 0.209
428 HE3 MET 54 2HE MET 54 3.778 -4.254 1.662
429 H LYS 55 H LYS 55 1.785 -7.453 -2.308
430 HA LYS 55 HA LYS 55 4.216 -8.457 -3.375
431 HB2 LYS 55 2HB LYS 55 2.108 -7.791 -4.650
432 HB3 LYS 55 1HB LYS 55 2.649 -6.121 -4.473
433 HG2 LYS 55 2HG LYS 55 4.864 -6.867 -5.483
434 HG3 LYS 55 1HG LYS 55 4.063 -8.383 -5.898
435 HD2 LYS 55 2HD LYS 55 3.093 -5.634 -6.739
436 HD3 LYS 55 1HD LYS 55 4.019 -6.726 -7.768
437 HE2 LYS 55 2HE LYS 55 2.164 -8.461 -7.268
438 HE3 LYS 55 1HE LYS 55 1.220 -7.085 -6.698
439 HZ1 LYS 55 3HZ LYS 55 1.113 -6.173 -8.773
440 HZ2 LYS 55 1HZ LYS 55 1.120 -7.820 -9.179
441 HZ3 LYS 55 2HZ LYS 55 2.549 -6.909 -9.308
442 H GLY 56 H GLY 56 3.286 -5.054 -3.074
443 HA2 GLY 56 2HA GLY 56 5.926 -4.069 -3.272
444 HA3 GLY 56 1HA GLY 56 4.514 -3.154 -2.762
445 H ASN 57 H ASN 57 6.534 -5.801 -1.426
446 HA ASN 57 HA ASN 57 6.042 -5.145 1.274
447 HB2 ASN 57 2HB ASN 57 6.978 -7.306 0.673
448 HB3 ASN 57 1HB ASN 57 8.418 -6.532 0.008
449 HD21 ASN 57 1HD2 ASN 57 6.921 -5.298 2.961
450 HD22 ASN 57 2HD2 ASN 57 8.159 -5.806 4.013
451 H GLU 58 H GLU 58 7.701 -3.476 -1.104
452 HA GLU 58 HA GLU 58 9.727 -2.265 0.572
453 HB2 GLU 58 2HB GLU 58 8.741 -1.480 -2.182
454 HB3 GLU 58 1HB GLU 58 10.206 -0.891 -1.395
455 HG2 GLU 58 2HG GLU 58 9.728 -3.841 -1.844
456 HG3 GLU 58 1HG GLU 58 10.473 -2.828 -3.074
457 H ILE 59 H ILE 59 8.059 -1.638 2.218
458 HA ILE 59 HA ILE 59 6.178 0.428 1.632
459 HB ILE 59 HB ILE 59 6.182 0.674 4.179
460 HG12 ILE 59 2HG1 ILE 59 7.899 -1.819 3.996
461 HG13 ILE 59 1HG1 ILE 59 8.551 -0.223 4.376
462 HG21 ILE 59 1HG2 ILE 59 4.558 -0.728 2.984
463 HG22 ILE 59 2HG2 ILE 59 5.055 -1.518 4.481
464 HG23 ILE 59 3HG2 ILE 59 5.717 -2.056 2.939
465 HD11 ILE 59 3HD1 ILE 59 7.237 -0.067 6.376
466 HD12 ILE 59 1HD1 ILE 59 7.977 -1.669 6.388
467 HD13 ILE 59 2HD1 ILE 59 6.283 -1.483 5.933
468 H PHE 60 H PHE 60 9.542 0.417 1.962
469 HA PHE 60 HA PHE 60 10.188 2.756 3.280
470 HB2 PHE 60 2HB PHE 60 11.426 1.625 0.760
471 HB3 PHE 60 1HB PHE 60 12.160 2.871 1.771
472 HD1 PHE 60 2HD PHE 60 12.988 2.353 4.016
473 HD2 PHE 60 1HD PHE 60 11.233 -0.682 1.535
474 HE1 PHE 60 2HE PHE 60 13.895 0.602 5.519
475 HE2 PHE 60 1HE PHE 60 12.140 -2.435 3.037
476 HZ PHE 60 HZ PHE 60 13.471 -1.793 5.030
477 H ARG 61 H ARG 61 8.702 2.348 0.141
478 HA ARG 61 HA ARG 61 9.164 4.931 -0.901
479 HB2 ARG 61 2HB ARG 61 7.065 2.826 -1.397
480 HB3 ARG 61 1HB ARG 61 6.975 4.395 -2.199
481 HG2 ARG 61 2HG ARG 61 8.176 2.641 -3.543
482 HG3 ARG 61 1HG ARG 61 9.153 4.071 -3.210
483 HD2 ARG 61 2HD ARG 61 10.390 2.959 -1.510
484 HD3 ARG 61 1HD ARG 61 9.236 1.631 -1.431
485 HE ARG 61 HE ARG 61 10.368 0.640 -3.189
486 HH11 ARG 61 1HH2 ARG 61 11.042 4.032 -3.060
487 HH12 ARG 61 2HH2 ARG 61 12.224 3.986 -4.326
488 HH21 ARG 61 1HH1 ARG 61 11.916 0.572 -4.849
489 HH22 ARG 61 2HH1 ARG 61 12.719 2.026 -5.338
490 H LEU 62 H LEU 62 6.427 3.615 0.965
491 HA LEU 62 HA LEU 62 4.789 5.841 1.030
492 HB2 LEU 62 2HB LEU 62 4.594 3.419 2.114
493 HB3 LEU 62 1HB LEU 62 5.159 4.254 3.557
494 HG LEU 62 HG LEU 62 2.699 4.921 1.913
495 HD11 LEU 62 1HD1 LEU 62 2.471 3.001 3.446
496 HD12 LEU 62 2HD1 LEU 62 1.521 4.374 4.013
497 HD13 LEU 62 3HD1 LEU 62 3.062 3.993 4.779
498 HD21 LEU 62 3HD2 LEU 62 4.089 6.391 4.160
499 HD22 LEU 62 1HD2 LEU 62 2.363 6.594 3.862
500 HD23 LEU 62 2HD2 LEU 62 3.527 7.030 2.614
501 H ASP 63 H ASP 63 7.411 5.023 3.311
502 HA ASP 63 HA ASP 63 7.261 7.227 4.984
503 HB2 ASP 63 2HB ASP 63 8.758 5.325 5.390
504 HB3 ASP 63 1HB ASP 63 9.757 5.811 4.020
505 H GLU 64 H GLU 64 7.947 9.319 4.910
506 HA GLU 64 HA GLU 64 8.045 10.727 2.541
507 HB2 GLU 64 2HB GLU 64 9.430 11.426 5.142
508 HB3 GLU 64 1HB GLU 64 9.078 12.556 3.834
509 HG2 GLU 64 2HG GLU 64 6.653 12.014 4.072
510 HG3 GLU 64 1HG GLU 64 7.047 10.994 5.456
511 H ALA 65 H ALA 65 9.374 10.294 0.887
512 HA ALA 65 HA ALA 65 12.145 10.859 1.038
513 HB1 ALA 65 1HB ALA 65 11.381 7.934 0.933
514 HB2 ALA 65 2HB ALA 65 12.367 8.733 2.157
515 HB3 ALA 65 3HB ALA 65 12.979 8.551 0.514
516 H LEU 66 H LEU 66 10.851 8.184 -0.847
517 HA LEU 66 HA LEU 66 11.552 9.472 -3.314
518 HB2 LEU 66 2HB LEU 66 10.157 6.887 -2.627
519 HB3 LEU 66 1HB LEU 66 10.345 7.422 -4.294
520 HG LEU 66 HG LEU 66 12.156 5.863 -3.515
521 HD11 LEU 66 1HD1 LEU 66 12.410 7.877 -5.244
522 HD12 LEU 66 2HD1 LEU 66 13.802 6.920 -4.750
523 HD13 LEU 66 3HD1 LEU 66 13.515 8.494 -4.014
524 HD21 LEU 66 3HD2 LEU 66 13.163 8.175 -1.853
525 HD22 LEU 66 1HD2 LEU 66 13.708 6.500 -1.845
526 HD23 LEU 66 2HD2 LEU 66 12.139 6.916 -1.160
527 H ARG 67 H ARG 67 10.348 11.322 -3.595
528 HA ARG 67 HA ARG 67 7.751 11.032 -4.710
529 HB2 ARG 67 2HB ARG 67 7.146 10.789 -2.315
530 HB3 ARG 67 1HB ARG 67 7.853 12.374 -1.998
531 HG2 ARG 67 2HG ARG 67 6.264 13.439 -3.504
532 HG3 ARG 67 1HG ARG 67 5.610 11.869 -3.976
533 HD2 ARG 67 2HD ARG 67 4.163 12.933 -2.297
534 HD3 ARG 67 1HD ARG 67 4.893 11.468 -1.648
535 HE ARG 67 HE ARG 67 6.557 13.640 -0.995
536 HH11 ARG 67 1HH2 ARG 67 3.397 12.388 -0.347
537 HH12 ARG 67 2HH2 ARG 67 3.306 13.063 1.246
538 HH21 ARG 67 1HH1 ARG 67 6.445 14.528 1.092
539 HH22 ARG 67 2HH1 ARG 67 5.031 14.274 2.060
540 H LYS 68 H LYS 68 8.662 12.236 -6.377
541 HA LYS 68 HA LYS 68 8.428 15.059 -6.163
542 HB2 LYS 68 2HB LYS 68 10.622 14.725 -5.002
543 HB3 LYS 68 1HB LYS 68 11.257 14.040 -6.498
544 HG2 LYS 68 2HG LYS 68 10.794 16.124 -7.690
545 HG3 LYS 68 1HG LYS 68 10.064 16.816 -6.240
546 HD2 LYS 68 2HD LYS 68 12.221 16.598 -5.052
547 HD3 LYS 68 1HD LYS 68 12.951 15.928 -6.513
548 HE2 LYS 68 2HE LYS 68 12.413 18.020 -7.726
549 HE3 LYS 68 1HE LYS 68 11.725 18.690 -6.247
550 HZ1 LYS 68 3HZ LYS 68 14.428 17.615 -6.078
551 HZ2 LYS 68 1HZ LYS 68 13.749 18.970 -5.318
552 HZ3 LYS 68 2HZ LYS 68 14.238 19.066 -6.941
553 H GLY 69 H GLY 69 7.054 14.334 -7.946
554 HA2 GLY 69 2HA GLY 69 8.002 14.982 -10.455
555 HA3 GLY 69 1HA GLY 69 8.179 13.233 -10.334
556 H HIS 70 H HIS 70 6.034 15.810 -10.931
557 HA HIS 70 HA HIS 70 3.550 14.635 -10.288
558 HB2 HIS 70 2HB HIS 70 3.822 17.029 -10.826
559 HB3 HIS 70 1HB HIS 70 4.196 16.604 -12.496
560 HD2 HIS 70 2HD HIS 70 1.951 16.308 -14.099
561 HE1 HIS 70 1HE HIS 70 -0.933 16.110 -11.022
562 HE2 HIS 70 2HE HIS 70 -0.596 16.191 -13.538
563 H SER 71 H SER 71 4.702 15.149 -13.615
564 HA SER 71 HA SER 71 3.064 13.128 -14.717
565 HB2 SER 71 2HB SER 71 5.592 14.355 -15.840
566 HB3 SER 71 1HB SER 71 4.404 13.431 -16.755
567 HG SER 71 HG SER 71 4.120 15.743 -16.851
568 H GLU 72 H GLU 72 3.265 11.080 -13.992
569 HA GLU 72 HA GLU 72 5.626 9.845 -13.106
570 HB2 GLU 72 2HB GLU 72 4.377 7.716 -13.430
571 HB3 GLU 72 1HB GLU 72 3.438 8.932 -12.563
572 HG2 GLU 72 2HG GLU 72 2.361 9.575 -14.725
573 HG3 GLU 72 1HG GLU 72 3.222 8.252 -15.508
574 H GLY 73 H GLY 73 6.594 7.866 -14.173
575 HA2 GLY 73 2HA GLY 73 7.836 8.586 -16.595
576 HA3 GLY 73 1HA GLY 73 7.869 6.981 -15.872
577 H GLY 74 H GLY 74 7.813 6.386 -18.225
578 HA2 GLY 74 2HA GLY 74 5.287 5.363 -18.932
579 HA3 GLY 74 1HA GLY 74 5.582 6.822 -19.875
580 H1 HOH 201 H2 HOH 77 0.065 18.959 -9.159
581 H2 HOH 201 H1 HOH 77 -1.224 18.347 -9.664
Start of MODEL 9
1 H1 VAL 1 1H VAL 1 7.781 12.097 -12.801
2 H2 VAL 1 2H VAL 1 6.490 11.104 -13.283
3 HA VAL 1 HA VAL 1 6.363 13.590 -11.675
4 HB VAL 1 HB VAL 1 5.042 12.778 -14.281
5 HG11 VAL 1 2HG1 VAL 1 3.727 14.411 -13.052
6 HG12 VAL 1 3HG1 VAL 1 4.540 15.237 -14.381
7 HG13 VAL 1 1HG1 VAL 1 5.163 15.386 -12.737
8 HG21 VAL 1 1HG2 VAL 1 7.457 14.515 -13.686
9 HG22 VAL 1 2HG2 VAL 1 6.625 14.499 -15.241
10 HG23 VAL 1 3HG2 VAL 1 7.420 13.039 -14.652
11 H ASP 2 H ASP 2 4.354 11.026 -13.149
12 HA ASP 2 HA ASP 2 2.392 10.047 -12.466
13 HB2 ASP 2 2HB ASP 2 3.234 10.838 -9.675
14 HB3 ASP 2 1HB ASP 2 2.200 9.492 -10.149
15 H MET 3 H MET 3 1.312 11.882 -13.530
16 HA MET 3 HA MET 3 0.365 14.075 -11.913
17 HB2 MET 3 2HB MET 3 0.800 14.159 -14.416
18 HB3 MET 3 1HB MET 3 -0.682 13.223 -14.614
19 HG2 MET 3 2HG MET 3 -1.304 15.531 -14.825
20 HG3 MET 3 1HG MET 3 -1.859 15.006 -13.237
21 HE1 MET 3 3HE MET 3 -1.898 17.803 -13.683
22 HE2 MET 3 1HE MET 3 -0.908 18.621 -12.466
23 HE3 MET 3 2HE MET 3 -1.972 17.299 -11.996
24 H SER 4 H SER 4 -1.080 11.156 -13.344
25 HA SER 4 HA SER 4 -3.685 11.629 -12.277
26 HB2 SER 4 2HB SER 4 -2.423 9.052 -13.236
27 HB3 SER 4 1HB SER 4 -4.141 9.308 -12.948
28 HG SER 4 HG SER 4 -2.471 10.311 -14.962
29 H ASN 5 H ASN 5 -1.032 9.447 -11.332
30 HA ASN 5 HA ASN 5 -0.553 8.402 -9.342
31 HB2 ASN 5 2HB ASN 5 -2.231 10.586 -8.097
32 HB3 ASN 5 1HB ASN 5 -0.963 9.640 -7.319
33 HD21 ASN 5 1HD2 ASN 5 1.300 10.009 -8.109
34 HD22 ASN 5 2HD2 ASN 5 1.697 11.494 -8.828
35 H VAL 6 H VAL 6 -1.940 6.638 -10.119
36 HA VAL 6 HA VAL 6 -4.667 6.438 -9.289
37 HB VAL 6 HB VAL 6 -2.782 4.185 -10.011
38 HG11 VAL 6 1HG1 VAL 6 -5.798 4.500 -10.138
39 HG12 VAL 6 2HG1 VAL 6 -4.906 3.471 -9.015
40 HG13 VAL 6 3HG1 VAL 6 -4.901 3.106 -10.742
41 HG21 VAL 6 3HG2 VAL 6 -2.754 5.929 -11.752
42 HG22 VAL 6 1HG2 VAL 6 -4.517 5.934 -11.784
43 HG23 VAL 6 2HG2 VAL 6 -3.630 4.507 -12.319
44 H VAL 7 H VAL 7 -5.121 6.516 -7.166
45 HA VAL 7 HA VAL 7 -3.379 5.356 -5.174
46 HB VAL 7 HB VAL 7 -5.092 6.118 -3.578
47 HG11 VAL 7 1HG1 VAL 7 -4.446 8.128 -5.758
48 HG12 VAL 7 2HG1 VAL 7 -3.410 7.721 -4.390
49 HG13 VAL 7 3HG1 VAL 7 -4.954 8.531 -4.117
50 HG21 VAL 7 3HG2 VAL 7 -7.117 5.675 -4.806
51 HG22 VAL 7 1HG2 VAL 7 -6.616 6.732 -6.125
52 HG23 VAL 7 2HG2 VAL 7 -7.040 7.418 -4.557
53 H LYS 8 H LYS 8 -4.467 3.955 -3.434
54 HA LYS 8 HA LYS 8 -6.507 2.120 -4.365
55 HB2 LYS 8 2HB LYS 8 -4.339 1.314 -5.411
56 HB3 LYS 8 1HB LYS 8 -3.753 1.022 -3.783
57 HG2 LYS 8 2HG LYS 8 -4.773 -1.017 -3.803
58 HG3 LYS 8 1HG LYS 8 -6.331 -0.199 -3.875
59 HD2 LYS 8 2HD LYS 8 -4.673 -0.766 -6.354
60 HD3 LYS 8 1HD LYS 8 -5.872 -1.891 -5.730
61 HE2 LYS 8 2HE LYS 8 -7.027 -0.617 -7.367
62 HE3 LYS 8 1HE LYS 8 -7.539 0.064 -5.824
63 HZ1 LYS 8 3HZ LYS 8 -5.337 1.141 -7.501
64 HZ2 LYS 8 1HZ LYS 8 -5.951 1.829 -6.078
65 HZ3 LYS 8 2HZ LYS 8 -6.918 1.758 -7.473
66 H THR 9 H THR 9 -7.349 0.837 -2.698
67 HA THR 9 HA THR 9 -6.152 0.951 -0.042
68 HB THR 9 HB THR 9 -8.928 2.063 -0.505
69 HG1 THR 9 1HG THR 9 -6.823 3.600 0.460
70 HG21 THR 9 3HG2 THR 9 -7.139 1.891 1.936
71 HG22 THR 9 1HG2 THR 9 -8.632 0.990 1.671
72 HG23 THR 9 2HG2 THR 9 -8.683 2.742 1.877
73 H TYR 10 H TYR 10 -6.182 -1.142 0.455
74 HA TYR 10 HA TYR 10 -8.592 -2.753 -0.176
75 HB2 TYR 10 2HB TYR 10 -5.690 -3.488 0.206
76 HB3 TYR 10 1HB TYR 10 -6.967 -4.689 0.280
77 HD1 TYR 10 2HD TYR 10 -8.766 -4.419 -1.751
78 HD2 TYR 10 1HD TYR 10 -4.632 -3.232 -1.870
79 HE1 TYR 10 2HE TYR 10 -8.796 -4.566 -4.220
80 HE2 TYR 10 1HE TYR 10 -4.670 -3.383 -4.345
81 HH TYR 10 HH TYR 10 -5.983 -4.569 -6.094
82 H ASP 11 H ASP 11 -9.878 -2.438 1.607
83 HA ASP 11 HA ASP 11 -9.023 -2.176 4.259
84 HB2 ASP 11 2HB ASP 11 -11.618 -3.244 3.137
85 HB3 ASP 11 1HB ASP 11 -11.349 -2.871 4.839
86 H LEU 12 H LEU 12 -7.499 -3.660 4.878
87 HA LEU 12 HA LEU 12 -7.802 -6.485 4.495
88 HB2 LEU 12 2HB LEU 12 -5.795 -4.639 5.491
89 HB3 LEU 12 1HB LEU 12 -5.946 -5.988 6.606
90 HG LEU 12 HG LEU 12 -5.407 -7.582 4.898
91 HD11 LEU 12 1HD1 LEU 12 -4.761 -6.395 2.536
92 HD12 LEU 12 2HD1 LEU 12 -6.099 -5.358 3.032
93 HD13 LEU 12 3HD1 LEU 12 -6.342 -7.095 2.857
94 HD21 LEU 12 3HD2 LEU 12 -3.491 -6.432 5.851
95 HD22 LEU 12 1HD2 LEU 12 -3.656 -5.113 4.690
96 HD23 LEU 12 2HD2 LEU 12 -3.177 -6.715 4.139
97 H GLN 13 H GLN 13 -7.833 -8.041 6.296
98 HA GLN 13 HA GLN 13 -10.066 -7.466 8.043
99 HB2 GLN 13 2HB GLN 13 -8.331 -9.894 7.580
100 HB3 GLN 13 1HB GLN 13 -9.561 -9.848 8.848
101 HG2 GLN 13 2HG GLN 13 -10.209 -9.141 5.981
102 HG3 GLN 13 1HG GLN 13 -10.276 -10.804 6.566
103 HE21 GLN 13 1HE2 GLN 13 -11.938 -7.739 6.552
104 HE22 GLN 13 2HE2 GLN 13 -13.248 -8.222 7.528
105 H ASP 14 H ASP 14 -6.656 -7.249 8.229
106 HA ASP 14 HA ASP 14 -6.464 -7.581 11.098
107 HB2 ASP 14 2HB ASP 14 -4.582 -8.120 9.564
108 HB3 ASP 14 1HB ASP 14 -4.463 -6.407 9.158
109 H GLY 15 H GLY 15 -8.067 -5.368 9.520
110 HA2 GLY 15 2HA GLY 15 -8.882 -3.319 10.263
111 HA3 GLY 15 1HA GLY 15 -7.669 -3.331 11.544
112 H SER 16 H SER 16 -5.793 -4.032 9.097
113 HA SER 16 HA SER 16 -4.968 -1.262 8.671
114 HB2 SER 16 2HB SER 16 -2.985 -2.247 7.641
115 HB3 SER 16 1HB SER 16 -3.295 -3.011 9.201
116 HG SER 16 HG SER 16 -4.668 -4.320 7.347
117 H LYS 17 H LYS 17 -4.046 -0.943 6.299
118 HA LYS 17 HA LYS 17 -5.878 -2.004 4.265
119 HB2 LYS 17 2HB LYS 17 -5.478 0.975 4.524
120 HB3 LYS 17 1HB LYS 17 -6.640 0.112 3.517
121 HG2 LYS 17 2HG LYS 17 -7.728 -0.752 5.597
122 HG3 LYS 17 1HG LYS 17 -6.629 0.253 6.539
123 HD2 LYS 17 2HD LYS 17 -7.514 2.273 5.567
124 HD3 LYS 17 1HD LYS 17 -8.463 1.353 4.397
125 HE2 LYS 17 2HE LYS 17 -9.838 0.419 6.177
126 HE3 LYS 17 1HE LYS 17 -8.835 1.196 7.402
127 HZ1 LYS 17 3HZ LYS 17 -9.437 3.345 6.206
128 HZ2 LYS 17 1HZ LYS 17 -10.641 2.615 7.149
129 HZ3 LYS 17 2HZ LYS 17 -10.672 2.450 5.459
130 H VAL 18 H VAL 18 -4.793 -2.465 2.475
131 HA VAL 18 HA VAL 18 -2.014 -1.669 2.240
132 HB VAL 18 HB VAL 18 -3.396 -3.086 -0.008
133 HG11 VAL 18 1HG1 VAL 18 -1.298 -4.385 0.011
134 HG12 VAL 18 2HG1 VAL 18 -0.768 -3.488 1.435
135 HG13 VAL 18 3HG1 VAL 18 -0.995 -2.651 -0.103
136 HG21 VAL 18 3HG2 VAL 18 -2.751 -4.462 2.612
137 HG22 VAL 18 1HG2 VAL 18 -3.325 -5.238 1.132
138 HG23 VAL 18 2HG2 VAL 18 -4.380 -4.141 2.019
139 H HIS 19 H HIS 19 -1.146 -0.307 0.681
140 HA HIS 19 HA HIS 19 -2.966 1.041 -1.198
141 HB2 HIS 19 2HB HIS 19 -2.651 3.155 -0.355
142 HB3 HIS 19 1HB HIS 19 -2.369 2.279 1.145
143 HD1 HIS 19 1HD HIS 19 -0.860 4.736 -1.006
144 HD2 HIS 19 2HD HIS 19 0.627 1.714 1.455
145 HE1 HIS 19 1HE HIS 19 1.577 5.285 -0.584
146 HE2 HIS 19 2HE HIS 19 2.492 3.453 0.914
147 H VAL 20 H VAL 20 -2.129 0.764 -3.163
148 HA VAL 20 HA VAL 20 0.712 0.212 -3.449
149 HB VAL 20 HB VAL 20 0.210 -0.843 -5.434
150 HG11 VAL 20 1HG1 VAL 20 -2.641 -0.913 -4.536
151 HG12 VAL 20 2HG1 VAL 20 -1.419 -1.510 -3.428
152 HG13 VAL 20 3HG1 VAL 20 -1.592 -2.238 -5.022
153 HG21 VAL 20 3HG2 VAL 20 -1.984 1.214 -5.763
154 HG22 VAL 20 1HG2 VAL 20 -1.852 -0.197 -6.814
155 HG23 VAL 20 2HG2 VAL 20 -0.548 0.987 -6.760
156 H PHE 21 H PHE 21 2.035 1.234 -5.039
157 HA PHE 21 HA PHE 21 1.519 4.128 -5.220
158 HB2 PHE 21 2HB PHE 21 4.004 2.435 -5.539
159 HB3 PHE 21 1HB PHE 21 3.963 4.156 -5.914
160 HD1 PHE 21 1HD PHE 21 3.338 1.675 -3.201
161 HD2 PHE 21 2HD PHE 21 4.095 5.787 -4.189
162 HE1 PHE 21 1HE PHE 21 3.624 2.201 -0.796
163 HE2 PHE 21 2HE PHE 21 4.381 6.312 -1.783
164 HZ PHE 21 HZ PHE 21 4.146 4.518 -0.087
165 H LYS 22 H LYS 22 3.102 4.779 -7.369
166 HA LYS 22 HA LYS 22 1.358 4.185 -9.565
167 HB2 LYS 22 2HB LYS 22 2.653 6.364 -9.130
168 HB3 LYS 22 1HB LYS 22 4.058 5.514 -9.767
169 HG2 LYS 22 2HG LYS 22 3.230 6.500 -11.712
170 HG3 LYS 22 1HG LYS 22 2.440 4.928 -11.778
171 HD2 LYS 22 2HD LYS 22 0.394 5.864 -10.840
172 HD3 LYS 22 1HD LYS 22 1.180 7.422 -10.588
173 HE2 LYS 22 2HE LYS 22 1.454 7.733 -12.979
174 HE3 LYS 22 1HE LYS 22 0.845 6.109 -13.299
175 HZ1 LYS 22 3HZ LYS 22 -0.760 8.071 -13.513
176 HZ2 LYS 22 1HZ LYS 22 -0.783 8.074 -11.818
177 HZ3 LYS 22 2HZ LYS 22 -1.290 6.695 -12.670
178 H ASP 23 H ASP 23 4.298 2.834 -8.339
179 HA ASP 23 HA ASP 23 5.120 1.600 -10.811
180 HB2 ASP 23 2HB ASP 23 5.959 0.855 -8.010
181 HB3 ASP 23 1HB ASP 23 6.829 0.538 -9.510
182 H GLY 24 H GLY 24 2.591 1.009 -8.743
183 HA2 GLY 24 2HA GLY 24 1.005 -0.702 -8.972
184 HA3 GLY 24 1HA GLY 24 2.185 -1.659 -9.861
185 H LYS 25 H LYS 25 4.052 -0.833 -7.427
186 HA LYS 25 HA LYS 25 3.766 -3.325 -6.050
187 HB2 LYS 25 2HB LYS 25 5.577 -2.510 -4.649
188 HB3 LYS 25 1HB LYS 25 5.916 -2.110 -6.322
189 HG2 LYS 25 2HG LYS 25 5.088 0.186 -5.950
190 HG3 LYS 25 1HG LYS 25 4.724 -0.211 -4.274
191 HD2 LYS 25 2HD LYS 25 6.821 0.759 -4.026
192 HD3 LYS 25 1HD LYS 25 7.271 -0.935 -4.193
193 HE2 LYS 25 2HE LYS 25 7.444 -0.425 -6.732
194 HE3 LYS 25 1HE LYS 25 7.442 1.270 -6.248
195 HZ1 LYS 25 3HZ LYS 25 9.349 0.874 -4.866
196 HZ2 LYS 25 1HZ LYS 25 9.687 0.340 -6.440
197 HZ3 LYS 25 2HZ LYS 25 9.320 -0.787 -5.221
198 H MET 26 H MET 26 2.958 -3.752 -3.996
199 HA MET 26 HA MET 26 0.836 -2.004 -3.078
200 HB2 MET 26 2HB MET 26 1.799 -4.759 -2.360
201 HB3 MET 26 1HB MET 26 0.696 -3.909 -1.275
202 HG2 MET 26 2HG MET 26 -0.964 -3.703 -2.977
203 HG3 MET 26 1HG MET 26 0.155 -4.235 -4.230
204 HE1 MET 26 3HE MET 26 -1.475 -5.677 -5.085
205 HE2 MET 26 1HE MET 26 -1.689 -7.364 -4.594
206 HE3 MET 26 2HE MET 26 -0.106 -6.788 -5.115
207 H GLY 27 H GLY 27 0.731 -2.207 -0.428
208 HA2 GLY 27 2HA GLY 27 3.113 -1.822 1.043
209 HA3 GLY 27 1HA GLY 27 2.532 -0.244 0.516
210 H MET 28 H MET 28 2.576 -2.037 3.154
211 HA MET 28 HA MET 28 -0.183 -2.154 3.926
212 HB2 MET 28 2HB MET 28 2.297 -2.194 5.656
213 HB3 MET 28 1HB MET 28 0.669 -2.635 6.172
214 HG2 MET 28 2HG MET 28 2.219 -3.998 3.955
215 HG3 MET 28 1HG MET 28 2.052 -4.619 5.594
216 HE1 MET 28 3HE MET 28 -1.421 -4.001 6.137
217 HE2 MET 28 1HE MET 28 0.033 -4.782 6.778
218 HE3 MET 28 2HE MET 28 -1.290 -5.758 6.154
219 H GLU 29 H GLU 29 -1.204 -0.945 5.571
220 HA GLU 29 HA GLU 29 -0.049 1.533 6.508
221 HB2 GLU 29 2HB GLU 29 -1.040 1.918 4.118
222 HB3 GLU 29 1HB GLU 29 -2.602 1.808 4.925
223 HG2 GLU 29 2HG GLU 29 -0.367 3.729 5.644
224 HG3 GLU 29 1HG GLU 29 -1.855 4.150 4.799
225 H ASN 30 H ASN 30 -0.500 1.081 8.606
226 HA ASN 30 HA ASN 30 -2.917 -0.227 9.410
227 HB2 ASN 30 2HB ASN 30 -2.061 -0.156 11.595
228 HB3 ASN 30 1HB ASN 30 -0.634 -0.292 10.573
229 HD21 ASN 30 1HD2 ASN 30 -1.261 2.731 9.842
230 HD22 ASN 30 2HD2 ASN 30 -0.547 3.564 11.144
231 H LYS 31 H LYS 31 -3.990 0.926 11.494
232 HA LYS 31 HA LYS 31 -5.590 3.006 10.405
233 HB2 LYS 31 2HB LYS 31 -6.428 1.388 12.051
234 HB3 LYS 31 1HB LYS 31 -5.340 2.051 13.268
235 HG2 LYS 31 2HG LYS 31 -7.093 4.058 11.915
236 HG3 LYS 31 1HG LYS 31 -7.938 2.887 12.922
237 HD2 LYS 31 2HD LYS 31 -6.379 3.455 14.805
238 HD3 LYS 31 1HD LYS 31 -5.687 4.724 13.797
239 HE2 LYS 31 2HE LYS 31 -7.430 5.626 15.299
240 HE3 LYS 31 1HE LYS 31 -7.898 5.791 13.607
241 HZ1 LYS 31 3HZ LYS 31 -9.477 4.178 13.785
242 HZ2 LYS 31 1HZ LYS 31 -9.536 4.795 15.363
243 HZ3 LYS 31 2HZ LYS 31 -8.681 3.361 15.045
244 H PHE 32 H PHE 32 -2.667 3.021 12.295
245 HA PHE 32 HA PHE 32 -2.982 5.748 13.214
246 HB2 PHE 32 2HB PHE 32 -0.582 3.903 13.211
247 HB3 PHE 32 1HB PHE 32 -0.640 5.486 13.990
248 HD1 PHE 32 1HD PHE 32 -2.426 2.194 13.877
249 HD2 PHE 32 2HD PHE 32 -1.460 5.684 16.190
250 HE1 PHE 32 1HE PHE 32 -3.492 1.170 15.868
251 HE2 PHE 32 2HE PHE 32 -2.527 4.658 18.180
252 HZ PHE 32 HZ PHE 32 -3.543 2.402 18.019
253 H GLY 33 H GLY 33 -2.848 4.861 10.234
254 HA2 GLY 33 2HA GLY 33 -2.182 5.878 8.276
255 HA3 GLY 33 1HA GLY 33 -1.641 7.239 9.258
256 H LYS 34 H LYS 34 -0.216 4.530 10.485
257 HA LYS 34 HA LYS 34 2.332 5.116 9.133
258 HB2 LYS 34 2HB LYS 34 1.653 3.596 11.659
259 HB3 LYS 34 1HB LYS 34 3.281 3.708 10.988
260 HG2 LYS 34 2HG LYS 34 3.181 6.167 11.138
261 HG3 LYS 34 1HG LYS 34 1.549 6.062 11.803
262 HD2 LYS 34 2HD LYS 34 2.449 4.710 13.698
263 HD3 LYS 34 1HD LYS 34 4.076 4.953 13.061
264 HE2 LYS 34 2HE LYS 34 2.169 7.137 13.953
265 HE3 LYS 34 1HE LYS 34 3.612 6.604 14.816
266 HZ1 LYS 34 3HZ LYS 34 4.364 8.421 13.643
267 HZ2 LYS 34 1HZ LYS 34 3.412 8.087 12.280
268 HZ3 LYS 34 2HZ LYS 34 4.787 7.145 12.605
269 H SER 35 H SER 35 3.711 3.337 8.477
270 HA SER 35 HA SER 35 2.209 1.294 7.064
271 HB2 SER 35 2HB SER 35 5.125 2.058 7.158
272 HB3 SER 35 1HB SER 35 4.552 0.640 6.283
273 HG SER 35 HG SER 35 4.388 2.184 4.796
274 H MET 36 H MET 36 3.055 -0.984 7.085
275 HA MET 36 HA MET 36 4.147 -1.863 9.666
276 HB2 MET 36 2HB MET 36 1.392 -2.482 8.614
277 HB3 MET 36 1HB MET 36 2.244 -3.686 9.579
278 HG2 MET 36 2HG MET 36 1.835 -0.821 10.472
279 HG3 MET 36 1HG MET 36 0.753 -2.145 10.911
280 HE1 MET 36 3HE MET 36 1.967 -0.517 13.215
281 HE2 MET 36 1HE MET 36 2.405 -1.861 14.278
282 HE3 MET 36 2HE MET 36 0.934 -1.941 13.314
283 H ASN 37 H ASN 37 5.856 -3.013 9.064
284 HA ASN 37 HA ASN 37 6.399 -4.044 6.554
285 HB2 ASN 37 2HB ASN 37 7.962 -3.777 8.571
286 HB3 ASN 37 1HB ASN 37 7.379 -5.360 9.082
287 HD21 ASN 37 1HD2 ASN 37 7.207 -6.770 6.693
288 HD22 ASN 37 2HD2 ASN 37 8.737 -6.858 5.953
289 H MET 38 H MET 38 5.961 -5.864 5.458
290 HA MET 38 HA MET 38 4.671 -8.131 6.805
291 HB2 MET 38 2HB MET 38 2.798 -6.767 6.061
292 HB3 MET 38 1HB MET 38 3.462 -6.718 4.422
293 HG2 MET 38 2HG MET 38 3.166 -9.073 4.143
294 HG3 MET 38 1HG MET 38 2.870 -9.312 5.852
295 HE1 MET 38 3HE MET 38 -0.745 -9.256 6.223
296 HE2 MET 38 1HE MET 38 0.641 -8.609 7.113
297 HE3 MET 38 2HE MET 38 0.745 -10.192 6.346
298 HA PRO 39 HA PRO 39 7.865 -9.901 4.051
299 HB2 PRO 39 2HB PRO 39 6.350 -12.406 4.705
300 HB3 PRO 39 1HB PRO 39 8.099 -12.101 4.753
301 HG2 PRO 39 2HG PRO 39 6.640 -12.209 6.989
302 HG3 PRO 39 1HG PRO 39 7.999 -11.084 6.818
303 HD2 PRO 39 2HD PRO 39 5.066 -10.506 6.764
304 HD3 PRO 39 1HD PRO 39 6.411 -9.484 7.298
305 H GLU 40 H GLU 40 7.839 -10.335 1.878
306 HA GLU 40 HA GLU 40 5.440 -10.027 0.408
307 HB2 GLU 40 2HB GLU 40 6.800 -10.619 -1.556
308 HB3 GLU 40 1HB GLU 40 7.646 -9.460 -0.526
309 HG2 GLU 40 2HG GLU 40 8.740 -11.514 0.584
310 HG3 GLU 40 1HG GLU 40 8.144 -12.425 -0.805
311 H GLY 41 H GLY 41 3.910 -11.460 -0.102
312 HA2 GLY 41 2HA GLY 41 3.269 -13.620 -0.999
313 HA3 GLY 41 1HA GLY 41 4.554 -14.358 -0.045
314 H LYS 42 H LYS 42 3.499 -12.232 2.084
315 HA LYS 42 HA LYS 42 1.930 -14.151 3.533
316 HB2 LYS 42 2HB LYS 42 2.933 -11.373 4.032
317 HB3 LYS 42 1HB LYS 42 1.593 -11.946 5.020
318 HG2 LYS 42 2HG LYS 42 3.991 -13.735 4.664
319 HG3 LYS 42 1HG LYS 42 4.115 -12.370 5.767
320 HD2 LYS 42 2HD LYS 42 2.357 -13.169 7.142
321 HD3 LYS 42 1HD LYS 42 1.808 -14.312 5.915
322 HE2 LYS 42 2HE LYS 42 3.786 -15.671 6.201
323 HE3 LYS 42 1HE LYS 42 4.520 -14.465 7.257
324 HZ1 LYS 42 3HZ LYS 42 3.644 -15.799 8.833
325 HZ2 LYS 42 1HZ LYS 42 2.422 -16.403 7.823
326 HZ3 LYS 42 2HZ LYS 42 2.249 -14.873 8.541
327 H VAL 43 H VAL 43 0.419 -14.371 1.721
328 HA VAL 43 HA VAL 43 -1.338 -12.779 0.550
329 HB VAL 43 HB VAL 43 -2.247 -15.229 2.059
330 HG11 VAL 43 1HG1 VAL 43 -3.787 -15.397 0.073
331 HG12 VAL 43 2HG1 VAL 43 -3.230 -13.799 -0.427
332 HG13 VAL 43 3HG1 VAL 43 -4.097 -13.995 1.097
333 HG21 VAL 43 3HG2 VAL 43 -0.268 -15.815 0.810
334 HG22 VAL 43 1HG2 VAL 43 -0.818 -14.898 -0.594
335 HG23 VAL 43 2HG2 VAL 43 -1.658 -16.376 -0.122
336 H MET 44 H MET 44 -2.854 -11.325 0.970
337 HA MET 44 HA MET 44 -3.838 -11.033 3.762
338 HB2 MET 44 2HB MET 44 -3.761 -8.868 1.663
339 HB3 MET 44 1HB MET 44 -4.039 -8.692 3.378
340 HG2 MET 44 2HG MET 44 -1.776 -9.064 3.901
341 HG3 MET 44 1HG MET 44 -1.440 -9.814 2.346
342 HE1 MET 44 3HE MET 44 -2.696 -7.557 0.105
343 HE2 MET 44 1HE MET 44 -1.494 -8.845 0.245
344 HE3 MET 44 2HE MET 44 -0.994 -7.208 -0.157
345 H GLU 45 H GLU 45 -6.076 -10.597 4.015
346 HA GLU 45 HA GLU 45 -7.749 -11.066 1.599
347 HB2 GLU 45 2HB GLU 45 -7.617 -13.090 3.042
348 HB3 GLU 45 1HB GLU 45 -8.274 -12.142 4.380
349 HG2 GLU 45 2HG GLU 45 -10.319 -11.716 3.148
350 HG3 GLU 45 1HG GLU 45 -9.658 -12.486 1.704
351 H THR 46 H THR 46 -9.092 -9.444 1.216
352 HA THR 46 HA THR 46 -9.527 -7.385 3.195
353 HB THR 46 HB THR 46 -10.703 -6.217 1.451
354 HG1 THR 46 1HG THR 46 -11.668 -7.251 -0.097
355 HG21 THR 46 3HG2 THR 46 -8.375 -7.768 0.285
356 HG22 THR 46 1HG2 THR 46 -8.238 -6.332 1.299
357 HG23 THR 46 2HG2 THR 46 -8.981 -6.217 -0.295
358 H ARG 47 H ARG 47 -11.789 -6.545 3.547
359 HA ARG 47 HA ARG 47 -13.337 -8.405 4.928
360 HB2 ARG 47 2HB ARG 47 -14.270 -5.810 3.675
361 HB3 ARG 47 1HB ARG 47 -15.077 -6.685 4.978
362 HG2 ARG 47 2HG ARG 47 -13.293 -6.270 6.500
363 HG3 ARG 47 1HG ARG 47 -12.213 -5.742 5.209
364 HD2 ARG 47 2HD ARG 47 -13.568 -3.761 4.822
365 HD3 ARG 47 1HD ARG 47 -14.769 -4.313 5.985
366 HE ARG 47 HE ARG 47 -12.171 -4.092 7.173
367 HH11 ARG 47 1HH2 ARG 47 -14.950 -2.331 6.101
368 HH12 ARG 47 2HH2 ARG 47 -14.718 -1.021 7.209
369 HH21 ARG 47 1HH1 ARG 47 -11.861 -2.376 8.629
370 HH22 ARG 47 2HH1 ARG 47 -12.970 -1.046 8.641
371 H ASP 48 H ASP 48 -13.569 -7.284 1.586
372 HA ASP 48 HA ASP 48 -16.007 -8.687 1.022
373 HB2 ASP 48 2HB ASP 48 -15.329 -6.723 -0.288
374 HB3 ASP 48 1HB ASP 48 -13.895 -7.588 -0.850
375 H GLY 49 H GLY 49 -13.009 -9.797 1.737
376 HA2 GLY 49 2HA GLY 49 -12.168 -11.955 1.659
377 HA3 GLY 49 1HA GLY 49 -13.562 -12.425 0.688
378 H THR 50 H THR 50 -11.460 -9.737 -0.142
379 HA THR 50 HA THR 50 -10.872 -10.974 -2.713
380 HB THR 50 HB THR 50 -9.812 -8.339 -1.689
381 HG1 THR 50 1HG THR 50 -11.766 -7.628 -1.758
382 HG21 THR 50 3HG2 THR 50 -9.860 -7.793 -4.104
383 HG22 THR 50 1HG2 THR 50 -10.447 -9.422 -4.447
384 HG23 THR 50 2HG2 THR 50 -8.835 -9.189 -3.768
385 H LYS 51 H LYS 51 -9.207 -12.324 -2.929
386 HA LYS 51 HA LYS 51 -7.083 -12.432 -0.985
387 HB2 LYS 51 2HB LYS 51 -7.985 -14.453 -2.131
388 HB3 LYS 51 1HB LYS 51 -7.296 -13.861 -3.645
389 HG2 LYS 51 2HG LYS 51 -5.043 -13.853 -2.593
390 HG3 LYS 51 1HG LYS 51 -5.745 -14.505 -1.114
391 HD2 LYS 51 2HD LYS 51 -5.893 -15.855 -3.828
392 HD3 LYS 51 1HD LYS 51 -4.725 -16.265 -2.574
393 HE2 LYS 51 2HE LYS 51 -6.863 -16.554 -1.061
394 HE3 LYS 51 1HE LYS 51 -7.698 -16.713 -2.606
395 HZ1 LYS 51 3HZ LYS 51 -6.497 -18.589 -3.160
396 HZ2 LYS 51 1HZ LYS 51 -6.766 -18.806 -1.500
397 HZ3 LYS 51 2HZ LYS 51 -5.253 -18.262 -2.050
398 H ILE 52 H ILE 52 -5.611 -10.870 -0.972
399 HA ILE 52 HA ILE 52 -4.344 -10.082 -3.540
400 HB ILE 52 HB ILE 52 -3.856 -7.892 -2.090
401 HG12 ILE 52 2HG1 ILE 52 -6.537 -8.772 -1.000
402 HG13 ILE 52 1HG1 ILE 52 -5.042 -8.939 -0.102
403 HG21 ILE 52 1HG2 ILE 52 -5.134 -7.994 -4.225
404 HG22 ILE 52 2HG2 ILE 52 -5.829 -6.852 -3.072
405 HG23 ILE 52 3HG2 ILE 52 -6.577 -8.432 -3.304
406 HD11 ILE 52 3HD1 ILE 52 -4.664 -6.466 -0.425
407 HD12 ILE 52 1HD1 ILE 52 -6.083 -6.850 0.546
408 HD13 ILE 52 2HD1 ILE 52 -6.270 -6.383 -1.143
409 H ILE 53 H ILE 53 -2.228 -10.429 -3.641
410 HA ILE 53 HA ILE 53 -0.848 -11.496 -1.299
411 HB ILE 53 HB ILE 53 0.121 -11.200 -4.147
412 HG12 ILE 53 2HG1 ILE 53 -1.020 -13.636 -2.744
413 HG13 ILE 53 1HG1 ILE 53 -1.941 -12.624 -3.862
414 HG21 ILE 53 1HG2 ILE 53 1.727 -12.970 -3.421
415 HG22 ILE 53 2HG2 ILE 53 1.107 -12.819 -1.778
416 HG23 ILE 53 3HG2 ILE 53 1.938 -11.461 -2.534
417 HD11 ILE 53 3HD1 ILE 53 0.612 -14.126 -4.514
418 HD12 ILE 53 1HD1 ILE 53 -0.261 -13.076 -5.629
419 HD13 ILE 53 2HD1 ILE 53 -1.012 -14.562 -5.048
420 H MET 54 H MET 54 0.914 -10.625 -0.321
421 HA MET 54 HA MET 54 1.251 -7.782 -0.480
422 HB2 MET 54 2HB MET 54 1.526 -9.103 1.627
423 HB3 MET 54 1HB MET 54 2.984 -9.825 0.941
424 HG2 MET 54 2HG MET 54 3.692 -7.969 2.308
425 HG3 MET 54 1HG MET 54 3.888 -7.481 0.638
426 HE1 MET 54 3HE MET 54 3.994 -4.905 1.600
427 HE2 MET 54 1HE MET 54 2.562 -4.099 0.948
428 HE3 MET 54 2HE MET 54 3.413 -5.301 -0.016
429 H LYS 55 H LYS 55 1.876 -7.404 -2.634
430 HA LYS 55 HA LYS 55 4.247 -8.625 -3.724
431 HB2 LYS 55 2HB LYS 55 2.281 -7.962 -5.114
432 HB3 LYS 55 1HB LYS 55 2.632 -6.276 -4.742
433 HG2 LYS 55 2HG LYS 55 3.587 -6.802 -6.901
434 HG3 LYS 55 1HG LYS 55 4.897 -6.563 -5.755
435 HD2 LYS 55 2HD LYS 55 3.963 -9.382 -5.917
436 HD3 LYS 55 1HD LYS 55 4.620 -8.773 -7.430
437 HE2 LYS 55 2HE LYS 55 6.168 -8.283 -4.900
438 HE3 LYS 55 1HE LYS 55 6.219 -9.878 -5.641
439 HZ1 LYS 55 3HZ LYS 55 6.868 -7.312 -6.984
440 HZ2 LYS 55 1HZ LYS 55 6.879 -8.836 -7.727
441 HZ3 LYS 55 2HZ LYS 55 7.986 -8.491 -6.484
442 H GLY 56 H GLY 56 3.333 -5.240 -3.114
443 HA2 GLY 56 2HA GLY 56 6.026 -4.300 -3.243
444 HA3 GLY 56 1HA GLY 56 4.615 -3.368 -2.764
445 H ASN 57 H ASN 57 7.013 -5.704 -1.561
446 HA ASN 57 HA ASN 57 6.241 -5.328 1.187
447 HB2 ASN 57 2HB ASN 57 7.319 -7.406 0.544
448 HB3 ASN 57 1HB ASN 57 8.743 -6.531 -0.019
449 HD21 ASN 57 1HD2 ASN 57 7.029 -5.501 2.893
450 HD22 ASN 57 2HD2 ASN 57 8.242 -5.975 3.990
451 H GLU 58 H GLU 58 7.857 -3.432 -1.041
452 HA GLU 58 HA GLU 58 9.726 -2.178 0.794
453 HB2 GLU 58 2HB GLU 58 8.846 -1.408 -2.001
454 HB3 GLU 58 1HB GLU 58 10.152 -0.639 -1.099
455 HG2 GLU 58 2HG GLU 58 11.179 -2.265 -2.532
456 HG3 GLU 58 1HG GLU 58 11.218 -2.935 -0.901
457 H ILE 59 H ILE 59 7.853 -1.803 2.330
458 HA ILE 59 HA ILE 59 5.892 0.178 1.741
459 HB ILE 59 HB ILE 59 5.636 0.217 4.257
460 HG12 ILE 59 2HG1 ILE 59 7.660 -2.035 4.158
461 HG13 ILE 59 1HG1 ILE 59 8.100 -0.383 4.601
462 HG21 ILE 59 1HG2 ILE 59 5.597 -2.371 2.691
463 HG22 ILE 59 2HG2 ILE 59 4.244 -1.293 3.041
464 HG23 ILE 59 3HG2 ILE 59 4.963 -2.255 4.333
465 HD11 ILE 59 3HD1 ILE 59 7.514 -1.987 6.526
466 HD12 ILE 59 1HD1 ILE 59 5.843 -1.846 5.976
467 HD13 ILE 59 2HD1 ILE 59 6.714 -0.416 6.527
468 H PHE 60 H PHE 60 9.214 0.384 2.356
469 HA PHE 60 HA PHE 60 9.581 2.630 3.902
470 HB2 PHE 60 2HB PHE 60 11.078 1.859 1.387
471 HB3 PHE 60 1HB PHE 60 11.645 3.019 2.588
472 HD1 PHE 60 1HD PHE 60 12.329 2.293 4.828
473 HD2 PHE 60 2HD PHE 60 10.999 -0.530 1.876
474 HE1 PHE 60 1HE PHE 60 13.240 0.435 6.194
475 HE2 PHE 60 2HE PHE 60 11.911 -2.388 3.242
476 HZ PHE 60 HZ PHE 60 13.031 -1.905 5.400
477 H ARG 61 H ARG 61 8.336 2.443 0.637
478 HA ARG 61 HA ARG 61 8.727 5.092 -0.185
479 HB2 ARG 61 2HB ARG 61 6.405 3.267 -0.837
480 HB3 ARG 61 1HB ARG 61 6.878 4.698 -1.748
481 HG2 ARG 61 2HG ARG 61 8.878 2.489 -1.258
482 HG3 ARG 61 1HG ARG 61 7.699 2.339 -2.555
483 HD2 ARG 61 2HD ARG 61 9.712 4.580 -2.218
484 HD3 ARG 61 1HD ARG 61 9.751 3.313 -3.438
485 HE ARG 61 HE ARG 61 7.290 4.689 -3.624
486 HH11 ARG 61 1HH2 ARG 61 10.687 5.109 -4.125
487 HH12 ARG 61 2HH2 ARG 61 10.497 6.280 -5.387
488 HH21 ARG 61 1HH1 ARG 61 7.032 6.224 -5.280
489 HH22 ARG 61 2HH1 ARG 61 8.427 6.911 -6.040
490 H LEU 62 H LEU 62 5.896 3.654 1.470
491 HA LEU 62 HA LEU 62 4.423 6.048 1.663
492 HB2 LEU 62 2HB LEU 62 3.798 3.520 2.171
493 HB3 LEU 62 1HB LEU 62 4.248 3.957 3.814
494 HG LEU 62 HG LEU 62 2.156 5.331 2.096
495 HD11 LEU 62 1HD1 LEU 62 1.798 3.875 4.723
496 HD12 LEU 62 2HD1 LEU 62 1.647 3.059 3.166
497 HD13 LEU 62 3HD1 LEU 62 0.552 4.378 3.581
498 HD21 LEU 62 3HD2 LEU 62 3.356 5.996 4.789
499 HD22 LEU 62 1HD2 LEU 62 1.710 6.488 4.392
500 HD23 LEU 62 2HD2 LEU 62 3.060 7.065 3.419
501 H ASP 63 H ASP 63 6.568 4.461 4.034
502 HA ASP 63 HA ASP 63 6.391 6.377 6.061
503 HB2 ASP 63 2HB ASP 63 7.457 4.172 6.347
504 HB3 ASP 63 1HB ASP 63 8.786 4.685 5.309
505 H GLU 64 H GLU 64 8.273 7.802 6.750
506 HA GLU 64 HA GLU 64 8.654 9.849 4.858
507 HB2 GLU 64 2HB GLU 64 10.281 10.764 6.490
508 HB3 GLU 64 1HB GLU 64 8.770 10.276 7.258
509 HG2 GLU 64 2HG GLU 64 9.824 8.095 7.854
510 HG3 GLU 64 1HG GLU 64 11.345 8.679 7.183
511 H ALA 65 H ALA 65 10.013 6.841 4.882
512 HA ALA 65 HA ALA 65 12.703 7.512 4.095
513 HB1 ALA 65 1HB ALA 65 12.329 5.380 5.160
514 HB2 ALA 65 2HB ALA 65 12.818 5.078 3.493
515 HB3 ALA 65 3HB ALA 65 11.122 4.938 3.954
516 H LEU 66 H LEU 66 11.483 9.107 2.491
517 HA LEU 66 HA LEU 66 10.526 7.975 0.043
518 HB2 LEU 66 2HB LEU 66 11.631 10.763 0.338
519 HB3 LEU 66 1HB LEU 66 10.349 10.194 -0.733
520 HG LEU 66 HG LEU 66 10.212 10.390 2.290
521 HD11 LEU 66 1HD1 LEU 66 9.984 12.547 1.148
522 HD12 LEU 66 2HD1 LEU 66 8.421 12.040 1.786
523 HD13 LEU 66 3HD1 LEU 66 8.770 11.867 0.066
524 HD21 LEU 66 3HD2 LEU 66 8.329 9.230 0.224
525 HD22 LEU 66 1HD2 LEU 66 7.758 9.773 1.803
526 HD23 LEU 66 2HD2 LEU 66 8.938 8.467 1.692
527 H ARG 67 H ARG 67 11.616 8.653 -2.083
528 HA ARG 67 HA ARG 67 14.464 8.914 -2.129
529 HB2 ARG 67 2HB ARG 67 14.261 6.532 -1.448
530 HB3 ARG 67 1HB ARG 67 13.335 6.219 -2.916
531 HG2 ARG 67 2HG ARG 67 15.222 6.899 -4.303
532 HG3 ARG 67 1HG ARG 67 16.147 7.350 -2.871
533 HD2 ARG 67 2HD ARG 67 16.134 5.030 -2.097
534 HD3 ARG 67 1HD ARG 67 15.133 4.557 -3.466
535 HE ARG 67 HE ARG 67 17.462 5.795 -4.454
536 HH11 ARG 67 1HH2 ARG 67 16.432 2.971 -2.740
537 HH12 ARG 67 2HH2 ARG 67 17.718 1.974 -3.333
538 HH21 ARG 67 1HH1 ARG 67 19.151 4.494 -5.236
539 HH22 ARG 67 2HH1 ARG 67 19.258 2.837 -4.747
540 H LYS 68 H LYS 68 15.261 9.266 -4.223
541 HA LYS 68 HA LYS 68 13.423 10.350 -6.079
542 HB2 LYS 68 2HB LYS 68 16.296 9.510 -6.536
543 HB3 LYS 68 1HB LYS 68 15.359 10.606 -7.552
544 HG2 LYS 68 2HG LYS 68 15.026 12.031 -5.451
545 HG3 LYS 68 1HG LYS 68 16.285 11.046 -4.708
546 HD2 LYS 68 2HD LYS 68 16.554 12.716 -7.225
547 HD3 LYS 68 1HD LYS 68 17.307 13.040 -5.662
548 HE2 LYS 68 2HE LYS 68 17.914 10.825 -7.615
549 HE3 LYS 68 1HE LYS 68 19.023 11.988 -6.891
550 HZ1 LYS 68 3HZ LYS 68 17.954 9.516 -5.800
551 HZ2 LYS 68 1HZ LYS 68 18.082 10.812 -4.714
552 HZ3 LYS 68 2HZ LYS 68 19.459 10.259 -5.541
553 H GLY 69 H GLY 69 11.957 8.472 -6.231
554 HA2 GLY 69 2HA GLY 69 12.757 6.039 -7.467
555 HA3 GLY 69 1HA GLY 69 11.103 6.631 -7.322
556 H HIS 70 H HIS 70 10.484 8.396 -8.869
557 HA HIS 70 HA HIS 70 10.975 7.573 -11.535
558 HB2 HIS 70 2HB HIS 70 9.675 9.572 -12.163
559 HB3 HIS 70 1HB HIS 70 8.888 8.674 -10.865
560 HD2 HIS 70 2HD HIS 70 11.595 10.407 -9.039
561 HE1 HIS 70 1HE HIS 70 8.523 13.299 -9.209
562 HE2 HIS 70 2HE HIS 70 10.716 12.675 -8.090
563 H SER 71 H SER 71 13.381 7.647 -11.387
564 HA SER 71 HA SER 71 14.378 9.933 -12.770
565 HB2 SER 71 2HB SER 71 14.394 10.984 -10.596
566 HB3 SER 71 1HB SER 71 15.184 9.585 -9.874
567 HG SER 71 HG SER 71 17.037 10.132 -10.809
568 H GLU 72 H GLU 72 15.652 8.945 -14.194
569 HA GLU 72 HA GLU 72 16.748 6.376 -13.898
570 HB2 GLU 72 2HB GLU 72 16.382 7.553 -16.073
571 HB3 GLU 72 1HB GLU 72 17.764 8.585 -15.701
572 HG2 GLU 72 2HG GLU 72 19.241 6.650 -15.610
573 HG3 GLU 72 1HG GLU 72 17.875 5.559 -15.841
574 H GLY 73 H GLY 73 17.863 6.215 -11.943
575 HA2 GLY 73 2HA GLY 73 20.628 6.718 -12.005
576 HA3 GLY 73 1HA GLY 73 19.865 7.974 -11.035
577 H GLY 74 H GLY 74 18.169 7.018 -9.428
578 HA2 GLY 74 2HA GLY 74 18.430 4.401 -8.426
579 HA3 GLY 74 1HA GLY 74 19.542 5.446 -7.544
580 H1 HOH 201 H2 HOH 77 6.514 8.868 -8.926
581 H2 HOH 201 H1 HOH 77 7.060 10.093 -8.223
Start of MODEL 10
1 H1 VAL 1 1H VAL 1 -0.319 11.928 -15.237
2 H2 VAL 1 2H VAL 1 0.447 10.628 -14.469
3 HA VAL 1 HA VAL 1 -1.910 10.554 -14.067
4 HB VAL 1 HB VAL 1 -1.814 10.705 -11.508
5 HG11 VAL 1 2HG1 VAL 1 -0.254 8.792 -11.364
6 HG12 VAL 1 3HG1 VAL 1 0.337 9.159 -12.985
7 HG13 VAL 1 1HG1 VAL 1 -1.334 8.643 -12.751
8 HG21 VAL 1 1HG2 VAL 1 1.048 11.456 -12.172
9 HG22 VAL 1 2HG2 VAL 1 0.487 10.969 -10.579
10 HG23 VAL 1 3HG2 VAL 1 -0.107 12.459 -11.304
11 H ASP 2 H ASP 2 -1.906 12.480 -11.375
12 HA ASP 2 HA ASP 2 -3.010 14.403 -10.801
13 HB2 ASP 2 2HB ASP 2 -2.486 15.437 -13.580
14 HB3 ASP 2 1HB ASP 2 -2.504 16.320 -12.053
15 H MET 3 H MET 3 -3.767 14.330 -14.283
16 HA MET 3 HA MET 3 -6.444 15.046 -14.035
17 HB2 MET 3 2HB MET 3 -5.117 14.987 -16.164
18 HB3 MET 3 1HB MET 3 -5.302 13.232 -16.171
19 HG2 MET 3 2HG MET 3 -7.727 13.442 -16.256
20 HG3 MET 3 1HG MET 3 -7.612 15.194 -16.103
21 HE1 MET 3 3HE MET 3 -9.289 13.949 -18.076
22 HE2 MET 3 1HE MET 3 -8.874 14.448 -19.721
23 HE3 MET 3 2HE MET 3 -9.024 15.652 -18.444
24 H SER 4 H SER 4 -4.959 11.828 -14.033
25 HA SER 4 HA SER 4 -7.285 10.276 -14.085
26 HB2 SER 4 2HB SER 4 -4.684 9.705 -12.649
27 HB3 SER 4 1HB SER 4 -5.922 8.515 -13.040
28 HG SER 4 HG SER 4 -4.508 10.142 -14.893
29 H ASN 5 H ASN 5 -5.433 11.422 -11.256
30 HA ASN 5 HA ASN 5 -6.022 11.639 -9.043
31 HB2 ASN 5 2HB ASN 5 -7.467 13.380 -10.071
32 HB3 ASN 5 1HB ASN 5 -8.753 12.186 -10.224
33 HD21 ASN 5 1HD2 ASN 5 -10.021 13.635 -8.723
34 HD22 ASN 5 2HD2 ASN 5 -9.731 13.538 -7.055
35 H VAL 6 H VAL 6 -5.739 9.098 -9.420
36 HA VAL 6 HA VAL 6 -8.102 7.820 -8.162
37 HB VAL 6 HB VAL 6 -7.964 7.155 -10.539
38 HG11 VAL 6 1HG1 VAL 6 -5.449 7.477 -10.654
39 HG12 VAL 6 2HG1 VAL 6 -6.043 5.994 -11.402
40 HG13 VAL 6 3HG1 VAL 6 -5.290 5.937 -9.807
41 HG21 VAL 6 3HG2 VAL 6 -7.061 4.898 -8.731
42 HG22 VAL 6 1HG2 VAL 6 -8.101 4.783 -10.151
43 HG23 VAL 6 2HG2 VAL 6 -8.690 5.573 -8.688
44 H VAL 7 H VAL 7 -7.614 6.034 -6.791
45 HA VAL 7 HA VAL 7 -4.824 5.506 -6.111
46 HB VAL 7 HB VAL 7 -6.769 6.714 -4.128
47 HG11 VAL 7 1HG1 VAL 7 -4.732 6.524 -2.600
48 HG12 VAL 7 2HG1 VAL 7 -4.049 5.430 -3.802
49 HG13 VAL 7 3HG1 VAL 7 -5.549 5.007 -2.978
50 HG21 VAL 7 3HG2 VAL 7 -4.822 8.371 -3.926
51 HG22 VAL 7 1HG2 VAL 7 -5.765 8.459 -5.413
52 HG23 VAL 7 2HG2 VAL 7 -4.195 7.656 -5.411
53 H LYS 8 H LYS 8 -4.566 3.642 -4.783
54 HA LYS 8 HA LYS 8 -6.850 1.782 -4.950
55 HB2 LYS 8 2HB LYS 8 -4.558 1.220 -5.919
56 HB3 LYS 8 1HB LYS 8 -3.993 1.113 -4.252
57 HG2 LYS 8 2HG LYS 8 -4.598 -1.109 -4.832
58 HG3 LYS 8 1HG LYS 8 -5.917 -0.504 -3.828
59 HD2 LYS 8 2HD LYS 8 -6.493 0.159 -6.604
60 HD3 LYS 8 1HD LYS 8 -6.088 -1.551 -6.506
61 HE2 LYS 8 2HE LYS 8 -7.752 -1.739 -4.607
62 HE3 LYS 8 1HE LYS 8 -8.250 -0.086 -4.967
63 HZ1 LYS 8 3HZ LYS 8 -8.713 -2.533 -6.461
64 HZ2 LYS 8 1HZ LYS 8 -8.335 -1.166 -7.391
65 HZ3 LYS 8 2HZ LYS 8 -9.669 -1.133 -6.338
66 H THR 9 H THR 9 -7.646 0.702 -3.173
67 HA THR 9 HA THR 9 -6.426 1.056 -0.554
68 HB THR 9 HB THR 9 -9.192 2.142 -1.131
69 HG1 THR 9 1HG THR 9 -8.115 3.883 -1.520
70 HG21 THR 9 3HG2 THR 9 -8.972 2.913 1.271
71 HG22 THR 9 1HG2 THR 9 -7.564 1.860 1.402
72 HG23 THR 9 2HG2 THR 9 -9.151 1.170 1.064
73 H TYR 10 H TYR 10 -6.411 -0.993 0.115
74 HA TYR 10 HA TYR 10 -8.780 -2.708 -0.366
75 HB2 TYR 10 2HB TYR 10 -5.914 -3.385 0.299
76 HB3 TYR 10 1HB TYR 10 -7.207 -4.569 0.223
77 HD1 TYR 10 2HD TYR 10 -8.705 -4.347 -2.019
78 HD2 TYR 10 1HD TYR 10 -4.602 -3.134 -1.611
79 HE1 TYR 10 2HE TYR 10 -8.410 -4.526 -4.473
80 HE2 TYR 10 1HE TYR 10 -4.309 -3.315 -4.068
81 HH TYR 10 HH TYR 10 -5.319 -4.435 -5.962
82 H ASP 11 H ASP 11 -10.108 -2.970 1.330
83 HA ASP 11 HA ASP 11 -9.276 -2.167 3.988
84 HB2 ASP 11 2HB ASP 11 -11.863 -3.233 2.855
85 HB3 ASP 11 1HB ASP 11 -11.630 -2.882 4.568
86 H LEU 12 H LEU 12 -7.721 -3.653 4.608
87 HA LEU 12 HA LEU 12 -7.985 -6.468 4.445
88 HB2 LEU 12 2HB LEU 12 -6.142 -4.523 5.611
89 HB3 LEU 12 1HB LEU 12 -6.323 -5.922 6.657
90 HG LEU 12 HG LEU 12 -5.656 -7.422 4.873
91 HD11 LEU 12 1HD1 LEU 12 -6.431 -6.673 2.824
92 HD12 LEU 12 2HD1 LEU 12 -4.757 -6.149 2.700
93 HD13 LEU 12 3HD1 LEU 12 -6.011 -4.991 3.157
94 HD21 LEU 12 3HD2 LEU 12 -3.739 -6.652 5.981
95 HD22 LEU 12 1HD2 LEU 12 -3.910 -5.009 5.360
96 HD23 LEU 12 2HD2 LEU 12 -3.350 -6.296 4.299
97 H GLN 13 H GLN 13 -8.425 -7.990 6.108
98 HA GLN 13 HA GLN 13 -10.688 -7.257 7.728
99 HB2 GLN 13 2HB GLN 13 -9.104 -9.810 7.403
100 HB3 GLN 13 1HB GLN 13 -10.465 -9.664 8.520
101 HG2 GLN 13 2HG GLN 13 -11.975 -9.119 6.719
102 HG3 GLN 13 1HG GLN 13 -10.642 -9.004 5.569
103 HE21 GLN 13 1HE2 GLN 13 -9.181 -11.349 6.335
104 HE22 GLN 13 2HE2 GLN 13 -10.131 -12.712 5.961
105 H ASP 14 H ASP 14 -7.319 -7.187 8.163
106 HA ASP 14 HA ASP 14 -7.337 -7.624 11.031
107 HB2 ASP 14 2HB ASP 14 -5.167 -6.493 9.246
108 HB3 ASP 14 1HB ASP 14 -4.969 -7.041 10.912
109 H GLY 15 H GLY 15 -8.755 -5.315 9.425
110 HA2 GLY 15 2HA GLY 15 -9.551 -3.263 10.192
111 HA3 GLY 15 1HA GLY 15 -8.388 -3.333 11.516
112 H SER 16 H SER 16 -6.366 -4.036 9.260
113 HA SER 16 HA SER 16 -5.521 -1.275 8.814
114 HB2 SER 16 2HB SER 16 -3.798 -2.795 9.516
115 HB3 SER 16 1HB SER 16 -4.235 -3.959 8.268
116 HG SER 16 HG SER 16 -3.454 -2.594 6.729
117 H LYS 17 H LYS 17 -4.221 -1.365 6.441
118 HA LYS 17 HA LYS 17 -5.836 -2.479 4.344
119 HB2 LYS 17 2HB LYS 17 -6.529 -0.299 3.370
120 HB3 LYS 17 1HB LYS 17 -7.292 -0.622 4.927
121 HG2 LYS 17 2HG LYS 17 -5.622 0.785 6.055
122 HG3 LYS 17 1HG LYS 17 -4.823 1.088 4.515
123 HD2 LYS 17 2HD LYS 17 -6.261 2.981 5.018
124 HD3 LYS 17 1HD LYS 17 -6.947 2.096 3.658
125 HE2 LYS 17 2HE LYS 17 -8.704 1.228 4.939
126 HE3 LYS 17 1HE LYS 17 -7.830 1.424 6.458
127 HZ1 LYS 17 3HZ LYS 17 -8.710 3.710 4.792
128 HZ2 LYS 17 1HZ LYS 17 -8.140 3.747 6.389
129 HZ3 LYS 17 2HZ LYS 17 -9.655 3.060 6.044
130 H VAL 18 H VAL 18 -4.845 -2.364 2.334
131 HA VAL 18 HA VAL 18 -2.037 -1.462 2.388
132 HB VAL 18 HB VAL 18 -2.974 -2.969 0.004
133 HG11 VAL 18 1HG1 VAL 18 -0.599 -2.484 0.521
134 HG12 VAL 18 2HG1 VAL 18 -0.915 -4.212 0.392
135 HG13 VAL 18 3HG1 VAL 18 -0.735 -3.466 1.979
136 HG21 VAL 18 3HG2 VAL 18 -3.187 -5.120 1.091
137 HG22 VAL 18 1HG2 VAL 18 -4.355 -4.028 1.822
138 HG23 VAL 18 2HG2 VAL 18 -2.859 -4.403 2.671
139 H HIS 19 H HIS 19 -1.172 -0.305 0.557
140 HA HIS 19 HA HIS 19 -3.103 1.008 -1.227
141 HB2 HIS 19 2HB HIS 19 -2.758 3.156 -0.479
142 HB3 HIS 19 1HB HIS 19 -2.417 2.333 1.036
143 HD1 HIS 19 1HD HIS 19 -0.973 4.664 -1.323
144 HD2 HIS 19 2HD HIS 19 0.564 1.828 1.321
145 HE1 HIS 19 1HE HIS 19 1.471 5.238 -0.996
146 HE2 HIS 19 2HE HIS 19 2.420 3.517 0.612
147 H VAL 20 H VAL 20 -2.346 0.699 -3.237
148 HA VAL 20 HA VAL 20 0.467 0.086 -3.601
149 HB VAL 20 HB VAL 20 -0.050 -0.840 -5.662
150 HG11 VAL 20 1HG1 VAL 20 -2.461 -1.829 -5.470
151 HG12 VAL 20 2HG1 VAL 20 -2.484 -1.056 -3.892
152 HG13 VAL 20 3HG1 VAL 20 -1.265 -2.264 -4.262
153 HG21 VAL 20 3HG2 VAL 20 -2.272 -0.166 -6.853
154 HG22 VAL 20 1HG2 VAL 20 -0.905 0.946 -6.906
155 HG23 VAL 20 2HG2 VAL 20 -2.228 1.234 -5.779
156 H PHE 21 H PHE 21 1.793 1.059 -5.209
157 HA PHE 21 HA PHE 21 1.404 3.975 -5.346
158 HB2 PHE 21 2HB PHE 21 3.828 2.238 -5.876
159 HB3 PHE 21 1HB PHE 21 3.806 3.997 -5.963
160 HD1 PHE 21 2HD PHE 21 3.419 5.357 -3.920
161 HD2 PHE 21 1HD PHE 21 3.807 1.082 -3.761
162 HE1 PHE 21 2HE PHE 21 3.783 5.481 -1.469
163 HE2 PHE 21 1HE PHE 21 4.170 1.206 -1.310
164 HZ PHE 21 HZ PHE 21 4.158 3.405 -0.165
165 H LYS 22 H LYS 22 3.068 4.480 -7.536
166 HA LYS 22 HA LYS 22 1.229 4.014 -9.704
167 HB2 LYS 22 2HB LYS 22 2.814 5.363 -11.022
168 HB3 LYS 22 1HB LYS 22 2.409 6.152 -9.496
169 HG2 LYS 22 2HG LYS 22 4.485 5.175 -8.498
170 HG3 LYS 22 1HG LYS 22 4.909 4.547 -10.090
171 HD2 LYS 22 2HD LYS 22 4.814 6.879 -10.987
172 HD3 LYS 22 1HD LYS 22 4.536 7.461 -9.345
173 HE2 LYS 22 2HE LYS 22 6.918 5.745 -10.063
174 HE3 LYS 22 1HE LYS 22 6.963 7.505 -10.159
175 HZ1 LYS 22 3HZ LYS 22 6.951 5.783 -7.841
176 HZ2 LYS 22 1HZ LYS 22 5.899 7.107 -7.731
177 HZ3 LYS 22 2HZ LYS 22 7.553 7.362 -8.021
178 H ASP 23 H ASP 23 4.117 2.533 -8.515
179 HA ASP 23 HA ASP 23 4.794 1.210 -11.003
180 HB2 ASP 23 2HB ASP 23 6.530 1.815 -9.352
181 HB3 ASP 23 1HB ASP 23 5.795 0.708 -8.191
182 H GLY 24 H GLY 24 2.222 0.819 -9.126
183 HA2 GLY 24 2HA GLY 24 0.664 -0.899 -9.065
184 HA3 GLY 24 1HA GLY 24 1.802 -1.913 -9.948
185 H LYS 25 H LYS 25 3.765 -0.942 -7.686
186 HA LYS 25 HA LYS 25 3.668 -3.327 -6.136
187 HB2 LYS 25 2HB LYS 25 5.106 -0.683 -5.844
188 HB3 LYS 25 1HB LYS 25 5.317 -1.983 -4.683
189 HG2 LYS 25 2HG LYS 25 5.636 -2.600 -7.610
190 HG3 LYS 25 1HG LYS 25 6.943 -1.769 -6.772
191 HD2 LYS 25 2HD LYS 25 7.247 -3.567 -5.240
192 HD3 LYS 25 1HD LYS 25 5.720 -4.319 -5.698
193 HE2 LYS 25 2HE LYS 25 7.573 -5.526 -6.741
194 HE3 LYS 25 1HE LYS 25 6.626 -4.707 -7.982
195 HZ1 LYS 25 3HZ LYS 25 8.325 -3.384 -8.505
196 HZ2 LYS 25 1HZ LYS 25 9.300 -4.494 -7.671
197 HZ3 LYS 25 2HZ LYS 25 8.740 -3.096 -6.883
198 H MET 26 H MET 26 2.947 -3.669 -4.044
199 HA MET 26 HA MET 26 0.743 -2.040 -3.161
200 HB2 MET 26 2HB MET 26 1.907 -4.672 -2.366
201 HB3 MET 26 1HB MET 26 0.916 -3.823 -1.182
202 HG2 MET 26 2HG MET 26 -0.973 -3.818 -2.595
203 HG3 MET 26 1HG MET 26 -0.016 -4.224 -4.022
204 HE1 MET 26 3HE MET 26 0.074 -6.710 -4.920
205 HE2 MET 26 1HE MET 26 -1.485 -5.886 -4.768
206 HE3 MET 26 2HE MET 26 -1.336 -7.586 -4.326
207 H GLY 27 H GLY 27 0.634 -1.830 -0.620
208 HA2 GLY 27 2HA GLY 27 3.134 -0.977 0.605
209 HA3 GLY 27 1HA GLY 27 2.002 0.324 0.245
210 H MET 28 H MET 28 2.925 -1.945 2.526
211 HA MET 28 HA MET 28 0.354 -2.388 3.754
212 HB2 MET 28 2HB MET 28 2.380 -3.946 3.841
213 HB3 MET 28 1HB MET 28 3.057 -2.827 5.016
214 HG2 MET 28 2HG MET 28 1.916 -4.584 6.219
215 HG3 MET 28 1HG MET 28 0.996 -3.098 6.393
216 HE1 MET 28 3HE MET 28 -1.896 -5.342 6.513
217 HE2 MET 28 1HE MET 28 -1.780 -3.584 6.378
218 HE3 MET 28 2HE MET 28 -0.613 -4.478 7.351
219 H GLU 29 H GLU 29 -0.599 -1.245 5.325
220 HA GLU 29 HA GLU 29 0.897 0.586 7.012
221 HB2 GLU 29 2HB GLU 29 -0.602 2.519 6.405
222 HB3 GLU 29 1HB GLU 29 0.553 2.066 5.153
223 HG2 GLU 29 2HG GLU 29 -1.257 0.670 4.093
224 HG3 GLU 29 1HG GLU 29 -2.387 1.343 5.265
225 H ASN 30 H ASN 30 0.025 0.562 8.988
226 HA ASN 30 HA ASN 30 -2.361 -0.940 9.480
227 HB2 ASN 30 2HB ASN 30 -1.818 -0.781 11.742
228 HB3 ASN 30 1HB ASN 30 -0.241 -0.647 10.971
229 HD21 ASN 30 1HD2 ASN 30 -0.999 2.210 10.073
230 HD22 ASN 30 2HD2 ASN 30 -0.781 3.142 11.480
231 H LYS 31 H LYS 31 -3.548 0.485 11.577
232 HA LYS 31 HA LYS 31 -5.237 2.283 10.063
233 HB2 LYS 31 2HB LYS 31 -6.150 0.667 11.709
234 HB3 LYS 31 1HB LYS 31 -5.322 1.539 12.997
235 HG2 LYS 31 2HG LYS 31 -7.045 3.220 11.219
236 HG3 LYS 31 1HG LYS 31 -7.906 2.061 12.229
237 HD2 LYS 31 2HD LYS 31 -6.689 2.968 14.225
238 HD3 LYS 31 1HD LYS 31 -5.981 4.204 13.186
239 HE2 LYS 31 2HE LYS 31 -8.257 4.972 12.574
240 HE3 LYS 31 1HE LYS 31 -8.942 3.767 13.665
241 HZ1 LYS 31 3HZ LYS 31 -7.027 5.150 15.109
242 HZ2 LYS 31 1HZ LYS 31 -8.712 5.226 15.295
243 HZ3 LYS 31 2HZ LYS 31 -7.919 6.328 14.271
244 H PHE 32 H PHE 32 -2.719 2.538 12.494
245 HA PHE 32 HA PHE 32 -3.235 5.331 13.045
246 HB2 PHE 32 2HB PHE 32 -0.963 3.481 13.788
247 HB3 PHE 32 1HB PHE 32 -1.056 5.171 14.293
248 HD1 PHE 32 2HD PHE 32 -2.746 1.868 14.495
249 HD2 PHE 32 1HD PHE 32 -2.544 5.875 16.031
250 HE1 PHE 32 2HE PHE 32 -4.252 1.229 16.357
251 HE2 PHE 32 1HE PHE 32 -4.051 5.236 17.895
252 HZ PHE 32 HZ PHE 32 -4.905 2.913 18.058
253 H GLY 33 H GLY 33 -2.411 4.140 10.278
254 HA2 GLY 33 2HA GLY 33 -1.346 4.999 8.424
255 HA3 GLY 33 1HA GLY 33 -1.015 6.450 9.370
256 H LYS 34 H LYS 34 0.114 3.872 11.111
257 HA LYS 34 HA LYS 34 2.872 4.500 10.481
258 HB2 LYS 34 2HB LYS 34 1.826 2.378 12.365
259 HB3 LYS 34 1HB LYS 34 3.430 3.110 12.360
260 HG2 LYS 34 2HG LYS 34 0.853 4.633 12.855
261 HG3 LYS 34 1HG LYS 34 1.929 4.055 14.125
262 HD2 LYS 34 2HD LYS 34 3.784 5.366 12.863
263 HD3 LYS 34 1HD LYS 34 2.451 6.177 12.041
264 HE2 LYS 34 2HE LYS 34 1.524 6.893 14.194
265 HE3 LYS 34 1HE LYS 34 2.807 6.037 15.050
266 HZ1 LYS 34 3HZ LYS 34 3.982 7.894 14.885
267 HZ2 LYS 34 1HZ LYS 34 2.863 8.606 13.832
268 HZ3 LYS 34 2HZ LYS 34 4.095 7.615 13.214
269 H SER 35 H SER 35 4.031 3.498 8.985
270 HA SER 35 HA SER 35 3.072 1.358 7.424
271 HB2 SER 35 2HB SER 35 5.170 1.413 6.331
272 HB3 SER 35 1HB SER 35 4.882 3.073 6.843
273 HG SER 35 HG SER 35 6.058 1.739 8.831
274 H MET 36 H MET 36 3.118 -0.786 7.689
275 HA MET 36 HA MET 36 4.759 -1.917 9.896
276 HB2 MET 36 2HB MET 36 1.996 -2.620 8.897
277 HB3 MET 36 1HB MET 36 2.963 -3.770 9.823
278 HG2 MET 36 2HG MET 36 3.202 -2.014 11.615
279 HG3 MET 36 1HG MET 36 2.063 -1.014 10.711
280 HE1 MET 36 3HE MET 36 0.932 -0.958 13.028
281 HE2 MET 36 1HE MET 36 1.804 -2.274 13.826
282 HE3 MET 36 2HE MET 36 0.043 -2.282 13.775
283 H ASN 37 H ASN 37 6.455 -2.940 9.077
284 HA ASN 37 HA ASN 37 6.720 -3.788 6.406
285 HB2 ASN 37 2HB ASN 37 8.609 -3.338 7.988
286 HB3 ASN 37 1HB ASN 37 8.232 -4.860 8.793
287 HD21 ASN 37 1HD2 ASN 37 7.783 -6.654 6.795
288 HD22 ASN 37 2HD2 ASN 37 9.110 -6.752 5.735
289 H MET 38 H MET 38 5.463 -5.278 5.491
290 HA MET 38 HA MET 38 4.794 -7.731 7.002
291 HB2 MET 38 2HB MET 38 2.798 -6.682 6.309
292 HB3 MET 38 1HB MET 38 3.437 -6.328 4.703
293 HG2 MET 38 2HG MET 38 3.334 -8.632 4.068
294 HG3 MET 38 1HG MET 38 3.113 -9.149 5.728
295 HE1 MET 38 3HE MET 38 1.156 -9.431 6.904
296 HE2 MET 38 1HE MET 38 -0.467 -8.820 6.543
297 HE3 MET 38 2HE MET 38 0.789 -7.719 7.110
298 HA PRO 39 HA PRO 39 7.953 -9.765 4.463
299 HB2 PRO 39 2HB PRO 39 6.012 -12.048 4.750
300 HB3 PRO 39 1HB PRO 39 7.781 -12.046 4.930
301 HG2 PRO 39 2HG PRO 39 6.188 -12.057 7.061
302 HG3 PRO 39 1HG PRO 39 7.697 -11.124 7.046
303 HD2 PRO 39 2HD PRO 39 4.883 -10.140 6.886
304 HD3 PRO 39 1HD PRO 39 6.326 -9.330 7.519
305 H GLU 40 H GLU 40 8.178 -10.208 2.276
306 HA GLU 40 HA GLU 40 6.017 -9.452 0.551
307 HB2 GLU 40 2HB GLU 40 8.450 -8.984 0.099
308 HB3 GLU 40 1HB GLU 40 8.665 -10.712 -0.200
309 HG2 GLU 40 2HG GLU 40 6.932 -10.605 -1.963
310 HG3 GLU 40 1HG GLU 40 6.782 -8.867 -1.698
311 H GLY 41 H GLY 41 4.491 -11.128 1.281
312 HA2 GLY 41 2HA GLY 41 4.027 -13.120 -0.535
313 HA3 GLY 41 1HA GLY 41 5.033 -13.890 0.689
314 H LYS 42 H LYS 42 3.728 -11.902 2.688
315 HA LYS 42 HA LYS 42 1.874 -13.689 3.773
316 HB2 LYS 42 2HB LYS 42 2.940 -11.160 4.494
317 HB3 LYS 42 1HB LYS 42 1.201 -10.933 4.484
318 HG2 LYS 42 2HG LYS 42 1.618 -11.659 6.677
319 HG3 LYS 42 1HG LYS 42 1.130 -13.148 5.875
320 HD2 LYS 42 2HD LYS 42 3.677 -13.450 5.410
321 HD3 LYS 42 1HD LYS 42 3.885 -12.233 6.668
322 HE2 LYS 42 2HE LYS 42 3.987 -14.520 7.609
323 HE3 LYS 42 1HE LYS 42 2.611 -13.623 8.248
324 HZ1 LYS 42 3HZ LYS 42 2.205 -15.198 5.819
325 HZ2 LYS 42 1HZ LYS 42 1.132 -14.877 7.093
326 HZ3 LYS 42 2HZ LYS 42 2.355 -16.040 7.286
327 H VAL 43 H VAL 43 -0.185 -14.146 3.336
328 HA VAL 43 HA VAL 43 -1.476 -12.830 1.085
329 HB VAL 43 HB VAL 43 -2.523 -15.068 2.829
330 HG11 VAL 43 1HG1 VAL 43 -3.855 -15.558 0.771
331 HG12 VAL 43 2HG1 VAL 43 -3.208 -14.090 0.040
332 HG13 VAL 43 3HG1 VAL 43 -4.236 -13.986 1.469
333 HG21 VAL 43 3HG2 VAL 43 -0.452 -15.855 1.935
334 HG22 VAL 43 1HG2 VAL 43 -0.743 -15.072 0.382
335 HG23 VAL 43 2HG2 VAL 43 -1.696 -16.479 0.850
336 H MET 44 H MET 44 -2.671 -11.049 1.367
337 HA MET 44 HA MET 44 -3.984 -10.590 3.983
338 HB2 MET 44 2HB MET 44 -3.712 -8.611 1.726
339 HB3 MET 44 1HB MET 44 -4.082 -8.287 3.402
340 HG2 MET 44 2HG MET 44 -1.845 -8.813 4.080
341 HG3 MET 44 1HG MET 44 -1.452 -9.474 2.494
342 HE1 MET 44 3HE MET 44 -2.551 -7.225 0.309
343 HE2 MET 44 1HE MET 44 -1.221 -8.378 0.467
344 HE3 MET 44 2HE MET 44 -0.887 -6.675 0.177
345 H GLU 45 H GLU 45 -6.201 -10.451 4.111
346 HA GLU 45 HA GLU 45 -7.731 -10.920 1.600
347 HB2 GLU 45 2HB GLU 45 -7.645 -12.896 3.119
348 HB3 GLU 45 1HB GLU 45 -8.405 -11.917 4.378
349 HG2 GLU 45 2HG GLU 45 -10.381 -11.589 3.028
350 HG3 GLU 45 1HG GLU 45 -9.612 -12.356 1.634
351 H THR 46 H THR 46 -9.077 -9.331 1.094
352 HA THR 46 HA THR 46 -9.660 -7.227 2.987
353 HB THR 46 HB THR 46 -10.701 -6.100 1.160
354 HG1 THR 46 1HG THR 46 -11.889 -7.951 0.443
355 HG21 THR 46 3HG2 THR 46 -8.919 -6.057 -0.427
356 HG22 THR 46 1HG2 THR 46 -8.484 -7.732 -0.084
357 HG23 THR 46 2HG2 THR 46 -8.183 -6.480 1.120
358 H ARG 47 H ARG 47 -11.891 -6.466 3.364
359 HA ARG 47 HA ARG 47 -13.490 -8.382 4.589
360 HB2 ARG 47 2HB ARG 47 -14.378 -5.732 3.420
361 HB3 ARG 47 1HB ARG 47 -15.236 -6.666 4.649
362 HG2 ARG 47 2HG ARG 47 -13.349 -6.428 6.190
363 HG3 ARG 47 1HG ARG 47 -12.430 -5.560 4.959
364 HD2 ARG 47 2HD ARG 47 -14.200 -3.811 4.915
365 HD3 ARG 47 1HD ARG 47 -15.042 -4.659 6.209
366 HE ARG 47 HE ARG 47 -12.739 -2.969 6.494
367 HH11 ARG 47 1HH2 ARG 47 -14.380 -5.761 7.710
368 HH12 ARG 47 2HH2 ARG 47 -13.732 -5.617 9.310
369 HH21 ARG 47 1HH1 ARG 47 -11.885 -2.773 8.590
370 HH22 ARG 47 2HH1 ARG 47 -12.320 -3.925 9.808
371 H ASP 48 H ASP 48 -13.596 -7.115 1.294
372 HA ASP 48 HA ASP 48 -16.017 -8.430 0.548
373 HB2 ASP 48 2HB ASP 48 -15.146 -6.489 -0.687
374 HB3 ASP 48 1HB ASP 48 -13.738 -7.434 -1.180
375 H GLY 49 H GLY 49 -13.038 -9.640 1.354
376 HA2 GLY 49 2HA GLY 49 -12.324 -11.853 1.338
377 HA3 GLY 49 1HA GLY 49 -13.675 -12.254 0.279
378 H THR 50 H THR 50 -11.419 -9.649 -0.403
379 HA THR 50 HA THR 50 -10.670 -10.967 -2.909
380 HB THR 50 HB THR 50 -9.830 -8.236 -1.925
381 HG1 THR 50 1HG THR 50 -11.666 -7.803 -3.559
382 HG21 THR 50 3HG2 THR 50 -8.550 -9.112 -3.810
383 HG22 THR 50 1HG2 THR 50 -9.615 -7.820 -4.364
384 HG23 THR 50 2HG2 THR 50 -10.040 -9.505 -4.668
385 H LYS 51 H LYS 51 -8.959 -12.263 -2.946
386 HA LYS 51 HA LYS 51 -6.971 -12.235 -0.864
387 HB2 LYS 51 2HB LYS 51 -7.746 -14.308 -2.056
388 HB3 LYS 51 1HB LYS 51 -6.899 -13.728 -3.492
389 HG2 LYS 51 2HG LYS 51 -4.776 -13.700 -2.270
390 HG3 LYS 51 1HG LYS 51 -5.601 -14.179 -0.788
391 HD2 LYS 51 2HD LYS 51 -4.782 -16.233 -1.559
392 HD3 LYS 51 1HD LYS 51 -6.419 -16.236 -2.209
393 HE2 LYS 51 2HE LYS 51 -4.758 -16.913 -3.917
394 HE3 LYS 51 1HE LYS 51 -5.573 -15.419 -4.375
395 HZ1 LYS 51 3HZ LYS 51 -3.163 -15.107 -2.791
396 HZ2 LYS 51 1HZ LYS 51 -3.706 -14.219 -4.130
397 HZ3 LYS 51 2HZ LYS 51 -2.931 -15.712 -4.362
398 H ILE 52 H ILE 52 -5.361 -10.849 -0.775
399 HA ILE 52 HA ILE 52 -3.953 -10.073 -3.256
400 HB ILE 52 HB ILE 52 -3.709 -7.757 -2.021
401 HG12 ILE 52 2HG1 ILE 52 -6.433 -8.581 -0.992
402 HG13 ILE 52 1HG1 ILE 52 -4.995 -8.755 -0.011
403 HG21 ILE 52 1HG2 ILE 52 -4.871 -8.135 -4.187
404 HG22 ILE 52 2HG2 ILE 52 -5.666 -6.914 -3.191
405 HG23 ILE 52 3HG2 ILE 52 -6.338 -8.542 -3.293
406 HD11 ILE 52 3HD1 ILE 52 -5.926 -6.624 0.545
407 HD12 ILE 52 1HD1 ILE 52 -6.157 -6.219 -1.151
408 HD13 ILE 52 2HD1 ILE 52 -4.532 -6.286 -0.474
409 H ILE 53 H ILE 53 -1.925 -10.679 -3.057
410 HA ILE 53 HA ILE 53 -0.754 -11.215 -0.442
411 HB ILE 53 HB ILE 53 0.465 -11.510 -3.197
412 HG12 ILE 53 2HG1 ILE 53 -0.864 -13.607 -1.450
413 HG13 ILE 53 1HG1 ILE 53 -1.647 -12.835 -2.831
414 HG21 ILE 53 1HG2 ILE 53 2.115 -11.449 -1.390
415 HG22 ILE 53 2HG2 ILE 53 1.964 -13.097 -1.998
416 HG23 ILE 53 3HG2 ILE 53 1.193 -12.644 -0.477
417 HD11 ILE 53 3HD1 ILE 53 0.899 -14.481 -2.904
418 HD12 ILE 53 1HD1 ILE 53 0.208 -13.638 -4.290
419 HD13 ILE 53 2HD1 ILE 53 -0.676 -14.965 -3.534
420 H MET 54 H MET 54 1.022 -10.186 0.431
421 HA MET 54 HA MET 54 1.308 -7.421 -0.135
422 HB2 MET 54 2HB MET 54 1.744 -8.551 2.093
423 HB3 MET 54 1HB MET 54 3.266 -9.131 1.411
424 HG2 MET 54 2HG MET 54 3.815 -7.087 2.525
425 HG3 MET 54 1HG MET 54 3.765 -6.699 0.816
426 HE1 MET 54 3HE MET 54 3.603 -4.107 1.635
427 HE2 MET 54 1HE MET 54 2.016 -3.519 1.125
428 HE3 MET 54 2HE MET 54 2.905 -4.648 0.110
429 H LYS 55 H LYS 55 1.787 -7.397 -2.396
430 HA LYS 55 HA LYS 55 4.162 -8.601 -3.457
431 HB2 LYS 55 2HB LYS 55 2.090 -7.896 -4.771
432 HB3 LYS 55 1HB LYS 55 2.671 -6.239 -4.613
433 HG2 LYS 55 2HG LYS 55 4.866 -7.028 -5.600
434 HG3 LYS 55 1HG LYS 55 4.070 -8.556 -5.969
435 HD2 LYS 55 2HD LYS 55 3.084 -5.845 -6.906
436 HD3 LYS 55 1HD LYS 55 4.046 -6.948 -7.890
437 HE2 LYS 55 2HE LYS 55 2.205 -8.699 -7.368
438 HE3 LYS 55 1HE LYS 55 1.233 -7.316 -6.869
439 HZ1 LYS 55 3HZ LYS 55 2.441 -7.801 -9.531
440 HZ2 LYS 55 1HZ LYS 55 1.756 -6.319 -9.075
441 HZ3 LYS 55 2HZ LYS 55 0.789 -7.714 -9.144
442 H GLY 56 H GLY 56 3.323 -5.171 -3.240
443 HA2 GLY 56 2HA GLY 56 6.009 -4.265 -3.376
444 HA3 GLY 56 1HA GLY 56 4.603 -3.296 -2.971
445 H ASN 57 H ASN 57 6.608 -5.863 -1.472
446 HA ASN 57 HA ASN 57 5.932 -5.174 1.184
447 HB2 ASN 57 2HB ASN 57 6.947 -7.313 0.730
448 HB3 ASN 57 1HB ASN 57 8.387 -6.544 0.062
449 HD21 ASN 57 1HD2 ASN 57 6.623 -5.558 3.025
450 HD22 ASN 57 2HD2 ASN 57 7.925 -5.853 4.081
451 H GLU 58 H GLU 58 7.578 -3.421 -1.106
452 HA GLU 58 HA GLU 58 9.531 -2.161 0.618
453 HB2 GLU 58 2HB GLU 58 8.523 -1.294 -2.102
454 HB3 GLU 58 1HB GLU 58 9.984 -0.729 -1.294
455 HG2 GLU 58 2HG GLU 58 10.973 -2.936 -1.399
456 HG3 GLU 58 1HG GLU 58 9.472 -3.625 -2.019
457 H ILE 59 H ILE 59 7.887 -1.650 2.289
458 HA ILE 59 HA ILE 59 5.862 0.300 1.780
459 HB ILE 59 HB ILE 59 5.793 0.443 4.290
460 HG12 ILE 59 2HG1 ILE 59 7.887 -1.745 4.142
461 HG13 ILE 59 1HG1 ILE 59 8.276 -0.065 4.525
462 HG21 ILE 59 1HG2 ILE 59 5.211 -2.052 4.541
463 HG22 ILE 59 2HG2 ILE 59 5.697 -2.216 2.854
464 HG23 ILE 59 3HG2 ILE 59 4.352 -1.159 3.286
465 HD11 ILE 59 3HD1 ILE 59 6.145 -1.545 6.067
466 HD12 ILE 59 1HD1 ILE 59 7.066 -0.118 6.546
467 HD13 ILE 59 2HD1 ILE 59 7.847 -1.697 6.499
468 H PHE 60 H PHE 60 9.226 0.510 2.079
469 HA PHE 60 HA PHE 60 9.691 2.865 3.459
470 HB2 PHE 60 2HB PHE 60 11.056 1.907 0.933
471 HB3 PHE 60 1HB PHE 60 11.693 3.119 2.044
472 HD1 PHE 60 1HD PHE 60 10.899 -0.454 1.592
473 HD2 PHE 60 2HD PHE 60 12.535 2.503 4.243
474 HE1 PHE 60 1HE PHE 60 11.849 -2.252 3.012
475 HE2 PHE 60 2HE PHE 60 13.484 0.705 5.664
476 HZ PHE 60 HZ PHE 60 13.140 -1.673 5.049
477 H ARG 61 H ARG 61 8.275 2.399 0.295
478 HA ARG 61 HA ARG 61 8.592 5.008 -0.728
479 HB2 ARG 61 2HB ARG 61 6.627 2.783 -1.235
480 HB3 ARG 61 1HB ARG 61 6.394 4.356 -1.997
481 HG2 ARG 61 2HG ARG 61 7.684 2.797 -3.442
482 HG3 ARG 61 1HG ARG 61 8.616 4.230 -3.012
483 HD2 ARG 61 2HD ARG 61 9.891 3.039 -1.391
484 HD3 ARG 61 1HD ARG 61 8.786 1.668 -1.421
485 HE ARG 61 HE ARG 61 9.740 1.873 -4.002
486 HH11 ARG 61 1HH2 ARG 61 11.073 1.535 -0.828
487 HH12 ARG 61 2HH2 ARG 61 12.465 0.651 -1.355
488 HH21 ARG 61 1HH1 ARG 61 11.563 0.714 -4.702
489 HH22 ARG 61 2HH1 ARG 61 12.744 0.185 -3.550
490 H LEU 62 H LEU 62 5.872 3.561 1.094
491 HA LEU 62 HA LEU 62 4.183 5.743 1.177
492 HB2 LEU 62 2HB LEU 62 3.484 3.613 2.071
493 HB3 LEU 62 1HB LEU 62 4.746 3.659 3.299
494 HG LEU 62 HG LEU 62 3.682 5.522 4.422
495 HD11 LEU 62 1HD1 LEU 62 1.945 5.564 1.951
496 HD12 LEU 62 2HD1 LEU 62 2.834 6.894 2.692
497 HD13 LEU 62 3HD1 LEU 62 1.380 6.269 3.467
498 HD21 LEU 62 3HD2 LEU 62 1.466 4.493 4.958
499 HD22 LEU 62 1HD2 LEU 62 2.785 3.323 4.973
500 HD23 LEU 62 2HD2 LEU 62 1.686 3.393 3.597
501 H ASP 63 H ASP 63 6.778 4.943 3.490
502 HA ASP 63 HA ASP 63 6.489 7.466 4.876
503 HB2 ASP 63 2HB ASP 63 8.607 6.652 6.046
504 HB3 ASP 63 1HB ASP 63 7.173 5.643 6.233
505 H GLU 64 H GLU 64 7.305 9.319 4.164
506 HA GLU 64 HA GLU 64 8.572 10.829 2.979
507 HB2 GLU 64 2HB GLU 64 10.785 8.862 3.610
508 HB3 GLU 64 1HB GLU 64 10.981 10.567 3.202
509 HG2 GLU 64 2HG GLU 64 9.754 11.223 5.211
510 HG3 GLU 64 1HG GLU 64 9.446 9.533 5.603
511 H ALA 65 H ALA 65 7.408 10.205 1.015
512 HA ALA 65 HA ALA 65 8.399 8.264 -0.798
513 HB1 ALA 65 1HB ALA 65 6.787 10.758 -1.392
514 HB2 ALA 65 2HB ALA 65 6.111 9.202 -0.911
515 HB3 ALA 65 3HB ALA 65 6.964 9.357 -2.447
516 H LEU 66 H LEU 66 9.960 8.344 -2.313
517 HA LEU 66 HA LEU 66 11.904 10.432 -2.232
518 HB2 LEU 66 2HB LEU 66 11.500 8.010 -3.984
519 HB3 LEU 66 1HB LEU 66 12.795 9.163 -4.300
520 HG LEU 66 HG LEU 66 13.741 8.798 -2.100
521 HD11 LEU 66 1HD1 LEU 66 12.649 6.947 -0.667
522 HD12 LEU 66 2HD1 LEU 66 11.216 7.196 -1.664
523 HD13 LEU 66 3HD1 LEU 66 11.855 8.520 -0.689
524 HD21 LEU 66 3HD2 LEU 66 14.370 7.178 -3.835
525 HD22 LEU 66 1HD2 LEU 66 12.975 6.179 -3.433
526 HD23 LEU 66 2HD2 LEU 66 14.284 6.376 -2.267
527 H ARG 67 H ARG 67 10.762 12.345 -2.745
528 HA ARG 67 HA ARG 67 9.994 14.004 -4.135
529 HB2 ARG 67 2HB ARG 67 12.148 13.393 -5.303
530 HB3 ARG 67 1HB ARG 67 11.197 12.356 -6.367
531 HG2 ARG 67 2HG ARG 67 9.871 14.261 -7.110
532 HG3 ARG 67 1HG ARG 67 10.703 15.321 -5.972
533 HD2 ARG 67 2HD ARG 67 11.653 15.568 -8.227
534 HD3 ARG 67 1HD ARG 67 12.841 14.878 -7.123
535 HE ARG 67 HE ARG 67 11.444 12.779 -8.402
536 HH11 ARG 67 1HH2 ARG 67 13.701 15.326 -9.029
537 HH12 ARG 67 2HH2 ARG 67 14.481 14.500 -10.338
538 HH21 ARG 67 1HH1 ARG 67 12.461 11.690 -10.116
539 HH22 ARG 67 2HH1 ARG 67 13.779 12.441 -10.952
540 H LYS 68 H LYS 68 8.318 14.527 -5.634
541 HA LYS 68 HA LYS 68 6.123 12.770 -5.591
542 HB2 LYS 68 2HB LYS 68 6.288 15.378 -5.985
543 HB3 LYS 68 1HB LYS 68 6.350 14.922 -7.685
544 HG2 LYS 68 2HG LYS 68 4.181 14.045 -5.745
545 HG3 LYS 68 1HG LYS 68 4.027 15.382 -6.883
546 HD2 LYS 68 2HD LYS 68 4.649 13.672 -8.708
547 HD3 LYS 68 1HD LYS 68 4.316 12.439 -7.492
548 HE2 LYS 68 2HE LYS 68 2.375 14.576 -8.421
549 HE3 LYS 68 1HE LYS 68 2.310 12.866 -8.847
550 HZ1 LYS 68 3HZ LYS 68 1.590 14.188 -6.367
551 HZ2 LYS 68 1HZ LYS 68 2.422 12.721 -6.193
552 HZ3 LYS 68 2HZ LYS 68 0.967 12.772 -7.067
553 H GLY 69 H GLY 69 6.370 10.795 -6.499
554 HA2 GLY 69 2HA GLY 69 7.852 9.971 -8.638
555 HA3 GLY 69 1HA GLY 69 6.302 9.249 -8.219
556 H HIS 70 H HIS 70 6.947 9.195 -10.814
557 HA HIS 70 HA HIS 70 6.242 9.774 -12.921
558 HB2 HIS 70 2HB HIS 70 4.029 9.412 -11.865
559 HB3 HIS 70 1HB HIS 70 3.990 11.114 -11.406
560 HD2 HIS 70 2HD HIS 70 4.865 9.535 -14.968
561 HE1 HIS 70 1HE HIS 70 1.867 12.471 -15.433
562 HE2 HIS 70 2HE HIS 70 3.357 10.825 -16.664
563 H SER 71 H SER 71 7.983 11.144 -13.403
564 HA SER 71 HA SER 71 7.279 13.836 -14.015
565 HB2 SER 71 2HB SER 71 8.989 14.927 -12.555
566 HB3 SER 71 1HB SER 71 7.640 14.238 -11.657
567 HG SER 71 HG SER 71 9.069 12.305 -11.525
568 H GLU 72 H GLU 72 8.649 14.693 -15.526
569 HA GLU 72 HA GLU 72 10.411 12.951 -16.891
570 HB2 GLU 72 2HB GLU 72 10.214 15.968 -17.055
571 HB3 GLU 72 1HB GLU 72 10.990 14.917 -18.239
572 HG2 GLU 72 2HG GLU 72 8.074 14.709 -17.447
573 HG3 GLU 72 1HG GLU 72 8.650 15.579 -18.869
574 H GLY 73 H GLY 73 10.924 15.458 -14.471
575 HA2 GLY 73 2HA GLY 73 12.760 15.995 -13.194
576 HA3 GLY 73 1HA GLY 73 13.382 14.396 -13.587
577 H GLY 74 H GLY 74 13.360 17.772 -14.478
578 HA2 GLY 74 2HA GLY 74 15.972 17.741 -15.522
579 HA3 GLY 74 1HA GLY 74 14.838 17.659 -16.867
580 H1 HOH 201 H2 HOH 77 2.626 14.999 -12.860
581 H2 HOH 201 H1 HOH 77 3.420 13.827 -12.324
Start of MODEL 11
1 H1 VAL 1 1H VAL 1 -4.117 15.805 -1.123
2 H2 VAL 1 2H VAL 1 -4.034 17.316 -1.889
3 HA VAL 1 HA VAL 1 -2.270 17.124 -0.291
4 HB VAL 1 HB VAL 1 -2.748 19.141 1.036
5 HG11 VAL 1 2HG1 VAL 1 -3.958 19.291 -1.740
6 HG12 VAL 1 3HG1 VAL 1 -2.229 19.309 -1.394
7 HG13 VAL 1 1HG1 VAL 1 -3.252 20.628 -0.831
8 HG21 VAL 1 1HG2 VAL 1 -5.585 18.875 -0.000
9 HG22 VAL 1 2HG2 VAL 1 -4.962 20.163 1.021
10 HG23 VAL 1 3HG2 VAL 1 -5.102 18.527 1.657
11 H ASP 2 H ASP 2 -3.862 14.854 0.312
12 HA ASP 2 HA ASP 2 -3.513 14.785 3.226
13 HB2 ASP 2 2HB ASP 2 -6.042 13.641 2.063
14 HB3 ASP 2 1HB ASP 2 -5.695 14.112 3.726
15 H MET 3 H MET 3 -2.680 12.898 3.908
16 HA MET 3 HA MET 3 -1.604 11.029 2.142
17 HB2 MET 3 2HB MET 3 -2.324 10.728 5.065
18 HB3 MET 3 1HB MET 3 -1.336 9.581 4.161
19 HG2 MET 3 2HG MET 3 0.304 11.334 3.674
20 HG3 MET 3 1HG MET 3 -0.697 12.526 4.503
21 HE1 MET 3 3HE MET 3 2.100 12.341 7.057
22 HE2 MET 3 1HE MET 3 0.955 13.352 6.164
23 HE3 MET 3 2HE MET 3 2.170 12.414 5.298
24 H SER 4 H SER 4 -4.765 11.185 3.627
25 HA SER 4 HA SER 4 -5.622 8.543 3.290
26 HB2 SER 4 2HB SER 4 -6.887 10.279 4.530
27 HB3 SER 4 1HB SER 4 -7.275 11.065 3.002
28 HG SER 4 HG SER 4 -8.949 9.683 3.571
29 H ASN 5 H ASN 5 -5.059 11.044 0.968
30 HA ASN 5 HA ASN 5 -6.695 9.939 -1.121
31 HB2 ASN 5 2HB ASN 5 -6.034 12.335 -1.031
32 HB3 ASN 5 1HB ASN 5 -4.364 11.858 -1.333
33 HD21 ASN 5 1HD2 ASN 5 -7.615 11.191 -2.778
34 HD22 ASN 5 2HD2 ASN 5 -7.078 11.318 -4.383
35 H VAL 6 H VAL 6 -6.233 7.904 -1.750
36 HA VAL 6 HA VAL 6 -3.476 7.338 -2.689
37 HB VAL 6 HB VAL 6 -3.882 4.962 -1.944
38 HG11 VAL 6 1HG1 VAL 6 -3.438 5.487 0.476
39 HG12 VAL 6 2HG1 VAL 6 -3.806 7.176 0.125
40 HG13 VAL 6 3HG1 VAL 6 -2.424 6.397 -0.644
41 HG21 VAL 6 3HG2 VAL 6 -6.143 6.286 -0.412
42 HG22 VAL 6 1HG2 VAL 6 -5.614 4.615 -0.222
43 HG23 VAL 6 2HG2 VAL 6 -6.344 5.141 -1.739
44 H VAL 7 H VAL 7 -3.343 5.823 -4.420
45 HA VAL 7 HA VAL 7 -5.535 6.050 -6.279
46 HB VAL 7 HB VAL 7 -3.154 6.148 -6.988
47 HG11 VAL 7 1HG1 VAL 7 -3.142 3.168 -6.450
48 HG12 VAL 7 2HG1 VAL 7 -2.434 4.347 -5.346
49 HG13 VAL 7 3HG1 VAL 7 -1.790 4.168 -6.979
50 HG21 VAL 7 3HG2 VAL 7 -5.066 5.404 -8.496
51 HG22 VAL 7 1HG2 VAL 7 -4.568 3.744 -8.173
52 HG23 VAL 7 2HG2 VAL 7 -3.465 4.853 -8.989
53 H LYS 8 H LYS 8 -4.631 3.829 -3.856
54 HA LYS 8 HA LYS 8 -6.770 2.001 -4.679
55 HB2 LYS 8 2HB LYS 8 -4.528 1.183 -5.624
56 HB3 LYS 8 1HB LYS 8 -4.051 0.903 -3.954
57 HG2 LYS 8 2HG LYS 8 -5.072 -1.139 -4.096
58 HG3 LYS 8 1HG LYS 8 -6.610 -0.284 -4.116
59 HD2 LYS 8 2HD LYS 8 -4.984 -0.881 -6.610
60 HD3 LYS 8 1HD LYS 8 -6.302 -1.893 -6.028
61 HE2 LYS 8 2HE LYS 8 -7.386 -0.513 -7.583
62 HE3 LYS 8 1HE LYS 8 -7.696 0.331 -6.066
63 HZ1 LYS 8 3HZ LYS 8 -6.872 1.744 -7.938
64 HZ2 LYS 8 1HZ LYS 8 -5.385 0.939 -7.822
65 HZ3 LYS 8 2HZ LYS 8 -5.961 1.851 -6.508
66 H THR 9 H THR 9 -7.596 0.752 -2.978
67 HA THR 9 HA THR 9 -6.463 1.000 -0.310
68 HB THR 9 HB THR 9 -9.263 2.020 -0.812
69 HG1 THR 9 1HG THR 9 -8.142 4.063 -0.241
70 HG21 THR 9 3HG2 THR 9 -9.055 2.833 1.488
71 HG22 THR 9 1HG2 THR 9 -7.406 2.216 1.575
72 HG23 THR 9 2HG2 THR 9 -8.761 1.094 1.434
73 H TYR 10 H TYR 10 -6.481 -1.084 0.259
74 HA TYR 10 HA TYR 10 -8.869 -2.729 -0.356
75 HB2 TYR 10 2HB TYR 10 -5.977 -3.452 0.138
76 HB3 TYR 10 1HB TYR 10 -7.265 -4.647 0.201
77 HD1 TYR 10 2HD TYR 10 -8.999 -4.395 -1.912
78 HD2 TYR 10 1HD TYR 10 -4.837 -3.299 -1.905
79 HE1 TYR 10 2HE TYR 10 -8.937 -4.598 -4.377
80 HE2 TYR 10 1HE TYR 10 -4.785 -3.510 -4.371
81 HH TYR 10 HH TYR 10 -7.093 -5.078 -6.133
82 H ASP 11 H ASP 11 -10.237 -2.714 1.317
83 HA ASP 11 HA ASP 11 -9.495 -2.160 3.995
84 HB2 ASP 11 2HB ASP 11 -11.984 -3.350 2.776
85 HB3 ASP 11 1HB ASP 11 -11.815 -3.020 4.500
86 H LEU 12 H LEU 12 -7.891 -3.546 4.673
87 HA LEU 12 HA LEU 12 -8.072 -6.396 4.469
88 HB2 LEU 12 2HB LEU 12 -6.185 -4.403 5.461
89 HB3 LEU 12 1HB LEU 12 -6.280 -5.766 6.571
90 HG LEU 12 HG LEU 12 -5.729 -7.329 4.795
91 HD11 LEU 12 1HD1 LEU 12 -6.308 -4.994 3.038
92 HD12 LEU 12 2HD1 LEU 12 -6.574 -6.715 2.759
93 HD13 LEU 12 3HD1 LEU 12 -4.970 -6.031 2.541
94 HD21 LEU 12 3HD2 LEU 12 -3.484 -6.053 3.983
95 HD22 LEU 12 1HD2 LEU 12 -3.686 -6.667 5.623
96 HD23 LEU 12 2HD2 LEU 12 -3.961 -4.958 5.276
97 H GLN 13 H GLN 13 -8.182 -7.861 6.322
98 HA GLN 13 HA GLN 13 -10.454 -7.244 7.977
99 HB2 GLN 13 2HB GLN 13 -8.608 -9.628 7.791
100 HB3 GLN 13 1HB GLN 13 -9.937 -9.535 8.949
101 HG2 GLN 13 2HG GLN 13 -11.557 -9.295 7.167
102 HG3 GLN 13 1HG GLN 13 -10.275 -9.170 5.961
103 HE21 GLN 13 1HE2 GLN 13 -10.570 -11.475 8.710
104 HE22 GLN 13 2HE2 GLN 13 -10.550 -12.868 7.731
105 H ASP 14 H ASP 14 -7.061 -6.899 8.267
106 HA ASP 14 HA ASP 14 -6.975 -7.006 11.161
107 HB2 ASP 14 2HB ASP 14 -4.948 -6.060 9.121
108 HB3 ASP 14 1HB ASP 14 -4.643 -6.205 10.853
109 H GLY 15 H GLY 15 -8.599 -4.983 9.405
110 HA2 GLY 15 2HA GLY 15 -9.453 -2.883 9.884
111 HA3 GLY 15 1HA GLY 15 -8.350 -2.791 11.257
112 H SER 16 H SER 16 -6.272 -3.613 9.011
113 HA SER 16 HA SER 16 -5.359 -0.904 8.570
114 HB2 SER 16 2HB SER 16 -3.494 -2.098 7.334
115 HB3 SER 16 1HB SER 16 -3.668 -2.522 9.037
116 HG SER 16 HG SER 16 -4.180 -4.479 8.466
117 H LYS 17 H LYS 17 -4.315 -0.702 6.178
118 HA LYS 17 HA LYS 17 -6.191 -1.554 4.105
119 HB2 LYS 17 2HB LYS 17 -5.726 1.360 4.791
120 HB3 LYS 17 1HB LYS 17 -6.526 0.790 3.327
121 HG2 LYS 17 2HG LYS 17 -8.136 -0.468 4.850
122 HG3 LYS 17 1HG LYS 17 -7.444 0.447 6.185
123 HD2 LYS 17 2HD LYS 17 -8.684 1.685 3.710
124 HD3 LYS 17 1HD LYS 17 -9.501 1.516 5.263
125 HE2 LYS 17 2HE LYS 17 -7.476 2.792 6.250
126 HE3 LYS 17 1HE LYS 17 -7.115 3.232 4.580
127 HZ1 LYS 17 3HZ LYS 17 -8.468 4.929 5.499
128 HZ2 LYS 17 1HZ LYS 17 -9.594 3.812 6.099
129 HZ3 LYS 17 2HZ LYS 17 -9.445 4.048 4.422
130 H VAL 18 H VAL 18 -5.064 -2.064 2.344
131 HA VAL 18 HA VAL 18 -2.254 -1.377 2.187
132 HB VAL 18 HB VAL 18 -3.703 -2.723 -0.069
133 HG11 VAL 18 1HG1 VAL 18 -1.305 -2.304 -0.264
134 HG12 VAL 18 2HG1 VAL 18 -1.610 -4.037 -0.144
135 HG13 VAL 18 3HG1 VAL 18 -1.019 -3.146 1.260
136 HG21 VAL 18 3HG2 VAL 18 -2.950 -4.138 2.499
137 HG22 VAL 18 1HG2 VAL 18 -3.618 -4.883 1.043
138 HG23 VAL 18 2HG2 VAL 18 -4.603 -3.779 2.001
139 H HIS 19 H HIS 19 -1.276 -0.237 0.415
140 HA HIS 19 HA HIS 19 -3.048 1.282 -1.367
141 HB2 HIS 19 2HB HIS 19 -2.578 3.360 -0.524
142 HB3 HIS 19 1HB HIS 19 -2.210 2.477 0.952
143 HD1 HIS 19 1HD HIS 19 -0.693 4.558 -1.684
144 HD2 HIS 19 2HD HIS 19 0.679 2.047 1.351
145 HE1 HIS 19 1HE HIS 19 1.766 5.070 -1.387
146 HE2 HIS 19 2HE HIS 19 2.621 3.536 0.447
147 H VAL 20 H VAL 20 -2.300 0.902 -3.374
148 HA VAL 20 HA VAL 20 0.519 0.178 -3.702
149 HB VAL 20 HB VAL 20 -0.069 -1.019 -5.575
150 HG11 VAL 20 1HG1 VAL 20 -2.910 -0.984 -4.692
151 HG12 VAL 20 2HG1 VAL 20 -1.725 -1.436 -3.481
152 HG13 VAL 20 3HG1 VAL 20 -1.846 -2.352 -4.980
153 HG21 VAL 20 3HG2 VAL 20 -2.130 -0.428 -6.969
154 HG22 VAL 20 1HG2 VAL 20 -0.794 0.720 -7.028
155 HG23 VAL 20 2HG2 VAL 20 -2.210 1.065 -6.034
156 H PHE 21 H PHE 21 1.810 0.994 -5.397
157 HA PHE 21 HA PHE 21 1.433 3.884 -5.806
158 HB2 PHE 21 2HB PHE 21 3.829 2.061 -6.128
159 HB3 PHE 21 1HB PHE 21 3.840 3.784 -6.495
160 HD1 PHE 21 2HD PHE 21 3.516 1.265 -3.814
161 HD2 PHE 21 1HD PHE 21 3.788 5.450 -4.735
162 HE1 PHE 21 2HE PHE 21 3.907 1.764 -1.417
163 HE2 PHE 21 1HE PHE 21 4.180 5.952 -2.338
164 HZ PHE 21 HZ PHE 21 4.239 4.107 -0.679
165 H LYS 22 H LYS 22 2.999 4.273 -8.023
166 HA LYS 22 HA LYS 22 1.197 3.515 -10.143
167 HB2 LYS 22 2HB LYS 22 3.829 5.011 -10.206
168 HB3 LYS 22 1HB LYS 22 2.725 4.840 -11.570
169 HG2 LYS 22 2HG LYS 22 1.027 6.111 -10.496
170 HG3 LYS 22 1HG LYS 22 1.825 5.994 -8.927
171 HD2 LYS 22 2HD LYS 22 2.208 8.218 -9.848
172 HD3 LYS 22 1HD LYS 22 3.730 7.327 -9.840
173 HE2 LYS 22 2HE LYS 22 3.626 6.917 -12.179
174 HE3 LYS 22 1HE LYS 22 1.924 7.369 -12.264
175 HZ1 LYS 22 3HZ LYS 22 2.548 9.433 -12.692
176 HZ2 LYS 22 1HZ LYS 22 4.184 9.011 -12.547
177 HZ3 LYS 22 2HZ LYS 22 3.316 9.524 -11.179
178 H ASP 23 H ASP 23 4.094 2.271 -8.780
179 HA ASP 23 HA ASP 23 4.988 0.853 -11.129
180 HB2 ASP 23 2HB ASP 23 5.745 0.550 -8.213
181 HB3 ASP 23 1HB ASP 23 6.562 -0.239 -9.564
182 H GLY 24 H GLY 24 2.407 0.446 -9.092
183 HA2 GLY 24 2HA GLY 24 0.817 -1.273 -9.212
184 HA3 GLY 24 1HA GLY 24 2.018 -2.315 -9.965
185 H LYS 25 H LYS 25 3.889 -1.346 -7.665
186 HA LYS 25 HA LYS 25 3.555 -3.632 -5.988
187 HB2 LYS 25 2HB LYS 25 5.170 -1.083 -5.820
188 HB3 LYS 25 1HB LYS 25 5.167 -2.238 -4.494
189 HG2 LYS 25 2HG LYS 25 5.868 -4.026 -6.077
190 HG3 LYS 25 1HG LYS 25 5.945 -2.821 -7.363
191 HD2 LYS 25 2HD LYS 25 7.578 -1.526 -5.933
192 HD3 LYS 25 1HD LYS 25 7.613 -2.909 -4.838
193 HE2 LYS 25 2HE LYS 25 8.441 -4.357 -6.600
194 HE3 LYS 25 1HE LYS 25 8.257 -3.074 -7.795
195 HZ1 LYS 25 3HZ LYS 25 9.879 -2.488 -5.441
196 HZ2 LYS 25 1HZ LYS 25 10.078 -1.985 -7.048
197 HZ3 LYS 25 2HZ LYS 25 10.540 -3.553 -6.587
198 H MET 26 H MET 26 2.670 -3.806 -3.942
199 HA MET 26 HA MET 26 0.516 -1.997 -3.330
200 HB2 MET 26 2HB MET 26 1.487 -4.622 -2.293
201 HB3 MET 26 1HB MET 26 0.476 -3.653 -1.220
202 HG2 MET 26 2HG MET 26 -1.305 -3.589 -2.807
203 HG3 MET 26 1HG MET 26 -0.286 -4.247 -4.085
204 HE1 MET 26 3HE MET 26 -1.970 -5.763 -4.703
205 HE2 MET 26 1HE MET 26 -2.117 -7.401 -4.055
206 HE3 MET 26 2HE MET 26 -0.582 -6.849 -4.719
207 H GLY 27 H GLY 27 0.436 -1.916 -0.592
208 HA2 GLY 27 2HA GLY 27 2.918 -0.913 0.508
209 HA3 GLY 27 1HA GLY 27 1.758 0.360 0.140
210 H MET 28 H MET 28 2.805 -1.703 2.517
211 HA MET 28 HA MET 28 0.222 -2.155 3.781
212 HB2 MET 28 2HB MET 28 2.234 -3.757 3.795
213 HB3 MET 28 1HB MET 28 2.926 -2.681 5.000
214 HG2 MET 28 2HG MET 28 1.753 -4.408 6.186
215 HG3 MET 28 1HG MET 28 0.812 -2.929 6.324
216 HE1 MET 28 3HE MET 28 -1.960 -5.324 6.410
217 HE2 MET 28 1HE MET 28 -2.053 -3.571 6.196
218 HE3 MET 28 2HE MET 28 -0.814 -4.277 7.233
219 H GLU 29 H GLU 29 -0.485 -1.265 5.667
220 HA GLU 29 HA GLU 29 1.076 0.704 7.117
221 HB2 GLU 29 2HB GLU 29 0.061 1.942 5.147
222 HB3 GLU 29 1HB GLU 29 -1.521 1.576 5.833
223 HG2 GLU 29 2HG GLU 29 -0.689 2.632 7.995
224 HG3 GLU 29 1HG GLU 29 0.698 3.213 7.075
225 H ASN 30 H ASN 30 0.669 0.195 9.192
226 HA ASN 30 HA ASN 30 -1.463 -1.461 9.999
227 HB2 ASN 30 2HB ASN 30 -0.664 -1.214 12.194
228 HB3 ASN 30 1HB ASN 30 0.772 -0.994 11.199
229 HD21 ASN 30 1HD2 ASN 30 -0.438 1.788 10.430
230 HD22 ASN 30 2HD2 ASN 30 -0.015 2.762 11.760
231 H LYS 31 H LYS 31 -3.265 -0.974 11.377
232 HA LYS 31 HA LYS 31 -4.964 0.985 10.424
233 HB2 LYS 31 2HB LYS 31 -6.190 0.655 12.670
234 HB3 LYS 31 1HB LYS 31 -5.982 -0.752 11.628
235 HG2 LYS 31 2HG LYS 31 -5.436 -1.370 13.912
236 HG3 LYS 31 1HG LYS 31 -3.959 -1.390 12.954
237 HD2 LYS 31 2HD LYS 31 -3.104 0.522 13.979
238 HD3 LYS 31 1HD LYS 31 -4.698 1.137 14.412
239 HE2 LYS 31 2HE LYS 31 -4.912 -0.416 16.209
240 HE3 LYS 31 1HE LYS 31 -3.546 -1.375 15.639
241 HZ1 LYS 31 3HZ LYS 31 -2.173 -0.106 16.797
242 HZ2 LYS 31 1HZ LYS 31 -3.499 0.734 17.439
243 HZ3 LYS 31 2HZ LYS 31 -2.741 1.299 16.027
244 H PHE 32 H PHE 32 -2.201 1.537 12.201
245 HA PHE 32 HA PHE 32 -3.221 3.910 13.590
246 HB2 PHE 32 2HB PHE 32 -1.431 2.112 14.424
247 HB3 PHE 32 1HB PHE 32 -0.309 3.171 13.572
248 HD1 PHE 32 2HD PHE 32 -2.947 3.088 16.201
249 HD2 PHE 32 1HD PHE 32 0.344 5.267 14.504
250 HE1 PHE 32 2HE PHE 32 -2.993 4.657 18.122
251 HE2 PHE 32 1HE PHE 32 0.296 6.836 16.425
252 HZ PHE 32 HZ PHE 32 -1.372 6.531 18.235
253 H GLY 33 H GLY 33 -2.752 3.466 10.540
254 HA2 GLY 33 2HA GLY 33 -2.241 4.846 8.766
255 HA3 GLY 33 1HA GLY 33 -2.059 6.155 9.935
256 H LYS 34 H LYS 34 -0.151 3.677 10.949
257 HA LYS 34 HA LYS 34 2.282 4.949 9.903
258 HB2 LYS 34 2HB LYS 34 1.989 4.542 12.362
259 HB3 LYS 34 1HB LYS 34 2.004 2.812 12.028
260 HG2 LYS 34 2HG LYS 34 4.251 2.860 11.272
261 HG3 LYS 34 1HG LYS 34 4.245 4.613 11.095
262 HD2 LYS 34 2HD LYS 34 5.481 3.842 13.129
263 HD3 LYS 34 1HD LYS 34 4.128 4.909 13.506
264 HE2 LYS 34 2HE LYS 34 3.788 1.908 13.485
265 HE3 LYS 34 1HE LYS 34 4.376 2.753 14.915
266 HZ1 LYS 34 3HZ LYS 34 2.235 4.228 14.135
267 HZ2 LYS 34 1HZ LYS 34 2.243 3.082 15.385
268 HZ3 LYS 34 2HZ LYS 34 1.729 2.635 13.828
269 H SER 35 H SER 35 4.101 3.501 9.303
270 HA SER 35 HA SER 35 3.238 1.604 7.323
271 HB2 SER 35 2HB SER 35 5.534 1.468 6.708
272 HB3 SER 35 1HB SER 35 5.251 3.147 7.153
273 HG SER 35 HG SER 35 6.951 1.381 8.222
274 H MET 36 H MET 36 3.489 -0.614 7.310
275 HA MET 36 HA MET 36 4.380 -1.908 9.817
276 HB2 MET 36 2HB MET 36 1.770 -1.728 9.230
277 HB3 MET 36 1HB MET 36 2.145 -3.120 8.219
278 HG2 MET 36 2HG MET 36 3.348 -4.010 10.379
279 HG3 MET 36 1HG MET 36 2.306 -2.856 11.209
280 HE1 MET 36 3HE MET 36 0.978 -6.521 11.635
281 HE2 MET 36 1HE MET 36 2.430 -5.544 11.899
282 HE3 MET 36 2HE MET 36 2.325 -6.611 10.503
283 H ASN 37 H ASN 37 6.117 -3.092 9.347
284 HA ASN 37 HA ASN 37 6.836 -3.849 6.702
285 HB2 ASN 37 2HB ASN 37 8.531 -3.459 8.405
286 HB3 ASN 37 1HB ASN 37 7.899 -4.790 9.372
287 HD21 ASN 37 1HD2 ASN 37 7.627 -5.579 6.087
288 HD22 ASN 37 2HD2 ASN 37 9.054 -6.496 5.938
289 H MET 38 H MET 38 5.382 -5.164 5.693
290 HA MET 38 HA MET 38 4.671 -7.723 6.994
291 HB2 MET 38 2HB MET 38 2.735 -6.481 6.298
292 HB3 MET 38 1HB MET 38 3.399 -6.256 4.677
293 HG2 MET 38 2HG MET 38 3.214 -8.588 4.188
294 HG3 MET 38 1HG MET 38 2.939 -8.989 5.874
295 HE1 MET 38 3HE MET 38 -0.650 -8.346 6.597
296 HE2 MET 38 1HE MET 38 0.928 -7.849 7.227
297 HE3 MET 38 2HE MET 38 0.654 -9.525 6.756
298 HA PRO 39 HA PRO 39 7.954 -9.471 4.342
299 HB2 PRO 39 2HB PRO 39 6.213 -11.885 4.793
300 HB3 PRO 39 1HB PRO 39 7.984 -11.746 4.859
301 HG2 PRO 39 2HG PRO 39 6.540 -11.822 7.087
302 HG3 PRO 39 1HG PRO 39 7.960 -10.768 6.953
303 HD2 PRO 39 2HD PRO 39 5.067 -10.028 6.945
304 HD3 PRO 39 1HD PRO 39 6.469 -9.083 7.474
305 H GLU 40 H GLU 40 8.102 -10.179 2.178
306 HA GLU 40 HA GLU 40 5.852 -9.527 0.509
307 HB2 GLU 40 2HB GLU 40 8.284 -9.072 -0.048
308 HB3 GLU 40 1HB GLU 40 8.461 -10.807 -0.325
309 HG2 GLU 40 2HG GLU 40 6.549 -10.663 -1.950
310 HG3 GLU 40 1HG GLU 40 6.604 -8.908 -1.780
311 H GLY 41 H GLY 41 4.322 -11.133 1.232
312 HA2 GLY 41 2HA GLY 41 3.792 -13.227 -0.375
313 HA3 GLY 41 1HA GLY 41 4.917 -13.945 0.776
314 H LYS 42 H LYS 42 3.617 -11.771 2.689
315 HA LYS 42 HA LYS 42 1.849 -13.622 3.965
316 HB2 LYS 42 2HB LYS 42 2.842 -10.863 4.481
317 HB3 LYS 42 1HB LYS 42 1.319 -11.289 5.253
318 HG2 LYS 42 2HG LYS 42 3.618 -13.229 5.445
319 HG3 LYS 42 1HG LYS 42 3.652 -11.787 6.453
320 HD2 LYS 42 2HD LYS 42 1.680 -12.370 7.593
321 HD3 LYS 42 1HD LYS 42 1.190 -13.523 6.350
322 HE2 LYS 42 2HE LYS 42 3.569 -13.834 8.208
323 HE3 LYS 42 1HE LYS 42 2.037 -14.696 8.350
324 HZ1 LYS 42 3HZ LYS 42 2.887 -16.207 6.992
325 HZ2 LYS 42 1HZ LYS 42 4.259 -15.261 6.680
326 HZ3 LYS 42 2HZ LYS 42 2.855 -15.052 5.747
327 H VAL 43 H VAL 43 0.188 -14.147 2.699
328 HA VAL 43 HA VAL 43 -1.319 -12.574 0.994
329 HB VAL 43 HB VAL 43 -2.510 -14.786 2.665
330 HG11 VAL 43 1HG1 VAL 43 -3.916 -15.142 0.787
331 HG12 VAL 43 2HG1 VAL 43 -2.886 -14.182 -0.272
332 HG13 VAL 43 3HG1 VAL 43 -3.855 -13.390 0.968
333 HG21 VAL 43 3HG2 VAL 43 -0.502 -14.922 0.406
334 HG22 VAL 43 1HG2 VAL 43 -1.596 -16.261 0.755
335 HG23 VAL 43 2HG2 VAL 43 -0.440 -15.726 1.974
336 H MET 44 H MET 44 -2.813 -11.027 1.226
337 HA MET 44 HA MET 44 -3.932 -10.524 3.937
338 HB2 MET 44 2HB MET 44 -3.737 -8.497 1.715
339 HB3 MET 44 1HB MET 44 -4.056 -8.211 3.408
340 HG2 MET 44 2HG MET 44 -1.798 -8.715 4.003
341 HG3 MET 44 1HG MET 44 -1.450 -9.378 2.408
342 HE1 MET 44 3HE MET 44 -1.011 -6.657 0.053
343 HE2 MET 44 1HE MET 44 -2.735 -6.934 0.315
344 HE3 MET 44 2HE MET 44 -1.605 -8.284 0.363
345 H GLU 45 H GLU 45 -6.128 -10.574 4.130
346 HA GLU 45 HA GLU 45 -7.702 -11.002 1.647
347 HB2 GLU 45 2HB GLU 45 -7.519 -12.898 3.334
348 HB3 GLU 45 1HB GLU 45 -8.458 -11.884 4.432
349 HG2 GLU 45 2HG GLU 45 -10.078 -13.207 3.338
350 HG3 GLU 45 1HG GLU 45 -10.150 -11.660 2.499
351 H THR 46 H THR 46 -9.065 -9.433 1.122
352 HA THR 46 HA THR 46 -9.640 -7.293 2.981
353 HB THR 46 HB THR 46 -10.662 -6.189 1.145
354 HG1 THR 46 1HG THR 46 -11.995 -7.695 0.310
355 HG21 THR 46 3HG2 THR 46 -8.163 -6.628 1.038
356 HG22 THR 46 1HG2 THR 46 -8.928 -6.248 -0.502
357 HG23 THR 46 2HG2 THR 46 -8.521 -7.917 -0.107
358 H ARG 47 H ARG 47 -11.860 -6.553 3.388
359 HA ARG 47 HA ARG 47 -13.443 -8.478 4.629
360 HB2 ARG 47 2HB ARG 47 -15.231 -6.735 4.611
361 HB3 ARG 47 1HB ARG 47 -13.670 -6.123 5.167
362 HG2 ARG 47 2HG ARG 47 -13.228 -5.338 2.814
363 HG3 ARG 47 1HG ARG 47 -14.888 -5.780 2.413
364 HD2 ARG 47 2HD ARG 47 -15.719 -4.249 4.158
365 HD3 ARG 47 1HD ARG 47 -14.063 -3.806 4.561
366 HE ARG 47 HE ARG 47 -14.395 -3.335 1.827
367 HH11 ARG 47 1HH2 ARG 47 -15.676 -2.265 4.859
368 HH12 ARG 47 2HH2 ARG 47 -16.038 -0.667 4.298
369 HH21 ARG 47 1HH1 ARG 47 -14.868 -1.242 1.084
370 HH22 ARG 47 2HH1 ARG 47 -15.582 -0.088 2.160
371 H ASP 48 H ASP 48 -13.602 -7.186 1.345
372 HA ASP 48 HA ASP 48 -16.043 -8.498 0.645
373 HB2 ASP 48 2HB ASP 48 -15.191 -6.513 -0.559
374 HB3 ASP 48 1HB ASP 48 -13.829 -7.472 -1.148
375 H GLY 49 H GLY 49 -13.126 -9.772 1.434
376 HA2 GLY 49 2HA GLY 49 -12.354 -11.950 1.292
377 HA3 GLY 49 1HA GLY 49 -13.758 -12.338 0.295
378 H THR 50 H THR 50 -11.342 -9.821 -0.301
379 HA THR 50 HA THR 50 -10.756 -11.047 -2.921
380 HB THR 50 HB THR 50 -9.928 -8.314 -1.934
381 HG1 THR 50 1HG THR 50 -12.325 -9.012 -2.124
382 HG21 THR 50 3HG2 THR 50 -9.854 -7.874 -4.389
383 HG22 THR 50 1HG2 THR 50 -10.220 -9.575 -4.671
384 HG23 THR 50 2HG2 THR 50 -8.712 -9.117 -3.879
385 H LYS 51 H LYS 51 -9.000 -12.275 -3.065
386 HA LYS 51 HA LYS 51 -6.962 -12.248 -1.032
387 HB2 LYS 51 2HB LYS 51 -7.665 -14.326 -2.185
388 HB3 LYS 51 1HB LYS 51 -7.004 -13.689 -3.692
389 HG2 LYS 51 2HG LYS 51 -4.768 -13.582 -2.723
390 HG3 LYS 51 1HG LYS 51 -5.394 -14.067 -1.149
391 HD2 LYS 51 2HD LYS 51 -4.572 -16.095 -1.989
392 HD3 LYS 51 1HD LYS 51 -6.275 -16.185 -2.430
393 HE2 LYS 51 2HE LYS 51 -4.819 -16.818 -4.327
394 HE3 LYS 51 1HE LYS 51 -5.743 -15.363 -4.692
395 HZ1 LYS 51 3HZ LYS 51 -3.015 -15.246 -3.559
396 HZ2 LYS 51 1HZ LYS 51 -3.884 -14.013 -4.332
397 HZ3 LYS 51 2HZ LYS 51 -3.289 -15.325 -5.234
398 H ILE 52 H ILE 52 -5.324 -10.887 -0.956
399 HA ILE 52 HA ILE 52 -4.033 -9.989 -3.455
400 HB ILE 52 HB ILE 52 -3.767 -7.710 -2.175
401 HG12 ILE 52 2HG1 ILE 52 -6.372 -8.683 -0.985
402 HG13 ILE 52 1HG1 ILE 52 -4.857 -8.685 -0.111
403 HG21 ILE 52 1HG2 ILE 52 -5.789 -6.860 -3.216
404 HG22 ILE 52 2HG2 ILE 52 -6.473 -8.484 -3.289
405 HG23 ILE 52 3HG2 ILE 52 -5.071 -8.070 -4.281
406 HD11 ILE 52 3HD1 ILE 52 -6.384 -6.322 -1.182
407 HD12 ILE 52 1HD1 ILE 52 -4.688 -6.189 -0.719
408 HD13 ILE 52 2HD1 ILE 52 -5.895 -6.635 0.482
409 H ILE 53 H ILE 53 -1.914 -10.294 -3.374
410 HA ILE 53 HA ILE 53 -0.662 -11.095 -0.853
411 HB ILE 53 HB ILE 53 0.728 -10.932 -3.522
412 HG12 ILE 53 2HG1 ILE 53 -1.340 -12.065 -4.016
413 HG13 ILE 53 1HG1 ILE 53 -0.077 -13.289 -3.894
414 HG21 ILE 53 1HG2 ILE 53 1.924 -12.898 -2.595
415 HG22 ILE 53 2HG2 ILE 53 0.954 -12.782 -1.128
416 HG23 ILE 53 3HG2 ILE 53 2.075 -11.487 -1.548
417 HD11 ILE 53 3HD1 ILE 53 -2.253 -12.629 -1.910
418 HD12 ILE 53 1HD1 ILE 53 -0.803 -13.499 -1.417
419 HD13 ILE 53 2HD1 ILE 53 -1.868 -14.186 -2.639
420 H MET 54 H MET 54 1.065 -10.081 0.090
421 HA MET 54 HA MET 54 1.229 -7.244 -0.215
422 HB2 MET 54 2HB MET 54 1.610 -8.459 1.943
423 HB3 MET 54 1HB MET 54 3.122 -9.082 1.278
424 HG2 MET 54 2HG MET 54 3.726 -7.142 2.532
425 HG3 MET 54 1HG MET 54 3.778 -6.650 0.851
426 HE1 MET 54 3HE MET 54 2.165 -3.407 1.222
427 HE2 MET 54 1HE MET 54 3.007 -4.553 0.172
428 HE3 MET 54 2HE MET 54 3.709 -4.092 1.721
429 H LYS 55 H LYS 55 1.722 -7.160 -2.496
430 HA LYS 55 HA LYS 55 4.130 -8.197 -3.603
431 HB2 LYS 55 2HB LYS 55 2.219 -6.021 -4.464
432 HB3 LYS 55 1HB LYS 55 3.658 -6.431 -5.403
433 HG2 LYS 55 2HG LYS 55 2.886 -8.766 -5.558
434 HG3 LYS 55 1HG LYS 55 1.440 -8.346 -4.641
435 HD2 LYS 55 2HD LYS 55 0.989 -6.582 -6.442
436 HD3 LYS 55 1HD LYS 55 2.236 -7.390 -7.393
437 HE2 LYS 55 2HE LYS 55 0.994 -9.495 -7.295
438 HE3 LYS 55 1HE LYS 55 -0.227 -8.750 -6.264
439 HZ1 LYS 55 3HZ LYS 55 -0.340 -8.865 -8.954
440 HZ2 LYS 55 1HZ LYS 55 0.289 -7.310 -8.705
441 HZ3 LYS 55 2HZ LYS 55 -1.190 -7.751 -7.994
442 H GLY 56 H GLY 56 3.192 -4.895 -2.712
443 HA2 GLY 56 2HA GLY 56 5.867 -3.895 -3.011
444 HA3 GLY 56 1HA GLY 56 4.468 -3.000 -2.440
445 H ASN 57 H ASN 57 6.808 -5.481 -1.388
446 HA ASN 57 HA ASN 57 6.202 -5.069 1.396
447 HB2 ASN 57 2HB ASN 57 7.077 -7.218 0.702
448 HB3 ASN 57 1HB ASN 57 8.524 -6.458 0.035
449 HD21 ASN 57 1HD2 ASN 57 7.083 -5.350 3.076
450 HD22 ASN 57 2HD2 ASN 57 8.342 -5.910 4.077
451 H GLU 58 H GLU 58 7.738 -3.234 -0.885
452 HA GLU 58 HA GLU 58 9.824 -2.130 0.833
453 HB2 GLU 58 2HB GLU 58 10.144 -0.568 -1.135
454 HB3 GLU 58 1HB GLU 58 10.382 -2.279 -1.494
455 HG2 GLU 58 2HG GLU 58 8.204 -2.456 -2.494
456 HG3 GLU 58 1HG GLU 58 7.745 -0.855 -1.918
457 H ILE 59 H ILE 59 7.544 -1.854 2.162
458 HA ILE 59 HA ILE 59 5.802 0.217 1.770
459 HB ILE 59 HB ILE 59 5.865 0.448 4.321
460 HG12 ILE 59 2HG1 ILE 59 7.786 -1.883 4.039
461 HG13 ILE 59 1HG1 ILE 59 8.306 -0.240 4.427
462 HG21 ILE 59 1HG2 ILE 59 5.485 -2.184 2.874
463 HG22 ILE 59 2HG2 ILE 59 4.251 -1.034 3.392
464 HG23 ILE 59 3HG2 ILE 59 5.110 -2.003 4.588
465 HD11 ILE 59 3HD1 ILE 59 7.105 -0.241 6.485
466 HD12 ILE 59 1HD1 ILE 59 7.919 -1.803 6.417
467 HD13 ILE 59 2HD1 ILE 59 6.198 -1.687 6.042
468 H PHE 60 H PHE 60 9.198 0.430 2.416
469 HA PHE 60 HA PHE 60 9.507 2.918 3.559
470 HB2 PHE 60 2HB PHE 60 11.148 1.668 1.343
471 HB3 PHE 60 1HB PHE 60 11.654 3.052 2.310
472 HD1 PHE 60 2HD PHE 60 10.903 -0.564 2.365
473 HD2 PHE 60 1HD PHE 60 12.306 2.802 4.633
474 HE1 PHE 60 2HE PHE 60 11.712 -2.097 4.139
475 HE2 PHE 60 1HE PHE 60 13.117 1.271 6.407
476 HZ PHE 60 HZ PHE 60 12.820 -1.178 6.159
477 H ARG 61 H ARG 61 8.463 2.120 0.328
478 HA ARG 61 HA ARG 61 8.953 4.472 -1.045
479 HB2 ARG 61 2HB ARG 61 7.965 2.339 -1.966
480 HB3 ARG 61 1HB ARG 61 6.420 2.848 -1.292
481 HG2 ARG 61 2HG ARG 61 6.462 3.562 -3.596
482 HG3 ARG 61 1HG ARG 61 6.640 4.999 -2.591
483 HD2 ARG 61 2HD ARG 61 9.163 3.636 -3.457
484 HD3 ARG 61 1HD ARG 61 8.261 4.520 -4.683
485 HE ARG 61 HE ARG 61 8.453 6.204 -2.472
486 HH11 ARG 61 1HH2 ARG 61 10.526 4.569 -4.707
487 HH12 ARG 61 2HH2 ARG 61 11.776 5.766 -4.637
488 HH21 ARG 61 1HH1 ARG 61 10.088 7.778 -2.373
489 HH22 ARG 61 2HH1 ARG 61 11.528 7.583 -3.316
490 H LEU 62 H LEU 62 6.044 3.685 0.905
491 HA LEU 62 HA LEU 62 4.677 6.077 0.507
492 HB2 LEU 62 2HB LEU 62 3.357 5.515 2.389
493 HB3 LEU 62 1HB LEU 62 3.853 3.983 1.680
494 HG LEU 62 HG LEU 62 5.925 4.417 3.455
495 HD11 LEU 62 1HD1 LEU 62 4.871 5.088 5.608
496 HD12 LEU 62 2HD1 LEU 62 3.398 5.506 4.736
497 HD13 LEU 62 3HD1 LEU 62 4.881 6.407 4.440
498 HD21 LEU 62 3HD2 LEU 62 3.284 3.081 4.126
499 HD22 LEU 62 1HD2 LEU 62 4.843 2.745 4.876
500 HD23 LEU 62 2HD2 LEU 62 4.576 2.340 3.182
501 H ASP 63 H ASP 63 7.461 5.411 2.493
502 HA ASP 63 HA ASP 63 7.255 7.784 4.099
503 HB2 ASP 63 2HB ASP 63 8.537 5.658 4.687
504 HB3 ASP 63 1HB ASP 63 9.771 6.210 3.554
505 H GLU 64 H GLU 64 9.857 6.908 1.827
506 HA GLU 64 HA GLU 64 10.571 9.635 1.373
507 HB2 GLU 64 2HB GLU 64 11.303 7.160 -0.213
508 HB3 GLU 64 1HB GLU 64 12.108 8.727 -0.307
509 HG2 GLU 64 2HG GLU 64 12.774 8.569 2.035
510 HG3 GLU 64 1HG GLU 64 11.887 7.054 2.211
511 H ALA 65 H ALA 65 10.292 10.892 -0.490
512 HA ALA 65 HA ALA 65 9.067 11.795 -2.213
513 HB1 ALA 65 1HB ALA 65 8.696 8.934 -3.113
514 HB2 ALA 65 2HB ALA 65 10.193 9.833 -3.357
515 HB3 ALA 65 3HB ALA 65 8.699 10.388 -4.113
516 H LEU 66 H LEU 66 7.407 12.401 -0.666
517 HA LEU 66 HA LEU 66 5.075 10.695 -0.389
518 HB2 LEU 66 2HB LEU 66 4.176 12.871 0.739
519 HB3 LEU 66 1HB LEU 66 5.434 11.945 1.552
520 HG LEU 66 HG LEU 66 6.333 14.077 -0.368
521 HD11 LEU 66 1HD1 LEU 66 5.259 14.672 2.408
522 HD12 LEU 66 2HD1 LEU 66 4.563 15.227 0.886
523 HD13 LEU 66 3HD1 LEU 66 6.149 15.808 1.393
524 HD21 LEU 66 3HD2 LEU 66 7.363 13.524 2.421
525 HD22 LEU 66 1HD2 LEU 66 8.234 14.158 1.025
526 HD23 LEU 66 2HD2 LEU 66 7.785 12.454 1.088
527 H ARG 67 H ARG 67 4.429 14.037 -0.785
528 HA ARG 67 HA ARG 67 3.088 15.176 -2.265
529 HB2 ARG 67 2HB ARG 67 5.112 14.885 -3.678
530 HB3 ARG 67 1HB ARG 67 4.431 13.381 -4.301
531 HG2 ARG 67 2HG ARG 67 2.566 14.537 -5.285
532 HG3 ARG 67 1HG ARG 67 2.996 16.041 -4.470
533 HD2 ARG 67 2HD ARG 67 3.710 16.076 -6.833
534 HD3 ARG 67 1HD ARG 67 5.094 16.152 -5.747
535 HE ARG 67 HE ARG 67 5.775 14.092 -6.569
536 HH11 ARG 67 1HH2 ARG 67 2.446 14.682 -7.310
537 HH12 ARG 67 2HH2 ARG 67 2.281 13.282 -8.318
538 HH21 ARG 67 1HH1 ARG 67 5.565 12.256 -7.889
539 HH22 ARG 67 2HH1 ARG 67 4.046 11.910 -8.646
540 H LYS 68 H LYS 68 0.989 14.726 -1.943
541 HA LYS 68 HA LYS 68 -0.272 12.696 -3.617
542 HB2 LYS 68 2HB LYS 68 -0.477 12.647 -0.595
543 HB3 LYS 68 1HB LYS 68 -1.505 11.718 -1.686
544 HG2 LYS 68 2HG LYS 68 0.660 10.763 -2.672
545 HG3 LYS 68 1HG LYS 68 1.478 11.460 -1.274
546 HD2 LYS 68 2HD LYS 68 -0.212 10.218 0.176
547 HD3 LYS 68 1HD LYS 68 -0.694 9.353 -1.286
548 HE2 LYS 68 2HE LYS 68 1.584 8.524 -1.589
549 HE3 LYS 68 1HE LYS 68 2.136 9.459 -0.199
550 HZ1 LYS 68 3HZ LYS 68 1.264 6.904 -0.109
551 HZ2 LYS 68 1HZ LYS 68 -0.120 7.764 0.361
552 HZ3 LYS 68 2HZ LYS 68 1.332 7.959 1.221
553 H GLY 69 H GLY 69 -0.715 15.087 -4.305
554 HA2 GLY 69 2HA GLY 69 -2.615 16.590 -2.790
555 HA3 GLY 69 1HA GLY 69 -2.194 16.852 -4.480
556 H HIS 70 H HIS 70 -4.820 16.670 -2.927
557 HA HIS 70 HA HIS 70 -6.208 14.358 -3.814
558 HB2 HIS 70 2HB HIS 70 -8.249 15.663 -3.259
559 HB3 HIS 70 1HB HIS 70 -7.053 15.696 -1.963
560 HD2 HIS 70 2HD HIS 70 -8.321 18.135 -4.828
561 HE1 HIS 70 1HE HIS 70 -6.334 20.406 -1.874
562 HE2 HIS 70 2HE HIS 70 -7.681 20.537 -4.023
563 H SER 71 H SER 71 -7.544 14.032 -5.574
564 HA SER 71 HA SER 71 -8.169 16.058 -7.483
565 HB2 SER 71 2HB SER 71 -5.853 15.895 -8.126
566 HB3 SER 71 1HB SER 71 -5.929 14.136 -8.143
567 HG SER 71 HG SER 71 -6.757 15.975 -10.012
568 H GLU 72 H GLU 72 -9.781 15.393 -8.833
569 HA GLU 72 HA GLU 72 -11.183 13.017 -8.223
570 HB2 GLU 72 2HB GLU 72 -12.224 15.068 -9.177
571 HB3 GLU 72 1HB GLU 72 -11.422 14.726 -10.711
572 HG2 GLU 72 2HG GLU 72 -12.593 12.595 -10.896
573 HG3 GLU 72 1HG GLU 72 -13.322 12.826 -9.307
574 H GLY 73 H GLY 73 -9.506 11.398 -8.434
575 HA2 GLY 73 2HA GLY 73 -8.150 10.818 -10.836
576 HA3 GLY 73 1HA GLY 73 -8.445 9.674 -9.531
577 H GLY 74 H GLY 74 -10.651 8.701 -9.452
578 HA2 GLY 74 2HA GLY 74 -11.311 7.491 -11.914
579 HA3 GLY 74 1HA GLY 74 -12.281 7.418 -10.446
580 H1 HOH 201 H2 HOH 77 -8.781 17.529 -0.624
581 H2 HOH 201 H1 HOH 77 -8.290 18.555 0.377
Start of MODEL 12
1 H1 VAL 1 1H VAL 1 0.731 16.920 -6.136
2 H2 VAL 1 2H VAL 1 2.204 17.337 -6.871
3 HA VAL 1 HA VAL 1 0.230 16.974 -8.396
4 HB VAL 1 HB VAL 1 2.750 15.341 -8.824
5 HG11 VAL 1 2HG1 VAL 1 2.279 15.880 -11.228
6 HG12 VAL 1 3HG1 VAL 1 0.733 16.567 -10.729
7 HG13 VAL 1 1HG1 VAL 1 1.052 14.849 -10.493
8 HG21 VAL 1 1HG2 VAL 1 3.406 17.575 -8.243
9 HG22 VAL 1 2HG2 VAL 1 2.113 18.277 -9.218
10 HG23 VAL 1 3HG2 VAL 1 3.479 17.483 -10.003
11 H ASP 2 H ASP 2 -1.398 15.752 -7.208
12 HA ASP 2 HA ASP 2 -1.566 13.006 -8.153
13 HB2 ASP 2 2HB ASP 2 -1.876 13.508 -5.194
14 HB3 ASP 2 1HB ASP 2 -1.793 11.962 -6.037
15 H MET 3 H MET 3 -3.239 14.278 -9.324
16 HA MET 3 HA MET 3 -5.462 15.430 -8.020
17 HB2 MET 3 2HB MET 3 -4.891 15.788 -10.415
18 HB3 MET 3 1HB MET 3 -5.375 14.127 -10.753
19 HG2 MET 3 2HG MET 3 -7.280 16.010 -9.367
20 HG3 MET 3 1HG MET 3 -7.118 16.033 -11.122
21 HE1 MET 3 3HE MET 3 -9.674 15.626 -11.036
22 HE2 MET 3 1HE MET 3 -9.773 15.297 -9.301
23 HE3 MET 3 2HE MET 3 -10.462 14.161 -10.457
24 H SER 4 H SER 4 -5.053 12.197 -9.475
25 HA SER 4 HA SER 4 -7.593 11.246 -8.569
26 HB2 SER 4 2HB SER 4 -5.185 9.617 -9.397
27 HB3 SER 4 1HB SER 4 -6.864 9.089 -9.370
28 HG SER 4 HG SER 4 -5.519 10.426 -11.279
29 H ASN 5 H ASN 5 -4.299 11.116 -7.325
30 HA ASN 5 HA ASN 5 -3.439 10.411 -5.313
31 HB2 ASN 5 2HB ASN 5 -4.907 12.160 -4.443
32 HB3 ASN 5 1HB ASN 5 -6.263 11.032 -4.414
33 HD21 ASN 5 1HD2 ASN 5 -2.931 10.159 -3.497
34 HD22 ASN 5 2HD2 ASN 5 -3.282 9.887 -1.859
35 H VAL 6 H VAL 6 -6.709 9.272 -4.629
36 HA VAL 6 HA VAL 6 -5.749 6.658 -3.938
37 HB VAL 6 HB VAL 6 -8.151 6.147 -3.582
38 HG11 VAL 6 1HG1 VAL 6 -7.437 8.877 -2.481
39 HG12 VAL 6 2HG1 VAL 6 -6.705 7.383 -1.895
40 HG13 VAL 6 3HG1 VAL 6 -8.442 7.642 -1.723
41 HG21 VAL 6 3HG2 VAL 6 -8.496 8.942 -4.714
42 HG22 VAL 6 1HG2 VAL 6 -9.765 8.047 -3.880
43 HG23 VAL 6 2HG2 VAL 6 -9.116 7.443 -5.405
44 H VAL 7 H VAL 7 -5.892 4.766 -5.055
45 HA VAL 7 HA VAL 7 -7.332 4.624 -7.587
46 HB VAL 7 HB VAL 7 -5.301 3.875 -8.822
47 HG11 VAL 7 1HG1 VAL 7 -6.199 6.276 -8.800
48 HG12 VAL 7 2HG1 VAL 7 -4.522 6.074 -9.311
49 HG13 VAL 7 3HG1 VAL 7 -4.885 6.644 -7.682
50 HG21 VAL 7 3HG2 VAL 7 -3.917 4.861 -6.308
51 HG22 VAL 7 1HG2 VAL 7 -3.089 4.492 -7.821
52 HG23 VAL 7 2HG2 VAL 7 -3.912 3.211 -6.932
53 H LYS 8 H LYS 8 -6.043 3.269 -4.791
54 HA LYS 8 HA LYS 8 -7.292 0.753 -5.239
55 HB2 LYS 8 2HB LYS 8 -5.267 0.453 -6.646
56 HB3 LYS 8 1HB LYS 8 -4.268 0.737 -5.226
57 HG2 LYS 8 2HG LYS 8 -4.790 -1.311 -4.262
58 HG3 LYS 8 1HG LYS 8 -6.384 -1.384 -5.019
59 HD2 LYS 8 2HD LYS 8 -3.990 -1.497 -6.836
60 HD3 LYS 8 1HD LYS 8 -4.351 -2.922 -5.880
61 HE2 LYS 8 2HE LYS 8 -5.472 -3.095 -8.040
62 HE3 LYS 8 1HE LYS 8 -6.683 -2.900 -6.770
63 HZ1 LYS 8 3HZ LYS 8 -5.610 -0.722 -8.481
64 HZ2 LYS 8 1HZ LYS 8 -6.786 -0.544 -7.272
65 HZ3 LYS 8 2HZ LYS 8 -7.129 -1.462 -8.661
66 H THR 9 H THR 9 -7.848 -0.048 -3.315
67 HA THR 9 HA THR 9 -6.139 0.299 -0.981
68 HB THR 9 HB THR 9 -8.961 1.381 -0.918
69 HG1 THR 9 1HG THR 9 -7.925 2.828 -2.138
70 HG21 THR 9 3HG2 THR 9 -8.410 2.162 1.241
71 HG22 THR 9 1HG2 THR 9 -6.680 1.940 0.975
72 HG23 THR 9 2HG2 THR 9 -7.727 0.536 1.191
73 H TYR 10 H TYR 10 -6.074 -1.738 -0.284
74 HA TYR 10 HA TYR 10 -8.487 -3.423 -0.403
75 HB2 TYR 10 2HB TYR 10 -5.619 -4.115 0.290
76 HB3 TYR 10 1HB TYR 10 -6.943 -5.264 0.170
77 HD1 TYR 10 2HD TYR 10 -8.369 -4.955 -2.136
78 HD2 TYR 10 1HD TYR 10 -4.214 -3.964 -1.597
79 HE1 TYR 10 2HE TYR 10 -7.998 -5.164 -4.574
80 HE2 TYR 10 1HE TYR 10 -3.854 -4.182 -4.032
81 HH TYR 10 HH TYR 10 -5.683 -5.754 -6.029
82 H ASP 11 H ASP 11 -9.785 -3.006 1.315
83 HA ASP 11 HA ASP 11 -8.804 -2.213 3.875
84 HB2 ASP 11 2HB ASP 11 -11.506 -3.174 2.933
85 HB3 ASP 11 1HB ASP 11 -11.174 -2.665 4.589
86 H LEU 12 H LEU 12 -7.309 -3.803 4.451
87 HA LEU 12 HA LEU 12 -7.716 -6.561 4.551
88 HB2 LEU 12 2HB LEU 12 -5.861 -4.607 5.750
89 HB3 LEU 12 1HB LEU 12 -6.076 -6.044 6.743
90 HG LEU 12 HG LEU 12 -5.330 -7.485 5.005
91 HD11 LEU 12 1HD1 LEU 12 -6.024 -5.197 3.234
92 HD12 LEU 12 2HD1 LEU 12 -6.120 -6.928 2.926
93 HD13 LEU 12 3HD1 LEU 12 -4.582 -6.094 2.763
94 HD21 LEU 12 3HD2 LEU 12 -3.653 -4.957 5.085
95 HD22 LEU 12 1HD2 LEU 12 -3.083 -6.491 4.432
96 HD23 LEU 12 2HD2 LEU 12 -3.505 -6.364 6.139
97 H GLN 13 H GLN 13 -8.368 -7.981 6.129
98 HA GLN 13 HA GLN 13 -10.584 -7.118 7.729
99 HB2 GLN 13 2HB GLN 13 -9.099 -9.737 7.478
100 HB3 GLN 13 1HB GLN 13 -10.455 -9.517 8.587
101 HG2 GLN 13 2HG GLN 13 -11.947 -8.981 6.782
102 HG3 GLN 13 1HG GLN 13 -10.616 -8.894 5.629
103 HE21 GLN 13 1HE2 GLN 13 -10.947 -11.415 8.132
104 HE22 GLN 13 2HE2 GLN 13 -11.178 -12.698 7.036
105 H ASP 14 H ASP 14 -7.208 -7.262 8.221
106 HA ASP 14 HA ASP 14 -7.306 -7.575 11.099
107 HB2 ASP 14 2HB ASP 14 -5.043 -6.720 9.277
108 HB3 ASP 14 1HB ASP 14 -4.889 -7.123 10.988
109 H GLY 15 H GLY 15 -8.575 -5.249 9.448
110 HA2 GLY 15 2HA GLY 15 -9.200 -3.108 10.096
111 HA3 GLY 15 1HA GLY 15 -8.088 -3.231 11.457
112 H SER 16 H SER 16 -6.069 -4.134 9.234
113 HA SER 16 HA SER 16 -4.775 -1.610 8.996
114 HB2 SER 16 2HB SER 16 -4.160 -4.006 7.280
115 HB3 SER 16 1HB SER 16 -3.061 -2.760 7.865
116 HG SER 16 HG SER 16 -3.181 -3.609 9.888
117 H LYS 17 H LYS 17 -3.831 -1.441 6.443
118 HA LYS 17 HA LYS 17 -5.966 -1.503 4.505
119 HB2 LYS 17 2HB LYS 17 -6.500 0.498 5.944
120 HB3 LYS 17 1HB LYS 17 -4.973 1.203 5.417
121 HG2 LYS 17 2HG LYS 17 -5.820 0.797 3.014
122 HG3 LYS 17 1HG LYS 17 -7.404 0.546 3.748
123 HD2 LYS 17 2HD LYS 17 -5.682 3.028 4.029
124 HD3 LYS 17 1HD LYS 17 -7.154 2.892 3.068
125 HE2 LYS 17 2HE LYS 17 -6.868 2.811 6.072
126 HE3 LYS 17 1HE LYS 17 -7.867 3.889 5.097
127 HZ1 LYS 17 3HZ LYS 17 -9.386 2.358 5.852
128 HZ2 LYS 17 1HZ LYS 17 -8.301 1.057 5.766
129 HZ3 LYS 17 2HZ LYS 17 -8.973 1.697 4.342
130 H VAL 18 H VAL 18 -4.975 -1.929 2.623
131 HA VAL 18 HA VAL 18 -2.122 -1.400 2.321
132 HB VAL 18 HB VAL 18 -3.883 -2.575 0.187
133 HG11 VAL 18 1HG1 VAL 18 -1.011 -3.024 1.037
134 HG12 VAL 18 2HG1 VAL 18 -1.548 -2.109 -0.371
135 HG13 VAL 18 3HG1 VAL 18 -1.813 -3.851 -0.298
136 HG21 VAL 18 3HG2 VAL 18 -3.559 -4.796 1.159
137 HG22 VAL 18 1HG2 VAL 18 -4.440 -3.763 2.286
138 HG23 VAL 18 2HG2 VAL 18 -2.725 -4.085 2.545
139 H HIS 19 H HIS 19 -1.211 -0.148 0.689
140 HA HIS 19 HA HIS 19 -2.959 1.430 -1.056
141 HB2 HIS 19 2HB HIS 19 -2.504 3.483 -0.140
142 HB3 HIS 19 1HB HIS 19 -2.128 2.565 1.312
143 HD1 HIS 19 1HD HIS 19 -0.680 4.910 -1.053
144 HD2 HIS 19 2HD HIS 19 0.827 1.942 1.462
145 HE1 HIS 19 1HE HIS 19 1.799 5.362 -0.809
146 HE2 HIS 19 2HE HIS 19 2.727 3.564 0.724
147 H VAL 20 H VAL 20 -2.186 1.087 -3.038
148 HA VAL 20 HA VAL 20 0.644 0.380 -3.344
149 HB VAL 20 HB VAL 20 0.039 -0.901 -5.152
150 HG11 VAL 20 1HG1 VAL 20 -2.720 -0.531 -4.011
151 HG12 VAL 20 2HG1 VAL 20 -1.467 -1.405 -3.157
152 HG13 VAL 20 3HG1 VAL 20 -2.037 -1.992 -4.720
153 HG21 VAL 20 3HG2 VAL 20 -2.041 1.222 -5.722
154 HG22 VAL 20 1HG2 VAL 20 -2.000 -0.312 -6.590
155 HG23 VAL 20 2HG2 VAL 20 -0.633 0.795 -6.694
156 H PHE 21 H PHE 21 1.919 1.251 -5.063
157 HA PHE 21 HA PHE 21 1.398 4.119 -5.500
158 HB2 PHE 21 2HB PHE 21 3.910 2.475 -5.903
159 HB3 PHE 21 1HB PHE 21 3.782 4.224 -6.081
160 HD1 PHE 21 1HD PHE 21 3.436 1.424 -3.653
161 HD2 PHE 21 2HD PHE 21 3.841 5.668 -4.184
162 HE1 PHE 21 1HE PHE 21 3.797 1.694 -1.215
163 HE2 PHE 21 2HE PHE 21 4.202 5.938 -1.745
164 HZ PHE 21 HZ PHE 21 4.180 3.949 -0.263
165 H LYS 22 H LYS 22 2.984 4.536 -7.717
166 HA LYS 22 HA LYS 22 1.214 3.702 -9.834
167 HB2 LYS 22 2HB LYS 22 3.818 5.244 -9.947
168 HB3 LYS 22 1HB LYS 22 2.664 5.072 -11.270
169 HG2 LYS 22 2HG LYS 22 0.918 6.062 -9.668
170 HG3 LYS 22 1HG LYS 22 2.280 6.516 -8.643
171 HD2 LYS 22 2HD LYS 22 1.984 7.301 -11.557
172 HD3 LYS 22 1HD LYS 22 1.598 8.350 -10.193
173 HE2 LYS 22 2HE LYS 22 4.009 7.912 -9.397
174 HE3 LYS 22 1HE LYS 22 4.298 7.275 -11.016
175 HZ1 LYS 22 3HZ LYS 22 3.722 9.341 -11.978
176 HZ2 LYS 22 1HZ LYS 22 4.809 9.684 -10.721
177 HZ3 LYS 22 2HZ LYS 22 3.146 9.957 -10.504
178 H ASP 23 H ASP 23 4.125 2.537 -8.443
179 HA ASP 23 HA ASP 23 5.088 1.139 -10.773
180 HB2 ASP 23 2HB ASP 23 5.788 0.926 -7.838
181 HB3 ASP 23 1HB ASP 23 6.603 0.024 -9.117
182 H GLY 24 H GLY 24 2.472 0.676 -8.794
183 HA2 GLY 24 2HA GLY 24 0.922 -1.065 -8.880
184 HA3 GLY 24 1HA GLY 24 2.107 -2.055 -9.728
185 H LYS 25 H LYS 25 3.829 -0.872 -7.253
186 HA LYS 25 HA LYS 25 3.694 -3.335 -5.743
187 HB2 LYS 25 2HB LYS 25 5.233 -0.746 -5.441
188 HB3 LYS 25 1HB LYS 25 5.380 -2.063 -4.287
189 HG2 LYS 25 2HG LYS 25 5.702 -2.680 -7.207
190 HG3 LYS 25 1HG LYS 25 7.034 -1.898 -6.364
191 HD2 LYS 25 2HD LYS 25 7.318 -3.709 -4.878
192 HD3 LYS 25 1HD LYS 25 5.722 -4.370 -5.231
193 HE2 LYS 25 2HE LYS 25 6.445 -4.951 -7.504
194 HE3 LYS 25 1HE LYS 25 8.029 -4.238 -7.197
195 HZ1 LYS 25 3HZ LYS 25 8.493 -6.374 -6.671
196 HZ2 LYS 25 1HZ LYS 25 6.896 -6.746 -6.231
197 HZ3 LYS 25 2HZ LYS 25 7.894 -5.890 -5.155
198 H MET 26 H MET 26 2.907 -3.609 -3.661
199 HA MET 26 HA MET 26 0.768 -1.831 -2.865
200 HB2 MET 26 2HB MET 26 1.746 -4.540 -2.037
201 HB3 MET 26 1HB MET 26 0.693 -3.650 -0.936
202 HG2 MET 26 2HG MET 26 -1.059 -3.547 -2.521
203 HG3 MET 26 1HG MET 26 -0.004 -4.013 -3.854
204 HE1 MET 26 3HE MET 26 -0.586 -6.597 -4.799
205 HE2 MET 26 1HE MET 26 -1.814 -5.359 -4.507
206 HE3 MET 26 2HE MET 26 -2.104 -7.024 -4.012
207 H GLY 27 H GLY 27 0.707 -1.954 -0.170
208 HA2 GLY 27 2HA GLY 27 3.114 -1.342 1.192
209 HA3 GLY 27 1HA GLY 27 2.350 0.157 0.667
210 H MET 28 H MET 28 2.665 -1.681 3.289
211 HA MET 28 HA MET 28 -0.068 -1.919 4.179
212 HB2 MET 28 2HB MET 28 2.524 -2.061 5.734
213 HB3 MET 28 1HB MET 28 0.938 -2.505 6.354
214 HG2 MET 28 2HG MET 28 2.344 -3.803 4.002
215 HG3 MET 28 1HG MET 28 2.218 -4.484 5.617
216 HE1 MET 28 3HE MET 28 -1.444 -5.247 6.137
217 HE2 MET 28 1HE MET 28 -1.168 -3.501 6.140
218 HE3 MET 28 2HE MET 28 0.028 -4.590 6.845
219 H GLU 29 H GLU 29 -1.192 -0.629 5.549
220 HA GLU 29 HA GLU 29 0.058 1.681 6.827
221 HB2 GLU 29 2HB GLU 29 -2.032 1.888 4.660
222 HB3 GLU 29 1HB GLU 29 -1.965 3.090 5.943
223 HG2 GLU 29 2HG GLU 29 0.411 2.345 4.219
224 HG3 GLU 29 1HG GLU 29 -0.657 3.702 3.881
225 H ASN 30 H ASN 30 -0.469 1.087 8.856
226 HA ASN 30 HA ASN 30 -2.966 -0.197 9.480
227 HB2 ASN 30 2HB ASN 30 -2.157 -0.333 11.709
228 HB3 ASN 30 1HB ASN 30 -0.754 -0.566 10.670
229 HD21 ASN 30 1HD2 ASN 30 -0.273 0.288 13.273
230 HD22 ASN 30 2HD2 ASN 30 0.207 1.923 13.268
231 H LYS 31 H LYS 31 -4.187 0.714 11.485
232 HA LYS 31 HA LYS 31 -5.630 2.954 10.701
233 HB2 LYS 31 2HB LYS 31 -6.353 1.230 12.366
234 HB3 LYS 31 1HB LYS 31 -5.269 1.969 13.542
235 HG2 LYS 31 2HG LYS 31 -7.183 3.832 12.177
236 HG3 LYS 31 1HG LYS 31 -7.898 2.669 13.291
237 HD2 LYS 31 2HD LYS 31 -6.277 3.427 15.048
238 HD3 LYS 31 1HD LYS 31 -5.719 4.678 13.939
239 HE2 LYS 31 2HE LYS 31 -8.014 5.586 13.811
240 HE3 LYS 31 1HE LYS 31 -8.561 4.346 14.939
241 HZ1 LYS 31 3HZ LYS 31 -7.471 5.308 16.679
242 HZ2 LYS 31 1HZ LYS 31 -7.855 6.696 15.782
243 HZ3 LYS 31 2HZ LYS 31 -6.291 6.039 15.699
244 H PHE 32 H PHE 32 -2.740 2.734 12.699
245 HA PHE 32 HA PHE 32 -2.851 5.509 13.512
246 HB2 PHE 32 2HB PHE 32 -0.648 3.443 13.724
247 HB3 PHE 32 1HB PHE 32 -0.598 5.051 14.451
248 HD1 PHE 32 2HD PHE 32 -2.413 1.806 14.440
249 HD2 PHE 32 1HD PHE 32 -1.803 5.552 16.455
250 HE1 PHE 32 2HE PHE 32 -3.694 0.966 16.390
251 HE2 PHE 32 1HE PHE 32 -3.086 4.711 18.405
252 HZ PHE 32 HZ PHE 32 -4.031 2.419 18.372
253 H GLY 33 H GLY 33 -2.550 4.415 10.580
254 HA2 GLY 33 2HA GLY 33 -1.664 5.267 8.634
255 HA3 GLY 33 1HA GLY 33 -1.128 6.658 9.577
256 H LYS 34 H LYS 34 0.040 3.951 11.076
257 HA LYS 34 HA LYS 34 2.734 4.445 10.117
258 HB2 LYS 34 2HB LYS 34 1.607 2.565 12.201
259 HB3 LYS 34 1HB LYS 34 3.324 2.678 11.812
260 HG2 LYS 34 2HG LYS 34 3.435 4.954 12.523
261 HG3 LYS 34 1HG LYS 34 1.678 5.093 12.589
262 HD2 LYS 34 2HD LYS 34 2.704 4.827 14.849
263 HD3 LYS 34 1HD LYS 34 1.583 3.524 14.454
264 HE2 LYS 34 2HE LYS 34 3.887 2.881 15.463
265 HE3 LYS 34 1HE LYS 34 3.321 1.984 14.054
266 HZ1 LYS 34 3HZ LYS 34 5.713 3.111 14.190
267 HZ2 LYS 34 1HZ LYS 34 4.843 4.405 13.524
268 HZ3 LYS 34 2HZ LYS 34 4.872 2.905 12.728
269 H SER 35 H SER 35 4.041 3.003 9.020
270 HA SER 35 HA SER 35 2.672 1.156 7.274
271 HB2 SER 35 2HB SER 35 5.074 0.747 6.469
272 HB3 SER 35 1HB SER 35 4.421 2.367 6.249
273 HG SER 35 HG SER 35 6.271 2.797 7.243
274 H MET 36 H MET 36 2.624 -1.026 7.370
275 HA MET 36 HA MET 36 3.842 -2.313 9.736
276 HB2 MET 36 2HB MET 36 1.260 -2.397 8.857
277 HB3 MET 36 1HB MET 36 1.903 -3.813 8.029
278 HG2 MET 36 2HG MET 36 2.072 -3.267 11.012
279 HG3 MET 36 1HG MET 36 1.000 -4.431 10.229
280 HE1 MET 36 3HE MET 36 3.149 -4.957 12.591
281 HE2 MET 36 1HE MET 36 3.671 -6.579 12.114
282 HE3 MET 36 2HE MET 36 1.975 -6.121 11.985
283 H ASN 37 H ASN 37 5.740 -3.269 9.351
284 HA ASN 37 HA ASN 37 6.744 -3.832 6.770
285 HB2 ASN 37 2HB ASN 37 8.269 -3.449 8.599
286 HB3 ASN 37 1HB ASN 37 7.616 -4.822 9.490
287 HD21 ASN 37 1HD2 ASN 37 7.738 -5.511 6.149
288 HD22 ASN 37 2HD2 ASN 37 9.198 -6.387 6.145
289 H MET 38 H MET 38 5.204 -5.097 5.677
290 HA MET 38 HA MET 38 4.807 -7.852 6.669
291 HB2 MET 38 2HB MET 38 2.758 -6.647 6.123
292 HB3 MET 38 1HB MET 38 3.357 -6.326 4.490
293 HG2 MET 38 2HG MET 38 3.374 -8.698 3.984
294 HG3 MET 38 1HG MET 38 3.024 -9.095 5.653
295 HE1 MET 38 3HE MET 38 0.815 -8.034 6.893
296 HE2 MET 38 1HE MET 38 0.909 -9.737 6.425
297 HE3 MET 38 2HE MET 38 -0.581 -8.830 6.169
298 HA PRO 39 HA PRO 39 7.830 -8.788 3.430
299 HB2 PRO 39 2HB PRO 39 8.078 -11.462 3.825
300 HB3 PRO 39 1HB PRO 39 8.761 -10.274 4.959
301 HG2 PRO 39 2HG PRO 39 6.225 -11.843 5.166
302 HG3 PRO 39 1HG PRO 39 7.437 -11.494 6.414
303 HD2 PRO 39 2HD PRO 39 5.082 -10.088 6.166
304 HD3 PRO 39 1HD PRO 39 6.555 -9.397 6.867
305 H GLU 40 H GLU 40 7.937 -10.091 1.445
306 HA GLU 40 HA GLU 40 5.429 -10.176 0.098
307 HB2 GLU 40 2HB GLU 40 6.728 -11.055 -1.802
308 HB3 GLU 40 1HB GLU 40 7.516 -9.648 -1.081
309 HG2 GLU 40 2HG GLU 40 8.851 -11.331 0.334
310 HG3 GLU 40 1HG GLU 40 8.262 -12.562 -0.786
311 H GLY 41 H GLY 41 4.004 -11.773 -0.085
312 HA2 GLY 41 2HA GLY 41 3.676 -14.181 -0.594
313 HA3 GLY 41 1HA GLY 41 4.815 -14.522 0.704
314 H LYS 42 H LYS 42 3.580 -12.204 2.262
315 HA LYS 42 HA LYS 42 1.692 -13.795 3.708
316 HB2 LYS 42 2HB LYS 42 2.839 -11.051 3.958
317 HB3 LYS 42 1HB LYS 42 1.305 -11.341 4.769
318 HG2 LYS 42 2HG LYS 42 3.556 -13.319 5.115
319 HG3 LYS 42 1HG LYS 42 3.573 -11.820 6.037
320 HD2 LYS 42 2HD LYS 42 1.552 -12.326 7.145
321 HD3 LYS 42 1HD LYS 42 1.121 -13.573 5.974
322 HE2 LYS 42 2HE LYS 42 3.443 -13.716 7.922
323 HE3 LYS 42 1HE LYS 42 1.913 -14.578 8.090
324 HZ1 LYS 42 3HZ LYS 42 2.798 -16.181 6.870
325 HZ2 LYS 42 1HZ LYS 42 4.185 -15.261 6.542
326 HZ3 LYS 42 2HZ LYS 42 2.818 -15.121 5.542
327 H VAL 43 H VAL 43 -0.089 -14.313 2.660
328 HA VAL 43 HA VAL 43 -1.468 -12.671 0.808
329 HB VAL 43 HB VAL 43 -2.665 -14.958 2.375
330 HG11 VAL 43 1HG1 VAL 43 -4.226 -13.720 0.970
331 HG12 VAL 43 2HG1 VAL 43 -3.892 -15.281 0.222
332 HG13 VAL 43 3HG1 VAL 43 -3.122 -13.821 -0.399
333 HG21 VAL 43 3HG2 VAL 43 -0.730 -14.961 0.048
334 HG22 VAL 43 1HG2 VAL 43 -1.797 -16.326 0.380
335 HG23 VAL 43 2HG2 VAL 43 -0.596 -15.835 1.573
336 H MET 44 H MET 44 -2.802 -11.032 1.133
337 HA MET 44 HA MET 44 -3.943 -10.587 3.833
338 HB2 MET 44 2HB MET 44 -3.839 -8.568 1.602
339 HB3 MET 44 1HB MET 44 -4.016 -8.286 3.308
340 HG2 MET 44 2HG MET 44 -1.725 -8.894 3.729
341 HG3 MET 44 1HG MET 44 -1.514 -9.456 2.073
342 HE1 MET 44 3HE MET 44 -0.804 -7.040 -0.087
343 HE2 MET 44 1HE MET 44 -2.491 -6.549 0.054
344 HE3 MET 44 2HE MET 44 -2.053 -8.250 0.165
345 H GLU 45 H GLU 45 -6.202 -10.020 3.967
346 HA GLU 45 HA GLU 45 -7.804 -10.677 1.557
347 HB2 GLU 45 2HB GLU 45 -7.634 -12.643 3.099
348 HB3 GLU 45 1HB GLU 45 -8.418 -11.669 4.346
349 HG2 GLU 45 2HG GLU 45 -10.377 -11.358 2.908
350 HG3 GLU 45 1HG GLU 45 -9.591 -12.265 1.613
351 H THR 46 H THR 46 -9.200 -9.131 1.085
352 HA THR 46 HA THR 46 -9.666 -6.904 2.775
353 HB THR 46 HB THR 46 -11.511 -6.395 1.102
354 HG1 THR 46 1HG THR 46 -11.550 -7.748 -0.705
355 HG21 THR 46 3HG2 THR 46 -8.805 -7.053 -0.075
356 HG22 THR 46 1HG2 THR 46 -9.132 -5.624 0.903
357 HG23 THR 46 2HG2 THR 46 -9.939 -5.836 -0.651
358 H ARG 47 H ARG 47 -12.122 -6.228 3.074
359 HA ARG 47 HA ARG 47 -13.174 -7.948 5.078
360 HB2 ARG 47 2HB ARG 47 -14.506 -5.629 3.655
361 HB3 ARG 47 1HB ARG 47 -15.039 -6.360 5.171
362 HG2 ARG 47 2HG ARG 47 -12.817 -5.779 6.173
363 HG3 ARG 47 1HG ARG 47 -12.414 -4.925 4.682
364 HD2 ARG 47 2HD ARG 47 -14.286 -3.407 4.988
365 HD3 ARG 47 1HD ARG 47 -14.838 -4.314 6.393
366 HE ARG 47 HE ARG 47 -12.198 -3.512 6.889
367 HH11 ARG 47 1HH2 ARG 47 -15.331 -2.147 6.348
368 HH12 ARG 47 2HH2 ARG 47 -15.037 -0.740 7.315
369 HH21 ARG 47 1HH1 ARG 47 -11.805 -1.669 8.158
370 HH22 ARG 47 2HH1 ARG 47 -13.041 -0.469 8.340
371 H ASP 48 H ASP 48 -13.927 -7.412 1.681
372 HA ASP 48 HA ASP 48 -16.328 -8.983 1.688
373 HB2 ASP 48 2HB ASP 48 -16.147 -8.835 -0.770
374 HB3 ASP 48 1HB ASP 48 -15.954 -7.256 -0.006
375 H GLY 49 H GLY 49 -12.945 -9.562 0.783
376 HA2 GLY 49 2HA GLY 49 -12.169 -11.875 1.475
377 HA3 GLY 49 1HA GLY 49 -13.533 -12.465 0.527
378 H THR 50 H THR 50 -11.359 -9.770 -0.256
379 HA THR 50 HA THR 50 -10.822 -10.965 -2.867
380 HB THR 50 HB THR 50 -9.735 -8.363 -1.785
381 HG1 THR 50 1HG THR 50 -12.274 -9.079 -2.703
382 HG21 THR 50 3HG2 THR 50 -8.713 -9.162 -3.850
383 HG22 THR 50 1HG2 THR 50 -9.760 -7.788 -4.210
384 HG23 THR 50 2HG2 THR 50 -10.303 -9.427 -4.565
385 H LYS 51 H LYS 51 -8.926 -11.858 -3.490
386 HA LYS 51 HA LYS 51 -6.893 -12.316 -1.424
387 HB2 LYS 51 2HB LYS 51 -7.661 -14.255 -2.680
388 HB3 LYS 51 1HB LYS 51 -7.241 -13.467 -4.204
389 HG2 LYS 51 2HG LYS 51 -4.904 -13.520 -3.693
390 HG3 LYS 51 1HG LYS 51 -5.212 -13.977 -2.018
391 HD2 LYS 51 2HD LYS 51 -6.129 -16.132 -2.749
392 HD3 LYS 51 1HD LYS 51 -5.884 -15.679 -4.437
393 HE2 LYS 51 2HE LYS 51 -3.488 -15.614 -4.146
394 HE3 LYS 51 1HE LYS 51 -3.645 -15.820 -2.402
395 HZ1 LYS 51 3HZ LYS 51 -4.865 -17.840 -4.125
396 HZ2 LYS 51 1HZ LYS 51 -4.132 -18.013 -2.606
397 HZ3 LYS 51 2HZ LYS 51 -3.171 -17.840 -3.997
398 H ILE 52 H ILE 52 -5.207 -11.023 -1.267
399 HA ILE 52 HA ILE 52 -3.966 -9.912 -3.711
400 HB ILE 52 HB ILE 52 -3.544 -7.801 -2.298
401 HG12 ILE 52 2HG1 ILE 52 -4.748 -9.278 -0.292
402 HG13 ILE 52 1HG1 ILE 52 -4.570 -7.526 -0.278
403 HG21 ILE 52 1HG2 ILE 52 -4.985 -7.706 -4.214
404 HG22 ILE 52 2HG2 ILE 52 -5.816 -6.878 -2.894
405 HG23 ILE 52 3HG2 ILE 52 -6.293 -8.516 -3.348
406 HD11 ILE 52 3HD1 ILE 52 -6.969 -8.940 -1.445
407 HD12 ILE 52 1HD1 ILE 52 -6.782 -7.217 -1.115
408 HD13 ILE 52 2HD1 ILE 52 -6.890 -8.365 0.219
409 H ILE 53 H ILE 53 -1.871 -10.352 -3.745
410 HA ILE 53 HA ILE 53 -0.542 -11.367 -1.339
411 HB ILE 53 HB ILE 53 0.693 -11.058 -4.075
412 HG12 ILE 53 2HG1 ILE 53 -1.378 -12.236 -4.448
413 HG13 ILE 53 1HG1 ILE 53 -0.076 -13.427 -4.460
414 HG21 ILE 53 1HG2 ILE 53 2.201 -11.632 -2.231
415 HG22 ILE 53 2HG2 ILE 53 2.000 -13.024 -3.295
416 HG23 ILE 53 3HG2 ILE 53 1.143 -12.960 -1.756
417 HD11 ILE 53 3HD1 ILE 53 -0.592 -13.763 -1.961
418 HD12 ILE 53 1HD1 ILE 53 -1.776 -14.391 -3.107
419 HD13 ILE 53 2HD1 ILE 53 -2.079 -12.869 -2.269
420 H MET 54 H MET 54 1.260 -10.422 -0.407
421 HA MET 54 HA MET 54 1.399 -7.562 -0.616
422 HB2 MET 54 2HB MET 54 1.763 -8.854 1.513
423 HB3 MET 54 1HB MET 54 3.307 -9.397 0.849
424 HG2 MET 54 2HG MET 54 3.751 -7.443 2.209
425 HG3 MET 54 1HG MET 54 3.928 -6.976 0.528
426 HE1 MET 54 3HE MET 54 2.451 -3.683 1.228
427 HE2 MET 54 1HE MET 54 3.174 -4.657 -0.059
428 HE3 MET 54 2HE MET 54 3.910 -4.618 1.541
429 H LYS 55 H LYS 55 2.010 -7.134 -2.759
430 HA LYS 55 HA LYS 55 4.464 -8.211 -3.842
431 HB2 LYS 55 2HB LYS 55 2.843 -5.879 -4.878
432 HB3 LYS 55 1HB LYS 55 4.005 -6.857 -5.775
433 HG2 LYS 55 2HG LYS 55 1.388 -7.829 -4.606
434 HG3 LYS 55 1HG LYS 55 1.714 -7.545 -6.312
435 HD2 LYS 55 2HD LYS 55 3.692 -9.225 -5.962
436 HD3 LYS 55 1HD LYS 55 2.801 -9.710 -4.518
437 HE2 LYS 55 2HE LYS 55 0.755 -9.910 -6.113
438 HE3 LYS 55 1HE LYS 55 1.956 -9.909 -7.405
439 HZ1 LYS 55 3HZ LYS 55 2.385 -11.692 -5.125
440 HZ2 LYS 55 1HZ LYS 55 2.800 -11.901 -6.755
441 HZ3 LYS 55 2HZ LYS 55 1.192 -12.121 -6.256
442 H GLY 56 H GLY 56 3.352 -5.047 -2.686
443 HA2 GLY 56 2HA GLY 56 6.008 -3.893 -2.959
444 HA3 GLY 56 1HA GLY 56 4.550 -3.070 -2.434
445 H ASN 57 H ASN 57 6.879 -5.543 -1.315
446 HA ASN 57 HA ASN 57 6.193 -5.151 1.452
447 HB2 ASN 57 2HB ASN 57 7.144 -7.278 0.766
448 HB3 ASN 57 1HB ASN 57 8.589 -6.471 0.150
449 HD21 ASN 57 1HD2 ASN 57 7.111 -5.319 3.134
450 HD22 ASN 57 2HD2 ASN 57 8.323 -5.904 4.178
451 H GLU 58 H GLU 58 8.025 -3.456 -0.833
452 HA GLU 58 HA GLU 58 9.941 -2.290 0.984
453 HB2 GLU 58 2HB GLU 58 9.108 -1.432 -1.800
454 HB3 GLU 58 1HB GLU 58 10.516 -0.845 -0.914
455 HG2 GLU 58 2HG GLU 58 11.451 -3.112 -0.853
456 HG3 GLU 58 1HG GLU 58 10.027 -3.737 -1.683
457 H ILE 59 H ILE 59 7.670 -1.957 2.281
458 HA ILE 59 HA ILE 59 5.950 0.121 1.811
459 HB ILE 59 HB ILE 59 5.996 0.434 4.357
460 HG12 ILE 59 2HG1 ILE 59 7.841 -1.965 4.174
461 HG13 ILE 59 1HG1 ILE 59 8.413 -0.329 4.512
462 HG21 ILE 59 1HG2 ILE 59 5.657 -2.353 3.205
463 HG22 ILE 59 2HG2 ILE 59 4.431 -1.085 3.204
464 HG23 ILE 59 3HG2 ILE 59 4.973 -1.788 4.729
465 HD11 ILE 59 3HD1 ILE 59 6.232 -1.625 6.155
466 HD12 ILE 59 1HD1 ILE 59 7.214 -0.217 6.561
467 HD13 ILE 59 2HD1 ILE 59 7.939 -1.825 6.547
468 H PHE 60 H PHE 60 9.334 0.298 2.344
469 HA PHE 60 HA PHE 60 9.752 2.778 3.474
470 HB2 PHE 60 2HB PHE 60 11.548 1.191 2.804
471 HB3 PHE 60 1HB PHE 60 11.273 1.633 1.119
472 HD1 PHE 60 1HD PHE 60 12.518 2.794 4.388
473 HD2 PHE 60 2HD PHE 60 11.905 3.828 0.264
474 HE1 PHE 60 1HE PHE 60 13.989 4.772 4.665
475 HE2 PHE 60 2HE PHE 60 13.376 5.805 0.542
476 HZ PHE 60 HZ PHE 60 14.418 6.278 2.742
477 H ARG 61 H ARG 61 8.523 1.995 0.307
478 HA ARG 61 HA ARG 61 8.977 4.336 -1.099
479 HB2 ARG 61 2HB ARG 61 7.887 2.207 -1.941
480 HB3 ARG 61 1HB ARG 61 6.397 2.767 -1.192
481 HG2 ARG 61 2HG ARG 61 6.138 3.597 -3.358
482 HG3 ARG 61 1HG ARG 61 6.872 4.983 -2.557
483 HD2 ARG 61 2HD ARG 61 9.072 4.365 -3.414
484 HD3 ARG 61 1HD ARG 61 8.422 2.881 -4.104
485 HE ARG 61 HE ARG 61 8.204 5.540 -5.215
486 HH11 ARG 61 1HH2 ARG 61 6.845 2.364 -5.011
487 HH12 ARG 61 2HH2 ARG 61 6.038 2.461 -6.541
488 HH21 ARG 61 1HH1 ARG 61 7.148 5.674 -7.223
489 HH22 ARG 61 2HH1 ARG 61 6.210 4.334 -7.792
490 H LEU 62 H LEU 62 6.188 3.595 1.031
491 HA LEU 62 HA LEU 62 4.789 5.964 0.752
492 HB2 LEU 62 2HB LEU 62 3.870 4.149 2.053
493 HB3 LEU 62 1HB LEU 62 5.197 4.241 3.207
494 HG LEU 62 HG LEU 62 4.452 6.409 3.993
495 HD11 LEU 62 1HD1 LEU 62 2.584 6.232 1.625
496 HD12 LEU 62 2HD1 LEU 62 3.682 7.541 2.064
497 HD13 LEU 62 3HD1 LEU 62 2.212 7.276 2.999
498 HD21 LEU 62 3HD2 LEU 62 2.137 5.810 4.767
499 HD22 LEU 62 1HD2 LEU 62 3.321 4.527 5.014
500 HD23 LEU 62 2HD2 LEU 62 2.182 4.428 3.671
501 H ASP 63 H ASP 63 7.385 5.255 3.093
502 HA ASP 63 HA ASP 63 7.489 7.780 4.304
503 HB2 ASP 63 2HB ASP 63 8.644 5.797 5.196
504 HB3 ASP 63 1HB ASP 63 9.759 5.832 3.833
505 H GLU 64 H GLU 64 9.142 9.449 4.059
506 HA GLU 64 HA GLU 64 10.712 9.657 1.687
507 HB2 GLU 64 2HB GLU 64 9.464 11.525 0.633
508 HB3 GLU 64 1HB GLU 64 8.558 10.013 0.609
509 HG2 GLU 64 2HG GLU 64 6.965 11.595 1.329
510 HG3 GLU 64 1HG GLU 64 7.501 10.846 2.829
511 H ALA 65 H ALA 65 11.082 12.286 1.392
512 HA ALA 65 HA ALA 65 11.111 13.808 3.792
513 HB1 ALA 65 1HB ALA 65 13.644 12.341 3.047
514 HB2 ALA 65 2HB ALA 65 12.797 12.319 4.594
515 HB3 ALA 65 3HB ALA 65 13.635 13.779 4.066
516 H LEU 66 H LEU 66 10.393 14.233 1.092
517 HA LEU 66 HA LEU 66 10.556 15.864 -0.512
518 HB2 LEU 66 2HB LEU 66 11.074 17.220 1.658
519 HB3 LEU 66 1HB LEU 66 12.740 17.187 1.087
520 HG LEU 66 HG LEU 66 11.667 18.014 -1.195
521 HD11 LEU 66 1HD1 LEU 66 9.604 18.850 0.870
522 HD12 LEU 66 2HD1 LEU 66 9.325 17.824 -0.535
523 HD13 LEU 66 3HD1 LEU 66 9.723 19.525 -0.753
524 HD21 LEU 66 3HD2 LEU 66 11.965 20.358 -0.446
525 HD22 LEU 66 1HD2 LEU 66 13.258 19.318 0.154
526 HD23 LEU 66 2HD2 LEU 66 11.953 19.815 1.233
527 H ARG 67 H ARG 67 12.985 13.781 0.306
528 HA ARG 67 HA ARG 67 15.084 14.685 -1.423
529 HB2 ARG 67 2HB ARG 67 14.496 12.005 -0.152
530 HB3 ARG 67 1HB ARG 67 15.937 12.332 -1.116
531 HG2 ARG 67 2HG ARG 67 16.616 14.100 0.415
532 HG3 ARG 67 1HG ARG 67 15.125 13.915 1.339
533 HD2 ARG 67 2HD ARG 67 17.001 12.749 2.441
534 HD3 ARG 67 1HD ARG 67 15.760 11.612 1.923
535 HE ARG 67 HE ARG 67 17.313 10.677 0.481
536 HH11 ARG 67 1HH2 ARG 67 18.289 13.854 1.445
537 HH12 ARG 67 2HH2 ARG 67 19.836 13.763 0.674
538 HH21 ARG 67 1HH1 ARG 67 19.341 10.550 -0.534
539 HH22 ARG 67 2HH1 ARG 67 20.433 11.893 -0.446
540 H LYS 68 H LYS 68 12.716 12.023 -1.680
541 HA LYS 68 HA LYS 68 13.377 11.422 -4.390
542 HB2 LYS 68 2HB LYS 68 10.746 10.764 -3.074
543 HB3 LYS 68 1HB LYS 68 11.617 9.852 -4.308
544 HG2 LYS 68 2HG LYS 68 12.458 10.246 -1.421
545 HG3 LYS 68 1HG LYS 68 11.909 8.743 -2.163
546 HD2 LYS 68 2HD LYS 68 13.869 9.029 -3.804
547 HD3 LYS 68 1HD LYS 68 14.475 10.250 -2.684
548 HE2 LYS 68 2HE LYS 68 15.462 8.032 -2.209
549 HE3 LYS 68 1HE LYS 68 14.475 8.598 -0.861
550 HZ1 LYS 68 3HZ LYS 68 12.743 7.166 -1.434
551 HZ2 LYS 68 1HZ LYS 68 14.138 6.220 -1.622
552 HZ3 LYS 68 2HZ LYS 68 13.365 6.870 -2.988
553 H GLY 69 H GLY 69 10.703 13.211 -2.869
554 HA2 GLY 69 2HA GLY 69 9.392 14.922 -3.696
555 HA3 GLY 69 1HA GLY 69 10.472 15.006 -5.085
556 H HIS 70 H HIS 70 8.236 15.405 -6.069
557 HA HIS 70 HA HIS 70 6.395 13.269 -6.361
558 HB2 HIS 70 2HB HIS 70 6.899 15.656 -8.155
559 HB3 HIS 70 1HB HIS 70 5.489 14.598 -8.236
560 HD2 HIS 70 2HD HIS 70 7.048 17.209 -5.687
561 HE1 HIS 70 1HE HIS 70 2.994 16.576 -4.689
562 HE2 HIS 70 2HE HIS 70 5.069 17.938 -4.148
563 H SER 71 H SER 71 9.498 13.732 -7.619
564 HA SER 71 HA SER 71 9.312 12.627 -10.192
565 HB2 SER 71 2HB SER 71 11.339 13.736 -9.319
566 HB3 SER 71 1HB SER 71 11.591 12.389 -8.213
567 HG SER 71 HG SER 71 11.418 12.179 -11.043
568 H GLU 72 H GLU 72 9.636 10.520 -10.967
569 HA GLU 72 HA GLU 72 8.361 8.458 -9.532
570 HB2 GLU 72 2HB GLU 72 8.574 8.566 -12.020
571 HB3 GLU 72 1HB GLU 72 10.280 8.152 -11.852
572 HG2 GLU 72 2HG GLU 72 9.701 6.042 -10.771
573 HG3 GLU 72 1HG GLU 72 7.991 6.462 -10.805
574 H GLY 73 H GLY 73 11.758 9.319 -9.913
575 HA2 GLY 73 2HA GLY 73 13.644 8.635 -8.786
576 HA3 GLY 73 1HA GLY 73 12.562 8.079 -7.512
577 H GLY 74 H GLY 74 14.363 7.175 -10.350
578 HA2 GLY 74 2HA GLY 74 14.690 4.495 -9.556
579 HA3 GLY 74 1HA GLY 74 13.400 4.565 -10.752
580 H1 HOH 201 H2 HOH 77 3.640 13.440 -4.155
581 H2 HOH 201 H1 HOH 77 4.092 12.979 -5.524
Start of MODEL 13
1 H1 VAL 1 1H VAL 1 0.524 13.436 -14.108
2 H2 VAL 1 2H VAL 1 2.085 12.819 -13.851
3 HA VAL 1 HA VAL 1 0.274 11.490 -12.810
4 HB VAL 1 HB VAL 1 2.280 12.744 -10.911
5 HG11 VAL 1 2HG1 VAL 1 2.182 10.466 -9.866
6 HG12 VAL 1 3HG1 VAL 1 0.857 10.066 -10.959
7 HG13 VAL 1 1HG1 VAL 1 0.656 11.344 -9.761
8 HG21 VAL 1 1HG2 VAL 1 3.718 10.812 -11.653
9 HG22 VAL 1 2HG2 VAL 1 3.434 12.011 -12.914
10 HG23 VAL 1 3HG2 VAL 1 2.540 10.491 -12.925
11 H ASP 2 H ASP 2 1.108 14.138 -10.583
12 HA ASP 2 HA ASP 2 -0.185 15.388 -9.154
13 HB2 ASP 2 2HB ASP 2 -2.389 15.032 -11.189
14 HB3 ASP 2 1HB ASP 2 -2.171 16.363 -10.053
15 H MET 3 H MET 3 -2.583 15.394 -8.159
16 HA MET 3 HA MET 3 -2.811 12.952 -6.730
17 HB2 MET 3 2HB MET 3 -3.501 15.254 -5.920
18 HB3 MET 3 1HB MET 3 -4.928 15.095 -6.944
19 HG2 MET 3 2HG MET 3 -5.567 14.341 -4.755
20 HG3 MET 3 1HG MET 3 -5.399 12.898 -5.757
21 HE1 MET 3 3HE MET 3 -5.393 13.107 -2.538
22 HE2 MET 3 1HE MET 3 -4.210 11.841 -2.185
23 HE3 MET 3 2HE MET 3 -5.396 11.610 -3.467
24 H SER 4 H SER 4 -4.328 14.202 -9.614
25 HA SER 4 HA SER 4 -6.631 12.691 -9.807
26 HB2 SER 4 2HB SER 4 -4.692 13.334 -12.040
27 HB3 SER 4 1HB SER 4 -6.377 12.863 -12.244
28 HG SER 4 HG SER 4 -5.374 15.159 -10.902
29 H ASN 5 H ASN 5 -3.439 11.570 -9.611
30 HA ASN 5 HA ASN 5 -3.392 9.286 -11.189
31 HB2 ASN 5 2HB ASN 5 -1.483 10.168 -9.837
32 HB3 ASN 5 1HB ASN 5 -2.263 9.526 -8.392
33 HD21 ASN 5 1HD2 ASN 5 -1.083 7.677 -7.837
34 HD22 ASN 5 2HD2 ASN 5 -0.663 6.442 -8.924
35 H VAL 6 H VAL 6 -4.216 7.256 -11.040
36 HA VAL 6 HA VAL 6 -6.555 6.825 -9.493
37 HB VAL 6 HB VAL 6 -4.842 4.736 -10.853
38 HG11 VAL 6 1HG1 VAL 6 -7.780 4.868 -10.106
39 HG12 VAL 6 2HG1 VAL 6 -6.563 3.811 -9.387
40 HG13 VAL 6 3HG1 VAL 6 -7.047 3.583 -11.067
41 HG21 VAL 6 3HG2 VAL 6 -5.383 6.586 -12.397
42 HG22 VAL 6 1HG2 VAL 6 -7.087 6.455 -11.961
43 HG23 VAL 6 2HG2 VAL 6 -6.290 5.134 -12.818
44 H VAL 7 H VAL 7 -6.446 6.732 -7.329
45 HA VAL 7 HA VAL 7 -4.185 5.632 -5.930
46 HB VAL 7 HB VAL 7 -5.528 6.068 -3.908
47 HG11 VAL 7 1HG1 VAL 7 -5.807 8.522 -4.265
48 HG12 VAL 7 2HG1 VAL 7 -5.595 8.267 -5.997
49 HG13 VAL 7 3HG1 VAL 7 -4.269 7.921 -4.886
50 HG21 VAL 7 3HG2 VAL 7 -7.734 5.459 -4.692
51 HG22 VAL 7 1HG2 VAL 7 -7.680 6.692 -5.953
52 HG23 VAL 7 2HG2 VAL 7 -7.777 7.168 -4.257
53 H LYS 8 H LYS 8 -5.347 4.241 -3.845
54 HA LYS 8 HA LYS 8 -7.053 2.125 -4.724
55 HB2 LYS 8 2HB LYS 8 -4.861 1.588 -5.897
56 HB3 LYS 8 1HB LYS 8 -4.166 1.345 -4.297
57 HG2 LYS 8 2HG LYS 8 -4.835 -0.832 -4.754
58 HG3 LYS 8 1HG LYS 8 -6.290 -0.233 -3.968
59 HD2 LYS 8 2HD LYS 8 -7.069 -1.296 -5.947
60 HD3 LYS 8 1HD LYS 8 -7.127 0.424 -6.303
61 HE2 LYS 8 2HE LYS 8 -4.589 -1.001 -7.013
62 HE3 LYS 8 1HE LYS 8 -6.008 -1.340 -8.000
63 HZ1 LYS 8 3HZ LYS 8 -6.205 1.267 -7.896
64 HZ2 LYS 8 1HZ LYS 8 -5.250 0.488 -9.060
65 HZ3 LYS 8 2HZ LYS 8 -4.525 1.151 -7.675
66 H THR 9 H THR 9 -7.808 0.939 -3.011
67 HA THR 9 HA THR 9 -6.398 0.945 -0.468
68 HB THR 9 HB THR 9 -9.165 2.149 -0.617
69 HG1 THR 9 1HG THR 9 -6.598 3.263 -0.699
70 HG21 THR 9 3HG2 THR 9 -8.661 2.783 1.715
71 HG22 THR 9 1HG2 THR 9 -7.098 1.975 1.593
72 HG23 THR 9 2HG2 THR 9 -8.586 1.035 1.501
73 H TYR 10 H TYR 10 -6.467 -1.172 -0.019
74 HA TYR 10 HA TYR 10 -8.979 -2.671 -0.484
75 HB2 TYR 10 2HB TYR 10 -6.219 -3.762 0.122
76 HB3 TYR 10 1HB TYR 10 -7.641 -4.689 -0.326
77 HD1 TYR 10 2HD TYR 10 -8.800 -3.351 -2.616
78 HD2 TYR 10 1HD TYR 10 -4.641 -3.831 -1.610
79 HE1 TYR 10 2HE TYR 10 -8.192 -3.122 -4.997
80 HE2 TYR 10 1HE TYR 10 -4.047 -3.604 -3.999
81 HH TYR 10 HH TYR 10 -4.943 -3.737 -6.134
82 H ASP 11 H ASP 11 -10.252 -2.815 1.229
83 HA ASP 11 HA ASP 11 -9.351 -2.259 3.881
84 HB2 ASP 11 2HB ASP 11 -11.953 -3.289 2.757
85 HB3 ASP 11 1HB ASP 11 -11.697 -3.014 4.480
86 H LEU 12 H LEU 12 -7.871 -3.699 4.640
87 HA LEU 12 HA LEU 12 -8.073 -6.533 4.330
88 HB2 LEU 12 2HB LEU 12 -6.251 -4.601 5.544
89 HB3 LEU 12 1HB LEU 12 -6.448 -6.001 6.591
90 HG LEU 12 HG LEU 12 -5.741 -7.505 4.834
91 HD11 LEU 12 1HD1 LEU 12 -6.426 -6.877 2.748
92 HD12 LEU 12 2HD1 LEU 12 -4.838 -6.127 2.662
93 HD13 LEU 12 3HD1 LEU 12 -6.250 -5.155 3.083
94 HD21 LEU 12 3HD2 LEU 12 -3.446 -6.409 4.278
95 HD22 LEU 12 1HD2 LEU 12 -3.858 -6.657 5.973
96 HD23 LEU 12 2HD2 LEU 12 -4.017 -5.056 5.246
97 H GLN 13 H GLN 13 -8.266 -8.044 6.177
98 HA GLN 13 HA GLN 13 -10.678 -7.471 7.661
99 HB2 GLN 13 2HB GLN 13 -8.851 -9.868 7.476
100 HB3 GLN 13 1HB GLN 13 -10.220 -9.813 8.590
101 HG2 GLN 13 2HG GLN 13 -10.545 -9.212 5.645
102 HG3 GLN 13 1HG GLN 13 -10.641 -10.858 6.273
103 HE21 GLN 13 1HE2 GLN 13 -12.562 -11.476 7.380
104 HE22 GLN 13 2HE2 GLN 13 -13.880 -10.423 7.614
105 H ASP 14 H ASP 14 -7.304 -7.202 8.202
106 HA ASP 14 HA ASP 14 -7.455 -7.383 11.098
107 HB2 ASP 14 2HB ASP 14 -5.212 -6.481 9.272
108 HB3 ASP 14 1HB ASP 14 -5.073 -6.744 11.013
109 H GLY 15 H GLY 15 -8.886 -5.274 9.329
110 HA2 GLY 15 2HA GLY 15 -9.669 -3.147 9.821
111 HA3 GLY 15 1HA GLY 15 -8.583 -3.107 11.208
112 H SER 16 H SER 16 -6.437 -3.971 9.111
113 HA SER 16 HA SER 16 -5.420 -1.322 8.676
114 HB2 SER 16 2HB SER 16 -3.537 -2.459 7.601
115 HB3 SER 16 1HB SER 16 -3.938 -3.244 9.130
116 HG SER 16 HG SER 16 -3.658 -4.744 7.415
117 H LYS 17 H LYS 17 -4.485 -0.862 6.377
118 HA LYS 17 HA LYS 17 -6.312 -1.671 4.224
119 HB2 LYS 17 2HB LYS 17 -5.851 1.222 4.999
120 HB3 LYS 17 1HB LYS 17 -6.733 0.665 3.576
121 HG2 LYS 17 2HG LYS 17 -8.286 -0.579 5.114
122 HG3 LYS 17 1HG LYS 17 -7.472 0.193 6.473
123 HD2 LYS 17 2HD LYS 17 -8.009 2.424 5.419
124 HD3 LYS 17 1HD LYS 17 -9.003 1.559 4.246
125 HE2 LYS 17 2HE LYS 17 -10.348 0.613 6.095
126 HE3 LYS 17 1HE LYS 17 -9.369 1.508 7.257
127 HZ1 LYS 17 3HZ LYS 17 -10.432 3.401 6.803
128 HZ2 LYS 17 1HZ LYS 17 -11.626 2.426 6.094
129 HZ3 LYS 17 2HZ LYS 17 -10.421 3.131 5.125
130 H VAL 18 H VAL 18 -5.132 -2.143 2.503
131 HA VAL 18 HA VAL 18 -2.342 -1.387 2.381
132 HB VAL 18 HB VAL 18 -3.704 -2.650 0.036
133 HG11 VAL 18 1HG1 VAL 18 -1.629 -3.997 0.029
134 HG12 VAL 18 2HG1 VAL 18 -1.105 -3.168 1.496
135 HG13 VAL 18 3HG1 VAL 18 -1.294 -2.266 -0.006
136 HG21 VAL 18 3HG2 VAL 18 -4.757 -3.795 1.943
137 HG22 VAL 18 1HG2 VAL 18 -3.166 -4.122 2.629
138 HG23 VAL 18 2HG2 VAL 18 -3.645 -4.868 1.100
139 H HIS 19 H HIS 19 -1.379 -0.281 0.578
140 HA HIS 19 HA HIS 19 -3.137 1.357 -1.112
141 HB2 HIS 19 2HB HIS 19 -2.868 3.088 0.386
142 HB3 HIS 19 1HB HIS 19 -1.461 2.348 1.135
143 HD1 HIS 19 1HD HIS 19 -2.438 4.475 -1.843
144 HD2 HIS 19 2HD HIS 19 1.004 3.267 0.176
145 HE1 HIS 19 1HE HIS 19 -0.531 5.844 -2.798
146 HE2 HIS 19 2HE HIS 19 1.576 5.119 -1.576
147 H VAL 20 H VAL 20 -2.438 0.987 -3.133
148 HA VAL 20 HA VAL 20 0.342 0.158 -3.525
149 HB VAL 20 HB VAL 20 -0.297 -0.947 -5.444
150 HG11 VAL 20 1HG1 VAL 20 -1.639 -2.062 -3.861
151 HG12 VAL 20 2HG1 VAL 20 -2.730 -1.755 -5.195
152 HG13 VAL 20 3HG1 VAL 20 -2.795 -0.749 -3.755
153 HG21 VAL 20 3HG2 VAL 20 -2.372 1.220 -5.784
154 HG22 VAL 20 1HG2 VAL 20 -2.384 -0.246 -6.767
155 HG23 VAL 20 2HG2 VAL 20 -0.997 0.841 -6.823
156 H PHE 21 H PHE 21 1.682 1.053 -5.144
157 HA PHE 21 HA PHE 21 1.286 3.951 -5.479
158 HB2 PHE 21 2HB PHE 21 3.689 2.138 -5.778
159 HB3 PHE 21 1HB PHE 21 3.706 3.846 -6.215
160 HD1 PHE 21 2HD PHE 21 3.287 1.451 -3.420
161 HD2 PHE 21 1HD PHE 21 3.721 5.576 -4.539
162 HE1 PHE 21 2HE PHE 21 3.665 2.055 -1.045
163 HE2 PHE 21 1HE PHE 21 4.099 6.180 -2.164
164 HZ PHE 21 HZ PHE 21 4.071 4.420 -0.417
165 H LYS 22 H LYS 22 2.851 4.407 -7.699
166 HA LYS 22 HA LYS 22 1.028 3.717 -9.820
167 HB2 LYS 22 2HB LYS 22 2.685 5.006 -11.230
168 HB3 LYS 22 1HB LYS 22 1.993 5.909 -9.880
169 HG2 LYS 22 2HG LYS 22 3.965 5.663 -8.568
170 HG3 LYS 22 1HG LYS 22 4.611 4.419 -9.640
171 HD2 LYS 22 2HD LYS 22 5.695 6.645 -9.982
172 HD3 LYS 22 1HD LYS 22 4.889 6.047 -11.432
173 HE2 LYS 22 2HE LYS 22 4.477 8.515 -10.756
174 HE3 LYS 22 1HE LYS 22 3.074 7.536 -11.184
175 HZ1 LYS 22 3HZ LYS 22 2.341 7.490 -9.064
176 HZ2 LYS 22 1HZ LYS 22 3.218 8.937 -8.949
177 HZ3 LYS 22 2HZ LYS 22 3.902 7.485 -8.393
178 H ASP 23 H ASP 23 3.878 2.356 -8.503
179 HA ASP 23 HA ASP 23 4.720 0.995 -10.925
180 HB2 ASP 23 2HB ASP 23 6.274 1.723 -9.060
181 HB3 ASP 23 1HB ASP 23 5.586 0.422 -8.088
182 H GLY 24 H GLY 24 2.126 0.596 -8.992
183 HA2 GLY 24 2HA GLY 24 0.566 -1.134 -9.008
184 HA3 GLY 24 1HA GLY 24 1.746 -2.162 -9.816
185 H LYS 25 H LYS 25 3.667 -1.179 -7.565
186 HA LYS 25 HA LYS 25 3.456 -3.489 -5.913
187 HB2 LYS 25 2HB LYS 25 4.995 -0.894 -5.724
188 HB3 LYS 25 1HB LYS 25 5.089 -2.111 -4.456
189 HG2 LYS 25 2HG LYS 25 5.754 -3.794 -6.190
190 HG3 LYS 25 1HG LYS 25 5.791 -2.491 -7.379
191 HD2 LYS 25 2HD LYS 25 7.437 -1.293 -5.883
192 HD3 LYS 25 1HD LYS 25 7.505 -2.753 -4.895
193 HE2 LYS 25 2HE LYS 25 8.342 -4.053 -6.749
194 HE3 LYS 25 1HE LYS 25 8.077 -2.718 -7.871
195 HZ1 LYS 25 3HZ LYS 25 10.408 -3.200 -6.702
196 HZ2 LYS 25 1HZ LYS 25 9.740 -2.141 -5.559
197 HZ3 LYS 25 2HZ LYS 25 9.911 -1.644 -7.174
198 H MET 26 H MET 26 2.691 -3.709 -3.827
199 HA MET 26 HA MET 26 0.499 -2.003 -3.098
200 HB2 MET 26 2HB MET 26 1.556 -4.643 -2.262
201 HB3 MET 26 1HB MET 26 0.706 -3.743 -1.006
202 HG2 MET 26 2HG MET 26 -1.285 -3.645 -2.265
203 HG3 MET 26 1HG MET 26 -0.466 -4.073 -3.768
204 HE1 MET 26 3HE MET 26 -2.106 -5.659 -4.396
205 HE2 MET 26 1HE MET 26 -1.963 -7.378 -3.999
206 HE3 MET 26 2HE MET 26 -0.601 -6.520 -4.713
207 H GLY 27 H GLY 27 0.410 -1.878 -0.452
208 HA2 GLY 27 2HA GLY 27 2.869 -0.848 0.692
209 HA3 GLY 27 1HA GLY 27 1.661 0.387 0.348
210 H MET 28 H MET 28 2.761 -1.760 2.640
211 HA MET 28 HA MET 28 0.207 -2.315 3.905
212 HB2 MET 28 2HB MET 28 2.250 -3.860 3.872
213 HB3 MET 28 1HB MET 28 2.947 -2.780 5.075
214 HG2 MET 28 2HG MET 28 1.844 -4.567 6.255
215 HG3 MET 28 1HG MET 28 0.886 -3.108 6.463
216 HE1 MET 28 3HE MET 28 -1.871 -3.545 6.356
217 HE2 MET 28 1HE MET 28 -0.761 -4.476 7.372
218 HE3 MET 28 2HE MET 28 -2.041 -5.293 6.486
219 H GLU 29 H GLU 29 -0.512 -0.147 4.293
220 HA GLU 29 HA GLU 29 0.968 1.339 6.385
221 HB2 GLU 29 2HB GLU 29 0.373 2.551 4.279
222 HB3 GLU 29 1HB GLU 29 -1.330 2.276 4.651
223 HG2 GLU 29 2HG GLU 29 -1.080 3.487 6.775
224 HG3 GLU 29 1HG GLU 29 0.633 3.737 6.441
225 H ASN 30 H ASN 30 0.332 0.565 8.332
226 HA ASN 30 HA ASN 30 -2.223 -0.506 8.901
227 HB2 ASN 30 2HB ASN 30 -1.529 -0.234 11.294
228 HB3 ASN 30 1HB ASN 30 -0.351 -1.089 10.299
229 HD21 ASN 30 1HD2 ASN 30 -1.093 2.322 11.247
230 HD22 ASN 30 2HD2 ASN 30 0.539 2.765 11.444
231 H LYS 31 H LYS 31 -3.800 0.373 10.424
232 HA LYS 31 HA LYS 31 -4.677 2.969 9.645
233 HB2 LYS 31 2HB LYS 31 -6.539 2.586 11.114
234 HB3 LYS 31 1HB LYS 31 -6.164 1.059 10.316
235 HG2 LYS 31 2HG LYS 31 -6.186 0.191 12.445
236 HG3 LYS 31 1HG LYS 31 -4.563 0.863 12.551
237 HD2 LYS 31 2HD LYS 31 -5.566 1.755 14.466
238 HD3 LYS 31 1HD LYS 31 -5.815 3.058 13.308
239 HE2 LYS 31 2HE LYS 31 -7.891 2.570 14.551
240 HE3 LYS 31 1HE LYS 31 -8.085 2.215 12.834
241 HZ1 LYS 31 3HZ LYS 31 -7.072 -0.011 14.327
242 HZ2 LYS 31 1HZ LYS 31 -8.383 0.064 13.254
243 HZ3 LYS 31 2HZ LYS 31 -8.594 0.501 14.881
244 H PHE 32 H PHE 32 -2.388 1.968 11.907
245 HA PHE 32 HA PHE 32 -2.871 4.028 13.876
246 HB2 PHE 32 2HB PHE 32 -1.720 1.713 14.198
247 HB3 PHE 32 1HB PHE 32 -0.280 2.517 13.577
248 HD1 PHE 32 2HD PHE 32 -2.836 2.564 16.265
249 HD2 PHE 32 1HD PHE 32 0.929 4.117 14.900
250 HE1 PHE 32 2HE PHE 32 -2.439 3.565 18.500
251 HE2 PHE 32 1HE PHE 32 1.327 5.118 17.134
252 HZ PHE 32 HZ PHE 32 -0.358 4.842 18.934
253 H GLY 33 H GLY 33 -2.095 4.435 10.842
254 HA2 GLY 33 2HA GLY 33 -1.078 6.137 9.667
255 HA3 GLY 33 1HA GLY 33 -0.832 6.952 11.210
256 H LYS 34 H LYS 34 0.369 3.734 10.484
257 HA LYS 34 HA LYS 34 3.120 4.759 10.163
258 HB2 LYS 34 2HB LYS 34 2.201 2.723 12.204
259 HB3 LYS 34 1HB LYS 34 3.889 2.951 11.742
260 HG2 LYS 34 2HG LYS 34 3.655 5.381 12.360
261 HG3 LYS 34 1HG LYS 34 2.049 5.011 12.991
262 HD2 LYS 34 2HD LYS 34 3.093 3.301 14.498
263 HD3 LYS 34 1HD LYS 34 4.678 3.834 13.938
264 HE2 LYS 34 2HE LYS 34 2.646 5.717 15.158
265 HE3 LYS 34 1HE LYS 34 3.887 4.897 16.107
266 HZ1 LYS 34 3HZ LYS 34 5.095 6.032 13.850
267 HZ2 LYS 34 1HZ LYS 34 5.333 6.429 15.483
268 HZ3 LYS 34 2HZ LYS 34 4.134 7.226 14.583
269 H SER 35 H SER 35 4.605 3.109 9.348
270 HA SER 35 HA SER 35 3.277 1.399 7.378
271 HB2 SER 35 2HB SER 35 6.244 1.801 7.727
272 HB3 SER 35 1HB SER 35 5.375 1.293 6.284
273 HG SER 35 HG SER 35 5.474 3.362 5.857
274 H MET 36 H MET 36 2.862 -0.665 7.823
275 HA MET 36 HA MET 36 4.337 -2.025 9.976
276 HB2 MET 36 2HB MET 36 1.714 -1.941 9.607
277 HB3 MET 36 1HB MET 36 2.035 -3.267 8.492
278 HG2 MET 36 2HG MET 36 2.756 -3.158 11.435
279 HG3 MET 36 1HG MET 36 1.541 -4.192 10.681
280 HE1 MET 36 3HE MET 36 4.179 -4.835 12.563
281 HE2 MET 36 1HE MET 36 4.602 -6.421 11.906
282 HE3 MET 36 2HE MET 36 2.914 -6.001 12.188
283 H ASN 37 H ASN 37 6.121 -3.077 9.361
284 HA ASN 37 HA ASN 37 6.698 -3.836 6.692
285 HB2 ASN 37 2HB ASN 37 8.495 -3.425 8.261
286 HB3 ASN 37 1HB ASN 37 7.923 -4.719 9.314
287 HD21 ASN 37 1HD2 ASN 37 7.486 -5.621 6.067
288 HD22 ASN 37 2HD2 ASN 37 8.900 -6.553 5.886
289 H MET 38 H MET 38 5.413 -5.263 5.671
290 HA MET 38 HA MET 38 4.683 -7.771 7.057
291 HB2 MET 38 2HB MET 38 2.727 -6.661 6.308
292 HB3 MET 38 1HB MET 38 3.432 -6.319 4.725
293 HG2 MET 38 2HG MET 38 3.305 -8.606 4.077
294 HG3 MET 38 1HG MET 38 3.068 -9.141 5.727
295 HE1 MET 38 3HE MET 38 -0.514 -8.787 6.531
296 HE2 MET 38 1HE MET 38 0.746 -7.678 7.092
297 HE3 MET 38 2HE MET 38 1.101 -9.394 6.907
298 HA PRO 39 HA PRO 39 7.927 -9.709 4.536
299 HB2 PRO 39 2HB PRO 39 6.040 -12.041 4.783
300 HB3 PRO 39 1HB PRO 39 7.803 -11.990 5.004
301 HG2 PRO 39 2HG PRO 39 6.152 -12.062 7.094
302 HG3 PRO 39 1HG PRO 39 7.644 -11.104 7.129
303 HD2 PRO 39 2HD PRO 39 4.818 -10.164 6.905
304 HD3 PRO 39 1HD PRO 39 6.233 -9.341 7.589
305 H GLU 40 H GLU 40 8.164 -10.130 2.341
306 HA GLU 40 HA GLU 40 5.985 -9.410 0.623
307 HB2 GLU 40 2HB GLU 40 8.427 -8.911 0.188
308 HB3 GLU 40 1HB GLU 40 8.638 -10.626 -0.171
309 HG2 GLU 40 2HG GLU 40 6.828 -10.435 -1.884
310 HG3 GLU 40 1HG GLU 40 6.792 -8.695 -1.598
311 H GLY 41 H GLY 41 4.462 -11.076 1.262
312 HA2 GLY 41 2HA GLY 41 4.027 -13.072 -0.531
313 HA3 GLY 41 1HA GLY 41 5.057 -13.842 0.673
314 H LYS 42 H LYS 42 3.675 -11.822 2.652
315 HA LYS 42 HA LYS 42 1.889 -13.676 3.763
316 HB2 LYS 42 2HB LYS 42 2.911 -11.154 4.506
317 HB3 LYS 42 1HB LYS 42 1.175 -10.909 4.442
318 HG2 LYS 42 2HG LYS 42 1.516 -11.632 6.649
319 HG3 LYS 42 1HG LYS 42 1.040 -13.118 5.834
320 HD2 LYS 42 2HD LYS 42 3.602 -13.441 5.451
321 HD3 LYS 42 1HD LYS 42 3.774 -12.232 6.723
322 HE2 LYS 42 2HE LYS 42 2.425 -13.621 8.245
323 HE3 LYS 42 1HE LYS 42 2.229 -14.829 6.975
324 HZ1 LYS 42 3HZ LYS 42 4.774 -13.984 8.245
325 HZ2 LYS 42 1HZ LYS 42 4.673 -15.031 6.914
326 HZ3 LYS 42 2HZ LYS 42 4.005 -15.489 8.409
327 H VAL 43 H VAL 43 -0.162 -14.181 3.338
328 HA VAL 43 HA VAL 43 -1.477 -12.942 1.067
329 HB VAL 43 HB VAL 43 -2.589 -15.084 2.881
330 HG11 VAL 43 1HG1 VAL 43 -3.860 -15.692 0.893
331 HG12 VAL 43 2HG1 VAL 43 -3.006 -14.479 -0.061
332 HG13 VAL 43 3HG1 VAL 43 -4.102 -13.978 1.226
333 HG21 VAL 43 3HG2 VAL 43 -0.708 -15.323 0.516
334 HG22 VAL 43 1HG2 VAL 43 -1.588 -16.679 1.220
335 HG23 VAL 43 2HG2 VAL 43 -0.381 -15.818 2.175
336 H MET 44 H MET 44 -2.604 -11.110 1.325
337 HA MET 44 HA MET 44 -3.945 -10.584 3.907
338 HB2 MET 44 2HB MET 44 -3.603 -8.738 1.542
339 HB3 MET 44 1HB MET 44 -4.147 -8.300 3.150
340 HG2 MET 44 2HG MET 44 -1.959 -8.796 4.067
341 HG3 MET 44 1HG MET 44 -1.412 -9.443 2.518
342 HE1 MET 44 3HE MET 44 -1.413 -8.329 0.459
343 HE2 MET 44 1HE MET 44 -0.889 -6.660 0.209
344 HE3 MET 44 2HE MET 44 -2.601 -7.037 0.324
345 H GLU 45 H GLU 45 -6.151 -10.601 4.058
346 HA GLU 45 HA GLU 45 -7.694 -11.110 1.564
347 HB2 GLU 45 2HB GLU 45 -7.537 -13.051 3.136
348 HB3 GLU 45 1HB GLU 45 -8.351 -12.069 4.358
349 HG2 GLU 45 2HG GLU 45 -10.288 -11.793 2.878
350 HG3 GLU 45 1HG GLU 45 -9.476 -12.724 1.617
351 H THR 46 H THR 46 -9.082 -9.563 1.040
352 HA THR 46 HA THR 46 -9.674 -7.414 2.854
353 HB THR 46 HB THR 46 -10.940 -6.467 1.028
354 HG1 THR 46 1HG THR 46 -12.040 -8.179 0.231
355 HG21 THR 46 3HG2 THR 46 -8.443 -6.470 0.922
356 HG22 THR 46 1HG2 THR 46 -9.207 -6.396 -0.665
357 HG23 THR 46 2HG2 THR 46 -8.526 -7.915 -0.082
358 H ARG 47 H ARG 47 -12.104 -6.672 2.869
359 HA ARG 47 HA ARG 47 -13.526 -8.574 4.439
360 HB2 ARG 47 2HB ARG 47 -14.525 -6.014 3.161
361 HB3 ARG 47 1HB ARG 47 -15.316 -6.901 4.467
362 HG2 ARG 47 2HG ARG 47 -13.549 -6.430 5.994
363 HG3 ARG 47 1HG ARG 47 -12.480 -5.879 4.703
364 HD2 ARG 47 2HD ARG 47 -13.432 -3.975 5.966
365 HD3 ARG 47 1HD ARG 47 -13.941 -3.958 4.280
366 HE ARG 47 HE ARG 47 -15.881 -5.364 5.742
367 HH11 ARG 47 1HH2 ARG 47 -14.515 -2.193 5.485
368 HH12 ARG 47 2HH2 ARG 47 -15.966 -1.380 5.968
369 HH21 ARG 47 1HH1 ARG 47 -17.786 -4.303 6.376
370 HH22 ARG 47 2HH1 ARG 47 -17.818 -2.574 6.473
371 H ASP 48 H ASP 48 -13.766 -7.481 1.089
372 HA ASP 48 HA ASP 48 -16.165 -8.923 0.496
373 HB2 ASP 48 2HB ASP 48 -14.007 -7.834 -1.328
374 HB3 ASP 48 1HB ASP 48 -15.573 -8.450 -1.863
375 H GLY 49 H GLY 49 -13.073 -9.935 1.183
376 HA2 GLY 49 2HA GLY 49 -12.308 -12.143 1.255
377 HA3 GLY 49 1HA GLY 49 -13.616 -12.615 0.172
378 H THR 50 H THR 50 -11.413 -9.935 -0.455
379 HA THR 50 HA THR 50 -10.575 -11.231 -2.948
380 HB THR 50 HB THR 50 -9.804 -8.485 -1.954
381 HG1 THR 50 1HG THR 50 -11.913 -8.981 -3.731
382 HG21 THR 50 3HG2 THR 50 -10.011 -9.727 -4.707
383 HG22 THR 50 1HG2 THR 50 -8.515 -9.372 -3.844
384 HG23 THR 50 2HG2 THR 50 -9.560 -8.055 -4.373
385 H LYS 51 H LYS 51 -8.834 -12.487 -2.935
386 HA LYS 51 HA LYS 51 -6.889 -12.370 -0.803
387 HB2 LYS 51 2HB LYS 51 -7.570 -14.513 -1.835
388 HB3 LYS 51 1HB LYS 51 -6.871 -13.981 -3.368
389 HG2 LYS 51 2HG LYS 51 -4.665 -13.966 -2.478
390 HG3 LYS 51 1HG LYS 51 -5.251 -14.066 -0.817
391 HD2 LYS 51 2HD LYS 51 -4.424 -16.255 -1.500
392 HD3 LYS 51 1HD LYS 51 -6.176 -16.332 -1.324
393 HE2 LYS 51 2HE LYS 51 -6.523 -16.281 -3.673
394 HE3 LYS 51 1HE LYS 51 -4.870 -15.751 -3.986
395 HZ1 LYS 51 3HZ LYS 51 -5.855 -18.370 -3.814
396 HZ2 LYS 51 1HZ LYS 51 -4.760 -18.138 -2.539
397 HZ3 LYS 51 2HZ LYS 51 -4.268 -17.858 -4.142
398 H ILE 52 H ILE 52 -5.482 -10.733 -0.783
399 HA ILE 52 HA ILE 52 -4.050 -10.069 -3.299
400 HB ILE 52 HB ILE 52 -3.780 -7.755 -2.009
401 HG12 ILE 52 2HG1 ILE 52 -6.511 -8.626 -1.042
402 HG13 ILE 52 1HG1 ILE 52 -5.091 -8.751 -0.030
403 HG21 ILE 52 1HG2 ILE 52 -5.732 -6.906 -3.192
404 HG22 ILE 52 2HG2 ILE 52 -6.379 -8.540 -3.344
405 HG23 ILE 52 3HG2 ILE 52 -4.901 -8.092 -4.200
406 HD11 ILE 52 3HD1 ILE 52 -6.208 -6.245 -1.285
407 HD12 ILE 52 1HD1 ILE 52 -4.670 -6.305 -0.430
408 HD13 ILE 52 2HD1 ILE 52 -6.167 -6.632 0.435
409 H ILE 53 H ILE 53 -1.969 -10.466 -3.223
410 HA ILE 53 HA ILE 53 -0.679 -11.157 -0.699
411 HB ILE 53 HB ILE 53 0.606 -11.129 -3.429
412 HG12 ILE 53 2HG1 ILE 53 -1.448 -12.364 -3.705
413 HG13 ILE 53 1HG1 ILE 53 -0.135 -13.534 -3.564
414 HG21 ILE 53 1HG2 ILE 53 2.095 -11.484 -1.523
415 HG22 ILE 53 2HG2 ILE 53 1.909 -12.993 -2.416
416 HG23 ILE 53 3HG2 ILE 53 1.038 -12.752 -0.903
417 HD11 ILE 53 3HD1 ILE 53 -0.695 -13.587 -1.048
418 HD12 ILE 53 1HD1 ILE 53 -1.840 -14.367 -2.137
419 HD13 ILE 53 2HD1 ILE 53 -2.191 -12.767 -1.488
420 H MET 54 H MET 54 1.097 -10.140 0.164
421 HA MET 54 HA MET 54 1.284 -7.313 -0.257
422 HB2 MET 54 2HB MET 54 1.639 -8.481 1.951
423 HB3 MET 54 1HB MET 54 3.177 -9.072 1.318
424 HG2 MET 54 2HG MET 54 3.745 -7.085 2.497
425 HG3 MET 54 1HG MET 54 3.720 -6.611 0.811
426 HE1 MET 54 3HE MET 54 3.598 -4.062 1.794
427 HE2 MET 54 1HE MET 54 2.033 -3.418 1.279
428 HE3 MET 54 2HE MET 54 2.930 -4.503 0.224
429 H LYS 55 H LYS 55 1.863 -7.177 -2.503
430 HA LYS 55 HA LYS 55 4.340 -8.296 -3.461
431 HB2 LYS 55 2HB LYS 55 2.784 -6.010 -4.687
432 HB3 LYS 55 1HB LYS 55 3.909 -7.103 -5.496
433 HG2 LYS 55 2HG LYS 55 1.252 -7.879 -4.271
434 HG3 LYS 55 1HG LYS 55 1.587 -7.729 -5.993
435 HD2 LYS 55 2HD LYS 55 3.481 -9.452 -5.562
436 HD3 LYS 55 1HD LYS 55 2.638 -9.782 -4.047
437 HE2 LYS 55 2HE LYS 55 0.520 -10.060 -5.513
438 HE3 LYS 55 1HE LYS 55 1.641 -10.166 -6.870
439 HZ1 LYS 55 3HZ LYS 55 1.868 -12.295 -6.351
440 HZ2 LYS 55 1HZ LYS 55 1.018 -12.116 -4.894
441 HZ3 LYS 55 2HZ LYS 55 2.688 -11.813 -4.945
442 H GLY 56 H GLY 56 3.218 -5.006 -2.777
443 HA2 GLY 56 2HA GLY 56 5.815 -3.843 -3.060
444 HA3 GLY 56 1HA GLY 56 4.364 -3.041 -2.475
445 H ASN 57 H ASN 57 6.603 -5.611 -1.361
446 HA ASN 57 HA ASN 57 6.106 -5.041 1.402
447 HB2 ASN 57 2HB ASN 57 6.866 -7.253 0.737
448 HB3 ASN 57 1HB ASN 57 8.347 -6.575 0.059
449 HD21 ASN 57 1HD2 ASN 57 6.899 -5.430 3.101
450 HD22 ASN 57 2HD2 ASN 57 8.154 -5.994 4.102
451 H GLU 58 H GLU 58 7.683 -3.340 -0.941
452 HA GLU 58 HA GLU 58 9.892 -2.347 0.678
453 HB2 GLU 58 2HB GLU 58 8.867 -1.483 -2.038
454 HB3 GLU 58 1HB GLU 58 10.353 -0.915 -1.274
455 HG2 GLU 58 2HG GLU 58 11.214 -3.227 -1.223
456 HG3 GLU 58 1HG GLU 58 9.731 -3.795 -1.988
457 H ILE 59 H ILE 59 7.579 -1.934 2.043
458 HA ILE 59 HA ILE 59 6.067 0.318 1.677
459 HB ILE 59 HB ILE 59 6.053 0.490 4.202
460 HG12 ILE 59 2HG1 ILE 59 7.837 -1.954 4.002
461 HG13 ILE 59 1HG1 ILE 59 8.442 -0.344 4.404
462 HG21 ILE 59 1HG2 ILE 59 4.436 -0.918 3.073
463 HG22 ILE 59 2HG2 ILE 59 5.044 -1.801 4.475
464 HG23 ILE 59 3HG2 ILE 59 5.635 -2.195 2.860
465 HD11 ILE 59 3HD1 ILE 59 6.199 -1.669 5.941
466 HD12 ILE 59 1HD1 ILE 59 7.138 -0.251 6.406
467 HD13 ILE 59 2HD1 ILE 59 7.895 -1.845 6.392
468 H PHE 60 H PHE 60 9.446 0.180 2.096
469 HA PHE 60 HA PHE 60 10.125 2.497 3.425
470 HB2 PHE 60 2HB PHE 60 11.724 0.814 2.479
471 HB3 PHE 60 1HB PHE 60 11.451 1.520 0.887
472 HD1 PHE 60 1HD PHE 60 12.896 2.066 4.233
473 HD2 PHE 60 2HD PHE 60 12.268 3.751 0.331
474 HE1 PHE 60 1HE PHE 60 14.563 3.834 4.728
475 HE2 PHE 60 2HE PHE 60 13.935 5.519 0.827
476 HZ PHE 60 HZ PHE 60 15.083 5.561 3.026
477 H ARG 61 H ARG 61 8.715 2.134 0.252
478 HA ARG 61 HA ARG 61 9.293 4.673 -0.819
479 HB2 ARG 61 2HB ARG 61 8.336 2.762 -2.104
480 HB3 ARG 61 1HB ARG 61 6.801 3.016 -1.273
481 HG2 ARG 61 2HG ARG 61 6.568 5.223 -2.210
482 HG3 ARG 61 1HG ARG 61 8.209 5.180 -2.856
483 HD2 ARG 61 2HD ARG 61 6.078 3.194 -3.671
484 HD3 ARG 61 1HD ARG 61 6.356 4.703 -4.537
485 HE ARG 61 HE ARG 61 8.797 3.268 -4.235
486 HH11 ARG 61 1HH2 ARG 61 5.786 3.302 -5.941
487 HH12 ARG 61 2HH2 ARG 61 6.411 2.498 -7.341
488 HH21 ARG 61 1HH1 ARG 61 9.624 2.213 -6.070
489 HH22 ARG 61 2HH1 ARG 61 8.585 1.882 -7.414
490 H LEU 62 H LEU 62 6.448 3.544 1.013
491 HA LEU 62 HA LEU 62 5.049 5.967 1.052
492 HB2 LEU 62 2HB LEU 62 4.440 3.521 1.898
493 HB3 LEU 62 1HB LEU 62 4.973 4.157 3.451
494 HG LEU 62 HG LEU 62 2.795 5.304 1.676
495 HD11 LEU 62 1HD1 LEU 62 2.204 3.273 2.988
496 HD12 LEU 62 2HD1 LEU 62 1.322 4.699 3.532
497 HD13 LEU 62 3HD1 LEU 62 2.699 4.108 4.461
498 HD21 LEU 62 3HD2 LEU 62 2.487 6.801 3.778
499 HD22 LEU 62 1HD2 LEU 62 3.800 7.199 2.673
500 HD23 LEU 62 2HD2 LEU 62 4.143 6.341 4.176
501 H ASP 63 H ASP 63 7.317 4.636 3.465
502 HA ASP 63 HA ASP 63 7.291 6.697 5.311
503 HB2 ASP 63 2HB ASP 63 9.602 4.972 4.404
504 HB3 ASP 63 1HB ASP 63 9.647 6.014 5.825
505 H GLU 64 H GLU 64 10.176 6.389 3.307
506 HA GLU 64 HA GLU 64 10.601 9.223 3.317
507 HB2 GLU 64 2HB GLU 64 11.983 7.039 1.738
508 HB3 GLU 64 1HB GLU 64 12.557 8.698 1.912
509 HG2 GLU 64 2HG GLU 64 13.741 7.417 3.547
510 HG3 GLU 64 1HG GLU 64 12.511 8.316 4.431
511 H ALA 65 H ALA 65 11.632 8.605 0.359
512 HA ALA 65 HA ALA 65 10.942 9.167 -1.758
513 HB1 ALA 65 1HB ALA 65 8.145 8.436 -0.898
514 HB2 ALA 65 2HB ALA 65 9.370 7.213 -1.236
515 HB3 ALA 65 3HB ALA 65 8.860 8.326 -2.506
516 H LEU 66 H LEU 66 11.381 11.390 -1.393
517 HA LEU 66 HA LEU 66 9.389 13.165 -0.338
518 HB2 LEU 66 2HB LEU 66 11.987 13.576 -1.814
519 HB3 LEU 66 1HB LEU 66 10.944 14.930 -1.384
520 HG LEU 66 HG LEU 66 12.756 14.465 0.296
521 HD11 LEU 66 1HD1 LEU 66 11.432 15.041 2.100
522 HD12 LEU 66 2HD1 LEU 66 10.174 13.873 1.710
523 HD13 LEU 66 3HD1 LEU 66 10.297 15.374 0.795
524 HD21 LEU 66 3HD2 LEU 66 12.771 12.477 1.586
525 HD22 LEU 66 1HD2 LEU 66 12.531 11.921 -0.069
526 HD23 LEU 66 2HD2 LEU 66 11.162 12.008 1.040
527 H ARG 67 H ARG 67 8.735 15.124 -1.734
528 HA ARG 67 HA ARG 67 7.154 14.136 -3.906
529 HB2 ARG 67 2HB ARG 67 7.699 16.987 -3.039
530 HB3 ARG 67 1HB ARG 67 6.422 16.468 -4.141
531 HG2 ARG 67 2HG ARG 67 5.488 15.032 -2.333
532 HG3 ARG 67 1HG ARG 67 6.716 15.659 -1.235
533 HD2 ARG 67 2HD ARG 67 4.670 17.351 -2.694
534 HD3 ARG 67 1HD ARG 67 4.555 16.866 -1.006
535 HE ARG 67 HE ARG 67 7.033 18.122 -1.342
536 HH11 ARG 67 1HH2 ARG 67 3.654 18.832 -1.576
537 HH12 ARG 67 2HH2 ARG 67 3.833 20.499 -1.145
538 HH21 ARG 67 1HH1 ARG 67 7.276 20.308 -0.776
539 HH22 ARG 67 2HH1 ARG 67 5.883 21.336 -0.691
540 H LYS 68 H LYS 68 8.401 13.399 -5.586
541 HA LYS 68 HA LYS 68 9.418 15.318 -7.421
542 HB2 LYS 68 2HB LYS 68 11.791 14.621 -7.384
543 HB3 LYS 68 1HB LYS 68 11.310 15.394 -5.872
544 HG2 LYS 68 2HG LYS 68 10.923 13.134 -4.884
545 HG3 LYS 68 1HG LYS 68 11.533 12.413 -6.373
546 HD2 LYS 68 2HD LYS 68 13.689 13.572 -6.058
547 HD3 LYS 68 1HD LYS 68 13.081 14.295 -4.568
548 HE2 LYS 68 2HE LYS 68 12.767 12.045 -3.601
549 HE3 LYS 68 1HE LYS 68 13.380 11.323 -5.088
550 HZ1 LYS 68 3HZ LYS 68 14.815 12.551 -2.924
551 HZ2 LYS 68 1HZ LYS 68 15.292 13.127 -4.447
552 HZ3 LYS 68 2HZ LYS 68 15.361 11.464 -4.109
553 H GLY 69 H GLY 69 8.034 12.512 -6.744
554 HA2 GLY 69 2HA GLY 69 9.220 10.612 -8.465
555 HA3 GLY 69 1HA GLY 69 7.546 10.595 -7.919
556 H HIS 70 H HIS 70 6.851 13.169 -9.012
557 HA HIS 70 HA HIS 70 6.012 12.404 -11.592
558 HB2 HIS 70 2HB HIS 70 4.866 14.116 -10.221
559 HB3 HIS 70 1HB HIS 70 6.241 15.198 -10.448
560 HD2 HIS 70 2HD HIS 70 6.672 15.878 -13.304
561 HE1 HIS 70 1HE HIS 70 2.651 15.086 -14.318
562 HE2 HIS 70 2HE HIS 70 4.810 16.158 -15.114
563 H SER 71 H SER 71 8.464 14.814 -10.626
564 HA SER 71 HA SER 71 9.395 15.291 -13.263
565 HB2 SER 71 2HB SER 71 10.914 15.670 -10.675
566 HB3 SER 71 1HB SER 71 11.231 16.467 -12.214
567 HG SER 71 HG SER 71 8.664 16.640 -11.119
568 H GLU 72 H GLU 72 10.851 14.250 -14.494
569 HA GLU 72 HA GLU 72 12.952 12.627 -13.501
570 HB2 GLU 72 2HB GLU 72 12.104 10.425 -14.291
571 HB3 GLU 72 1HB GLU 72 11.179 11.059 -12.929
572 HG2 GLU 72 2HG GLU 72 9.505 11.969 -14.539
573 HG3 GLU 72 1HG GLU 72 10.402 11.213 -15.855
574 H GLY 73 H GLY 73 13.825 11.185 -15.387
575 HA2 GLY 73 2HA GLY 73 14.734 11.121 -17.499
576 HA3 GLY 73 1HA GLY 73 13.194 11.763 -18.066
577 H GLY 74 H GLY 74 16.471 12.493 -17.236
578 HA2 GLY 74 2HA GLY 74 16.565 14.849 -18.774
579 HA3 GLY 74 1HA GLY 74 16.374 15.298 -17.082
580 H1 HOH 201 H2 HOH 77 3.270 16.796 -11.228
581 H2 HOH 201 H1 HOH 77 1.820 17.112 -10.928
Start of MODEL 14
1 H1 VAL 1 1H VAL 1 3.732 12.909 -11.532
2 H2 VAL 1 2H VAL 1 5.215 12.454 -12.216
3 HA VAL 1 HA VAL 1 3.446 11.222 -13.240
4 HB VAL 1 HB VAL 1 4.283 8.945 -12.822
5 HG11 VAL 1 2HG1 VAL 1 6.457 11.059 -12.724
6 HG12 VAL 1 3HG1 VAL 1 5.626 10.506 -14.179
7 HG13 VAL 1 1HG1 VAL 1 6.662 9.398 -13.280
8 HG21 VAL 1 1HG2 VAL 1 5.825 10.183 -10.520
9 HG22 VAL 1 2HG2 VAL 1 5.891 8.504 -11.042
10 HG23 VAL 1 3HG2 VAL 1 4.417 9.144 -10.322
11 H ASP 2 H ASP 2 2.119 12.461 -11.060
12 HA ASP 2 HA ASP 2 0.229 10.322 -10.368
13 HB2 ASP 2 2HB ASP 2 1.100 12.227 -8.207
14 HB3 ASP 2 1HB ASP 2 0.317 10.652 -8.056
15 H MET 3 H MET 3 -0.007 12.392 -12.269
16 HA MET 3 HA MET 3 -1.368 14.667 -11.235
17 HB2 MET 3 2HB MET 3 -0.312 14.579 -13.489
18 HB3 MET 3 1HB MET 3 -1.561 13.445 -14.001
19 HG2 MET 3 2HG MET 3 -2.326 16.107 -12.805
20 HG3 MET 3 1HG MET 3 -1.897 15.980 -14.510
21 HE1 MET 3 3HE MET 3 -4.724 16.875 -13.110
22 HE2 MET 3 1HE MET 3 -5.808 16.258 -14.365
23 HE3 MET 3 2HE MET 3 -4.297 17.045 -14.810
24 H SER 4 H SER 4 -2.518 11.644 -12.730
25 HA SER 4 HA SER 4 -5.271 12.189 -12.543
26 HB2 SER 4 2HB SER 4 -5.563 9.753 -12.778
27 HB3 SER 4 1HB SER 4 -4.369 10.368 -13.916
28 HG SER 4 HG SER 4 -3.646 8.487 -12.821
29 H ASN 5 H ASN 5 -3.091 11.952 -10.081
30 HA ASN 5 HA ASN 5 -3.198 11.422 -7.832
31 HB2 ASN 5 2HB ASN 5 -5.054 12.482 -6.699
32 HB3 ASN 5 1HB ASN 5 -4.556 13.503 -8.046
33 HD21 ASN 5 1HD2 ASN 5 -5.941 13.435 -10.029
34 HD22 ASN 5 2HD2 ASN 5 -7.568 12.968 -9.897
35 H VAL 6 H VAL 6 -3.327 9.082 -8.883
36 HA VAL 6 HA VAL 6 -5.684 7.579 -8.766
37 HB VAL 6 HB VAL 6 -4.202 5.616 -8.572
38 HG11 VAL 6 1HG1 VAL 6 -4.514 6.931 -10.735
39 HG12 VAL 6 2HG1 VAL 6 -3.063 5.933 -10.653
40 HG13 VAL 6 3HG1 VAL 6 -2.950 7.675 -10.402
41 HG21 VAL 6 3HG2 VAL 6 -2.589 6.486 -6.964
42 HG22 VAL 6 1HG2 VAL 6 -2.082 7.735 -8.101
43 HG23 VAL 6 2HG2 VAL 6 -1.734 6.040 -8.441
44 H VAL 7 H VAL 7 -6.378 6.019 -7.174
45 HA VAL 7 HA VAL 7 -5.424 6.376 -4.426
46 HB VAL 7 HB VAL 7 -8.306 6.863 -5.223
47 HG11 VAL 7 1HG1 VAL 7 -8.501 7.453 -2.777
48 HG12 VAL 7 2HG1 VAL 7 -6.883 6.786 -2.547
49 HG13 VAL 7 3HG1 VAL 7 -8.199 5.743 -3.084
50 HG21 VAL 7 3HG2 VAL 7 -6.067 8.678 -4.292
51 HG22 VAL 7 1HG2 VAL 7 -7.765 9.140 -4.188
52 HG23 VAL 7 2HG2 VAL 7 -7.034 8.819 -5.760
53 H LYS 8 H LYS 8 -4.771 4.226 -4.489
54 HA LYS 8 HA LYS 8 -6.825 2.163 -4.969
55 HB2 LYS 8 2HB LYS 8 -4.385 2.190 -5.955
56 HB3 LYS 8 1HB LYS 8 -3.929 1.576 -4.369
57 HG2 LYS 8 2HG LYS 8 -4.328 -0.422 -5.498
58 HG3 LYS 8 1HG LYS 8 -5.925 -0.128 -4.802
59 HD2 LYS 8 2HD LYS 8 -6.674 0.896 -6.912
60 HD3 LYS 8 1HD LYS 8 -5.068 0.671 -7.605
61 HE2 LYS 8 2HE LYS 8 -5.379 -1.830 -7.078
62 HE3 LYS 8 1HE LYS 8 -7.084 -1.440 -6.834
63 HZ1 LYS 8 3HZ LYS 8 -6.072 -0.281 -9.230
64 HZ2 LYS 8 1HZ LYS 8 -7.404 -1.307 -9.011
65 HZ3 LYS 8 2HZ LYS 8 -5.853 -1.967 -9.225
66 H THR 9 H THR 9 -7.660 0.958 -3.356
67 HA THR 9 HA THR 9 -6.360 0.905 -0.723
68 HB THR 9 HB THR 9 -9.247 1.744 -1.046
69 HG1 THR 9 1HG THR 9 -6.858 3.158 -0.914
70 HG21 THR 9 3HG2 THR 9 -7.379 1.673 1.341
71 HG22 THR 9 1HG2 THR 9 -8.701 0.544 1.039
72 HG23 THR 9 2HG2 THR 9 -9.047 2.245 1.359
73 H TYR 10 H TYR 10 -6.922 -0.857 0.539
74 HA TYR 10 HA TYR 10 -8.885 -2.785 -0.527
75 HB2 TYR 10 2HB TYR 10 -5.967 -3.327 0.035
76 HB3 TYR 10 1HB TYR 10 -7.174 -4.603 -0.053
77 HD1 TYR 10 2HD TYR 10 -8.768 -4.458 -2.181
78 HD2 TYR 10 1HD TYR 10 -4.838 -2.746 -1.938
79 HE1 TYR 10 2HE TYR 10 -8.619 -4.455 -4.655
80 HE2 TYR 10 1HE TYR 10 -4.688 -2.738 -4.414
81 HH TYR 10 HH TYR 10 -5.638 -3.479 -6.312
82 H ASP 11 H ASP 11 -10.264 -2.529 1.191
83 HA ASP 11 HA ASP 11 -9.557 -2.200 3.876
84 HB2 ASP 11 2HB ASP 11 -12.031 -3.375 2.608
85 HB3 ASP 11 1HB ASP 11 -11.877 -3.049 4.333
86 H LEU 12 H LEU 12 -7.995 -3.599 4.594
87 HA LEU 12 HA LEU 12 -8.151 -6.444 4.254
88 HB2 LEU 12 2HB LEU 12 -6.290 -4.487 5.326
89 HB3 LEU 12 1HB LEU 12 -6.433 -5.833 6.444
90 HG LEU 12 HG LEU 12 -5.726 -7.412 4.780
91 HD11 LEU 12 1HD1 LEU 12 -6.388 -5.223 2.859
92 HD12 LEU 12 2HD1 LEU 12 -6.593 -6.967 2.697
93 HD13 LEU 12 3HD1 LEU 12 -5.011 -6.249 2.449
94 HD21 LEU 12 3HD2 LEU 12 -4.102 -4.857 4.805
95 HD22 LEU 12 1HD2 LEU 12 -3.521 -6.324 4.027
96 HD23 LEU 12 2HD2 LEU 12 -3.855 -6.324 5.755
97 H GLN 13 H GLN 13 -8.285 -7.976 6.050
98 HA GLN 13 HA GLN 13 -10.599 -7.408 7.685
99 HB2 GLN 13 2HB GLN 13 -10.370 -9.739 8.415
100 HB3 GLN 13 1HB GLN 13 -10.272 -9.625 6.656
101 HG2 GLN 13 2HG GLN 13 -7.764 -9.582 6.873
102 HG3 GLN 13 1HG GLN 13 -7.961 -9.911 8.596
103 HE21 GLN 13 1HE2 GLN 13 -9.850 -11.269 5.855
104 HE22 GLN 13 2HE2 GLN 13 -9.423 -12.887 6.173
105 H ASP 14 H ASP 14 -7.221 -7.108 8.026
106 HA ASP 14 HA ASP 14 -7.165 -7.426 10.914
107 HB2 ASP 14 2HB ASP 14 -5.096 -6.396 8.958
108 HB3 ASP 14 1HB ASP 14 -4.815 -6.655 10.681
109 H GLY 15 H GLY 15 -8.710 -5.254 9.251
110 HA2 GLY 15 2HA GLY 15 -9.548 -3.188 9.907
111 HA3 GLY 15 1HA GLY 15 -8.394 -3.176 11.240
112 H SER 16 H SER 16 -6.388 -3.910 8.925
113 HA SER 16 HA SER 16 -5.537 -1.161 8.496
114 HB2 SER 16 2HB SER 16 -3.515 -2.127 7.610
115 HB3 SER 16 1HB SER 16 -3.944 -3.017 9.072
116 HG SER 16 HG SER 16 -5.207 -4.233 7.169
117 H LYS 17 H LYS 17 -4.507 -0.890 6.144
118 HA LYS 17 HA LYS 17 -6.278 -1.907 4.044
119 HB2 LYS 17 2HB LYS 17 -5.901 1.068 4.446
120 HB3 LYS 17 1HB LYS 17 -6.913 0.271 3.241
121 HG2 LYS 17 2HG LYS 17 -8.230 -0.742 5.136
122 HG3 LYS 17 1HG LYS 17 -7.305 0.273 6.240
123 HD2 LYS 17 2HD LYS 17 -8.125 2.288 5.181
124 HD3 LYS 17 1HD LYS 17 -8.907 1.351 3.907
125 HE2 LYS 17 2HE LYS 17 -10.518 2.091 5.656
126 HE3 LYS 17 1HE LYS 17 -10.421 0.334 5.536
127 HZ1 LYS 17 3HZ LYS 17 -9.926 1.949 7.766
128 HZ2 LYS 17 1HZ LYS 17 -8.462 1.212 7.333
129 HZ3 LYS 17 2HZ LYS 17 -9.829 0.256 7.652
130 H VAL 18 H VAL 18 -5.113 -2.352 2.293
131 HA VAL 18 HA VAL 18 -2.334 -1.489 2.169
132 HB VAL 18 HB VAL 18 -3.532 -3.006 -0.107
133 HG11 VAL 18 1HG1 VAL 18 -1.121 -2.527 0.013
134 HG12 VAL 18 2HG1 VAL 18 -1.439 -4.260 0.073
135 HG13 VAL 18 3HG1 VAL 18 -1.034 -3.388 1.551
136 HG21 VAL 18 3HG2 VAL 18 -3.117 -4.261 2.613
137 HG22 VAL 18 1HG2 VAL 18 -3.497 -5.120 1.119
138 HG23 VAL 18 2HG2 VAL 18 -4.676 -4.021 1.827
139 H HIS 19 H HIS 19 -1.431 -0.363 0.380
140 HA HIS 19 HA HIS 19 -3.284 1.048 -1.428
141 HB2 HIS 19 2HB HIS 19 -1.637 3.121 -0.787
142 HB3 HIS 19 1HB HIS 19 -3.169 2.832 0.038
143 HD1 HIS 19 1HD HIS 19 -2.889 1.028 2.150
144 HD2 HIS 19 2HD HIS 19 0.479 3.201 1.005
145 HE1 HIS 19 1HE HIS 19 -1.257 0.879 4.074
146 HE2 HIS 19 2HE HIS 19 0.799 2.210 3.397
147 H VAL 20 H VAL 20 -2.517 0.685 -3.420
148 HA VAL 20 HA VAL 20 0.309 0.051 -3.750
149 HB VAL 20 HB VAL 20 -0.207 -1.002 -5.740
150 HG11 VAL 20 1HG1 VAL 20 -2.591 -1.994 -5.542
151 HG12 VAL 20 2HG1 VAL 20 -2.694 -1.096 -4.033
152 HG13 VAL 20 3HG1 VAL 20 -1.450 -2.311 -4.251
153 HG21 VAL 20 3HG2 VAL 20 -2.354 1.078 -6.020
154 HG22 VAL 20 1HG2 VAL 20 -2.411 -0.386 -7.001
155 HG23 VAL 20 2HG2 VAL 20 -1.026 0.701 -7.112
156 H PHE 21 H PHE 21 1.610 1.009 -5.410
157 HA PHE 21 HA PHE 21 1.131 3.906 -5.632
158 HB2 PHE 21 2HB PHE 21 3.593 2.198 -6.057
159 HB3 PHE 21 1HB PHE 21 3.539 3.937 -6.343
160 HD1 PHE 21 2HD PHE 21 3.264 5.519 -4.489
161 HD2 PHE 21 1HD PHE 21 3.478 1.285 -3.801
162 HE1 PHE 21 2HE PHE 21 3.642 5.929 -2.072
163 HE2 PHE 21 1HE PHE 21 3.857 1.695 -1.385
164 HZ PHE 21 HZ PHE 21 3.938 4.018 -0.520
165 H LYS 22 H LYS 22 2.727 4.416 -7.868
166 HA LYS 22 HA LYS 22 0.865 3.800 -9.978
167 HB2 LYS 22 2HB LYS 22 2.641 5.073 -11.372
168 HB3 LYS 22 1HB LYS 22 1.741 5.966 -10.150
169 HG2 LYS 22 2HG LYS 22 4.277 4.668 -9.225
170 HG3 LYS 22 1HG LYS 22 4.458 6.033 -10.322
171 HD2 LYS 22 2HD LYS 22 3.325 7.514 -8.846
172 HD3 LYS 22 1HD LYS 22 2.693 6.189 -7.870
173 HE2 LYS 22 2HE LYS 22 4.964 5.631 -7.120
174 HE3 LYS 22 1HE LYS 22 5.627 6.909 -8.137
175 HZ1 LYS 22 3HZ LYS 22 3.697 7.320 -5.920
176 HZ2 LYS 22 1HZ LYS 22 4.397 8.535 -6.872
177 HZ3 LYS 22 2HZ LYS 22 5.368 7.611 -5.829
178 H ASP 23 H ASP 23 3.896 2.519 -8.861
179 HA ASP 23 HA ASP 23 4.508 1.154 -11.340
180 HB2 ASP 23 2HB ASP 23 6.228 -0.020 -9.786
181 HB3 ASP 23 1HB ASP 23 6.441 1.693 -10.147
182 H GLY 24 H GLY 24 2.075 0.671 -9.305
183 HA2 GLY 24 2HA GLY 24 0.601 -1.124 -9.220
184 HA3 GLY 24 1HA GLY 24 1.798 -2.115 -10.048
185 H LYS 25 H LYS 25 3.705 -1.005 -7.793
186 HA LYS 25 HA LYS 25 3.642 -3.339 -6.176
187 HB2 LYS 25 2HB LYS 25 4.977 -0.643 -5.873
188 HB3 LYS 25 1HB LYS 25 5.208 -1.938 -4.708
189 HG2 LYS 25 2HG LYS 25 5.618 -2.543 -7.625
190 HG3 LYS 25 1HG LYS 25 6.874 -1.661 -6.762
191 HD2 LYS 25 2HD LYS 25 7.219 -3.440 -5.223
192 HD3 LYS 25 1HD LYS 25 5.727 -4.249 -5.698
193 HE2 LYS 25 2HE LYS 25 7.734 -5.345 -6.671
194 HE3 LYS 25 1HE LYS 25 6.652 -4.717 -7.916
195 HZ1 LYS 25 3HZ LYS 25 9.331 -4.125 -7.567
196 HZ2 LYS 25 1HZ LYS 25 8.491 -2.722 -7.116
197 HZ3 LYS 25 2HZ LYS 25 8.248 -3.398 -8.655
198 H MET 26 H MET 26 2.906 -3.660 -4.102
199 HA MET 26 HA MET 26 0.629 -2.096 -3.274
200 HB2 MET 26 2HB MET 26 1.807 -4.730 -2.583
201 HB3 MET 26 1HB MET 26 0.949 -3.925 -1.269
202 HG2 MET 26 2HG MET 26 -1.060 -3.783 -2.552
203 HG3 MET 26 1HG MET 26 -0.231 -4.278 -4.031
204 HE1 MET 26 3HE MET 26 -1.733 -5.953 -4.672
205 HE2 MET 26 1HE MET 26 -1.587 -7.641 -4.158
206 HE3 MET 26 2HE MET 26 -0.192 -6.795 -4.825
207 H GLY 27 H GLY 27 0.485 -1.904 -0.717
208 HA2 GLY 27 2HA GLY 27 2.961 -0.951 0.509
209 HA3 GLY 27 1HA GLY 27 1.740 0.280 0.197
210 H MET 28 H MET 28 2.899 -1.321 2.664
211 HA MET 28 HA MET 28 0.285 -2.013 3.883
212 HB2 MET 28 2HB MET 28 2.089 -3.788 3.656
213 HB3 MET 28 1HB MET 28 3.030 -2.863 4.817
214 HG2 MET 28 2HG MET 28 1.886 -4.410 6.160
215 HG3 MET 28 1HG MET 28 0.917 -2.952 6.298
216 HE1 MET 28 3HE MET 28 -1.818 -3.354 6.214
217 HE2 MET 28 1HE MET 28 -0.736 -4.249 7.291
218 HE3 MET 28 2HE MET 28 -2.037 -5.084 6.454
219 H GLU 29 H GLU 29 -0.447 -0.384 5.105
220 HA GLU 29 HA GLU 29 1.316 0.777 7.141
221 HB2 GLU 29 2HB GLU 29 1.317 2.302 5.107
222 HB3 GLU 29 1HB GLU 29 -0.400 2.566 5.412
223 HG2 GLU 29 2HG GLU 29 0.292 3.184 7.809
224 HG3 GLU 29 1HG GLU 29 1.938 3.271 7.186
225 H ASN 30 H ASN 30 0.290 0.210 8.930
226 HA ASN 30 HA ASN 30 -2.427 -0.412 9.160
227 HB2 ASN 30 2HB ASN 30 -2.063 -0.483 11.520
228 HB3 ASN 30 1HB ASN 30 -0.577 -1.039 10.755
229 HD21 ASN 30 1HD2 ASN 30 -0.181 -0.150 13.281
230 HD22 ASN 30 2HD2 ASN 30 0.499 1.411 13.301
231 H LYS 31 H LYS 31 -3.880 0.766 10.820
232 HA LYS 31 HA LYS 31 -4.361 3.419 9.765
233 HB2 LYS 31 2HB LYS 31 -6.389 3.342 11.167
234 HB3 LYS 31 1HB LYS 31 -6.236 1.911 10.151
235 HG2 LYS 31 2HG LYS 31 -6.620 0.768 12.109
236 HG3 LYS 31 1HG LYS 31 -4.906 1.049 12.395
237 HD2 LYS 31 2HD LYS 31 -5.409 3.033 13.725
238 HD3 LYS 31 1HD LYS 31 -7.123 2.900 13.333
239 HE2 LYS 31 2HE LYS 31 -7.235 0.732 14.480
240 HE3 LYS 31 1HE LYS 31 -5.512 0.820 14.840
241 HZ1 LYS 31 3HZ LYS 31 -6.868 3.184 15.658
242 HZ2 LYS 31 1HZ LYS 31 -5.904 2.129 16.570
243 HZ3 LYS 31 2HZ LYS 31 -7.562 1.808 16.375
244 H PHE 32 H PHE 32 -2.494 2.189 12.267
245 HA PHE 32 HA PHE 32 -2.947 4.319 14.170
246 HB2 PHE 32 2HB PHE 32 -2.050 1.834 14.519
247 HB3 PHE 32 1HB PHE 32 -0.484 2.599 14.253
248 HD1 PHE 32 1HD PHE 32 -3.484 2.507 16.413
249 HD2 PHE 32 2HD PHE 32 0.444 4.156 15.865
250 HE1 PHE 32 1HE PHE 32 -3.509 3.342 18.748
251 HE2 PHE 32 2HE PHE 32 0.419 4.991 18.201
252 HZ PHE 32 HZ PHE 32 -1.557 4.585 19.642
253 H GLY 33 H GLY 33 -1.664 4.420 11.223
254 HA2 GLY 33 2HA GLY 33 -0.427 6.071 10.174
255 HA3 GLY 33 1HA GLY 33 -0.161 6.818 11.750
256 H LYS 34 H LYS 34 0.644 3.618 12.029
257 HA LYS 34 HA LYS 34 3.524 4.199 11.649
258 HB2 LYS 34 2HB LYS 34 2.206 2.009 13.272
259 HB3 LYS 34 1HB LYS 34 3.927 2.383 13.224
260 HG2 LYS 34 2HG LYS 34 1.899 4.473 14.036
261 HG3 LYS 34 1HG LYS 34 2.533 3.320 15.205
262 HD2 LYS 34 2HD LYS 34 4.863 4.048 14.533
263 HD3 LYS 34 1HD LYS 34 4.115 5.333 13.585
264 HE2 LYS 34 2HE LYS 34 3.013 6.200 15.607
265 HE3 LYS 34 1HE LYS 34 3.736 4.906 16.562
266 HZ1 LYS 34 3HZ LYS 34 5.188 6.656 16.871
267 HZ2 LYS 34 1HZ LYS 34 5.045 7.210 15.274
268 HZ3 LYS 34 2HZ LYS 34 5.934 5.799 15.606
269 H SER 35 H SER 35 4.497 3.317 9.956
270 HA SER 35 HA SER 35 3.253 1.583 8.132
271 HB2 SER 35 2HB SER 35 5.342 1.498 7.010
272 HB3 SER 35 1HB SER 35 5.272 3.096 7.746
273 HG SER 35 HG SER 35 6.606 2.387 9.371
274 H MET 36 H MET 36 3.097 -0.599 7.982
275 HA MET 36 HA MET 36 4.405 -2.209 10.110
276 HB2 MET 36 2HB MET 36 1.763 -2.416 8.682
277 HB3 MET 36 1HB MET 36 2.529 -3.894 9.272
278 HG2 MET 36 2HG MET 36 2.044 -1.454 11.008
279 HG3 MET 36 1HG MET 36 0.929 -2.821 10.906
280 HE1 MET 36 3HE MET 36 2.370 -5.611 12.800
281 HE2 MET 36 1HE MET 36 1.915 -5.375 11.107
282 HE3 MET 36 2HE MET 36 0.944 -4.661 12.391
283 H ASN 37 H ASN 37 6.176 -3.164 9.389
284 HA ASN 37 HA ASN 37 6.672 -3.630 6.608
285 HB2 ASN 37 2HB ASN 37 8.481 -3.143 8.222
286 HB3 ASN 37 1HB ASN 37 8.165 -4.684 9.018
287 HD21 ASN 37 1HD2 ASN 37 7.961 -6.547 7.093
288 HD22 ASN 37 2HD2 ASN 37 9.303 -6.551 6.049
289 H MET 38 H MET 38 4.931 -4.965 5.944
290 HA MET 38 HA MET 38 4.675 -7.612 7.125
291 HB2 MET 38 2HB MET 38 2.638 -6.533 6.427
292 HB3 MET 38 1HB MET 38 3.268 -6.280 4.797
293 HG2 MET 38 2HG MET 38 3.302 -8.662 4.389
294 HG3 MET 38 1HG MET 38 2.931 -9.002 6.070
295 HE1 MET 38 3HE MET 38 -0.736 -8.412 6.526
296 HE2 MET 38 1HE MET 38 0.717 -7.633 7.172
297 HE3 MET 38 2HE MET 38 0.672 -9.383 6.967
298 HA PRO 39 HA PRO 39 7.786 -8.980 4.137
299 HB2 PRO 39 2HB PRO 39 7.908 -11.617 4.811
300 HB3 PRO 39 1HB PRO 39 8.622 -10.341 5.821
301 HG2 PRO 39 2HG PRO 39 6.023 -11.776 6.148
302 HG3 PRO 39 1HG PRO 39 7.221 -11.325 7.376
303 HD2 PRO 39 2HD PRO 39 4.928 -9.883 6.918
304 HD3 PRO 39 1HD PRO 39 6.411 -9.157 7.552
305 H GLU 40 H GLU 40 7.612 -9.613 2.054
306 HA GLU 40 HA GLU 40 5.242 -10.069 0.767
307 HB2 GLU 40 2HB GLU 40 7.421 -9.559 -0.335
308 HB3 GLU 40 1HB GLU 40 7.909 -11.232 -0.065
309 HG2 GLU 40 2HG GLU 40 5.336 -10.570 -1.506
310 HG3 GLU 40 1HG GLU 40 6.874 -10.632 -2.363
311 H GLY 41 H GLY 41 3.834 -11.684 0.634
312 HA2 GLY 41 2HA GLY 41 3.510 -14.097 0.189
313 HA3 GLY 41 1HA GLY 41 4.686 -14.410 1.461
314 H LYS 42 H LYS 42 3.404 -12.027 2.959
315 HA LYS 42 HA LYS 42 1.623 -13.637 4.518
316 HB2 LYS 42 2HB LYS 42 2.736 -10.897 4.656
317 HB3 LYS 42 1HB LYS 42 1.160 -11.079 5.413
318 HG2 LYS 42 2HG LYS 42 3.340 -13.085 6.002
319 HG3 LYS 42 1HG LYS 42 3.341 -11.530 6.823
320 HD2 LYS 42 2HD LYS 42 1.266 -11.922 7.862
321 HD3 LYS 42 1HD LYS 42 0.853 -13.226 6.748
322 HE2 LYS 42 2HE LYS 42 2.705 -14.590 7.697
323 HE3 LYS 42 1HE LYS 42 3.039 -13.298 8.850
324 HZ1 LYS 42 3HZ LYS 42 1.445 -15.286 9.436
325 HZ2 LYS 42 1HZ LYS 42 0.298 -14.300 8.672
326 HZ3 LYS 42 2HZ LYS 42 1.154 -13.718 10.019
327 H VAL 43 H VAL 43 0.291 -14.238 2.712
328 HA VAL 43 HA VAL 43 -1.311 -12.859 1.064
329 HB VAL 43 HB VAL 43 -2.461 -15.004 2.849
330 HG11 VAL 43 1HG1 VAL 43 -2.851 -14.566 -0.114
331 HG12 VAL 43 2HG1 VAL 43 -3.853 -13.750 1.084
332 HG13 VAL 43 3HG1 VAL 43 -3.847 -15.511 0.991
333 HG21 VAL 43 3HG2 VAL 43 -0.359 -15.905 2.210
334 HG22 VAL 43 1HG2 VAL 43 -0.446 -15.188 0.602
335 HG23 VAL 43 2HG2 VAL 43 -1.492 -16.545 1.021
336 H MET 44 H MET 44 -2.611 -11.152 1.240
337 HA MET 44 HA MET 44 -3.921 -10.586 3.840
338 HB2 MET 44 2HB MET 44 -3.564 -8.742 1.477
339 HB3 MET 44 1HB MET 44 -4.111 -8.310 3.084
340 HG2 MET 44 2HG MET 44 -1.921 -8.811 4.006
341 HG3 MET 44 1HG MET 44 -1.373 -9.445 2.456
342 HE1 MET 44 3HE MET 44 -0.853 -6.619 0.165
343 HE2 MET 44 1HE MET 44 -2.552 -7.077 0.279
344 HE3 MET 44 2HE MET 44 -1.300 -8.307 0.401
345 H GLU 45 H GLU 45 -6.157 -10.429 3.918
346 HA GLU 45 HA GLU 45 -7.635 -10.995 1.397
347 HB2 GLU 45 2HB GLU 45 -7.478 -12.972 2.936
348 HB3 GLU 45 1HB GLU 45 -8.348 -12.029 4.149
349 HG2 GLU 45 2HG GLU 45 -10.254 -11.779 2.652
350 HG3 GLU 45 1HG GLU 45 -9.380 -12.602 1.356
351 H THR 46 H THR 46 -9.030 -9.455 0.888
352 HA THR 46 HA THR 46 -9.710 -7.389 2.790
353 HB THR 46 HB THR 46 -10.806 -6.301 0.953
354 HG1 THR 46 1HG THR 46 -11.591 -7.380 -0.677
355 HG21 THR 46 3HG2 THR 46 -8.312 -6.370 0.957
356 HG22 THR 46 1HG2 THR 46 -8.992 -6.213 -0.662
357 HG23 THR 46 2HG2 THR 46 -8.382 -7.772 -0.112
358 H ARG 47 H ARG 47 -11.974 -6.707 3.134
359 HA ARG 47 HA ARG 47 -13.520 -8.685 4.330
360 HB2 ARG 47 2HB ARG 47 -14.404 -6.027 3.180
361 HB3 ARG 47 1HB ARG 47 -15.363 -7.021 4.282
362 HG2 ARG 47 2HG ARG 47 -13.634 -6.840 6.001
363 HG3 ARG 47 1HG ARG 47 -12.602 -5.928 4.900
364 HD2 ARG 47 2HD ARG 47 -13.797 -4.419 6.445
365 HD3 ARG 47 1HD ARG 47 -14.290 -4.142 4.776
366 HE ARG 47 HE ARG 47 -16.034 -6.029 5.959
367 HH11 ARG 47 1HH2 ARG 47 -15.142 -2.688 6.079
368 HH12 ARG 47 2HH2 ARG 47 -16.706 -2.147 6.590
369 HH21 ARG 47 1HH1 ARG 47 -18.087 -5.327 6.629
370 HH22 ARG 47 2HH1 ARG 47 -18.373 -3.641 6.902
371 H ASP 48 H ASP 48 -13.622 -7.412 1.036
372 HA ASP 48 HA ASP 48 -15.983 -8.807 0.249
373 HB2 ASP 48 2HB ASP 48 -13.701 -7.710 -1.414
374 HB3 ASP 48 1HB ASP 48 -15.252 -8.263 -2.052
375 H GLY 49 H GLY 49 -12.989 -9.926 1.116
376 HA2 GLY 49 2HA GLY 49 -12.212 -12.118 1.118
377 HA3 GLY 49 1HA GLY 49 -13.519 -12.555 0.018
378 H THR 50 H THR 50 -11.334 -9.878 -0.597
379 HA THR 50 HA THR 50 -10.496 -11.133 -3.096
380 HB THR 50 HB THR 50 -9.597 -8.452 -2.040
381 HG1 THR 50 1HG THR 50 -12.074 -9.222 -2.519
382 HG21 THR 50 3HG2 THR 50 -9.493 -7.954 -4.474
383 HG22 THR 50 1HG2 THR 50 -9.976 -9.615 -4.811
384 HG23 THR 50 2HG2 THR 50 -8.435 -9.289 -4.017
385 H LYS 51 H LYS 51 -8.786 -12.436 -3.130
386 HA LYS 51 HA LYS 51 -6.838 -12.450 -1.002
387 HB2 LYS 51 2HB LYS 51 -7.533 -14.538 -2.105
388 HB3 LYS 51 1HB LYS 51 -6.883 -13.946 -3.637
389 HG2 LYS 51 2HG LYS 51 -4.647 -13.976 -2.821
390 HG3 LYS 51 1HG LYS 51 -5.180 -14.152 -1.148
391 HD2 LYS 51 2HD LYS 51 -4.386 -16.310 -1.961
392 HD3 LYS 51 1HD LYS 51 -6.134 -16.387 -1.728
393 HE2 LYS 51 2HE LYS 51 -6.561 -16.228 -4.059
394 HE3 LYS 51 1HE LYS 51 -4.917 -15.687 -4.404
395 HZ1 LYS 51 3HZ LYS 51 -5.927 -18.370 -3.927
396 HZ2 LYS 51 1HZ LYS 51 -4.420 -18.013 -3.238
397 HZ3 LYS 51 2HZ LYS 51 -4.647 -17.848 -4.914
398 H ILE 52 H ILE 52 -5.407 -10.842 -0.906
399 HA ILE 52 HA ILE 52 -3.926 -10.113 -3.373
400 HB ILE 52 HB ILE 52 -3.695 -7.824 -2.038
401 HG12 ILE 52 2HG1 ILE 52 -6.452 -8.709 -1.157
402 HG13 ILE 52 1HG1 ILE 52 -5.058 -8.872 -0.113
403 HG21 ILE 52 1HG2 ILE 52 -6.260 -8.581 -3.455
404 HG22 ILE 52 2HG2 ILE 52 -4.759 -8.123 -4.266
405 HG23 ILE 52 3HG2 ILE 52 -5.613 -6.951 -3.260
406 HD11 ILE 52 3HD1 ILE 52 -6.076 -6.768 0.422
407 HD12 ILE 52 1HD1 ILE 52 -6.198 -6.334 -1.280
408 HD13 ILE 52 2HD1 ILE 52 -4.623 -6.393 -0.496
409 H ILE 53 H ILE 53 -1.879 -10.645 -3.225
410 HA ILE 53 HA ILE 53 -0.675 -11.339 -0.675
411 HB ILE 53 HB ILE 53 0.778 -11.250 -3.315
412 HG12 ILE 53 2HG1 ILE 53 -1.308 -12.343 -3.827
413 HG13 ILE 53 1HG1 ILE 53 -0.069 -13.588 -3.677
414 HG21 ILE 53 1HG2 ILE 53 0.917 -13.061 -0.885
415 HG22 ILE 53 2HG2 ILE 53 2.075 -11.800 -1.308
416 HG23 ILE 53 3HG2 ILE 53 1.911 -13.226 -2.332
417 HD11 ILE 53 3HD1 ILE 53 -0.836 -13.759 -1.207
418 HD12 ILE 53 1HD1 ILE 53 -1.893 -14.443 -2.440
419 HD13 ILE 53 2HD1 ILE 53 -2.263 -12.871 -1.732
420 H MET 54 H MET 54 1.080 -10.324 0.290
421 HA MET 54 HA MET 54 1.268 -7.495 -0.107
422 HB2 MET 54 2HB MET 54 1.630 -8.636 2.098
423 HB3 MET 54 1HB MET 54 3.154 -9.265 1.467
424 HG2 MET 54 2HG MET 54 3.712 -7.262 2.663
425 HG3 MET 54 1HG MET 54 3.798 -6.851 0.961
426 HE1 MET 54 3HE MET 54 2.208 -3.573 1.246
427 HE2 MET 54 1HE MET 54 3.067 -4.736 0.224
428 HE3 MET 54 2HE MET 54 3.725 -4.282 1.793
429 H LYS 55 H LYS 55 1.797 -7.436 -2.370
430 HA LYS 55 HA LYS 55 4.239 -8.518 -3.368
431 HB2 LYS 55 2HB LYS 55 2.293 -7.994 -4.816
432 HB3 LYS 55 1HB LYS 55 2.508 -6.283 -4.467
433 HG2 LYS 55 2HG LYS 55 3.520 -6.809 -6.617
434 HG3 LYS 55 1HG LYS 55 4.783 -6.384 -5.470
435 HD2 LYS 55 2HD LYS 55 4.121 -9.293 -5.561
436 HD3 LYS 55 1HD LYS 55 4.807 -8.655 -7.049
437 HE2 LYS 55 2HE LYS 55 6.163 -7.939 -4.469
438 HE3 LYS 55 1HE LYS 55 6.385 -9.562 -5.115
439 HZ1 LYS 55 3HZ LYS 55 7.960 -8.624 -6.356
440 HZ2 LYS 55 1HZ LYS 55 7.396 -7.049 -6.078
441 HZ3 LYS 55 2HZ LYS 55 6.688 -7.999 -7.294
442 H GLY 56 H GLY 56 3.339 -5.114 -3.376
443 HA2 GLY 56 2HA GLY 56 5.942 -4.098 -3.373
444 HA3 GLY 56 1HA GLY 56 4.501 -3.195 -2.939
445 H ASN 57 H ASN 57 6.779 -5.586 -1.581
446 HA ASN 57 HA ASN 57 6.060 -5.008 1.130
447 HB2 ASN 57 2HB ASN 57 7.099 -7.149 0.493
448 HB3 ASN 57 1HB ASN 57 8.571 -6.293 0.024
449 HD21 ASN 57 1HD2 ASN 57 6.842 -5.043 2.788
450 HD22 ASN 57 2HD2 ASN 57 7.916 -5.629 3.972
451 H GLU 58 H GLU 58 7.612 -3.204 -1.161
452 HA GLU 58 HA GLU 58 9.636 -1.985 0.515
453 HB2 GLU 58 2HB GLU 58 8.548 -1.124 -2.176
454 HB3 GLU 58 1HB GLU 58 10.007 -0.508 -1.399
455 HG2 GLU 58 2HG GLU 58 9.645 -3.455 -1.963
456 HG3 GLU 58 1HG GLU 58 10.304 -2.360 -3.172
457 H ILE 59 H ILE 59 7.817 -1.600 2.171
458 HA ILE 59 HA ILE 59 5.864 0.384 1.762
459 HB ILE 59 HB ILE 59 5.865 0.556 4.259
460 HG12 ILE 59 2HG1 ILE 59 8.049 -1.544 4.100
461 HG13 ILE 59 1HG1 ILE 59 8.374 0.157 4.443
462 HG21 ILE 59 1HG2 ILE 59 4.667 -1.249 2.929
463 HG22 ILE 59 2HG2 ILE 59 5.033 -1.672 4.599
464 HG23 ILE 59 3HG2 ILE 59 6.027 -2.310 3.291
465 HD11 ILE 59 3HD1 ILE 59 8.064 -1.452 6.458
466 HD12 ILE 59 1HD1 ILE 59 6.345 -1.378 6.068
467 HD13 ILE 59 2HD1 ILE 59 7.218 0.095 6.494
468 H PHE 60 H PHE 60 9.230 0.642 1.898
469 HA PHE 60 HA PHE 60 9.638 3.095 3.192
470 HB2 PHE 60 2HB PHE 60 11.461 1.580 2.472
471 HB3 PHE 60 1HB PHE 60 11.123 1.999 0.793
472 HD1 PHE 60 2HD PHE 60 11.581 4.258 -0.066
473 HD2 PHE 60 1HD PHE 60 12.516 3.169 3.982
474 HE1 PHE 60 2HE PHE 60 13.001 6.279 0.149
475 HE2 PHE 60 1HE PHE 60 13.936 5.191 4.198
476 HZ PHE 60 HZ PHE 60 14.180 6.745 2.282
477 H ARG 61 H ARG 61 8.368 2.346 0.025
478 HA ARG 61 HA ARG 61 8.727 4.778 -1.286
479 HB2 ARG 61 2HB ARG 61 7.790 2.633 -2.255
480 HB3 ARG 61 1HB ARG 61 6.261 3.044 -1.491
481 HG2 ARG 61 2HG ARG 61 5.910 4.009 -3.575
482 HG3 ARG 61 1HG ARG 61 6.637 5.377 -2.742
483 HD2 ARG 61 2HD ARG 61 8.231 3.387 -4.387
484 HD3 ARG 61 1HD ARG 61 7.594 4.892 -5.032
485 HE ARG 61 HE ARG 61 8.998 5.685 -2.827
486 HH11 ARG 61 1HH2 ARG 61 9.666 3.739 -5.611
487 HH12 ARG 61 2HH2 ARG 61 11.348 4.153 -5.666
488 HH21 ARG 61 1HH1 ARG 61 11.202 6.230 -2.893
489 HH22 ARG 61 2HH1 ARG 61 12.217 5.563 -4.128
490 H LEU 62 H LEU 62 5.987 3.738 0.752
491 HA LEU 62 HA LEU 62 4.435 6.032 0.579
492 HB2 LEU 62 2HB LEU 62 4.107 3.722 1.854
493 HB3 LEU 62 1HB LEU 62 4.692 4.645 3.234
494 HG LEU 62 HG LEU 62 2.296 5.307 1.492
495 HD11 LEU 62 1HD1 LEU 62 2.462 4.688 4.454
496 HD12 LEU 62 2HD1 LEU 62 2.074 3.484 3.225
497 HD13 LEU 62 3HD1 LEU 62 1.002 4.861 3.480
498 HD21 LEU 62 3HD2 LEU 62 2.014 7.122 3.330
499 HD22 LEU 62 1HD2 LEU 62 3.208 7.416 2.067
500 HD23 LEU 62 2HD2 LEU 62 3.726 6.860 3.658
501 H ASP 63 H ASP 63 6.982 5.287 2.965
502 HA ASP 63 HA ASP 63 6.916 7.609 4.465
503 HB2 ASP 63 2HB ASP 63 9.341 6.008 3.615
504 HB3 ASP 63 1HB ASP 63 9.317 7.191 4.922
505 H GLU 64 H GLU 64 8.370 9.480 4.430
506 HA GLU 64 HA GLU 64 8.178 10.996 2.114
507 HB2 GLU 64 2HB GLU 64 10.234 11.239 4.324
508 HB3 GLU 64 1HB GLU 64 9.840 12.494 3.148
509 HG2 GLU 64 2HG GLU 64 7.814 11.246 5.023
510 HG3 GLU 64 1HG GLU 64 8.657 12.757 5.356
511 H ALA 65 H ALA 65 8.835 9.656 0.361
512 HA ALA 65 HA ALA 65 11.517 8.652 0.165
513 HB1 ALA 65 1HB ALA 65 9.359 9.033 -1.921
514 HB2 ALA 65 2HB ALA 65 9.730 7.546 -1.048
515 HB3 ALA 65 3HB ALA 65 10.888 8.202 -2.204
516 H LEU 66 H LEU 66 11.620 11.351 0.851
517 HA LEU 66 HA LEU 66 12.638 13.328 0.273
518 HB2 LEU 66 2HB LEU 66 13.847 11.861 -2.067
519 HB3 LEU 66 1HB LEU 66 14.543 13.167 -1.107
520 HG LEU 66 HG LEU 66 14.008 10.331 -0.178
521 HD11 LEU 66 1HD1 LEU 66 16.545 11.927 -0.643
522 HD12 LEU 66 2HD1 LEU 66 16.008 10.515 -1.553
523 HD13 LEU 66 3HD1 LEU 66 16.495 10.344 0.133
524 HD21 LEU 66 3HD2 LEU 66 13.573 11.727 1.704
525 HD22 LEU 66 1HD2 LEU 66 14.888 12.828 1.291
526 HD23 LEU 66 2HD2 LEU 66 15.247 11.211 1.900
527 H ARG 67 H ARG 67 12.935 14.932 -1.579
528 HA ARG 67 HA ARG 67 10.437 15.416 -2.795
529 HB2 ARG 67 2HB ARG 67 12.127 17.169 -2.265
530 HB3 ARG 67 1HB ARG 67 13.122 16.563 -3.588
531 HG2 ARG 67 2HG ARG 67 11.363 17.056 -5.199
532 HG3 ARG 67 1HG ARG 67 10.269 17.537 -3.902
533 HD2 ARG 67 2HD ARG 67 11.356 19.482 -5.047
534 HD3 ARG 67 1HD ARG 67 11.690 19.413 -3.319
535 HE ARG 67 HE ARG 67 13.725 18.041 -4.747
536 HH11 ARG 67 1HH2 ARG 67 12.467 21.199 -4.096
537 HH12 ARG 67 2HH2 ARG 67 13.990 21.997 -4.291
538 HH21 ARG 67 1HH1 ARG 67 15.728 19.082 -5.004
539 HH22 ARG 67 2HH1 ARG 67 15.838 20.799 -4.804
540 H LYS 68 H LYS 68 13.543 14.460 -4.282
541 HA LYS 68 HA LYS 68 12.363 13.977 -6.847
542 HB2 LYS 68 2HB LYS 68 14.996 12.847 -5.913
543 HB3 LYS 68 1HB LYS 68 14.521 13.327 -7.541
544 HG2 LYS 68 2HG LYS 68 14.979 15.169 -5.177
545 HG3 LYS 68 1HG LYS 68 15.988 15.035 -6.618
546 HD2 LYS 68 2HD LYS 68 13.879 15.654 -7.952
547 HD3 LYS 68 1HD LYS 68 13.177 16.128 -6.405
548 HE2 LYS 68 2HE LYS 68 14.221 18.060 -7.545
549 HE3 LYS 68 1HE LYS 68 15.037 17.693 -6.025
550 HZ1 LYS 68 3HZ LYS 68 16.864 16.873 -7.090
551 HZ2 LYS 68 1HZ LYS 68 16.391 18.058 -8.209
552 HZ3 LYS 68 2HZ LYS 68 16.005 16.426 -8.485
553 H GLY 69 H GLY 69 11.694 12.089 -7.766
554 HA2 GLY 69 2HA GLY 69 12.239 9.494 -6.787
555 HA3 GLY 69 1HA GLY 69 10.681 10.028 -6.164
556 H HIS 70 H HIS 70 8.927 9.825 -7.433
557 HA HIS 70 HA HIS 70 7.630 9.201 -9.224
558 HB2 HIS 70 2HB HIS 70 9.839 10.556 -10.791
559 HB3 HIS 70 1HB HIS 70 8.217 10.196 -11.384
560 HD2 HIS 70 2HD HIS 70 9.887 12.573 -8.682
561 HE1 HIS 70 1HE HIS 70 5.997 13.983 -9.523
562 HE2 HIS 70 2HE HIS 70 8.144 14.473 -8.259
563 H SER 71 H SER 71 9.761 7.384 -8.256
564 HA SER 71 HA SER 71 10.750 5.390 -8.828
565 HB2 SER 71 2HB SER 71 9.478 3.970 -10.266
566 HB3 SER 71 1HB SER 71 8.317 4.990 -9.421
567 HG SER 71 HG SER 71 8.198 6.293 -11.247
568 H GLU 72 H GLU 72 12.787 5.988 -9.482
569 HA GLU 72 HA GLU 72 13.419 7.205 -11.955
570 HB2 GLU 72 2HB GLU 72 15.160 5.470 -10.185
571 HB3 GLU 72 1HB GLU 72 15.732 6.552 -11.455
572 HG2 GLU 72 2HG GLU 72 14.092 7.459 -9.074
573 HG3 GLU 72 1HG GLU 72 15.852 7.547 -9.148
574 H GLY 73 H GLY 73 12.869 3.892 -11.023
575 HA2 GLY 73 2HA GLY 73 12.709 1.957 -12.258
576 HA3 GLY 73 1HA GLY 73 12.552 2.988 -13.678
577 H GLY 74 H GLY 74 14.884 1.463 -11.502
578 HA2 GLY 74 2HA GLY 74 16.618 0.650 -13.568
579 HA3 GLY 74 1HA GLY 74 17.248 2.135 -12.861
580 H1 HOH 201 H2 HOH 77 5.653 11.871 -7.175
581 H2 HOH 201 H1 HOH 77 6.860 11.216 -7.808
Start of MODEL 15
1 H1 VAL 1 1H VAL 1 0.177 10.556 -19.965
2 H2 VAL 1 2H VAL 1 -1.423 10.214 -20.417
3 HA VAL 1 HA VAL 1 -0.594 11.472 -17.858
4 HB VAL 1 HB VAL 1 -1.959 13.410 -18.990
5 HG11 VAL 1 2HG1 VAL 1 0.106 14.273 -20.023
6 HG12 VAL 1 3HG1 VAL 1 0.808 12.656 -19.985
7 HG13 VAL 1 1HG1 VAL 1 0.459 13.502 -18.478
8 HG21 VAL 1 1HG2 VAL 1 -1.884 13.424 -21.411
9 HG22 VAL 1 2HG2 VAL 1 -2.660 11.922 -20.911
10 HG23 VAL 1 3HG2 VAL 1 -0.978 11.911 -21.438
11 H ASP 2 H ASP 2 -1.899 10.156 -16.589
12 HA ASP 2 HA ASP 2 -4.625 10.871 -16.380
13 HB2 ASP 2 2HB ASP 2 -5.515 8.512 -16.896
14 HB3 ASP 2 1HB ASP 2 -5.127 9.548 -18.268
15 H MET 3 H MET 3 -2.470 10.747 -14.621
16 HA MET 3 HA MET 3 -2.553 8.347 -13.042
17 HB2 MET 3 2HB MET 3 -1.197 9.660 -11.435
18 HB3 MET 3 1HB MET 3 -0.544 9.730 -13.073
19 HG2 MET 3 2HG MET 3 -1.784 11.896 -13.398
20 HG3 MET 3 1HG MET 3 -2.217 11.845 -11.688
21 HE1 MET 3 3HE MET 3 0.440 14.638 -11.858
22 HE2 MET 3 1HE MET 3 -1.275 14.205 -11.825
23 HE3 MET 3 2HE MET 3 -0.385 14.178 -13.345
24 H SER 4 H SER 4 -4.270 11.381 -13.091
25 HA SER 4 HA SER 4 -5.257 11.594 -10.524
26 HB2 SER 4 2HB SER 4 -7.258 12.653 -11.556
27 HB3 SER 4 1HB SER 4 -5.745 13.259 -12.225
28 HG SER 4 HG SER 4 -6.051 11.641 -13.906
29 H ASN 5 H ASN 5 -5.684 9.015 -12.672
30 HA ASN 5 HA ASN 5 -8.220 8.049 -12.280
31 HB2 ASN 5 2HB ASN 5 -6.471 6.952 -13.665
32 HB3 ASN 5 1HB ASN 5 -5.693 6.386 -12.187
33 HD21 ASN 5 1HD2 ASN 5 -8.524 5.963 -14.270
34 HD22 ASN 5 2HD2 ASN 5 -9.075 4.541 -13.523
35 H VAL 6 H VAL 6 -9.153 6.557 -10.786
36 HA VAL 6 HA VAL 6 -8.855 7.236 -8.088
37 HB VAL 6 HB VAL 6 -10.884 6.187 -9.022
38 HG11 VAL 6 1HG1 VAL 6 -10.937 3.867 -9.624
39 HG12 VAL 6 2HG1 VAL 6 -9.307 3.604 -9.006
40 HG13 VAL 6 3HG1 VAL 6 -9.553 4.564 -10.465
41 HG21 VAL 6 3HG2 VAL 6 -10.209 6.039 -6.554
42 HG22 VAL 6 1HG2 VAL 6 -9.703 4.384 -6.898
43 HG23 VAL 6 2HG2 VAL 6 -11.392 4.853 -7.107
44 H VAL 7 H VAL 7 -7.626 6.482 -6.450
45 HA VAL 7 HA VAL 7 -5.336 4.855 -7.084
46 HB VAL 7 HB VAL 7 -4.758 5.179 -4.699
47 HG11 VAL 7 1HG1 VAL 7 -4.474 7.596 -4.820
48 HG12 VAL 7 2HG1 VAL 7 -5.760 7.720 -6.020
49 HG13 VAL 7 3HG1 VAL 7 -4.246 6.914 -6.430
50 HG21 VAL 7 3HG2 VAL 7 -6.267 6.648 -3.344
51 HG22 VAL 7 1HG2 VAL 7 -7.000 5.093 -3.736
52 HG23 VAL 7 2HG2 VAL 7 -7.471 6.541 -4.628
53 H LYS 8 H LYS 8 -4.777 3.139 -5.259
54 HA LYS 8 HA LYS 8 -6.964 1.161 -5.326
55 HB2 LYS 8 2HB LYS 8 -4.639 0.639 -6.229
56 HB3 LYS 8 1HB LYS 8 -4.082 0.693 -4.558
57 HG2 LYS 8 2HG LYS 8 -4.565 -1.597 -4.972
58 HG3 LYS 8 1HG LYS 8 -5.913 -0.993 -4.015
59 HD2 LYS 8 2HD LYS 8 -6.519 -0.575 -6.831
60 HD3 LYS 8 1HD LYS 8 -6.025 -2.248 -6.600
61 HE2 LYS 8 2HE LYS 8 -7.684 -2.420 -4.724
62 HE3 LYS 8 1HE LYS 8 -8.238 -0.793 -5.120
63 HZ1 LYS 8 3HZ LYS 8 -8.985 -3.203 -6.313
64 HZ2 LYS 8 1HZ LYS 8 -8.130 -2.311 -7.476
65 HZ3 LYS 8 2HZ LYS 8 -9.491 -1.632 -6.718
66 H THR 9 H THR 9 -7.684 0.118 -3.483
67 HA THR 9 HA THR 9 -6.543 0.755 -0.883
68 HB THR 9 HB THR 9 -9.406 1.513 -1.513
69 HG1 THR 9 1HG THR 9 -7.029 2.862 -1.664
70 HG21 THR 9 3HG2 THR 9 -9.246 2.544 0.772
71 HG22 THR 9 1HG2 THR 9 -7.682 1.752 0.965
72 HG23 THR 9 2HG2 THR 9 -9.146 0.783 0.778
73 H TYR 10 H TYR 10 -6.364 -1.237 -0.084
74 HA TYR 10 HA TYR 10 -8.581 -3.168 -0.465
75 HB2 TYR 10 2HB TYR 10 -5.644 -3.552 0.135
76 HB3 TYR 10 1HB TYR 10 -6.820 -4.850 0.255
77 HD1 TYR 10 2HD TYR 10 -8.478 -4.945 -1.919
78 HD2 TYR 10 1HD TYR 10 -4.454 -3.430 -1.880
79 HE1 TYR 10 2HE TYR 10 -8.303 -5.340 -4.357
80 HE2 TYR 10 1HE TYR 10 -4.285 -3.829 -4.318
81 HH TYR 10 HH TYR 10 -5.687 -5.640 -5.986
82 H ASP 11 H ASP 11 -9.950 -2.830 1.224
83 HA ASP 11 HA ASP 11 -9.070 -2.115 3.842
84 HB2 ASP 11 2HB ASP 11 -11.712 -3.118 2.784
85 HB3 ASP 11 1HB ASP 11 -11.440 -2.663 4.467
86 H LEU 12 H LEU 12 -7.529 -3.698 4.363
87 HA LEU 12 HA LEU 12 -7.914 -6.472 4.382
88 HB2 LEU 12 2HB LEU 12 -6.045 -4.536 5.588
89 HB3 LEU 12 1HB LEU 12 -6.241 -5.993 6.556
90 HG LEU 12 HG LEU 12 -5.530 -7.398 4.744
91 HD11 LEU 12 1HD1 LEU 12 -4.757 -5.995 2.571
92 HD12 LEU 12 2HD1 LEU 12 -6.102 -4.977 3.081
93 HD13 LEU 12 3HD1 LEU 12 -6.367 -6.681 2.717
94 HD21 LEU 12 3HD2 LEU 12 -3.267 -6.640 4.473
95 HD22 LEU 12 1HD2 LEU 12 -3.814 -6.034 6.034
96 HD23 LEU 12 2HD2 LEU 12 -3.747 -4.953 4.640
97 H GLN 13 H GLN 13 -8.161 -7.874 6.279
98 HA GLN 13 HA GLN 13 -10.525 -7.125 7.770
99 HB2 GLN 13 2HB GLN 13 -8.821 -9.613 7.620
100 HB3 GLN 13 1HB GLN 13 -10.121 -9.457 8.802
101 HG2 GLN 13 2HG GLN 13 -10.622 -8.913 5.873
102 HG3 GLN 13 1HG GLN 13 -10.671 -10.557 6.512
103 HE21 GLN 13 1HE2 GLN 13 -11.622 -8.143 8.797
104 HE22 GLN 13 2HE2 GLN 13 -13.303 -8.380 8.667
105 H ASP 14 H ASP 14 -7.118 -7.078 8.275
106 HA ASP 14 HA ASP 14 -7.227 -7.133 11.161
107 HB2 ASP 14 2HB ASP 14 -4.999 -6.318 9.279
108 HB3 ASP 14 1HB ASP 14 -4.834 -6.555 11.020
109 H GLY 15 H GLY 15 -8.607 -5.010 9.333
110 HA2 GLY 15 2HA GLY 15 -9.341 -2.859 9.810
111 HA3 GLY 15 1HA GLY 15 -8.235 -2.823 11.183
112 H SER 16 H SER 16 -6.133 -3.776 9.083
113 HA SER 16 HA SER 16 -5.027 -1.182 8.606
114 HB2 SER 16 2HB SER 16 -3.287 -2.449 7.347
115 HB3 SER 16 1HB SER 16 -3.557 -3.074 8.975
116 HG SER 16 HG SER 16 -5.273 -4.315 7.462
117 H LYS 17 H LYS 17 -4.114 -0.825 6.239
118 HA LYS 17 HA LYS 17 -6.048 -1.512 4.159
119 HB2 LYS 17 2HB LYS 17 -5.547 1.350 5.013
120 HB3 LYS 17 1HB LYS 17 -6.409 0.868 3.552
121 HG2 LYS 17 2HG LYS 17 -7.961 -0.471 5.069
122 HG3 LYS 17 1HG LYS 17 -7.209 0.369 6.422
123 HD2 LYS 17 2HD LYS 17 -7.800 2.547 5.314
124 HD3 LYS 17 1HD LYS 17 -8.705 1.628 4.110
125 HE2 LYS 17 2HE LYS 17 -10.135 0.688 5.865
126 HE3 LYS 17 1HE LYS 17 -9.208 1.541 7.100
127 HZ1 LYS 17 3HZ LYS 17 -11.402 2.538 6.058
128 HZ2 LYS 17 1HZ LYS 17 -10.305 3.126 4.905
129 HZ3 LYS 17 2HZ LYS 17 -10.110 3.528 6.545
130 H VAL 18 H VAL 18 -4.927 -1.984 2.400
131 HA VAL 18 HA VAL 18 -2.156 -1.065 2.143
132 HB VAL 18 HB VAL 18 -3.436 -2.778 0.046
133 HG11 VAL 18 1HG1 VAL 18 -0.826 -3.120 1.524
134 HG12 VAL 18 2HG1 VAL 18 -0.994 -2.072 0.116
135 HG13 VAL 18 3HG1 VAL 18 -1.287 -3.804 -0.034
136 HG21 VAL 18 3HG2 VAL 18 -2.775 -3.783 2.825
137 HG22 VAL 18 1HG2 VAL 18 -3.146 -4.797 1.429
138 HG23 VAL 18 2HG2 VAL 18 -4.381 -3.728 2.095
139 H HIS 19 H HIS 19 -1.374 0.070 0.340
140 HA HIS 19 HA HIS 19 -3.295 1.105 -1.627
141 HB2 HIS 19 2HB HIS 19 -1.820 3.393 -1.130
142 HB3 HIS 19 1HB HIS 19 -3.439 3.094 -0.507
143 HD1 HIS 19 1HD HIS 19 -3.659 3.277 1.937
144 HD2 HIS 19 2HD HIS 19 0.258 2.314 0.855
145 HE1 HIS 19 1HE HIS 19 -2.310 3.258 4.075
146 HE2 HIS 19 2HE HIS 19 0.073 2.652 3.437
147 H VAL 20 H VAL 20 -2.437 0.644 -3.539
148 HA VAL 20 HA VAL 20 0.404 0.145 -3.760
149 HB VAL 20 HB VAL 20 0.000 -0.891 -5.797
150 HG11 VAL 20 1HG1 VAL 20 -1.200 -2.277 -4.345
151 HG12 VAL 20 2HG1 VAL 20 -2.354 -1.983 -5.630
152 HG13 VAL 20 3HG1 VAL 20 -2.491 -1.110 -4.110
153 HG21 VAL 20 3HG2 VAL 20 -0.904 0.861 -7.107
154 HG22 VAL 20 1HG2 VAL 20 -2.328 1.013 -6.078
155 HG23 VAL 20 2HG2 VAL 20 -2.144 -0.391 -7.129
156 H PHE 21 H PHE 21 1.763 1.119 -5.377
157 HA PHE 21 HA PHE 21 1.151 3.990 -5.753
158 HB2 PHE 21 2HB PHE 21 3.807 2.540 -5.856
159 HB3 PHE 21 1HB PHE 21 3.563 4.284 -5.950
160 HD1 PHE 21 1HD PHE 21 3.406 1.320 -3.759
161 HD2 PHE 21 2HD PHE 21 2.946 5.585 -3.988
162 HE1 PHE 21 1HE PHE 21 3.391 1.450 -1.283
163 HE2 PHE 21 2HE PHE 21 2.931 5.714 -1.511
164 HZ PHE 21 HZ PHE 21 3.154 3.648 -0.160
165 H LYS 22 H LYS 22 2.841 4.670 -7.732
166 HA LYS 22 HA LYS 22 1.458 3.873 -10.074
167 HB2 LYS 22 2HB LYS 22 4.118 5.287 -9.770
168 HB3 LYS 22 1HB LYS 22 3.195 5.170 -11.269
169 HG2 LYS 22 2HG LYS 22 1.248 6.220 -9.981
170 HG3 LYS 22 1HG LYS 22 2.418 6.595 -8.717
171 HD2 LYS 22 2HD LYS 22 2.698 7.439 -11.618
172 HD3 LYS 22 1HD LYS 22 2.093 8.480 -10.329
173 HE2 LYS 22 2HE LYS 22 4.296 7.939 -9.101
174 HE3 LYS 22 1HE LYS 22 4.864 7.327 -10.653
175 HZ1 LYS 22 3HZ LYS 22 5.358 9.727 -10.164
176 HZ2 LYS 22 1HZ LYS 22 3.698 10.028 -10.334
177 HZ3 LYS 22 2HZ LYS 22 4.588 9.421 -11.648
178 H ASP 23 H ASP 23 4.244 2.616 -8.433
179 HA ASP 23 HA ASP 23 5.259 1.136 -10.695
180 HB2 ASP 23 2HB ASP 23 5.870 1.001 -7.736
181 HB3 ASP 23 1HB ASP 23 6.709 0.053 -8.964
182 H GLY 24 H GLY 24 2.426 0.806 -9.420
183 HA2 GLY 24 2HA GLY 24 0.911 -0.909 -9.182
184 HA3 GLY 24 1HA GLY 24 2.036 -1.888 -10.120
185 H LYS 25 H LYS 25 3.692 -0.703 -7.511
186 HA LYS 25 HA LYS 25 3.669 -3.284 -6.162
187 HB2 LYS 25 2HB LYS 25 5.199 -0.701 -5.837
188 HB3 LYS 25 1HB LYS 25 5.331 -1.995 -4.654
189 HG2 LYS 25 2HG LYS 25 5.975 -3.563 -6.480
190 HG3 LYS 25 1HG LYS 25 5.934 -2.214 -7.614
191 HD2 LYS 25 2HD LYS 25 7.601 -1.043 -6.079
192 HD3 LYS 25 1HD LYS 25 7.785 -2.590 -5.252
193 HE2 LYS 25 2HE LYS 25 8.485 -3.660 -7.336
194 HE3 LYS 25 1HE LYS 25 8.219 -2.158 -8.223
195 HZ1 LYS 25 3HZ LYS 25 10.211 -1.438 -7.627
196 HZ2 LYS 25 1HZ LYS 25 10.528 -2.951 -6.929
197 HZ3 LYS 25 2HZ LYS 25 9.882 -1.698 -5.981
198 H MET 26 H MET 26 2.936 -3.665 -4.090
199 HA MET 26 HA MET 26 0.758 -2.026 -3.161
200 HB2 MET 26 2HB MET 26 1.878 -4.700 -2.487
201 HB3 MET 26 1HB MET 26 1.029 -3.873 -1.185
202 HG2 MET 26 2HG MET 26 -0.958 -3.651 -2.544
203 HG3 MET 26 1HG MET 26 -0.119 -4.308 -3.954
204 HE1 MET 26 3HE MET 26 -1.805 -5.854 -4.428
205 HE2 MET 26 1HE MET 26 -1.876 -7.494 -3.765
206 HE3 MET 26 2HE MET 26 -0.405 -6.921 -4.555
207 H GLY 27 H GLY 27 0.654 -1.840 -0.639
208 HA2 GLY 27 2HA GLY 27 3.174 -0.995 0.583
209 HA3 GLY 27 1HA GLY 27 1.984 0.275 0.309
210 H MET 28 H MET 28 3.102 -1.826 2.581
211 HA MET 28 HA MET 28 0.542 -2.501 3.799
212 HB2 MET 28 2HB MET 28 2.551 -4.033 3.794
213 HB3 MET 28 1HB MET 28 3.315 -2.917 4.916
214 HG2 MET 28 2HG MET 28 2.267 -4.660 6.200
215 HG3 MET 28 1HG MET 28 1.360 -3.178 6.434
216 HE1 MET 28 3HE MET 28 -0.549 -4.165 7.355
217 HE2 MET 28 1HE MET 28 -1.917 -4.747 6.400
218 HE3 MET 28 2HE MET 28 -1.295 -3.119 6.145
219 H GLU 29 H GLU 29 -0.498 -1.187 5.108
220 HA GLU 29 HA GLU 29 0.974 0.532 6.981
221 HB2 GLU 29 2HB GLU 29 0.594 2.025 5.124
222 HB3 GLU 29 1HB GLU 29 -1.079 1.494 4.980
223 HG2 GLU 29 2HG GLU 29 -0.788 3.715 6.145
224 HG3 GLU 29 1HG GLU 29 -1.666 2.514 7.086
225 H ASN 30 H ASN 30 0.063 0.458 8.955
226 HA ASN 30 HA ASN 30 -2.335 -1.104 9.336
227 HB2 ASN 30 2HB ASN 30 -1.864 -0.971 11.662
228 HB3 ASN 30 1HB ASN 30 -0.308 -1.138 10.853
229 HD21 ASN 30 1HD2 ASN 30 -0.137 -0.065 13.346
230 HD22 ASN 30 2HD2 ASN 30 0.121 1.616 13.278
231 H LYS 31 H LYS 31 -3.551 0.097 11.490
232 HA LYS 31 HA LYS 31 -5.139 2.115 10.162
233 HB2 LYS 31 2HB LYS 31 -6.313 0.491 11.469
234 HB3 LYS 31 1HB LYS 31 -5.308 0.807 12.881
235 HG2 LYS 31 2HG LYS 31 -6.723 3.198 11.781
236 HG3 LYS 31 1HG LYS 31 -7.774 1.962 12.466
237 HD2 LYS 31 2HD LYS 31 -5.350 2.874 14.011
238 HD3 LYS 31 1HD LYS 31 -6.817 3.849 14.027
239 HE2 LYS 31 2HE LYS 31 -6.632 0.922 14.806
240 HE3 LYS 31 1HE LYS 31 -6.802 2.276 15.921
241 HZ1 LYS 31 3HZ LYS 31 -8.966 1.636 15.662
242 HZ2 LYS 31 1HZ LYS 31 -8.762 1.154 14.048
243 HZ3 LYS 31 2HZ LYS 31 -8.852 2.806 14.435
244 H PHE 32 H PHE 32 -2.679 2.023 12.662
245 HA PHE 32 HA PHE 32 -3.165 4.739 13.535
246 HB2 PHE 32 2HB PHE 32 -0.765 2.972 14.053
247 HB3 PHE 32 1HB PHE 32 -1.216 4.428 14.940
248 HD1 PHE 32 1HD PHE 32 -3.704 4.432 15.879
249 HD2 PHE 32 2HD PHE 32 -1.452 0.902 14.919
250 HE1 PHE 32 1HE PHE 32 -5.161 3.096 17.375
251 HE2 PHE 32 2HE PHE 32 -2.911 -0.435 16.413
252 HZ PHE 32 HZ PHE 32 -4.766 0.662 17.641
253 H GLY 33 H GLY 33 -2.370 3.925 10.659
254 HA2 GLY 33 2HA GLY 33 -1.253 4.962 8.934
255 HA3 GLY 33 1HA GLY 33 -0.902 6.277 10.055
256 H LYS 34 H LYS 34 0.157 3.473 11.470
257 HA LYS 34 HA LYS 34 2.935 4.119 10.904
258 HB2 LYS 34 2HB LYS 34 1.951 3.438 13.192
259 HB3 LYS 34 1HB LYS 34 1.970 1.793 12.563
260 HG2 LYS 34 2HG LYS 34 4.389 2.003 12.093
261 HG3 LYS 34 1HG LYS 34 4.368 3.639 12.751
262 HD2 LYS 34 2HD LYS 34 3.715 2.806 14.941
263 HD3 LYS 34 1HD LYS 34 3.557 1.167 14.307
264 HE2 LYS 34 2HE LYS 34 5.701 1.357 15.436
265 HE3 LYS 34 1HE LYS 34 5.989 1.224 13.701
266 HZ1 LYS 34 3HZ LYS 34 5.640 3.924 14.305
267 HZ2 LYS 34 1HZ LYS 34 7.052 3.146 13.779
268 HZ3 LYS 34 2HZ LYS 34 6.736 3.295 15.440
269 H SER 35 H SER 35 4.154 3.151 9.425
270 HA SER 35 HA SER 35 3.118 1.207 7.642
271 HB2 SER 35 2HB SER 35 6.005 1.987 8.105
272 HB3 SER 35 1HB SER 35 5.360 1.167 6.685
273 HG SER 35 HG SER 35 5.600 3.682 6.910
274 H MET 36 H MET 36 2.970 -0.930 7.854
275 HA MET 36 HA MET 36 4.522 -2.272 9.997
276 HB2 MET 36 2HB MET 36 1.861 -2.818 8.693
277 HB3 MET 36 1HB MET 36 2.755 -4.145 9.440
278 HG2 MET 36 2HG MET 36 2.120 -1.550 10.872
279 HG3 MET 36 1HG MET 36 1.106 -2.993 10.972
280 HE1 MET 36 3HE MET 36 1.320 -4.717 12.564
281 HE2 MET 36 1HE MET 36 2.841 -5.465 13.074
282 HE3 MET 36 2HE MET 36 2.393 -5.444 11.369
283 H ASN 37 H ASN 37 6.322 -3.179 9.273
284 HA ASN 37 HA ASN 37 6.822 -3.779 6.549
285 HB2 ASN 37 2HB ASN 37 8.605 -3.262 8.181
286 HB3 ASN 37 1HB ASN 37 8.280 -4.791 8.997
287 HD21 ASN 37 1HD2 ASN 37 8.109 -6.684 7.100
288 HD22 ASN 37 2HD2 ASN 37 9.463 -6.699 6.073
289 H MET 38 H MET 38 5.132 -5.135 5.843
290 HA MET 38 HA MET 38 4.915 -7.798 7.038
291 HB2 MET 38 2HB MET 38 2.820 -6.804 6.472
292 HB3 MET 38 1HB MET 38 3.369 -6.392 4.844
293 HG2 MET 38 2HG MET 38 3.499 -8.768 4.277
294 HG3 MET 38 1HG MET 38 3.113 -9.201 5.933
295 HE1 MET 38 3HE MET 38 -0.530 -8.722 6.400
296 HE2 MET 38 1HE MET 38 0.616 -7.459 6.871
297 HE3 MET 38 2HE MET 38 1.059 -9.161 7.027
298 HA PRO 39 HA PRO 39 7.913 -9.075 3.907
299 HB2 PRO 39 2HB PRO 39 8.068 -11.726 4.493
300 HB3 PRO 39 1HB PRO 39 8.786 -10.481 5.538
301 HG2 PRO 39 2HG PRO 39 6.199 -11.945 5.848
302 HG3 PRO 39 1HG PRO 39 7.416 -11.541 7.072
303 HD2 PRO 39 2HD PRO 39 5.113 -10.086 6.714
304 HD3 PRO 39 1HD PRO 39 6.606 -9.384 7.352
305 H GLU 40 H GLU 40 7.685 -9.641 1.809
306 HA GLU 40 HA GLU 40 5.283 -10.068 0.569
307 HB2 GLU 40 2HB GLU 40 6.528 -10.837 -1.372
308 HB3 GLU 40 1HB GLU 40 7.411 -9.524 -0.592
309 HG2 GLU 40 2HG GLU 40 8.658 -11.400 0.696
310 HG3 GLU 40 1HG GLU 40 8.008 -12.482 -0.538
311 H GLY 41 H GLY 41 3.848 -11.659 0.511
312 HA2 GLY 41 2HA GLY 41 3.533 -14.075 -0.032
313 HA3 GLY 41 1HA GLY 41 4.715 -14.410 1.229
314 H LYS 42 H LYS 42 3.425 -12.057 2.774
315 HA LYS 42 HA LYS 42 1.644 -13.710 4.300
316 HB2 LYS 42 2HB LYS 42 2.780 -10.982 4.503
317 HB3 LYS 42 1HB LYS 42 1.228 -11.196 5.301
318 HG2 LYS 42 2HG LYS 42 3.409 -13.233 5.753
319 HG3 LYS 42 1HG LYS 42 3.476 -11.696 6.609
320 HD2 LYS 42 2HD LYS 42 1.444 -12.078 7.733
321 HD3 LYS 42 1HD LYS 42 0.952 -13.342 6.604
322 HE2 LYS 42 2HE LYS 42 1.677 -14.355 8.713
323 HE3 LYS 42 1HE LYS 42 2.818 -14.768 7.432
324 HZ1 LYS 42 3HZ LYS 42 3.878 -14.026 9.526
325 HZ2 LYS 42 1HZ LYS 42 3.177 -12.498 9.309
326 HZ3 LYS 42 2HZ LYS 42 4.304 -13.081 8.181
327 H VAL 43 H VAL 43 0.183 -14.275 2.659
328 HA VAL 43 HA VAL 43 -1.374 -12.798 1.011
329 HB VAL 43 HB VAL 43 -2.566 -14.942 2.767
330 HG11 VAL 43 1HG1 VAL 43 -2.970 -14.375 -0.176
331 HG12 VAL 43 2HG1 VAL 43 -3.960 -13.628 1.077
332 HG13 VAL 43 3HG1 VAL 43 -3.963 -15.380 0.879
333 HG21 VAL 43 3HG2 VAL 43 -0.600 -15.150 0.479
334 HG22 VAL 43 1HG2 VAL 43 -1.676 -16.480 0.906
335 HG23 VAL 43 2HG2 VAL 43 -0.495 -15.891 2.075
336 H MET 44 H MET 44 -2.659 -11.099 1.222
337 HA MET 44 HA MET 44 -3.848 -10.472 3.863
338 HB2 MET 44 2HB MET 44 -3.435 -8.712 1.432
339 HB3 MET 44 1HB MET 44 -4.079 -8.192 2.981
340 HG2 MET 44 2HG MET 44 -1.954 -8.758 4.065
341 HG3 MET 44 1HG MET 44 -1.319 -9.372 2.540
342 HE1 MET 44 3HE MET 44 -0.726 -6.506 0.308
343 HE2 MET 44 1HE MET 44 -2.451 -6.871 0.386
344 HE3 MET 44 2HE MET 44 -1.268 -8.173 0.480
345 H GLU 45 H GLU 45 -6.103 -9.920 3.939
346 HA GLU 45 HA GLU 45 -7.685 -10.619 1.532
347 HB2 GLU 45 2HB GLU 45 -7.505 -12.599 3.062
348 HB3 GLU 45 1HB GLU 45 -8.307 -11.643 4.310
349 HG2 GLU 45 2HG GLU 45 -10.254 -11.332 2.844
350 HG3 GLU 45 1HG GLU 45 -9.452 -12.246 1.566
351 H THR 46 H THR 46 -9.195 -9.157 1.098
352 HA THR 46 HA THR 46 -9.661 -6.972 2.897
353 HB THR 46 HB THR 46 -11.367 -6.297 1.141
354 HG1 THR 46 1HG THR 46 -10.202 -8.426 -0.298
355 HG21 THR 46 3HG2 THR 46 -8.542 -6.168 1.069
356 HG22 THR 46 1HG2 THR 46 -9.658 -5.210 0.093
357 HG23 THR 46 2HG2 THR 46 -9.019 -6.726 -0.527
358 H ARG 47 H ARG 47 -11.996 -6.253 3.293
359 HA ARG 47 HA ARG 47 -13.236 -8.152 4.980
360 HB2 ARG 47 2HB ARG 47 -15.085 -6.479 5.095
361 HB3 ARG 47 1HB ARG 47 -13.489 -5.807 5.436
362 HG2 ARG 47 2HG ARG 47 -13.321 -4.903 3.195
363 HG3 ARG 47 1HG ARG 47 -14.811 -5.711 2.710
364 HD2 ARG 47 2HD ARG 47 -15.454 -3.478 3.164
365 HD3 ARG 47 1HD ARG 47 -15.956 -4.392 4.581
366 HE ARG 47 HE ARG 47 -13.779 -2.441 4.443
367 HH11 ARG 47 1HH2 ARG 47 -15.426 -4.934 6.200
368 HH12 ARG 47 2HH2 ARG 47 -14.790 -4.457 7.738
369 HH21 ARG 47 1HH1 ARG 47 -12.944 -1.817 6.456
370 HH22 ARG 47 2HH1 ARG 47 -13.385 -2.695 7.882
371 H ASP 48 H ASP 48 -13.720 -7.278 1.628
372 HA ASP 48 HA ASP 48 -16.262 -8.576 1.345
373 HB2 ASP 48 2HB ASP 48 -15.971 -8.218 -1.025
374 HB3 ASP 48 1HB ASP 48 -15.425 -6.771 -0.176
375 H GLY 49 H GLY 49 -12.900 -9.466 0.630
376 HA2 GLY 49 2HA GLY 49 -12.402 -11.871 1.236
377 HA3 GLY 49 1HA GLY 49 -13.766 -12.275 0.194
378 H THR 50 H THR 50 -11.315 -9.769 -0.379
379 HA THR 50 HA THR 50 -10.663 -11.072 -2.945
380 HB THR 50 HB THR 50 -9.691 -8.371 -2.020
381 HG1 THR 50 1HG THR 50 -11.609 -7.721 -3.353
382 HG21 THR 50 3HG2 THR 50 -10.264 -9.565 -4.744
383 HG22 THR 50 1HG2 THR 50 -8.665 -9.361 -4.030
384 HG23 THR 50 2HG2 THR 50 -9.633 -7.946 -4.443
385 H LYS 51 H LYS 51 -8.786 -12.089 -3.274
386 HA LYS 51 HA LYS 51 -6.872 -12.269 -1.081
387 HB2 LYS 51 2HB LYS 51 -7.569 -14.306 -2.257
388 HB3 LYS 51 1HB LYS 51 -6.942 -13.653 -3.773
389 HG2 LYS 51 2HG LYS 51 -4.695 -13.721 -3.002
390 HG3 LYS 51 1HG LYS 51 -5.194 -13.939 -1.324
391 HD2 LYS 51 2HD LYS 51 -4.420 -16.076 -2.209
392 HD3 LYS 51 1HD LYS 51 -6.161 -16.158 -1.939
393 HE2 LYS 51 2HE LYS 51 -6.638 -15.928 -4.256
394 HE3 LYS 51 1HE LYS 51 -4.997 -15.396 -4.622
395 HZ1 LYS 51 3HZ LYS 51 -5.628 -17.806 -5.124
396 HZ2 LYS 51 1HZ LYS 51 -5.508 -18.056 -3.451
397 HZ3 LYS 51 2HZ LYS 51 -4.156 -17.519 -4.327
398 H ILE 52 H ILE 52 -5.441 -10.671 -0.919
399 HA ILE 52 HA ILE 52 -3.979 -9.808 -3.359
400 HB ILE 52 HB ILE 52 -3.579 -7.655 -1.971
401 HG12 ILE 52 2HG1 ILE 52 -5.075 -9.072 -0.048
402 HG13 ILE 52 1HG1 ILE 52 -4.678 -7.364 0.011
403 HG21 ILE 52 1HG2 ILE 52 -5.714 -6.679 -2.809
404 HG22 ILE 52 2HG2 ILE 52 -6.279 -8.313 -3.170
405 HG23 ILE 52 3HG2 ILE 52 -4.869 -7.660 -4.008
406 HD11 ILE 52 3HD1 ILE 52 -6.764 -6.792 -1.054
407 HD12 ILE 52 1HD1 ILE 52 -7.099 -7.845 0.317
408 HD13 ILE 52 2HD1 ILE 52 -7.145 -8.495 -1.320
409 H ILE 53 H ILE 53 -1.920 -10.354 -3.309
410 HA ILE 53 HA ILE 53 -0.685 -11.265 -0.818
411 HB ILE 53 HB ILE 53 0.631 -11.117 -3.530
412 HG12 ILE 53 2HG1 ILE 53 -1.457 -12.261 -3.900
413 HG13 ILE 53 1HG1 ILE 53 -0.189 -13.484 -3.815
414 HG21 ILE 53 1HG2 ILE 53 0.981 -12.894 -1.097
415 HG22 ILE 53 2HG2 ILE 53 2.092 -11.639 -1.647
416 HG23 ILE 53 3HG2 ILE 53 1.851 -13.093 -2.616
417 HD11 ILE 53 3HD1 ILE 53 -0.785 -13.659 -1.310
418 HD12 ILE 53 1HD1 ILE 53 -1.935 -14.342 -2.457
419 HD13 ILE 53 2HD1 ILE 53 -2.249 -12.769 -1.726
420 H MET 54 H MET 54 1.089 -10.304 0.160
421 HA MET 54 HA MET 54 1.321 -7.473 -0.171
422 HB2 MET 54 2HB MET 54 1.712 -8.673 1.997
423 HB3 MET 54 1HB MET 54 3.217 -9.301 1.320
424 HG2 MET 54 2HG MET 54 3.825 -7.334 2.542
425 HG3 MET 54 1HG MET 54 3.865 -6.876 0.850
426 HE1 MET 54 3HE MET 54 2.277 -3.608 1.235
427 HE2 MET 54 1HE MET 54 3.061 -4.761 0.145
428 HE3 MET 54 2HE MET 54 3.824 -4.335 1.676
429 H LYS 55 H LYS 55 1.757 -7.442 -2.454
430 HA LYS 55 HA LYS 55 4.129 -8.517 -3.581
431 HB2 LYS 55 2HB LYS 55 2.349 -7.989 -5.077
432 HB3 LYS 55 1HB LYS 55 2.185 -6.364 -4.428
433 HG2 LYS 55 2HG LYS 55 3.281 -6.396 -6.661
434 HG3 LYS 55 1HG LYS 55 4.317 -5.702 -5.426
435 HD2 LYS 55 2HD LYS 55 5.543 -7.272 -6.900
436 HD3 LYS 55 1HD LYS 55 5.542 -7.820 -5.230
437 HE2 LYS 55 2HE LYS 55 4.987 -9.538 -7.119
438 HE3 LYS 55 1HE LYS 55 3.994 -9.539 -5.665
439 HZ1 LYS 55 3HZ LYS 55 3.186 -7.768 -7.839
440 HZ2 LYS 55 1HZ LYS 55 2.233 -8.654 -6.751
441 HZ3 LYS 55 2HZ LYS 55 2.957 -9.435 -8.073
442 H GLY 56 H GLY 56 3.337 -5.097 -3.309
443 HA2 GLY 56 2HA GLY 56 5.991 -4.174 -3.400
444 HA3 GLY 56 1HA GLY 56 4.592 -3.239 -2.894
445 H ASN 57 H ASN 57 7.142 -5.402 -1.759
446 HA ASN 57 HA ASN 57 6.400 -5.146 1.012
447 HB2 ASN 57 2HB ASN 57 7.655 -7.104 0.308
448 HB3 ASN 57 1HB ASN 57 8.969 -6.088 -0.287
449 HD21 ASN 57 1HD2 ASN 57 7.260 -5.284 2.705
450 HD22 ASN 57 2HD2 ASN 57 8.555 -5.648 3.749
451 H GLU 58 H GLU 58 7.624 -3.021 -1.189
452 HA GLU 58 HA GLU 58 9.511 -1.636 0.538
453 HB2 GLU 58 2HB GLU 58 8.311 -0.856 -2.134
454 HB3 GLU 58 1HB GLU 58 9.618 -0.001 -1.310
455 HG2 GLU 58 2HG GLU 58 10.652 -1.460 -2.913
456 HG3 GLU 58 1HG GLU 58 10.911 -2.183 -1.326
457 H ILE 59 H ILE 59 7.967 -1.364 2.302
458 HA ILE 59 HA ILE 59 5.629 0.239 2.003
459 HB ILE 59 HB ILE 59 5.782 0.354 4.528
460 HG12 ILE 59 2HG1 ILE 59 8.104 -1.548 4.094
461 HG13 ILE 59 1HG1 ILE 59 8.313 0.150 4.528
462 HG21 ILE 59 1HG2 ILE 59 5.523 -2.197 4.731
463 HG22 ILE 59 2HG2 ILE 59 5.862 -2.255 3.003
464 HG23 ILE 59 3HG2 ILE 59 4.455 -1.375 3.597
465 HD11 ILE 59 3HD1 ILE 59 8.190 -1.752 6.395
466 HD12 ILE 59 1HD1 ILE 59 6.454 -1.501 6.207
467 HD13 ILE 59 2HD1 ILE 59 7.498 -0.155 6.670
468 H PHE 60 H PHE 60 8.992 0.959 2.459
469 HA PHE 60 HA PHE 60 8.966 3.425 3.693
470 HB2 PHE 60 2HB PHE 60 11.004 2.191 2.925
471 HB3 PHE 60 1HB PHE 60 10.649 2.723 1.279
472 HD1 PHE 60 1HD PHE 60 11.650 3.813 4.663
473 HD2 PHE 60 2HD PHE 60 10.930 5.040 0.610
474 HE1 PHE 60 1HE PHE 60 12.760 5.983 5.123
475 HE2 PHE 60 2HE PHE 60 12.039 7.211 1.070
476 HZ PHE 60 HZ PHE 60 12.953 7.682 3.326
477 H ARG 61 H ARG 61 7.881 2.571 0.493
478 HA ARG 61 HA ARG 61 7.880 5.054 -0.764
479 HB2 ARG 61 2HB ARG 61 7.321 2.772 -1.757
480 HB3 ARG 61 1HB ARG 61 5.701 3.001 -1.107
481 HG2 ARG 61 2HG ARG 61 5.679 3.781 -3.391
482 HG3 ARG 61 1HG ARG 61 5.584 5.193 -2.345
483 HD2 ARG 61 2HD ARG 61 7.715 5.917 -2.906
484 HD3 ARG 61 1HD ARG 61 8.314 4.286 -3.197
485 HE ARG 61 HE ARG 61 7.161 6.039 -5.137
486 HH11 ARG 61 1HH2 ARG 61 7.427 2.737 -4.134
487 HH12 ARG 61 2HH2 ARG 61 7.198 2.091 -5.724
488 HH21 ARG 61 1HH1 ARG 61 6.858 5.198 -7.225
489 HH22 ARG 61 2HH1 ARG 61 6.875 3.485 -7.474
490 H LEU 62 H LEU 62 5.704 3.803 1.693
491 HA LEU 62 HA LEU 62 3.466 5.382 1.392
492 HB2 LEU 62 2HB LEU 62 4.888 4.688 3.972
493 HB3 LEU 62 1HB LEU 62 3.227 5.260 3.858
494 HG LEU 62 HG LEU 62 4.083 2.829 2.283
495 HD11 LEU 62 1HD1 LEU 62 3.123 2.797 5.161
496 HD12 LEU 62 2HD1 LEU 62 4.778 2.459 4.651
497 HD13 LEU 62 3HD1 LEU 62 3.466 1.389 4.157
498 HD21 LEU 62 3HD2 LEU 62 1.476 3.780 3.516
499 HD22 LEU 62 1HD2 LEU 62 1.681 2.230 2.702
500 HD23 LEU 62 2HD2 LEU 62 1.875 3.731 1.800
501 H ASP 63 H ASP 63 6.674 6.335 2.404
502 HA ASP 63 HA ASP 63 6.218 8.700 3.747
503 HB2 ASP 63 2HB ASP 63 8.385 9.484 2.696
504 HB3 ASP 63 1HB ASP 63 8.463 7.930 3.521
505 H GLU 64 H GLU 64 7.034 8.660 0.271
506 HA GLU 64 HA GLU 64 4.800 10.199 -0.550
507 HB2 GLU 64 2HB GLU 64 5.896 11.979 0.740
508 HB3 GLU 64 1HB GLU 64 7.382 11.737 -0.179
509 HG2 GLU 64 2HG GLU 64 6.320 12.431 -2.224
510 HG3 GLU 64 1HG GLU 64 4.731 12.434 -1.463
511 H ALA 65 H ALA 65 4.666 10.268 -2.757
512 HA ALA 65 HA ALA 65 6.587 8.693 -4.233
513 HB1 ALA 65 1HB ALA 65 4.207 8.473 -4.724
514 HB2 ALA 65 2HB ALA 65 5.058 9.083 -6.142
515 HB3 ALA 65 3HB ALA 65 4.112 10.184 -5.138
516 H LEU 66 H LEU 66 5.237 11.952 -4.800
517 HA LEU 66 HA LEU 66 6.169 13.852 -5.683
518 HB2 LEU 66 2HB LEU 66 7.824 13.343 -3.778
519 HB3 LEU 66 1HB LEU 66 8.876 12.695 -5.034
520 HG LEU 66 HG LEU 66 8.396 15.005 -6.235
521 HD11 LEU 66 1HD1 LEU 66 8.179 16.842 -4.540
522 HD12 LEU 66 2HD1 LEU 66 7.820 15.623 -3.318
523 HD13 LEU 66 3HD1 LEU 66 6.725 15.857 -4.681
524 HD21 LEU 66 3HD2 LEU 66 10.215 14.676 -3.829
525 HD22 LEU 66 1HD2 LEU 66 10.335 16.003 -4.985
526 HD23 LEU 66 2HD2 LEU 66 10.618 14.344 -5.515
527 H ARG 67 H ARG 67 8.698 11.453 -6.436
528 HA ARG 67 HA ARG 67 9.351 12.301 -8.958
529 HB2 ARG 67 2HB ARG 67 10.177 10.074 -9.398
530 HB3 ARG 67 1HB ARG 67 10.463 10.444 -7.698
531 HG2 ARG 67 2HG ARG 67 8.247 9.284 -7.202
532 HG3 ARG 67 1HG ARG 67 8.280 8.707 -8.869
533 HD2 ARG 67 2HD ARG 67 10.393 8.195 -6.758
534 HD3 ARG 67 1HD ARG 67 9.251 7.015 -7.394
535 HE ARG 67 HE ARG 67 10.708 8.116 -9.545
536 HH11 ARG 67 1HH2 ARG 67 11.105 6.121 -6.745
537 HH12 ARG 67 2HH2 ARG 67 12.411 5.201 -7.417
538 HH21 ARG 67 1HH1 ARG 67 12.420 6.914 -10.432
539 HH22 ARG 67 2HH1 ARG 67 13.155 5.651 -9.502
540 H LYS 68 H LYS 68 8.634 11.938 -11.044
541 HA LYS 68 HA LYS 68 5.811 11.578 -11.369
542 HB2 LYS 68 2HB LYS 68 6.254 11.899 -13.748
543 HB3 LYS 68 1HB LYS 68 7.146 13.093 -12.804
544 HG2 LYS 68 2HG LYS 68 9.116 11.450 -12.876
545 HG3 LYS 68 1HG LYS 68 8.211 10.594 -14.125
546 HD2 LYS 68 2HD LYS 68 8.952 13.533 -14.245
547 HD3 LYS 68 1HD LYS 68 9.822 12.244 -15.076
548 HE2 LYS 68 2HE LYS 68 7.551 11.626 -16.126
549 HE3 LYS 68 1HE LYS 68 6.997 13.198 -15.552
550 HZ1 LYS 68 3HZ LYS 68 8.232 14.283 -17.059
551 HZ2 LYS 68 1HZ LYS 68 8.188 12.812 -17.904
552 HZ3 LYS 68 2HZ LYS 68 9.538 13.200 -16.948
553 H GLY 69 H GLY 69 5.700 10.158 -13.791
554 HA2 GLY 69 2HA GLY 69 6.903 7.585 -13.625
555 HA3 GLY 69 1HA GLY 69 5.274 7.544 -12.956
556 H HIS 70 H HIS 70 3.557 7.465 -14.313
557 HA HIS 70 HA HIS 70 2.402 7.133 -16.272
558 HB2 HIS 70 2HB HIS 70 2.713 9.545 -16.484
559 HB3 HIS 70 1HB HIS 70 4.302 9.297 -17.209
560 HD2 HIS 70 2HD HIS 70 4.214 9.050 -19.962
561 HE1 HIS 70 1HE HIS 70 0.100 8.185 -20.348
562 HE2 HIS 70 2HE HIS 70 2.249 8.624 -21.627
563 H SER 71 H SER 71 2.915 5.058 -16.852
564 HA SER 71 HA SER 71 3.852 3.347 -18.063
565 HB2 SER 71 2HB SER 71 3.206 4.903 -19.926
566 HB3 SER 71 1HB SER 71 4.840 5.557 -19.876
567 HG SER 71 HG SER 71 5.319 3.095 -19.986
568 H GLU 72 H GLU 72 5.406 2.546 -16.712
569 HA GLU 72 HA GLU 72 8.128 2.860 -17.468
570 HB2 GLU 72 2HB GLU 72 8.969 3.838 -15.348
571 HB3 GLU 72 1HB GLU 72 7.970 4.969 -16.260
572 HG2 GLU 72 2HG GLU 72 7.158 5.173 -14.056
573 HG3 GLU 72 1HG GLU 72 6.003 4.082 -14.819
574 H GLY 73 H GLY 73 5.650 1.221 -16.134
575 HA2 GLY 73 2HA GLY 73 7.147 -1.084 -15.521
576 HA3 GLY 73 1HA GLY 73 6.755 -0.259 -14.015
577 H GLY 74 H GLY 74 4.989 -0.859 -17.062
578 HA2 GLY 74 2HA GLY 74 2.455 -1.116 -15.866
579 HA3 GLY 74 1HA GLY 74 2.894 -1.723 -17.460
580 H1 HOH 201 H2 HOH 77 -1.249 6.684 -16.813
581 H2 HOH 201 H1 HOH 77 0.248 6.629 -17.037
Start of MODEL 16
1 H1 VAL 1 1H VAL 1 -4.619 9.365 -13.929
2 H2 VAL 1 2H VAL 1 -4.002 8.218 -12.839
3 HA VAL 1 HA VAL 1 -6.259 7.922 -14.727
4 HB VAL 1 HB VAL 1 -4.889 5.812 -15.232
5 HG11 VAL 1 2HG1 VAL 1 -3.729 8.571 -15.722
6 HG12 VAL 1 3HG1 VAL 1 -4.877 7.712 -16.749
7 HG13 VAL 1 1HG1 VAL 1 -3.225 7.116 -16.584
8 HG21 VAL 1 1HG2 VAL 1 -3.582 6.054 -13.049
9 HG22 VAL 1 2HG2 VAL 1 -2.709 7.373 -13.824
10 HG23 VAL 1 3HG2 VAL 1 -2.613 5.743 -14.488
11 H ASP 2 H ASP 2 -7.486 7.976 -12.524
12 HA ASP 2 HA ASP 2 -8.274 5.305 -11.930
13 HB2 ASP 2 2HB ASP 2 -7.672 5.449 -9.460
14 HB3 ASP 2 1HB ASP 2 -6.335 5.137 -10.566
15 H MET 3 H MET 3 -10.038 6.852 -12.763
16 HA MET 3 HA MET 3 -11.151 8.697 -10.844
17 HB2 MET 3 2HB MET 3 -13.004 8.881 -12.473
18 HB3 MET 3 1HB MET 3 -11.430 9.106 -13.235
19 HG2 MET 3 2HG MET 3 -11.463 6.673 -13.870
20 HG3 MET 3 1HG MET 3 -13.115 6.587 -13.258
21 HE1 MET 3 3HE MET 3 -10.835 7.207 -16.081
22 HE2 MET 3 1HE MET 3 -10.815 8.874 -15.490
23 HE3 MET 3 2HE MET 3 -11.520 8.501 -17.062
24 H SER 4 H SER 4 -11.603 5.347 -11.728
25 HA SER 4 HA SER 4 -14.141 4.863 -10.655
26 HB2 SER 4 2HB SER 4 -11.797 2.957 -10.554
27 HB3 SER 4 1HB SER 4 -13.509 2.545 -10.571
28 HG SER 4 HG SER 4 -12.839 4.171 -12.634
29 H ASN 5 H ASN 5 -10.982 5.054 -9.095
30 HA ASN 5 HA ASN 5 -12.186 5.587 -6.540
31 HB2 ASN 5 2HB ASN 5 -12.314 3.055 -6.776
32 HB3 ASN 5 1HB ASN 5 -10.552 3.056 -6.723
33 HD21 ASN 5 1HD2 ASN 5 -13.464 3.516 -4.803
34 HD22 ASN 5 2HD2 ASN 5 -12.675 3.666 -3.308
35 H VAL 6 H VAL 6 -10.612 6.177 -4.931
36 HA VAL 6 HA VAL 6 -8.455 7.666 -5.920
37 HB VAL 6 HB VAL 6 -7.692 7.524 -3.417
38 HG11 VAL 6 1HG1 VAL 6 -10.396 8.615 -4.258
39 HG12 VAL 6 2HG1 VAL 6 -8.852 9.463 -4.333
40 HG13 VAL 6 3HG1 VAL 6 -9.561 9.058 -2.770
41 HG21 VAL 6 3HG2 VAL 6 -9.289 6.640 -1.879
42 HG22 VAL 6 1HG2 VAL 6 -9.092 5.392 -3.107
43 HG23 VAL 6 2HG2 VAL 6 -10.506 6.442 -3.140
44 H VAL 7 H VAL 7 -6.855 6.753 -7.055
45 HA VAL 7 HA VAL 7 -5.194 5.278 -7.682
46 HB VAL 7 HB VAL 7 -4.718 5.425 -4.694
47 HG11 VAL 7 1HG1 VAL 7 -2.318 4.975 -5.486
48 HG12 VAL 7 2HG1 VAL 7 -3.033 4.458 -7.012
49 HG13 VAL 7 3HG1 VAL 7 -3.424 3.602 -5.521
50 HG21 VAL 7 3HG2 VAL 7 -3.148 7.222 -5.308
51 HG22 VAL 7 1HG2 VAL 7 -4.781 7.620 -5.844
52 HG23 VAL 7 2HG2 VAL 7 -3.590 7.037 -7.007
53 H LYS 8 H LYS 8 -5.446 3.789 -4.517
54 HA LYS 8 HA LYS 8 -7.120 1.616 -5.277
55 HB2 LYS 8 2HB LYS 8 -5.110 1.098 -6.659
56 HB3 LYS 8 1HB LYS 8 -4.155 1.025 -5.185
57 HG2 LYS 8 2HG LYS 8 -5.029 -1.009 -4.530
58 HG3 LYS 8 1HG LYS 8 -6.624 -0.664 -5.212
59 HD2 LYS 8 2HD LYS 8 -4.274 -1.092 -7.058
60 HD3 LYS 8 1HD LYS 8 -5.103 -2.477 -6.359
61 HE2 LYS 8 2HE LYS 8 -7.260 -1.612 -7.257
62 HE3 LYS 8 1HE LYS 8 -6.380 -0.289 -8.026
63 HZ1 LYS 8 3HZ LYS 8 -5.319 -2.923 -8.559
64 HZ2 LYS 8 1HZ LYS 8 -5.592 -1.627 -9.618
65 HZ3 LYS 8 2HZ LYS 8 -6.876 -2.651 -9.185
66 H THR 9 H THR 9 -7.730 0.458 -3.513
67 HA THR 9 HA THR 9 -6.119 0.509 -1.076
68 HB THR 9 HB THR 9 -8.391 1.192 0.135
69 HG1 THR 9 1HG THR 9 -9.037 3.029 -1.512
70 HG21 THR 9 3HG2 THR 9 -6.240 2.416 0.268
71 HG22 THR 9 1HG2 THR 9 -7.618 3.512 0.183
72 HG23 THR 9 2HG2 THR 9 -6.626 3.232 -1.248
73 H TYR 10 H TYR 10 -6.620 -1.110 0.357
74 HA TYR 10 HA TYR 10 -8.773 -2.999 -0.364
75 HB2 TYR 10 2HB TYR 10 -5.859 -3.696 0.061
76 HB3 TYR 10 1HB TYR 10 -7.158 -4.877 0.072
77 HD1 TYR 10 2HD TYR 10 -8.857 -4.550 -2.055
78 HD2 TYR 10 1HD TYR 10 -4.688 -3.491 -1.958
79 HE1 TYR 10 2HE TYR 10 -8.762 -4.681 -4.525
80 HE2 TYR 10 1HE TYR 10 -4.598 -3.630 -4.422
81 HH TYR 10 HH TYR 10 -5.790 -4.657 -6.253
82 H ASP 11 H ASP 11 -10.006 -2.698 1.427
83 HA ASP 11 HA ASP 11 -8.953 -2.237 4.028
84 HB2 ASP 11 2HB ASP 11 -11.678 -3.054 3.022
85 HB3 ASP 11 1HB ASP 11 -11.332 -2.803 4.732
86 H LEU 12 H LEU 12 -7.564 -3.792 4.733
87 HA LEU 12 HA LEU 12 -8.026 -6.598 4.444
88 HB2 LEU 12 2HB LEU 12 -5.985 -4.833 5.620
89 HB3 LEU 12 1HB LEU 12 -6.211 -6.311 6.549
90 HG LEU 12 HG LEU 12 -5.691 -7.688 4.652
91 HD11 LEU 12 1HD1 LEU 12 -6.571 -6.865 2.693
92 HD12 LEU 12 2HD1 LEU 12 -4.944 -6.231 2.492
93 HD13 LEU 12 3HD1 LEU 12 -6.226 -5.188 3.109
94 HD21 LEU 12 3HD2 LEU 12 -3.820 -6.509 5.875
95 HD22 LEU 12 1HD2 LEU 12 -3.784 -5.339 4.553
96 HD23 LEU 12 2HD2 LEU 12 -3.417 -7.033 4.243
97 H GLN 13 H GLN 13 -8.126 -8.069 6.363
98 HA GLN 13 HA GLN 13 -10.439 -7.364 7.947
99 HB2 GLN 13 2HB GLN 13 -8.703 -9.830 7.772
100 HB3 GLN 13 1HB GLN 13 -10.033 -9.684 8.924
101 HG2 GLN 13 2HG GLN 13 -10.415 -9.185 5.967
102 HG3 GLN 13 1HG GLN 13 -10.580 -10.794 6.673
103 HE21 GLN 13 1HE2 GLN 13 -12.919 -10.225 5.718
104 HE22 GLN 13 2HE2 GLN 13 -13.995 -9.532 6.841
105 H ASP 14 H ASP 14 -7.007 -7.336 8.351
106 HA ASP 14 HA ASP 14 -6.968 -7.455 11.212
107 HB2 ASP 14 2HB ASP 14 -4.917 -6.375 9.265
108 HB3 ASP 14 1HB ASP 14 -4.637 -6.689 10.979
109 H GLY 15 H GLY 15 -8.524 -5.321 9.471
110 HA2 GLY 15 2HA GLY 15 -9.413 -3.265 10.096
111 HA3 GLY 15 1HA GLY 15 -8.284 -3.219 11.450
112 H SER 16 H SER 16 -6.263 -3.949 9.103
113 HA SER 16 HA SER 16 -5.404 -1.197 8.726
114 HB2 SER 16 2HB SER 16 -4.232 -3.872 7.954
115 HB3 SER 16 1HB SER 16 -3.506 -2.339 7.473
116 HG SER 16 HG SER 16 -3.785 -3.494 10.013
117 H LYS 17 H LYS 17 -4.259 -1.191 6.261
118 HA LYS 17 HA LYS 17 -6.106 -2.066 4.229
119 HB2 LYS 17 2HB LYS 17 -6.723 0.173 3.437
120 HB3 LYS 17 1HB LYS 17 -7.299 -0.092 5.082
121 HG2 LYS 17 2HG LYS 17 -5.194 1.055 5.901
122 HG3 LYS 17 1HG LYS 17 -4.860 1.483 4.225
123 HD2 LYS 17 2HD LYS 17 -5.993 3.355 5.265
124 HD3 LYS 17 1HD LYS 17 -7.097 2.606 4.114
125 HE2 LYS 17 2HE LYS 17 -7.209 1.598 6.932
126 HE3 LYS 17 1HE LYS 17 -7.858 3.209 6.626
127 HZ1 LYS 17 3HZ LYS 17 -9.110 0.808 6.148
128 HZ2 LYS 17 1HZ LYS 17 -8.678 1.385 4.613
129 HZ3 LYS 17 2HZ LYS 17 -9.624 2.347 5.645
130 H VAL 18 H VAL 18 -5.050 -2.332 2.353
131 HA VAL 18 HA VAL 18 -2.243 -1.606 2.243
132 HB VAL 18 HB VAL 18 -3.671 -2.866 -0.072
133 HG11 VAL 18 1HG1 VAL 18 -1.591 -3.969 -0.415
134 HG12 VAL 18 2HG1 VAL 18 -1.038 -3.579 1.214
135 HG13 VAL 18 3HG1 VAL 18 -1.187 -2.304 0.005
136 HG21 VAL 18 3HG2 VAL 18 -4.555 -4.017 1.962
137 HG22 VAL 18 1HG2 VAL 18 -2.897 -4.388 2.431
138 HG23 VAL 18 2HG2 VAL 18 -3.575 -5.073 0.949
139 H HIS 19 H HIS 19 -1.276 -0.397 0.562
140 HA HIS 19 HA HIS 19 -3.012 1.232 -1.166
141 HB2 HIS 19 2HB HIS 19 -2.854 2.858 0.479
142 HB3 HIS 19 1HB HIS 19 -1.347 2.217 1.117
143 HD1 HIS 19 1HD HIS 19 -2.705 4.517 -1.528
144 HD2 HIS 19 2HD HIS 19 1.002 3.225 -0.123
145 HE1 HIS 19 1HE HIS 19 -0.972 6.035 -2.580
146 HE2 HIS 19 2HE HIS 19 1.294 5.261 -1.734
147 H VAL 20 H VAL 20 -2.218 0.944 -3.172
148 HA VAL 20 HA VAL 20 0.607 0.228 -3.494
149 HB VAL 20 HB VAL 20 0.023 -0.865 -5.438
150 HG11 VAL 20 1HG1 VAL 20 -2.808 -0.768 -4.474
151 HG12 VAL 20 2HG1 VAL 20 -1.591 -1.431 -3.405
152 HG13 VAL 20 3HG1 VAL 20 -1.857 -2.157 -4.989
153 HG21 VAL 20 3HG2 VAL 20 -2.129 -0.122 -6.743
154 HG22 VAL 20 1HG2 VAL 20 -0.665 0.852 -6.884
155 HG23 VAL 20 2HG2 VAL 20 -1.967 1.369 -5.817
156 H PHE 21 H PHE 21 1.929 1.200 -5.117
157 HA PHE 21 HA PHE 21 1.511 4.104 -5.283
158 HB2 PHE 21 2HB PHE 21 3.916 2.352 -5.836
159 HB3 PHE 21 1HB PHE 21 3.897 4.104 -6.028
160 HD1 PHE 21 2HD PHE 21 3.111 1.435 -3.518
161 HD2 PHE 21 1HD PHE 21 4.422 5.472 -4.185
162 HE1 PHE 21 2HE PHE 21 3.550 1.693 -1.092
163 HE2 PHE 21 1HE PHE 21 4.860 5.730 -1.758
164 HZ PHE 21 HZ PHE 21 4.423 3.841 -0.213
165 H LYS 22 H LYS 22 3.009 4.720 -7.489
166 HA LYS 22 HA LYS 22 1.153 4.157 -9.620
167 HB2 LYS 22 2HB LYS 22 2.409 6.358 -9.198
168 HB3 LYS 22 1HB LYS 22 3.810 5.556 -9.910
169 HG2 LYS 22 2HG LYS 22 2.282 4.986 -11.891
170 HG3 LYS 22 1HG LYS 22 1.147 6.152 -11.213
171 HD2 LYS 22 2HD LYS 22 4.035 6.768 -11.909
172 HD3 LYS 22 1HD LYS 22 2.652 7.165 -12.929
173 HE2 LYS 22 2HE LYS 22 1.711 8.403 -10.873
174 HE3 LYS 22 1HE LYS 22 3.335 8.264 -10.200
175 HZ1 LYS 22 3HZ LYS 22 2.719 9.452 -12.849
176 HZ2 LYS 22 1HZ LYS 22 4.225 9.433 -12.068
177 HZ3 LYS 22 2HZ LYS 22 2.948 10.353 -11.427
178 H ASP 23 H ASP 23 4.138 2.841 -8.506
179 HA ASP 23 HA ASP 23 4.935 1.671 -11.016
180 HB2 ASP 23 2HB ASP 23 6.581 2.212 -9.265
181 HB3 ASP 23 1HB ASP 23 5.819 1.035 -8.194
182 H GLY 24 H GLY 24 2.451 1.010 -8.920
183 HA2 GLY 24 2HA GLY 24 0.879 -0.717 -9.196
184 HA3 GLY 24 1HA GLY 24 2.091 -1.668 -10.051
185 H LYS 25 H LYS 25 3.949 -0.850 -7.652
186 HA LYS 25 HA LYS 25 3.647 -3.298 -6.221
187 HB2 LYS 25 2HB LYS 25 5.424 -2.428 -4.795
188 HB3 LYS 25 1HB LYS 25 5.794 -2.074 -6.473
189 HG2 LYS 25 2HG LYS 25 4.933 0.224 -6.181
190 HG3 LYS 25 1HG LYS 25 4.550 -0.130 -4.499
191 HD2 LYS 25 2HD LYS 25 6.636 0.868 -4.247
192 HD3 LYS 25 1HD LYS 25 7.105 -0.825 -4.370
193 HE2 LYS 25 2HE LYS 25 7.253 -0.332 -6.943
194 HE3 LYS 25 1HE LYS 25 7.328 1.354 -6.434
195 HZ1 LYS 25 3HZ LYS 25 9.495 0.000 -6.669
196 HZ2 LYS 25 1HZ LYS 25 9.070 -0.642 -5.157
197 HZ3 LYS 25 2HZ LYS 25 9.301 1.033 -5.333
198 H MET 26 H MET 26 2.796 -3.702 -4.179
199 HA MET 26 HA MET 26 0.633 -1.987 -3.359
200 HB2 MET 26 2HB MET 26 1.636 -4.687 -2.599
201 HB3 MET 26 1HB MET 26 0.709 -3.823 -1.376
202 HG2 MET 26 2HG MET 26 -1.173 -3.611 -2.815
203 HG3 MET 26 1HG MET 26 -0.248 -4.126 -4.224
204 HE1 MET 26 3HE MET 26 -1.617 -7.468 -4.516
205 HE2 MET 26 1HE MET 26 -0.126 -6.648 -5.002
206 HE3 MET 26 2HE MET 26 -1.665 -5.786 -5.043
207 H GLY 27 H GLY 27 0.509 -1.975 -0.714
208 HA2 GLY 27 2HA GLY 27 3.005 -1.165 0.524
209 HA3 GLY 27 1HA GLY 27 1.894 0.168 0.220
210 H MET 28 H MET 28 2.877 -1.788 2.584
211 HA MET 28 HA MET 28 0.274 -2.453 3.729
212 HB2 MET 28 2HB MET 28 2.318 -3.961 3.825
213 HB3 MET 28 1HB MET 28 2.999 -2.815 4.970
214 HG2 MET 28 2HG MET 28 1.909 -4.563 6.228
215 HG3 MET 28 1HG MET 28 0.956 -3.093 6.379
216 HE1 MET 28 3HE MET 28 -1.802 -3.525 6.305
217 HE2 MET 28 1HE MET 28 -0.688 -4.411 7.355
218 HE3 MET 28 2HE MET 28 -1.976 -5.262 6.515
219 H GLU 29 H GLU 29 -0.456 -0.234 3.965
220 HA GLU 29 HA GLU 29 0.864 1.290 6.137
221 HB2 GLU 29 2HB GLU 29 0.495 2.473 3.981
222 HB3 GLU 29 1HB GLU 29 -1.239 2.196 4.154
223 HG2 GLU 29 2HG GLU 29 -1.278 3.471 6.232
224 HG3 GLU 29 1HG GLU 29 0.473 3.670 6.176
225 H ASN 30 H ASN 30 0.048 0.576 8.038
226 HA ASN 30 HA ASN 30 -2.642 -0.343 8.356
227 HB2 ASN 30 2HB ASN 30 -2.108 -0.539 10.699
228 HB3 ASN 30 1HB ASN 30 -0.712 -1.083 9.767
229 HD21 ASN 30 1HD2 ASN 30 0.134 -0.428 12.165
230 HD22 ASN 30 2HD2 ASN 30 0.771 1.148 12.259
231 H LYS 31 H LYS 31 -4.224 0.628 9.820
232 HA LYS 31 HA LYS 31 -4.624 3.400 9.202
233 HB2 LYS 31 2HB LYS 31 -6.759 3.167 10.184
234 HB3 LYS 31 1HB LYS 31 -6.432 1.602 9.445
235 HG2 LYS 31 2HG LYS 31 -6.159 2.308 12.391
236 HG3 LYS 31 1HG LYS 31 -7.352 1.235 11.663
237 HD2 LYS 31 2HD LYS 31 -5.420 -0.195 10.848
238 HD3 LYS 31 1HD LYS 31 -4.369 0.783 11.873
239 HE2 LYS 31 2HE LYS 31 -5.073 -1.231 13.080
240 HE3 LYS 31 1HE LYS 31 -5.774 0.201 13.835
241 HZ1 LYS 31 3HZ LYS 31 -7.806 -0.531 13.402
242 HZ2 LYS 31 1HZ LYS 31 -7.128 -2.005 12.910
243 HZ3 LYS 31 2HZ LYS 31 -7.445 -0.792 11.762
244 H PHE 32 H PHE 32 -2.672 1.981 11.424
245 HA PHE 32 HA PHE 32 -3.224 3.701 13.685
246 HB2 PHE 32 2HB PHE 32 -2.177 1.306 13.676
247 HB3 PHE 32 1HB PHE 32 -0.668 2.146 13.313
248 HD1 PHE 32 1HD PHE 32 -3.610 2.451 15.632
249 HD2 PHE 32 2HD PHE 32 0.641 2.828 15.134
250 HE1 PHE 32 1HE PHE 32 -3.378 3.034 18.032
251 HE2 PHE 32 2HE PHE 32 0.870 3.409 17.534
252 HZ PHE 32 HZ PHE 32 -1.139 3.512 18.983
253 H GLY 33 H GLY 33 -1.805 4.192 10.728
254 HA2 GLY 33 2HA GLY 33 -0.786 6.126 9.927
255 HA3 GLY 33 1HA GLY 33 -0.615 6.693 11.588
256 H LYS 34 H LYS 34 0.477 3.536 11.343
257 HA LYS 34 HA LYS 34 3.294 4.398 10.940
258 HB2 LYS 34 2HB LYS 34 2.345 2.195 12.781
259 HB3 LYS 34 1HB LYS 34 3.978 2.844 12.642
260 HG2 LYS 34 2HG LYS 34 1.564 4.452 13.535
261 HG3 LYS 34 1HG LYS 34 2.743 3.729 14.628
262 HD2 LYS 34 2HD LYS 34 4.517 5.038 13.253
263 HD3 LYS 34 1HD LYS 34 3.150 5.972 12.648
264 HE2 LYS 34 2HE LYS 34 4.164 7.054 14.625
265 HE3 LYS 34 1HE LYS 34 2.506 6.550 14.952
266 HZ1 LYS 34 3HZ LYS 34 3.183 5.114 16.492
267 HZ2 LYS 34 1HZ LYS 34 4.680 5.908 16.445
268 HZ3 LYS 34 2HZ LYS 34 4.435 4.504 15.519
269 H SER 35 H SER 35 4.216 3.465 9.246
270 HA SER 35 HA SER 35 2.999 1.490 7.660
271 HB2 SER 35 2HB SER 35 5.897 2.337 7.847
272 HB3 SER 35 1HB SER 35 5.249 1.288 6.592
273 HG SER 35 HG SER 35 4.288 3.890 7.204
274 H MET 36 H MET 36 2.921 -0.670 7.794
275 HA MET 36 HA MET 36 4.465 -2.008 9.935
276 HB2 MET 36 2HB MET 36 1.917 -2.703 8.473
277 HB3 MET 36 1HB MET 36 2.792 -3.892 9.440
278 HG2 MET 36 2HG MET 36 1.937 -1.193 10.518
279 HG3 MET 36 1HG MET 36 0.950 -2.650 10.671
280 HE1 MET 36 3HE MET 36 2.071 -0.913 13.241
281 HE2 MET 36 1HE MET 36 2.183 -2.361 14.250
282 HE3 MET 36 2HE MET 36 0.871 -2.195 13.085
283 H ASN 37 H ASN 37 6.046 -3.399 9.449
284 HA ASN 37 HA ASN 37 6.768 -3.799 6.671
285 HB2 ASN 37 2HB ASN 37 8.553 -3.350 8.215
286 HB3 ASN 37 1HB ASN 37 8.048 -4.669 9.268
287 HD21 ASN 37 1HD2 ASN 37 7.694 -5.521 5.972
288 HD22 ASN 37 2HD2 ASN 37 9.134 -6.414 5.812
289 H MET 38 H MET 38 5.099 -5.117 5.854
290 HA MET 38 HA MET 38 4.779 -7.793 7.018
291 HB2 MET 38 2HB MET 38 2.722 -6.676 6.414
292 HB3 MET 38 1HB MET 38 3.311 -6.375 4.776
293 HG2 MET 38 2HG MET 38 3.332 -8.750 4.299
294 HG3 MET 38 1HG MET 38 2.986 -9.134 5.976
295 HE1 MET 38 3HE MET 38 0.614 -9.613 6.830
296 HE2 MET 38 1HE MET 38 -0.654 -8.412 6.535
297 HE3 MET 38 2HE MET 38 0.905 -7.913 7.190
298 HA PRO 39 HA PRO 39 7.850 -9.041 3.939
299 HB2 PRO 39 2HB PRO 39 7.763 -11.762 4.310
300 HB3 PRO 39 1HB PRO 39 8.607 -10.654 5.414
301 HG2 PRO 39 2HG PRO 39 5.906 -11.900 5.687
302 HG3 PRO 39 1HG PRO 39 7.167 -11.663 6.912
303 HD2 PRO 39 2HD PRO 39 5.002 -10.021 6.708
304 HD3 PRO 39 1HD PRO 39 6.571 -9.445 7.288
305 H GLU 40 H GLU 40 7.866 -9.866 1.839
306 HA GLU 40 HA GLU 40 5.391 -9.916 0.482
307 HB2 GLU 40 2HB GLU 40 7.416 -9.192 -0.641
308 HB3 GLU 40 1HB GLU 40 8.147 -10.783 -0.408
309 HG2 GLU 40 2HG GLU 40 6.582 -11.823 -1.878
310 HG3 GLU 40 1HG GLU 40 5.554 -10.390 -1.911
311 H GLY 41 H GLY 41 3.959 -11.488 0.943
312 HA2 GLY 41 2HA GLY 41 3.683 -13.862 -0.119
313 HA3 GLY 41 1HA GLY 41 4.862 -14.285 1.118
314 H LYS 42 H LYS 42 3.467 -12.022 2.761
315 HA LYS 42 HA LYS 42 1.780 -13.805 4.234
316 HB2 LYS 42 2HB LYS 42 2.718 -11.000 4.501
317 HB3 LYS 42 1HB LYS 42 1.183 -11.354 5.285
318 HG2 LYS 42 2HG LYS 42 3.504 -13.238 5.703
319 HG3 LYS 42 1HG LYS 42 3.469 -11.716 6.585
320 HD2 LYS 42 2HD LYS 42 1.474 -12.248 7.707
321 HD3 LYS 42 1HD LYS 42 1.059 -13.520 6.556
322 HE2 LYS 42 2HE LYS 42 3.373 -13.595 8.517
323 HE3 LYS 42 1HE LYS 42 1.863 -14.495 8.673
324 HZ1 LYS 42 3HZ LYS 42 2.746 -15.081 6.159
325 HZ2 LYS 42 1HZ LYS 42 2.871 -16.085 7.520
326 HZ3 LYS 42 2HZ LYS 42 4.168 -15.077 7.088
327 H VAL 43 H VAL 43 0.061 -14.496 3.186
328 HA VAL 43 HA VAL 43 -1.486 -13.248 1.287
329 HB VAL 43 HB VAL 43 -2.385 -15.199 3.419
330 HG11 VAL 43 1HG1 VAL 43 -3.679 -14.223 0.860
331 HG12 VAL 43 2HG1 VAL 43 -4.351 -14.191 2.490
332 HG13 VAL 43 3HG1 VAL 43 -4.147 -15.728 1.652
333 HG21 VAL 43 3HG2 VAL 43 -0.621 -16.160 2.108
334 HG22 VAL 43 1HG2 VAL 43 -1.273 -15.484 0.616
335 HG23 VAL 43 2HG2 VAL 43 -2.125 -16.792 1.439
336 H MET 44 H MET 44 -2.758 -11.556 1.262
337 HA MET 44 HA MET 44 -3.790 -10.426 3.797
338 HB2 MET 44 2HB MET 44 -3.116 -9.204 1.115
339 HB3 MET 44 1HB MET 44 -3.985 -8.332 2.375
340 HG2 MET 44 2HG MET 44 -2.026 -8.869 3.905
341 HG3 MET 44 1HG MET 44 -1.177 -9.451 2.477
342 HE1 MET 44 3HE MET 44 -2.568 -7.091 0.294
343 HE2 MET 44 1HE MET 44 -1.172 -8.179 0.315
344 HE3 MET 44 2HE MET 44 -0.936 -6.439 0.167
345 H GLU 45 H GLU 45 -5.988 -10.357 4.053
346 HA GLU 45 HA GLU 45 -7.683 -11.044 1.702
347 HB2 GLU 45 2HB GLU 45 -7.464 -12.876 3.394
348 HB3 GLU 45 1HB GLU 45 -8.201 -11.798 4.584
349 HG2 GLU 45 2HG GLU 45 -10.222 -11.617 3.246
350 HG3 GLU 45 1HG GLU 45 -9.486 -12.555 1.944
351 H THR 46 H THR 46 -9.100 -9.549 1.155
352 HA THR 46 HA THR 46 -9.636 -7.299 2.913
353 HB THR 46 HB THR 46 -10.654 -6.277 1.035
354 HG1 THR 46 1HG THR 46 -11.404 -7.421 -0.671
355 HG21 THR 46 3HG2 THR 46 -8.910 -6.367 -0.576
356 HG22 THR 46 1HG2 THR 46 -8.540 -8.047 -0.192
357 HG23 THR 46 2HG2 THR 46 -8.142 -6.773 0.958
358 H ARG 47 H ARG 47 -11.853 -6.536 3.280
359 HA ARG 47 HA ARG 47 -13.450 -8.469 4.547
360 HB2 ARG 47 2HB ARG 47 -14.188 -5.710 3.540
361 HB3 ARG 47 1HB ARG 47 -15.168 -6.679 4.646
362 HG2 ARG 47 2HG ARG 47 -13.430 -6.650 6.322
363 HG3 ARG 47 1HG ARG 47 -12.294 -5.894 5.204
364 HD2 ARG 47 2HD ARG 47 -13.122 -4.145 6.615
365 HD3 ARG 47 1HD ARG 47 -13.904 -3.940 5.052
366 HE ARG 47 HE ARG 47 -15.177 -4.784 7.543
367 HH11 ARG 47 1HH2 ARG 47 -15.345 -4.437 4.100
368 HH12 ARG 47 2HH2 ARG 47 -17.075 -4.485 4.045
369 HH21 ARG 47 1HH1 ARG 47 -17.444 -4.848 7.472
370 HH22 ARG 47 2HH1 ARG 47 -18.262 -4.718 5.951
371 H ASP 48 H ASP 48 -13.599 -7.055 1.314
372 HA ASP 48 HA ASP 48 -16.090 -8.178 0.554
373 HB2 ASP 48 2HB ASP 48 -15.042 -6.331 -0.685
374 HB3 ASP 48 1HB ASP 48 -13.720 -7.399 -1.166
375 H GLY 49 H GLY 49 -13.201 -9.640 1.322
376 HA2 GLY 49 2HA GLY 49 -12.711 -11.917 1.333
377 HA3 GLY 49 1HA GLY 49 -14.088 -12.197 0.267
378 H THR 50 H THR 50 -11.513 -9.854 -0.343
379 HA THR 50 HA THR 50 -10.851 -11.299 -2.830
380 HB THR 50 HB THR 50 -9.966 -8.536 -1.978
381 HG1 THR 50 1HG THR 50 -12.178 -8.511 -2.102
382 HG21 THR 50 3HG2 THR 50 -8.641 -9.580 -3.760
383 HG22 THR 50 1HG2 THR 50 -9.617 -8.262 -4.409
384 HG23 THR 50 2HG2 THR 50 -10.116 -9.935 -4.659
385 H LYS 51 H LYS 51 -9.181 -12.649 -2.750
386 HA LYS 51 HA LYS 51 -7.211 -12.501 -0.640
387 HB2 LYS 51 2HB LYS 51 -7.942 -14.685 -1.391
388 HB3 LYS 51 1HB LYS 51 -7.456 -14.317 -3.050
389 HG2 LYS 51 2HG LYS 51 -5.139 -14.270 -2.457
390 HG3 LYS 51 1HG LYS 51 -5.511 -14.268 -0.732
391 HD2 LYS 51 2HD LYS 51 -6.364 -16.528 -0.845
392 HD3 LYS 51 1HD LYS 51 -6.239 -16.537 -2.604
393 HE2 LYS 51 2HE LYS 51 -3.928 -16.333 -0.651
394 HE3 LYS 51 1HE LYS 51 -4.336 -17.736 -1.640
395 HZ1 LYS 51 3HZ LYS 51 -3.465 -15.067 -2.597
396 HZ2 LYS 51 1HZ LYS 51 -4.038 -16.296 -3.615
397 HZ3 LYS 51 2HZ LYS 51 -2.611 -16.531 -2.722
398 H ILE 52 H ILE 52 -5.714 -10.964 -0.748
399 HA ILE 52 HA ILE 52 -4.295 -10.519 -3.319
400 HB ILE 52 HB ILE 52 -3.761 -8.219 -2.101
401 HG12 ILE 52 2HG1 ILE 52 -6.479 -8.884 -0.939
402 HG13 ILE 52 1HG1 ILE 52 -4.998 -8.969 -0.007
403 HG21 ILE 52 1HG2 ILE 52 -6.489 -8.783 -3.277
404 HG22 ILE 52 2HG2 ILE 52 -5.025 -8.491 -4.219
405 HG23 ILE 52 3HG2 ILE 52 -5.688 -7.213 -3.199
406 HD11 ILE 52 3HD1 ILE 52 -5.877 -6.805 0.421
407 HD12 ILE 52 1HD1 ILE 52 -6.264 -6.550 -1.278
408 HD13 ILE 52 2HD1 ILE 52 -4.585 -6.542 -0.744
409 H ILE 53 H ILE 53 -2.038 -10.281 -3.209
410 HA ILE 53 HA ILE 53 -0.807 -11.373 -0.738
411 HB ILE 53 HB ILE 53 0.391 -11.256 -3.511
412 HG12 ILE 53 2HG1 ILE 53 -1.608 -12.608 -3.659
413 HG13 ILE 53 1HG1 ILE 53 -0.221 -13.696 -3.608
414 HG21 ILE 53 1HG2 ILE 53 1.053 -12.814 -0.998
415 HG22 ILE 53 2HG2 ILE 53 2.007 -11.512 -1.709
416 HG23 ILE 53 3HG2 ILE 53 1.840 -13.049 -2.558
417 HD11 ILE 53 3HD1 ILE 53 -0.640 -13.737 -1.034
418 HD12 ILE 53 1HD1 ILE 53 -1.726 -14.660 -2.071
419 HD13 ILE 53 2HD1 ILE 53 -2.230 -13.094 -1.440
420 H MET 54 H MET 54 0.963 -10.356 0.178
421 HA MET 54 HA MET 54 1.112 -7.516 -0.206
422 HB2 MET 54 2HB MET 54 1.503 -8.623 1.994
423 HB3 MET 54 1HB MET 54 2.982 -9.334 1.347
424 HG2 MET 54 2HG MET 54 3.713 -7.393 2.496
425 HG3 MET 54 1HG MET 54 3.704 -6.916 0.808
426 HE1 MET 54 3HE MET 54 2.228 -3.614 1.247
427 HE2 MET 54 1HE MET 54 2.963 -4.791 0.151
428 HE3 MET 54 2HE MET 54 3.768 -4.364 1.659
429 H LYS 55 H LYS 55 1.625 -7.379 -2.449
430 HA LYS 55 HA LYS 55 4.017 -8.507 -3.535
431 HB2 LYS 55 2HB LYS 55 1.928 -7.761 -4.806
432 HB3 LYS 55 1HB LYS 55 2.530 -6.114 -4.619
433 HG2 LYS 55 2HG LYS 55 4.667 -6.810 -5.689
434 HG3 LYS 55 1HG LYS 55 3.986 -8.412 -5.962
435 HD2 LYS 55 2HD LYS 55 2.544 -5.950 -6.954
436 HD3 LYS 55 1HD LYS 55 3.867 -6.643 -7.888
437 HE2 LYS 55 2HE LYS 55 1.346 -8.095 -7.024
438 HE3 LYS 55 1HE LYS 55 1.737 -7.568 -8.658
439 HZ1 LYS 55 3HZ LYS 55 2.879 -9.761 -7.089
440 HZ2 LYS 55 1HZ LYS 55 3.881 -8.967 -8.205
441 HZ3 LYS 55 2HZ LYS 55 2.449 -9.714 -8.732
442 H GLY 56 H GLY 56 3.178 -5.086 -3.238
443 HA2 GLY 56 2HA GLY 56 5.847 -4.173 -3.343
444 HA3 GLY 56 1HA GLY 56 4.444 -3.218 -2.878
445 H ASN 57 H ASN 57 6.935 -5.414 -1.674
446 HA ASN 57 HA ASN 57 6.185 -5.069 1.091
447 HB2 ASN 57 2HB ASN 57 7.329 -7.106 0.435
448 HB3 ASN 57 1HB ASN 57 8.694 -6.178 -0.192
449 HD21 ASN 57 1HD2 ASN 57 7.045 -5.246 2.805
450 HD22 ASN 57 2HD2 ASN 57 8.333 -5.653 3.840
451 H GLU 58 H GLU 58 7.542 -3.063 -1.150
452 HA GLU 58 HA GLU 58 9.506 -1.761 0.548
453 HB2 GLU 58 2HB GLU 58 8.350 -0.929 -2.124
454 HB3 GLU 58 1HB GLU 58 9.746 -0.202 -1.332
455 HG2 GLU 58 2HG GLU 58 10.837 -2.477 -1.352
456 HG3 GLU 58 1HG GLU 58 9.497 -3.043 -2.349
457 H ILE 59 H ILE 59 7.902 -1.391 2.298
458 HA ILE 59 HA ILE 59 5.757 0.465 1.897
459 HB ILE 59 HB ILE 59 5.794 0.530 4.444
460 HG12 ILE 59 2HG1 ILE 59 7.799 -1.713 4.080
461 HG13 ILE 59 1HG1 ILE 59 8.268 -0.074 4.535
462 HG21 ILE 59 1HG2 ILE 59 4.262 -0.959 3.398
463 HG22 ILE 59 2HG2 ILE 59 5.133 -1.951 4.568
464 HG23 ILE 59 3HG2 ILE 59 5.552 -2.033 2.857
465 HD11 ILE 59 3HD1 ILE 59 7.888 -1.746 6.453
466 HD12 ILE 59 1HD1 ILE 59 6.172 -1.612 6.073
467 HD13 ILE 59 2HD1 ILE 59 7.075 -0.186 6.585
468 H PHE 60 H PHE 60 9.126 0.735 2.877
469 HA PHE 60 HA PHE 60 9.200 3.235 4.026
470 HB2 PHE 60 2HB PHE 60 11.499 3.399 3.228
471 HB3 PHE 60 1HB PHE 60 11.165 1.760 3.778
472 HD1 PHE 60 1HD PHE 60 11.404 3.912 0.745
473 HD2 PHE 60 2HD PHE 60 11.315 -0.094 2.295
474 HE1 PHE 60 1HE PHE 60 12.035 3.034 -1.485
475 HE2 PHE 60 2HE PHE 60 11.946 -0.971 0.063
476 HZ PHE 60 HZ PHE 60 12.305 0.592 -1.827
477 H ARG 61 H ARG 61 8.660 2.398 0.681
478 HA ARG 61 HA ARG 61 9.261 4.778 -0.609
479 HB2 ARG 61 2HB ARG 61 8.508 2.645 -1.701
480 HB3 ARG 61 1HB ARG 61 6.864 3.031 -1.198
481 HG2 ARG 61 2HG ARG 61 7.159 3.793 -3.482
482 HG3 ARG 61 1HG ARG 61 7.045 5.204 -2.434
483 HD2 ARG 61 2HD ARG 61 9.787 4.123 -2.968
484 HD3 ARG 61 1HD ARG 61 8.980 4.975 -4.280
485 HE ARG 61 HE ARG 61 8.765 6.495 -1.897
486 HH11 ARG 61 1HH2 ARG 61 11.033 5.432 -4.285
487 HH12 ARG 61 2HH2 ARG 61 12.071 6.808 -4.111
488 HH21 ARG 61 1HH1 ARG 61 10.121 8.301 -1.663
489 HH22 ARG 61 2HH1 ARG 61 11.555 8.432 -2.627
490 H LEU 62 H LEU 62 6.345 3.892 1.203
491 HA LEU 62 HA LEU 62 4.689 6.021 0.605
492 HB2 LEU 62 2HB LEU 62 4.182 4.034 2.109
493 HB3 LEU 62 1HB LEU 62 5.038 4.892 3.385
494 HG LEU 62 HG LEU 62 3.425 6.885 2.773
495 HD11 LEU 62 1HD1 LEU 62 1.171 6.000 2.065
496 HD12 LEU 62 2HD1 LEU 62 1.953 4.475 1.659
497 HD13 LEU 62 3HD1 LEU 62 2.389 5.948 0.794
498 HD21 LEU 62 3HD2 LEU 62 1.785 6.048 4.404
499 HD22 LEU 62 1HD2 LEU 62 3.422 5.643 4.919
500 HD23 LEU 62 2HD2 LEU 62 2.394 4.407 4.191
501 H ASP 63 H ASP 63 7.558 5.953 2.598
502 HA ASP 63 HA ASP 63 7.208 8.337 4.039
503 HB2 ASP 63 2HB ASP 63 9.010 6.651 4.436
504 HB3 ASP 63 1HB ASP 63 9.816 7.229 2.979
505 H GLU 64 H GLU 64 6.746 10.261 3.184
506 HA GLU 64 HA GLU 64 6.778 12.101 1.807
507 HB2 GLU 64 2HB GLU 64 9.608 11.150 1.297
508 HB3 GLU 64 1HB GLU 64 8.981 12.758 0.934
509 HG2 GLU 64 2HG GLU 64 8.952 11.541 3.706
510 HG3 GLU 64 1HG GLU 64 10.235 12.599 3.121
511 H ALA 65 H ALA 65 5.402 11.832 0.146
512 HA ALA 65 HA ALA 65 6.416 11.217 -2.451
513 HB1 ALA 65 1HB ALA 65 5.029 9.219 -2.885
514 HB2 ALA 65 2HB ALA 65 4.556 9.190 -1.186
515 HB3 ALA 65 3HB ALA 65 6.238 8.915 -1.638
516 H LEU 66 H LEU 66 4.824 13.213 -0.910
517 HA LEU 66 HA LEU 66 2.968 14.543 -1.168
518 HB2 LEU 66 2HB LEU 66 4.175 14.622 -3.457
519 HB3 LEU 66 1HB LEU 66 2.887 13.559 -4.016
520 HG LEU 66 HG LEU 66 1.300 15.371 -2.905
521 HD11 LEU 66 1HD1 LEU 66 2.272 17.665 -3.173
522 HD12 LEU 66 2HD1 LEU 66 3.852 16.929 -3.434
523 HD13 LEU 66 3HD1 LEU 66 3.037 16.743 -1.882
524 HD21 LEU 66 3HD2 LEU 66 2.783 15.807 -5.517
525 HD22 LEU 66 1HD2 LEU 66 1.282 16.619 -5.070
526 HD23 LEU 66 2HD2 LEU 66 1.305 14.871 -5.295
527 H ARG 67 H ARG 67 1.111 13.573 -3.562
528 HA ARG 67 HA ARG 67 -0.167 11.221 -2.606
529 HB2 ARG 67 2HB ARG 67 -0.793 12.764 -0.761
530 HB3 ARG 67 1HB ARG 67 -1.571 13.820 -1.942
531 HG2 ARG 67 2HG ARG 67 -3.133 12.071 -2.565
532 HG3 ARG 67 1HG ARG 67 -2.293 10.903 -1.543
533 HD2 ARG 67 2HD ARG 67 -4.325 11.791 -0.436
534 HD3 ARG 67 1HD ARG 67 -2.864 12.202 0.454
535 HE ARG 67 HE ARG 67 -3.462 14.296 -1.347
536 HH11 ARG 67 1HH2 ARG 67 -4.632 12.760 1.524
537 HH12 ARG 67 2HH2 ARG 67 -5.382 14.191 2.149
538 HH21 ARG 67 1HH1 ARG 67 -4.443 16.177 -0.533
539 HH22 ARG 67 2HH1 ARG 67 -5.276 16.125 0.985
540 H LYS 68 H LYS 68 -0.785 14.364 -4.166
541 HA LYS 68 HA LYS 68 -2.845 13.673 -5.867
542 HB2 LYS 68 2HB LYS 68 -1.760 15.953 -5.572
543 HB3 LYS 68 1HB LYS 68 -0.525 15.412 -6.710
544 HG2 LYS 68 2HG LYS 68 -2.454 14.820 -8.290
545 HG3 LYS 68 1HG LYS 68 -3.487 15.752 -7.205
546 HD2 LYS 68 2HD LYS 68 -1.039 16.769 -8.676
547 HD3 LYS 68 1HD LYS 68 -2.716 17.204 -9.005
548 HE2 LYS 68 2HE LYS 68 -1.026 17.924 -6.615
549 HE3 LYS 68 1HE LYS 68 -1.930 18.995 -7.686
550 HZ1 LYS 68 3HZ LYS 68 -2.865 17.385 -5.446
551 HZ2 LYS 68 1HZ LYS 68 -3.904 17.498 -6.782
552 HZ3 LYS 68 2HZ LYS 68 -3.389 18.908 -5.985
553 H GLY 69 H GLY 69 -3.016 12.753 -7.892
554 HA2 GLY 69 2HA GLY 69 -0.833 11.987 -9.526
555 HA3 GLY 69 1HA GLY 69 -1.340 10.614 -8.546
556 H HIS 70 H HIS 70 -2.119 12.669 -11.215
557 HA HIS 70 HA HIS 70 -3.937 10.781 -12.323
558 HB2 HIS 70 2HB HIS 70 -5.455 11.707 -10.632
559 HB3 HIS 70 1HB HIS 70 -5.147 13.335 -11.237
560 HD2 HIS 70 2HD HIS 70 -6.861 14.079 -13.279
561 HE1 HIS 70 1HE HIS 70 -8.235 10.228 -14.329
562 HE2 HIS 70 2HE HIS 70 -8.498 12.713 -14.785
563 H SER 71 H SER 71 -1.702 13.026 -12.639
564 HA SER 71 HA SER 71 -2.083 13.370 -15.437
565 HB2 SER 71 2HB SER 71 -3.726 15.028 -14.804
566 HB3 SER 71 1HB SER 71 -2.603 15.768 -13.666
567 HG SER 71 HG SER 71 -2.727 15.916 -16.436
568 H GLU 72 H GLU 72 -0.763 15.782 -13.214
569 HA GLU 72 HA GLU 72 1.729 15.948 -14.489
570 HB2 GLU 72 2HB GLU 72 0.703 17.623 -12.881
571 HB3 GLU 72 1HB GLU 72 1.233 16.566 -11.574
572 HG2 GLU 72 2HG GLU 72 2.968 18.193 -11.873
573 HG3 GLU 72 1HG GLU 72 3.566 16.689 -12.570
574 H GLY 73 H GLY 73 2.438 13.778 -14.796
575 HA2 GLY 73 2HA GLY 73 2.877 11.945 -12.678
576 HA3 GLY 73 1HA GLY 73 3.618 11.872 -14.273
577 H GLY 74 H GLY 74 5.593 12.990 -14.645
578 HA2 GLY 74 2HA GLY 74 6.977 14.542 -12.759
579 HA3 GLY 74 1HA GLY 74 7.453 12.863 -12.530
580 H1 HOH 201 H2 HOH 77 -7.912 10.794 -10.625
581 H2 HOH 201 H1 HOH 77 -6.993 10.252 -9.553
Start of MODEL 17
1 H1 VAL 1 1H VAL 1 -1.844 13.310 -10.114
2 H2 VAL 1 2H VAL 1 -0.444 12.727 -10.871
3 HA VAL 1 HA VAL 1 -1.373 11.034 -9.465
4 HB VAL 1 HB VAL 1 0.617 10.552 -8.110
5 HG11 VAL 1 2HG1 VAL 1 0.739 10.215 -10.538
6 HG12 VAL 1 3HG1 VAL 1 2.302 10.745 -9.914
7 HG13 VAL 1 1HG1 VAL 1 1.255 11.887 -10.756
8 HG21 VAL 1 1HG2 VAL 1 1.475 13.384 -8.784
9 HG22 VAL 1 2HG2 VAL 1 2.417 12.199 -7.888
10 HG23 VAL 1 3HG2 VAL 1 0.940 12.856 -7.193
11 H ASP 2 H ASP 2 -2.849 13.351 -8.702
12 HA ASP 2 HA ASP 2 -3.618 12.620 -6.080
13 HB2 ASP 2 2HB ASP 2 -2.964 14.922 -5.065
14 HB3 ASP 2 1HB ASP 2 -1.727 13.672 -5.180
15 H MET 3 H MET 3 -3.619 14.874 -8.735
16 HA MET 3 HA MET 3 -5.847 16.446 -7.910
17 HB2 MET 3 2HB MET 3 -4.697 15.903 -10.658
18 HB3 MET 3 1HB MET 3 -5.941 17.104 -10.316
19 HG2 MET 3 2HG MET 3 -3.836 18.264 -10.301
20 HG3 MET 3 1HG MET 3 -4.351 18.119 -8.621
21 HE1 MET 3 3HE MET 3 -0.589 17.789 -8.142
22 HE2 MET 3 1HE MET 3 -2.084 18.681 -7.831
23 HE3 MET 3 2HE MET 3 -1.323 18.757 -9.417
24 H SER 4 H SER 4 -5.537 13.675 -10.131
25 HA SER 4 HA SER 4 -8.282 13.486 -10.775
26 HB2 SER 4 2HB SER 4 -6.137 11.350 -10.763
27 HB3 SER 4 1HB SER 4 -7.723 11.187 -11.513
28 HG SER 4 HG SER 4 -5.831 11.956 -12.832
29 H ASN 5 H ASN 5 -6.832 13.115 -7.833
30 HA ASN 5 HA ASN 5 -7.469 12.186 -5.833
31 HB2 ASN 5 2HB ASN 5 -10.169 11.923 -7.176
32 HB3 ASN 5 1HB ASN 5 -9.850 11.946 -5.442
33 HD21 ASN 5 1HD2 ASN 5 -11.412 13.891 -7.230
34 HD22 ASN 5 2HD2 ASN 5 -10.731 15.406 -6.883
35 H VAL 6 H VAL 6 -6.998 10.470 -8.475
36 HA VAL 6 HA VAL 6 -8.258 7.969 -7.925
37 HB VAL 6 HB VAL 6 -7.394 8.614 -10.164
38 HG11 VAL 6 1HG1 VAL 6 -4.658 8.069 -8.984
39 HG12 VAL 6 2HG1 VAL 6 -5.302 9.695 -9.214
40 HG13 VAL 6 3HG1 VAL 6 -5.032 8.648 -10.607
41 HG21 VAL 6 3HG2 VAL 6 -6.004 6.158 -9.051
42 HG22 VAL 6 1HG2 VAL 6 -6.515 6.426 -10.719
43 HG23 VAL 6 2HG2 VAL 6 -7.721 6.215 -9.449
44 H VAL 7 H VAL 7 -7.570 6.243 -6.753
45 HA VAL 7 HA VAL 7 -4.885 5.922 -5.827
46 HB VAL 7 HB VAL 7 -5.528 7.730 -4.308
47 HG11 VAL 7 1HG1 VAL 7 -8.002 7.235 -4.461
48 HG12 VAL 7 2HG1 VAL 7 -7.421 7.531 -2.822
49 HG13 VAL 7 3HG1 VAL 7 -7.736 5.881 -3.362
50 HG21 VAL 7 3HG2 VAL 7 -5.613 5.094 -2.813
51 HG22 VAL 7 1HG2 VAL 7 -4.960 6.631 -2.245
52 HG23 VAL 7 2HG2 VAL 7 -4.138 5.745 -3.529
53 H LYS 8 H LYS 8 -4.563 3.938 -4.750
54 HA LYS 8 HA LYS 8 -6.778 2.020 -5.103
55 HB2 LYS 8 2HB LYS 8 -4.380 1.737 -6.091
56 HB3 LYS 8 1HB LYS 8 -3.922 1.292 -4.448
57 HG2 LYS 8 2HG LYS 8 -4.481 -0.792 -5.315
58 HG3 LYS 8 1HG LYS 8 -6.023 -0.314 -4.613
59 HD2 LYS 8 2HD LYS 8 -6.716 -0.966 -6.741
60 HD3 LYS 8 1HD LYS 8 -6.428 0.749 -7.023
61 HE2 LYS 8 2HE LYS 8 -4.068 0.120 -7.739
62 HE3 LYS 8 1HE LYS 8 -4.590 -1.564 -7.693
63 HZ1 LYS 8 3HZ LYS 8 -6.515 -0.681 -9.157
64 HZ2 LYS 8 1HZ LYS 8 -5.004 -0.994 -9.863
65 HZ3 LYS 8 2HZ LYS 8 -5.451 0.601 -9.486
66 H THR 9 H THR 9 -7.576 0.794 -3.424
67 HA THR 9 HA THR 9 -6.319 0.910 -0.797
68 HB THR 9 HB THR 9 -9.112 1.996 -1.194
69 HG1 THR 9 1HG THR 9 -8.199 3.965 -0.826
70 HG21 THR 9 3HG2 THR 9 -8.812 0.878 0.952
71 HG22 THR 9 1HG2 THR 9 -8.847 2.623 1.201
72 HG23 THR 9 2HG2 THR 9 -7.310 1.759 1.230
73 H TYR 10 H TYR 10 -6.491 -1.026 0.109
74 HA TYR 10 HA TYR 10 -8.800 -2.769 -0.585
75 HB2 TYR 10 2HB TYR 10 -6.087 -3.706 0.354
76 HB3 TYR 10 1HB TYR 10 -7.390 -4.673 -0.292
77 HD1 TYR 10 2HD TYR 10 -8.031 -2.639 -2.647
78 HD2 TYR 10 1HD TYR 10 -4.440 -4.515 -1.193
79 HE1 TYR 10 2HE TYR 10 -7.034 -2.475 -4.895
80 HE2 TYR 10 1HE TYR 10 -3.453 -4.348 -3.458
81 HH TYR 10 HH TYR 10 -5.250 -2.847 -6.148
82 H ASP 11 H ASP 11 -10.092 -2.052 1.131
83 HA ASP 11 HA ASP 11 -9.302 -1.702 3.781
84 HB2 ASP 11 2HB ASP 11 -11.926 -2.615 2.597
85 HB3 ASP 11 1HB ASP 11 -11.706 -2.274 4.313
86 H LEU 12 H LEU 12 -7.910 -3.239 4.553
87 HA LEU 12 HA LEU 12 -8.222 -6.025 4.235
88 HB2 LEU 12 2HB LEU 12 -6.356 -4.241 5.466
89 HB3 LEU 12 1HB LEU 12 -6.791 -5.435 6.684
90 HG LEU 12 HG LEU 12 -6.218 -7.252 5.123
91 HD11 LEU 12 1HD1 LEU 12 -6.301 -5.097 3.157
92 HD12 LEU 12 2HD1 LEU 12 -6.256 -6.839 2.909
93 HD13 LEU 12 3HD1 LEU 12 -4.754 -5.942 3.082
94 HD21 LEU 12 3HD2 LEU 12 -3.991 -5.206 5.207
95 HD22 LEU 12 1HD2 LEU 12 -3.827 -6.962 5.197
96 HD23 LEU 12 2HD2 LEU 12 -4.495 -6.148 6.613
97 H GLN 13 H GLN 13 -8.536 -7.576 6.034
98 HA GLN 13 HA GLN 13 -11.078 -7.045 7.306
99 HB2 GLN 13 2HB GLN 13 -10.869 -9.377 8.118
100 HB3 GLN 13 1HB GLN 13 -10.626 -9.253 6.372
101 HG2 GLN 13 2HG GLN 13 -8.167 -9.209 6.742
102 HG3 GLN 13 1HG GLN 13 -8.444 -9.420 8.472
103 HE21 GLN 13 1HE2 GLN 13 -10.333 -11.021 5.897
104 HE22 GLN 13 2HE2 GLN 13 -9.824 -12.598 6.287
105 H ASP 14 H ASP 14 -7.811 -6.627 8.155
106 HA ASP 14 HA ASP 14 -8.334 -6.794 11.053
107 HB2 ASP 14 2HB ASP 14 -5.793 -6.244 11.091
108 HB3 ASP 14 1HB ASP 14 -6.302 -7.847 10.560
109 H GLY 15 H GLY 15 -9.257 -4.639 9.052
110 HA2 GLY 15 2HA GLY 15 -9.816 -2.410 9.397
111 HA3 GLY 15 1HA GLY 15 -8.802 -2.408 10.840
112 H SER 16 H SER 16 -6.609 -3.614 9.037
113 HA SER 16 HA SER 16 -5.218 -1.202 8.538
114 HB2 SER 16 2HB SER 16 -4.696 -3.939 7.357
115 HB3 SER 16 1HB SER 16 -3.549 -2.604 7.442
116 HG SER 16 HG SER 16 -4.317 -2.812 9.855
117 H LYS 17 H LYS 17 -4.341 -0.583 6.357
118 HA LYS 17 HA LYS 17 -6.265 -1.058 4.157
119 HB2 LYS 17 2HB LYS 17 -5.188 1.668 4.922
120 HB3 LYS 17 1HB LYS 17 -6.316 1.302 3.619
121 HG2 LYS 17 2HG LYS 17 -8.013 0.601 5.202
122 HG3 LYS 17 1HG LYS 17 -6.879 0.737 6.543
123 HD2 LYS 17 2HD LYS 17 -8.390 2.699 6.417
124 HD3 LYS 17 1HD LYS 17 -6.701 3.151 6.195
125 HE2 LYS 17 2HE LYS 17 -8.490 4.120 4.553
126 HE3 LYS 17 1HE LYS 17 -6.967 3.525 3.895
127 HZ1 LYS 17 3HZ LYS 17 -9.305 2.756 2.966
128 HZ2 LYS 17 1HZ LYS 17 -9.139 1.598 4.195
129 HZ3 LYS 17 2HZ LYS 17 -7.956 1.723 2.981
130 H VAL 18 H VAL 18 -5.225 -1.704 2.400
131 HA VAL 18 HA VAL 18 -2.335 -1.366 2.170
132 HB VAL 18 HB VAL 18 -4.057 -2.615 0.043
133 HG11 VAL 18 1HG1 VAL 18 -1.505 -2.266 -0.075
134 HG12 VAL 18 2HG1 VAL 18 -2.125 -3.873 -0.456
135 HG13 VAL 18 3HG1 VAL 18 -1.406 -3.556 1.123
136 HG21 VAL 18 3HG2 VAL 18 -4.796 -3.531 2.289
137 HG22 VAL 18 1HG2 VAL 18 -3.144 -4.101 2.520
138 HG23 VAL 18 2HG2 VAL 18 -4.122 -4.729 1.189
139 H HIS 19 H HIS 19 -1.327 -0.375 0.348
140 HA HIS 19 HA HIS 19 -3.008 1.228 -1.452
141 HB2 HIS 19 2HB HIS 19 -0.868 2.977 -0.755
142 HB3 HIS 19 1HB HIS 19 -2.574 3.192 -0.380
143 HD1 HIS 19 1HD HIS 19 -3.360 2.653 2.003
144 HD2 HIS 19 2HD HIS 19 0.703 1.913 1.410
145 HE1 HIS 19 1HE HIS 19 -2.361 2.262 4.294
146 HE2 HIS 19 2HE HIS 19 0.112 1.797 3.948
147 H VAL 20 H VAL 20 -2.365 0.708 -3.419
148 HA VAL 20 HA VAL 20 0.457 -0.048 -3.840
149 HB VAL 20 HB VAL 20 -0.220 -1.597 -5.402
150 HG11 VAL 20 1HG1 VAL 20 -1.902 -2.880 -4.417
151 HG12 VAL 20 2HG1 VAL 20 -2.869 -1.475 -4.001
152 HG13 VAL 20 3HG1 VAL 20 -1.426 -1.829 -3.086
153 HG21 VAL 20 3HG2 VAL 20 -2.502 0.278 -5.974
154 HG22 VAL 20 1HG2 VAL 20 -2.564 -1.399 -6.519
155 HG23 VAL 20 2HG2 VAL 20 -1.271 -0.339 -7.075
156 H PHE 21 H PHE 21 1.703 0.968 -5.320
157 HA PHE 21 HA PHE 21 0.736 3.537 -6.312
158 HB2 PHE 21 2HB PHE 21 3.465 2.237 -6.308
159 HB3 PHE 21 1HB PHE 21 3.135 3.847 -6.950
160 HD1 PHE 21 1HD PHE 21 2.645 1.769 -3.867
161 HD2 PHE 21 2HD PHE 21 3.201 5.705 -5.505
162 HE1 PHE 21 1HE PHE 21 2.783 2.707 -1.575
163 HE2 PHE 21 2HE PHE 21 3.339 6.640 -3.212
164 HZ PHE 21 HZ PHE 21 3.130 5.141 -1.247
165 H LYS 22 H LYS 22 1.573 4.192 -8.542
166 HA LYS 22 HA LYS 22 0.260 2.728 -10.518
167 HB2 LYS 22 2HB LYS 22 0.936 5.125 -10.697
168 HB3 LYS 22 1HB LYS 22 2.602 4.598 -10.935
169 HG2 LYS 22 2HG LYS 22 2.020 3.427 -12.963
170 HG3 LYS 22 1HG LYS 22 0.298 3.686 -12.678
171 HD2 LYS 22 2HD LYS 22 0.620 6.120 -12.892
172 HD3 LYS 22 1HD LYS 22 2.345 5.870 -13.170
173 HE2 LYS 22 2HE LYS 22 1.240 6.145 -15.320
174 HE3 LYS 22 1HE LYS 22 1.775 4.472 -15.165
175 HZ1 LYS 22 3HZ LYS 22 -0.421 3.808 -14.556
176 HZ2 LYS 22 1HZ LYS 22 -0.528 4.711 -15.989
177 HZ3 LYS 22 2HZ LYS 22 -0.960 5.418 -14.505
178 H ASP 23 H ASP 23 3.355 2.235 -9.098
179 HA ASP 23 HA ASP 23 4.484 0.738 -11.289
180 HB2 ASP 23 2HB ASP 23 5.294 0.866 -8.374
181 HB3 ASP 23 1HB ASP 23 6.250 0.159 -9.678
182 H GLY 24 H GLY 24 1.866 0.095 -9.642
183 HA2 GLY 24 2HA GLY 24 0.653 -1.825 -9.285
184 HA3 GLY 24 1HA GLY 24 1.944 -2.718 -10.079
185 H LYS 25 H LYS 25 3.717 -1.237 -7.916
186 HA LYS 25 HA LYS 25 3.959 -3.465 -6.167
187 HB2 LYS 25 2HB LYS 25 4.906 -0.594 -5.935
188 HB3 LYS 25 1HB LYS 25 5.373 -1.868 -4.819
189 HG2 LYS 25 2HG LYS 25 5.751 -2.313 -7.767
190 HG3 LYS 25 1HG LYS 25 6.904 -1.297 -6.911
191 HD2 LYS 25 2HD LYS 25 6.189 -3.998 -5.779
192 HD3 LYS 25 1HD LYS 25 7.339 -3.892 -7.107
193 HE2 LYS 25 2HE LYS 25 8.692 -2.279 -5.768
194 HE3 LYS 25 1HE LYS 25 7.575 -2.499 -4.422
195 HZ1 LYS 25 3HZ LYS 25 8.300 -4.604 -4.035
196 HZ2 LYS 25 1HZ LYS 25 9.736 -3.937 -4.643
197 HZ3 LYS 25 2HZ LYS 25 8.747 -4.882 -5.651
198 H MET 26 H MET 26 3.193 -3.749 -4.064
199 HA MET 26 HA MET 26 0.772 -2.275 -3.411
200 HB2 MET 26 2HB MET 26 1.925 -4.911 -2.751
201 HB3 MET 26 1HB MET 26 1.114 -4.144 -1.388
202 HG2 MET 26 2HG MET 26 -0.930 -3.965 -2.594
203 HG3 MET 26 1HG MET 26 -0.157 -4.385 -4.122
204 HE1 MET 26 3HE MET 26 -1.433 -6.229 -4.918
205 HE2 MET 26 1HE MET 26 -1.063 -7.891 -4.432
206 HE3 MET 26 2HE MET 26 0.229 -6.812 -4.954
207 H GLY 27 H GLY 27 0.519 -2.217 -0.832
208 HA2 GLY 27 2HA GLY 27 2.886 -0.960 0.402
209 HA3 GLY 27 1HA GLY 27 1.384 -0.042 0.305
210 H MET 28 H MET 28 1.883 -0.192 2.770
211 HA MET 28 HA MET 28 -0.014 -2.002 3.889
212 HB2 MET 28 2HB MET 28 2.117 -3.417 3.420
213 HB3 MET 28 1HB MET 28 2.814 -2.548 4.789
214 HG2 MET 28 2HG MET 28 1.877 -4.488 5.755
215 HG3 MET 28 1HG MET 28 0.679 -3.231 6.063
216 HE1 MET 28 3HE MET 28 -1.983 -4.108 5.669
217 HE2 MET 28 1HE MET 28 -0.770 -4.914 6.676
218 HE3 MET 28 2HE MET 28 -1.809 -5.862 5.622
219 H GLU 29 H GLU 29 -0.747 -1.201 5.776
220 HA GLU 29 HA GLU 29 0.941 0.395 7.522
221 HB2 GLU 29 2HB GLU 29 0.042 1.972 5.733
222 HB3 GLU 29 1HB GLU 29 -1.559 1.668 6.406
223 HG2 GLU 29 2HG GLU 29 -0.763 2.424 8.622
224 HG3 GLU 29 1HG GLU 29 0.822 2.759 7.930
225 H ASN 30 H ASN 30 0.496 -0.428 9.454
226 HA ASN 30 HA ASN 30 -1.822 -1.921 10.072
227 HB2 ASN 30 2HB ASN 30 -1.023 -1.680 12.446
228 HB3 ASN 30 1HB ASN 30 0.192 -2.300 11.327
229 HD21 ASN 30 1HD2 ASN 30 1.715 -1.399 13.090
230 HD22 ASN 30 2HD2 ASN 30 2.147 0.244 12.976
231 H LYS 31 H LYS 31 -3.433 -1.400 11.724
232 HA LYS 31 HA LYS 31 -4.938 0.847 11.172
233 HB2 LYS 31 2HB LYS 31 -6.101 0.419 13.310
234 HB3 LYS 31 1HB LYS 31 -5.836 -1.063 12.391
235 HG2 LYS 31 2HG LYS 31 -4.993 -1.872 14.371
236 HG3 LYS 31 1HG LYS 31 -3.535 -1.004 13.897
237 HD2 LYS 31 2HD LYS 31 -3.884 -0.194 16.064
238 HD3 LYS 31 1HD LYS 31 -4.690 1.040 15.100
239 HE2 LYS 31 2HE LYS 31 -6.858 -0.054 15.472
240 HE3 LYS 31 1HE LYS 31 -6.068 -1.336 16.388
241 HZ1 LYS 31 3HZ LYS 31 -5.436 1.328 17.290
242 HZ2 LYS 31 1HZ LYS 31 -5.881 -0.044 18.183
243 HZ3 LYS 31 2HZ LYS 31 -7.077 0.918 17.454
244 H PHE 32 H PHE 32 -2.010 0.681 12.899
245 HA PHE 32 HA PHE 32 -2.447 3.018 14.549
246 HB2 PHE 32 2HB PHE 32 0.035 1.424 13.873
247 HB3 PHE 32 1HB PHE 32 0.018 2.800 14.980
248 HD1 PHE 32 1HD PHE 32 -1.465 2.719 17.029
249 HD2 PHE 32 2HD PHE 32 -0.723 -0.723 14.571
250 HE1 PHE 32 1HE PHE 32 -2.242 1.241 18.863
251 HE2 PHE 32 2HE PHE 32 -1.500 -2.201 16.405
252 HZ PHE 32 HZ PHE 32 -2.258 -1.220 18.551
253 H GLY 33 H GLY 33 -2.222 2.716 11.335
254 HA2 GLY 33 2HA GLY 33 -1.834 4.242 9.651
255 HA3 GLY 33 1HA GLY 33 -1.545 5.454 10.900
256 H LYS 34 H LYS 34 0.401 2.865 11.574
257 HA LYS 34 HA LYS 34 2.758 4.213 10.437
258 HB2 LYS 34 2HB LYS 34 2.554 1.959 12.453
259 HB3 LYS 34 1HB LYS 34 4.033 2.790 11.983
260 HG2 LYS 34 2HG LYS 34 1.709 4.413 13.004
261 HG3 LYS 34 1HG LYS 34 2.710 3.542 14.161
262 HD2 LYS 34 2HD LYS 34 4.045 5.255 12.069
263 HD3 LYS 34 1HD LYS 34 3.332 6.023 13.484
264 HE2 LYS 34 2HE LYS 34 4.683 4.526 14.946
265 HE3 LYS 34 1HE LYS 34 5.444 3.844 13.510
266 HZ1 LYS 34 3HZ LYS 34 6.892 5.497 13.625
267 HZ2 LYS 34 1HZ LYS 34 6.022 6.271 14.859
268 HZ3 LYS 34 2HZ LYS 34 5.638 6.574 13.233
269 H SER 35 H SER 35 4.104 3.279 8.972
270 HA SER 35 HA SER 35 3.111 1.247 7.275
271 HB2 SER 35 2HB SER 35 6.021 1.997 7.478
272 HB3 SER 35 1HB SER 35 5.115 1.490 6.057
273 HG SER 35 HG SER 35 5.447 3.958 7.106
274 H MET 36 H MET 36 2.846 -0.810 7.902
275 HA MET 36 HA MET 36 4.620 -2.013 9.878
276 HB2 MET 36 2HB MET 36 2.043 -2.306 9.704
277 HB3 MET 36 1HB MET 36 2.409 -3.441 8.403
278 HG2 MET 36 2HG MET 36 3.592 -3.625 11.193
279 HG3 MET 36 1HG MET 36 2.176 -4.529 10.657
280 HE1 MET 36 3HE MET 36 3.439 -6.781 11.355
281 HE2 MET 36 1HE MET 36 4.742 -5.716 11.899
282 HE3 MET 36 2HE MET 36 5.106 -7.116 10.894
283 H ASN 37 H ASN 37 6.509 -2.807 9.211
284 HA ASN 37 HA ASN 37 7.154 -3.445 6.543
285 HB2 ASN 37 2HB ASN 37 8.938 -2.917 8.031
286 HB3 ASN 37 1HB ASN 37 8.458 -4.180 9.163
287 HD21 ASN 37 1HD2 ASN 37 8.166 -5.158 5.873
288 HD22 ASN 37 2HD2 ASN 37 9.601 -6.071 5.788
289 H MET 38 H MET 38 5.450 -4.797 5.814
290 HA MET 38 HA MET 38 5.199 -7.454 7.000
291 HB2 MET 38 2HB MET 38 3.150 -6.351 6.305
292 HB3 MET 38 1HB MET 38 3.781 -6.139 4.668
293 HG2 MET 38 2HG MET 38 3.797 -8.505 4.283
294 HG3 MET 38 1HG MET 38 3.496 -8.839 5.980
295 HE1 MET 38 3HE MET 38 1.548 -8.532 7.223
296 HE2 MET 38 1HE MET 38 -0.103 -8.315 6.625
297 HE3 MET 38 2HE MET 38 0.948 -6.920 6.844
298 HA PRO 39 HA PRO 39 8.307 -8.769 3.989
299 HB2 PRO 39 2HB PRO 39 8.337 -11.453 4.527
300 HB3 PRO 39 1HB PRO 39 9.119 -10.250 5.573
301 HG2 PRO 39 2HG PRO 39 6.481 -11.610 5.899
302 HG3 PRO 39 1HG PRO 39 7.713 -11.232 7.118
303 HD2 PRO 39 2HD PRO 39 5.454 -9.723 6.764
304 HD3 PRO 39 1HD PRO 39 6.970 -9.047 7.378
305 H GLU 40 H GLU 40 8.208 -9.416 1.894
306 HA GLU 40 HA GLU 40 5.798 -9.698 0.572
307 HB2 GLU 40 2HB GLU 40 7.792 -9.069 -0.625
308 HB3 GLU 40 1HB GLU 40 8.568 -10.602 -0.224
309 HG2 GLU 40 2HG GLU 40 7.086 -11.834 -1.618
310 HG3 GLU 40 1HG GLU 40 5.988 -10.465 -1.791
311 H GLY 41 H GLY 41 4.368 -11.236 1.256
312 HA2 GLY 41 2HA GLY 41 4.201 -13.715 0.280
313 HA3 GLY 41 1HA GLY 41 5.253 -13.986 1.660
314 H LYS 42 H LYS 42 3.769 -11.770 3.160
315 HA LYS 42 HA LYS 42 1.911 -13.515 4.420
316 HB2 LYS 42 2HB LYS 42 2.973 -10.834 4.913
317 HB3 LYS 42 1HB LYS 42 1.243 -10.884 5.231
318 HG2 LYS 42 2HG LYS 42 1.750 -13.033 6.604
319 HG3 LYS 42 1HG LYS 42 3.438 -12.522 6.520
320 HD2 LYS 42 2HD LYS 42 2.887 -10.412 7.593
321 HD3 LYS 42 1HD LYS 42 1.169 -10.811 7.562
322 HE2 LYS 42 2HE LYS 42 3.177 -12.594 8.939
323 HE3 LYS 42 1HE LYS 42 2.425 -11.233 9.772
324 HZ1 LYS 42 3HZ LYS 42 1.153 -13.212 10.159
325 HZ2 LYS 42 1HZ LYS 42 1.024 -13.520 8.497
326 HZ3 LYS 42 2HZ LYS 42 0.248 -12.167 9.172
327 H VAL 43 H VAL 43 -0.244 -13.728 4.212
328 HA VAL 43 HA VAL 43 -1.410 -12.707 1.761
329 HB VAL 43 HB VAL 43 -2.630 -14.478 3.887
330 HG11 VAL 43 1HG1 VAL 43 -4.323 -13.452 2.474
331 HG12 VAL 43 2HG1 VAL 43 -4.123 -15.130 1.970
332 HG13 VAL 43 3HG1 VAL 43 -3.397 -13.831 1.022
333 HG21 VAL 43 3HG2 VAL 43 -1.081 -15.077 1.352
334 HG22 VAL 43 1HG2 VAL 43 -2.070 -16.276 2.186
335 HG23 VAL 43 2HG2 VAL 43 -0.672 -15.568 2.996
336 H MET 44 H MET 44 -2.613 -10.993 1.568
337 HA MET 44 HA MET 44 -3.748 -9.654 3.943
338 HB2 MET 44 2HB MET 44 -2.872 -8.799 1.191
339 HB3 MET 44 1HB MET 44 -4.139 -7.872 1.982
340 HG2 MET 44 2HG MET 44 -2.578 -6.780 3.229
341 HG3 MET 44 1HG MET 44 -1.966 -8.299 3.865
342 HE1 MET 44 3HE MET 44 -1.661 -7.361 -0.197
343 HE2 MET 44 1HE MET 44 -0.674 -5.950 0.209
344 HE3 MET 44 2HE MET 44 -2.280 -6.132 0.905
345 H GLU 45 H GLU 45 -6.004 -9.240 4.002
346 HA GLU 45 HA GLU 45 -7.625 -10.471 1.843
347 HB2 GLU 45 2HB GLU 45 -7.333 -12.069 3.749
348 HB3 GLU 45 1HB GLU 45 -8.134 -10.892 4.793
349 HG2 GLU 45 2HG GLU 45 -10.152 -10.988 3.463
350 HG3 GLU 45 1HG GLU 45 -9.361 -12.002 2.254
351 H THR 46 H THR 46 -9.075 -9.107 1.104
352 HA THR 46 HA THR 46 -9.750 -6.702 2.589
353 HB THR 46 HB THR 46 -10.664 -5.903 0.590
354 HG1 THR 46 1HG THR 46 -11.930 -7.149 -0.495
355 HG21 THR 46 3HG2 THR 46 -8.168 -6.650 0.530
356 HG22 THR 46 1HG2 THR 46 -8.960 -6.230 -0.990
357 HG23 THR 46 2HG2 THR 46 -8.742 -7.919 -0.542
358 H ARG 47 H ARG 47 -12.051 -6.016 2.734
359 HA ARG 47 HA ARG 47 -13.561 -7.913 4.201
360 HB2 ARG 47 2HB ARG 47 -14.232 -5.204 3.045
361 HB3 ARG 47 1HB ARG 47 -15.405 -6.156 3.960
362 HG2 ARG 47 2HG ARG 47 -13.780 -6.265 5.854
363 HG3 ARG 47 1HG ARG 47 -12.696 -5.211 4.945
364 HD2 ARG 47 2HD ARG 47 -14.223 -3.392 5.025
365 HD3 ARG 47 1HD ARG 47 -15.552 -4.429 5.539
366 HE ARG 47 HE ARG 47 -14.825 -4.130 7.713
367 HH11 ARG 47 1HH2 ARG 47 -12.247 -3.540 5.483
368 HH12 ARG 47 2HH2 ARG 47 -11.121 -3.041 6.702
369 HH21 ARG 47 1HH1 ARG 47 -13.354 -3.481 9.318
370 HH22 ARG 47 2HH1 ARG 47 -11.748 -3.008 8.873
371 H ASP 48 H ASP 48 -13.719 -6.769 0.863
372 HA ASP 48 HA ASP 48 -16.149 -8.039 0.161
373 HB2 ASP 48 2HB ASP 48 -15.135 -6.280 -1.218
374 HB3 ASP 48 1HB ASP 48 -13.769 -7.337 -1.575
375 H GLY 49 H GLY 49 -13.211 -9.334 1.078
376 HA2 GLY 49 2HA GLY 49 -12.630 -11.578 1.285
377 HA3 GLY 49 1HA GLY 49 -14.020 -12.004 0.288
378 H THR 50 H THR 50 -11.256 -9.841 -0.365
379 HA THR 50 HA THR 50 -10.667 -11.447 -2.795
380 HB THR 50 HB THR 50 -10.266 -8.513 -2.186
381 HG1 THR 50 1HG THR 50 -11.827 -8.244 -3.632
382 HG21 THR 50 3HG2 THR 50 -8.318 -9.183 -3.402
383 HG22 THR 50 1HG2 THR 50 -9.406 -8.442 -4.572
384 HG23 THR 50 2HG2 THR 50 -9.266 -10.199 -4.486
385 H LYS 51 H LYS 51 -8.832 -12.560 -2.764
386 HA LYS 51 HA LYS 51 -6.936 -12.229 -0.602
387 HB2 LYS 51 2HB LYS 51 -7.609 -14.458 -1.569
388 HB3 LYS 51 1HB LYS 51 -6.690 -14.034 -3.016
389 HG2 LYS 51 2HG LYS 51 -4.705 -13.613 -1.447
390 HG3 LYS 51 1HG LYS 51 -5.657 -14.416 -0.198
391 HD2 LYS 51 2HD LYS 51 -4.944 -15.632 -2.884
392 HD3 LYS 51 1HD LYS 51 -4.128 -15.994 -1.363
393 HE2 LYS 51 2HE LYS 51 -5.693 -17.734 -1.534
394 HE3 LYS 51 1HE LYS 51 -6.523 -16.578 -0.493
395 HZ1 LYS 51 3HZ LYS 51 -7.094 -15.825 -3.088
396 HZ2 LYS 51 1HZ LYS 51 -8.148 -16.560 -1.979
397 HZ3 LYS 51 2HZ LYS 51 -7.257 -17.517 -3.064
398 H ILE 52 H ILE 52 -5.148 -11.095 -0.620
399 HA ILE 52 HA ILE 52 -3.873 -10.335 -3.172
400 HB ILE 52 HB ILE 52 -3.464 -8.050 -1.817
401 HG12 ILE 52 2HG1 ILE 52 -6.255 -8.795 -0.911
402 HG13 ILE 52 1HG1 ILE 52 -4.855 -9.042 0.116
403 HG21 ILE 52 1HG2 ILE 52 -5.352 -7.066 -3.011
404 HG22 ILE 52 2HG2 ILE 52 -6.076 -8.659 -3.217
405 HG23 ILE 52 3HG2 ILE 52 -4.563 -8.267 -4.036
406 HD11 ILE 52 3HD1 ILE 52 -4.288 -6.621 -0.167
407 HD12 ILE 52 1HD1 ILE 52 -5.836 -6.880 0.629
408 HD13 ILE 52 2HD1 ILE 52 -5.789 -6.421 -1.070
409 H ILE 53 H ILE 53 -1.652 -10.339 -3.082
410 HA ILE 53 HA ILE 53 -0.436 -11.221 -0.521
411 HB ILE 53 HB ILE 53 0.726 -11.452 -3.301
412 HG12 ILE 53 2HG1 ILE 53 -1.341 -12.708 -3.288
413 HG13 ILE 53 1HG1 ILE 53 -0.010 -13.854 -3.138
414 HG21 ILE 53 1HG2 ILE 53 2.099 -13.209 -2.178
415 HG22 ILE 53 2HG2 ILE 53 1.347 -12.772 -0.644
416 HG23 ILE 53 3HG2 ILE 53 2.354 -11.603 -1.495
417 HD11 ILE 53 3HD1 ILE 53 -0.392 -13.608 -0.569
418 HD12 ILE 53 1HD1 ILE 53 -1.536 -14.578 -1.495
419 HD13 ILE 53 2HD1 ILE 53 -1.955 -12.932 -1.026
420 H MET 54 H MET 54 1.273 -10.182 0.335
421 HA MET 54 HA MET 54 1.643 -7.432 -0.219
422 HB2 MET 54 2HB MET 54 2.065 -8.494 1.991
423 HB3 MET 54 1HB MET 54 3.452 -9.338 1.302
424 HG2 MET 54 2HG MET 54 4.445 -7.471 2.306
425 HG3 MET 54 1HG MET 54 4.271 -6.939 0.641
426 HE1 MET 54 3HE MET 54 2.994 -3.593 1.256
427 HE2 MET 54 1HE MET 54 3.515 -4.802 0.079
428 HE3 MET 54 2HE MET 54 4.540 -4.403 1.454
429 H LYS 55 H LYS 55 2.142 -7.236 -2.436
430 HA LYS 55 HA LYS 55 4.439 -8.587 -3.559
431 HB2 LYS 55 2HB LYS 55 2.308 -7.889 -4.801
432 HB3 LYS 55 1HB LYS 55 2.956 -6.251 -4.764
433 HG2 LYS 55 2HG LYS 55 3.815 -6.983 -6.802
434 HG3 LYS 55 1HG LYS 55 5.139 -7.420 -5.727
435 HD2 LYS 55 2HD LYS 55 4.848 -9.416 -6.901
436 HD3 LYS 55 1HD LYS 55 3.817 -9.705 -5.503
437 HE2 LYS 55 2HE LYS 55 2.667 -10.304 -7.610
438 HE3 LYS 55 1HE LYS 55 1.846 -8.977 -6.792
439 HZ1 LYS 55 3HZ LYS 55 2.236 -8.700 -9.249
440 HZ2 LYS 55 1HZ LYS 55 3.886 -8.536 -8.893
441 HZ3 LYS 55 2HZ LYS 55 2.768 -7.420 -8.268
442 H GLY 56 H GLY 56 3.620 -5.152 -3.111
443 HA2 GLY 56 2HA GLY 56 6.349 -4.315 -3.470
444 HA3 GLY 56 1HA GLY 56 4.979 -3.289 -3.066
445 H ASN 57 H ASN 57 7.480 -5.385 -1.750
446 HA ASN 57 HA ASN 57 6.737 -5.022 0.995
447 HB2 ASN 57 2HB ASN 57 8.075 -6.945 0.310
448 HB3 ASN 57 1HB ASN 57 9.369 -5.874 -0.232
449 HD21 ASN 57 1HD2 ASN 57 7.582 -4.998 2.662
450 HD22 ASN 57 2HD2 ASN 57 8.819 -5.380 3.767
451 H GLU 58 H GLU 58 8.226 -3.030 -1.307
452 HA GLU 58 HA GLU 58 9.844 -1.505 0.562
453 HB2 GLU 58 2HB GLU 58 9.136 -1.170 -2.353
454 HB3 GLU 58 1HB GLU 58 10.054 0.044 -1.462
455 HG2 GLU 58 2HG GLU 58 11.725 -1.686 -0.857
456 HG3 GLU 58 1HG GLU 58 10.821 -2.871 -1.798
457 H ILE 59 H ILE 59 7.724 -1.344 1.894
458 HA ILE 59 HA ILE 59 5.759 0.558 1.045
459 HB ILE 59 HB ILE 59 4.809 0.287 3.220
460 HG12 ILE 59 2HG1 ILE 59 7.531 -0.808 4.021
461 HG13 ILE 59 1HG1 ILE 59 6.776 0.672 4.617
462 HG21 ILE 59 1HG2 ILE 59 4.888 -1.719 1.628
463 HG22 ILE 59 2HG2 ILE 59 4.573 -2.086 3.324
464 HG23 ILE 59 3HG2 ILE 59 6.180 -2.350 2.652
465 HD11 ILE 59 3HD1 ILE 59 6.422 -1.000 6.296
466 HD12 ILE 59 1HD1 ILE 59 5.871 -2.173 5.102
467 HD13 ILE 59 2HD1 ILE 59 4.876 -0.769 5.480
468 H PHE 60 H PHE 60 8.917 0.862 2.187
469 HA PHE 60 HA PHE 60 8.947 3.018 3.883
470 HB2 PHE 60 2HB PHE 60 10.834 2.468 1.583
471 HB3 PHE 60 1HB PHE 60 11.161 3.567 2.923
472 HD1 PHE 60 2HD PHE 60 11.325 2.682 5.256
473 HD2 PHE 60 1HD PHE 60 10.997 0.089 1.848
474 HE1 PHE 60 2HE PHE 60 12.105 0.772 6.634
475 HE2 PHE 60 1HE PHE 60 11.776 -1.820 3.224
476 HZ PHE 60 HZ PHE 60 12.330 -1.479 5.618
477 H ARG 61 H ARG 61 8.203 3.019 0.453
478 HA ARG 61 HA ARG 61 8.568 5.781 -0.025
479 HB2 ARG 61 2HB ARG 61 7.070 5.441 -1.966
480 HB3 ARG 61 1HB ARG 61 8.330 4.212 -1.869
481 HG2 ARG 61 2HG ARG 61 6.758 2.639 -0.844
482 HG3 ARG 61 1HG ARG 61 5.494 3.870 -0.846
483 HD2 ARG 61 2HD ARG 61 5.335 3.870 -3.204
484 HD3 ARG 61 1HD ARG 61 6.880 3.051 -3.401
485 HE ARG 61 HE ARG 61 4.319 1.809 -2.754
486 HH11 ARG 61 1HH2 ARG 61 7.769 1.562 -2.925
487 HH12 ARG 61 2HH2 ARG 61 7.778 -0.169 -2.985
488 HH21 ARG 61 1HH1 ARG 61 4.327 -0.456 -2.831
489 HH22 ARG 61 2HH1 ARG 61 5.832 -1.312 -2.929
490 H LEU 62 H LEU 62 5.909 3.956 1.381
491 HA LEU 62 HA LEU 62 3.828 5.767 1.204
492 HB2 LEU 62 2HB LEU 62 4.057 3.389 2.373
493 HB3 LEU 62 1HB LEU 62 4.301 4.360 3.821
494 HG LEU 62 HG LEU 62 1.907 4.432 1.960
495 HD11 LEU 62 1HD1 LEU 62 1.795 2.571 3.476
496 HD12 LEU 62 2HD1 LEU 62 0.741 3.823 4.133
497 HD13 LEU 62 3HD1 LEU 62 2.340 3.563 4.829
498 HD21 LEU 62 3HD2 LEU 62 1.048 6.049 3.787
499 HD22 LEU 62 1HD2 LEU 62 2.204 6.692 2.622
500 HD23 LEU 62 2HD2 LEU 62 2.742 6.234 4.239
501 H ASP 63 H ASP 63 6.334 5.596 3.740
502 HA ASP 63 HA ASP 63 5.472 7.984 5.055
503 HB2 ASP 63 2HB ASP 63 8.153 6.585 5.195
504 HB3 ASP 63 1HB ASP 63 7.536 7.772 6.341
505 H GLU 64 H GLU 64 6.850 9.923 5.287
506 HA GLU 64 HA GLU 64 7.807 11.785 4.337
507 HB2 GLU 64 2HB GLU 64 9.474 9.594 3.084
508 HB3 GLU 64 1HB GLU 64 9.842 11.312 2.918
509 HG2 GLU 64 2HG GLU 64 11.127 10.412 4.778
510 HG3 GLU 64 1HG GLU 64 9.890 11.497 5.409
511 H ALA 65 H ALA 65 8.399 9.767 1.511
512 HA ALA 65 HA ALA 65 7.730 9.980 -0.677
513 HB1 ALA 65 1HB ALA 65 5.572 9.271 0.429
514 HB2 ALA 65 2HB ALA 65 5.373 10.184 -1.067
515 HB3 ALA 65 3HB ALA 65 5.124 10.975 0.489
516 H LEU 66 H LEU 66 8.927 12.283 0.759
517 HA LEU 66 HA LEU 66 9.042 14.620 0.671
518 HB2 LEU 66 2HB LEU 66 9.927 15.264 -1.536
519 HB3 LEU 66 1HB LEU 66 10.638 13.770 -0.949
520 HG LEU 66 HG LEU 66 8.188 13.519 -2.671
521 HD11 LEU 66 1HD1 LEU 66 9.386 15.154 -3.966
522 HD12 LEU 66 2HD1 LEU 66 9.667 13.584 -4.716
523 HD13 LEU 66 3HD1 LEU 66 10.917 14.317 -3.711
524 HD21 LEU 66 3HD2 LEU 66 10.777 11.977 -2.885
525 HD22 LEU 66 1HD2 LEU 66 9.138 11.446 -3.262
526 HD23 LEU 66 2HD2 LEU 66 9.642 11.631 -1.583
527 H ARG 67 H ARG 67 8.429 16.038 -1.927
528 HA ARG 67 HA ARG 67 5.621 15.960 -2.347
529 HB2 ARG 67 2HB ARG 67 5.655 16.900 -0.036
530 HB3 ARG 67 1HB ARG 67 6.605 18.258 -0.640
531 HG2 ARG 67 2HG ARG 67 4.813 18.890 -2.168
532 HG3 ARG 67 1HG ARG 67 3.873 17.474 -1.694
533 HD2 ARG 67 2HD ARG 67 4.704 19.722 0.160
534 HD3 ARG 67 1HD ARG 67 3.095 19.511 -0.523
535 HE ARG 67 HE ARG 67 3.760 17.128 0.785
536 HH11 ARG 67 1HH2 ARG 67 3.248 20.476 1.492
537 HH12 ARG 67 2HH2 ARG 67 2.669 20.190 3.100
538 HH21 ARG 67 1HH1 ARG 67 3.003 16.744 2.891
539 HH22 ARG 67 2HH1 ARG 67 2.531 18.078 3.892
540 H LYS 68 H LYS 68 6.631 15.961 -4.465
541 HA LYS 68 HA LYS 68 7.236 18.704 -5.419
542 HB2 LYS 68 2HB LYS 68 8.623 16.130 -6.211
543 HB3 LYS 68 1HB LYS 68 8.838 17.671 -7.035
544 HG2 LYS 68 2HG LYS 68 9.272 17.498 -4.052
545 HG3 LYS 68 1HG LYS 68 10.538 16.962 -5.152
546 HD2 LYS 68 2HD LYS 68 10.429 19.197 -6.290
547 HD3 LYS 68 1HD LYS 68 9.288 19.724 -5.051
548 HE2 LYS 68 2HE LYS 68 10.943 19.323 -3.302
549 HE3 LYS 68 1HE LYS 68 12.079 18.684 -4.491
550 HZ1 LYS 68 3HZ LYS 68 12.077 21.211 -3.715
551 HZ2 LYS 68 1HZ LYS 68 10.995 21.334 -5.016
552 HZ3 LYS 68 2HZ LYS 68 12.562 20.729 -5.270
553 H GLY 69 H GLY 69 5.366 15.910 -5.648
554 HA2 GLY 69 2HA GLY 69 3.712 15.240 -7.099
555 HA3 GLY 69 1HA GLY 69 3.686 16.908 -7.665
556 H HIS 70 H HIS 70 3.216 14.874 -9.443
557 HA HIS 70 HA HIS 70 5.545 13.956 -10.800
558 HB2 HIS 70 2HB HIS 70 3.969 13.392 -12.626
559 HB3 HIS 70 1HB HIS 70 3.399 12.820 -11.059
560 HD2 HIS 70 2HD HIS 70 2.244 15.184 -13.892
561 HE1 HIS 70 1HE HIS 70 -0.410 15.762 -10.660
562 HE2 HIS 70 2HE HIS 70 0.001 16.270 -13.114
563 H SER 71 H SER 71 6.747 15.993 -10.868
564 HA SER 71 HA SER 71 5.933 18.288 -12.247
565 HB2 SER 71 2HB SER 71 7.963 18.172 -10.843
566 HB3 SER 71 1HB SER 71 8.726 17.136 -12.046
567 HG SER 71 HG SER 71 7.688 19.724 -12.579
568 H GLU 72 H GLU 72 5.965 18.908 -14.363
569 HA GLU 72 HA GLU 72 5.847 18.660 -16.645
570 HB2 GLU 72 2HB GLU 72 8.325 18.563 -16.296
571 HB3 GLU 72 1HB GLU 72 8.203 16.803 -16.239
572 HG2 GLU 72 2HG GLU 72 7.295 16.747 -18.498
573 HG3 GLU 72 1HG GLU 72 7.259 18.507 -18.561
574 H GLY 73 H GLY 73 3.812 17.534 -16.441
575 HA2 GLY 73 2HA GLY 73 3.702 15.121 -17.888
576 HA3 GLY 73 1HA GLY 73 3.530 14.752 -16.175
577 H GLY 74 H GLY 74 2.006 16.030 -18.984
578 HA2 GLY 74 2HA GLY 74 -0.172 17.394 -17.794
579 HA3 GLY 74 1HA GLY 74 -0.144 16.727 -19.424
580 H1 HOH 201 H2 HOH 77 2.237 16.208 -8.736
581 H2 HOH 201 H1 HOH 77 1.404 16.174 -7.471
Start of MODEL 18
1 H1 VAL 1 1H VAL 1 -2.059 16.059 -14.481
2 H2 VAL 1 2H VAL 1 -3.626 16.488 -13.989
3 HA VAL 1 HA VAL 1 -1.114 17.106 -12.533
4 HB VAL 1 HB VAL 1 -1.948 19.492 -13.089
5 HG11 VAL 1 2HG1 VAL 1 0.039 18.440 -14.125
6 HG12 VAL 1 3HG1 VAL 1 -0.835 19.442 -15.284
7 HG13 VAL 1 1HG1 VAL 1 -0.998 17.686 -15.334
8 HG21 VAL 1 1HG2 VAL 1 -4.204 18.553 -13.877
9 HG22 VAL 1 2HG2 VAL 1 -3.355 18.023 -15.329
10 HG23 VAL 1 3HG2 VAL 1 -3.441 19.741 -14.935
11 H ASP 2 H ASP 2 -2.305 15.926 -10.777
12 HA ASP 2 HA ASP 2 -3.714 17.839 -9.136
13 HB2 ASP 2 2HB ASP 2 -5.656 16.179 -8.797
14 HB3 ASP 2 1HB ASP 2 -5.663 17.151 -10.268
15 H MET 3 H MET 3 -3.499 17.374 -6.990
16 HA MET 3 HA MET 3 -1.538 15.538 -6.164
17 HB2 MET 3 2HB MET 3 -2.358 16.040 -3.862
18 HB3 MET 3 1HB MET 3 -2.068 17.490 -4.823
19 HG2 MET 3 2HG MET 3 -4.519 17.479 -5.427
20 HG3 MET 3 1HG MET 3 -4.738 16.181 -4.254
21 HE1 MET 3 3HE MET 3 -2.938 19.663 -4.632
22 HE2 MET 3 1HE MET 3 -3.991 20.613 -3.577
23 HE3 MET 3 2HE MET 3 -4.661 19.787 -4.979
24 H SER 4 H SER 4 -5.009 15.245 -6.506
25 HA SER 4 HA SER 4 -5.613 13.071 -4.927
26 HB2 SER 4 2HB SER 4 -7.260 14.296 -6.313
27 HB3 SER 4 1HB SER 4 -6.586 13.541 -7.756
28 HG SER 4 HG SER 4 -7.534 12.068 -5.529
29 H ASN 5 H ASN 5 -4.413 12.965 -8.288
30 HA ASN 5 HA ASN 5 -3.536 11.213 -9.515
31 HB2 ASN 5 2HB ASN 5 -2.124 10.715 -6.884
32 HB3 ASN 5 1HB ASN 5 -1.582 10.195 -8.479
33 HD21 ASN 5 1HD2 ASN 5 -1.427 12.765 -6.210
34 HD22 ASN 5 2HD2 ASN 5 -0.724 13.923 -7.233
35 H VAL 6 H VAL 6 -2.590 8.693 -8.632
36 HA VAL 6 HA VAL 6 -4.931 7.143 -8.793
37 HB VAL 6 HB VAL 6 -2.666 6.350 -9.438
38 HG11 VAL 6 1HG1 VAL 6 -1.560 7.360 -7.387
39 HG12 VAL 6 2HG1 VAL 6 -1.065 5.709 -7.762
40 HG13 VAL 6 3HG1 VAL 6 -2.218 6.009 -6.461
41 HG21 VAL 6 3HG2 VAL 6 -4.619 4.815 -8.839
42 HG22 VAL 6 1HG2 VAL 6 -3.846 4.599 -7.268
43 HG23 VAL 6 2HG2 VAL 6 -3.016 4.086 -8.736
44 H VAL 7 H VAL 7 -5.825 5.674 -7.216
45 HA VAL 7 HA VAL 7 -5.278 6.222 -4.390
46 HB VAL 7 HB VAL 7 -8.030 6.597 -5.600
47 HG11 VAL 7 1HG1 VAL 7 -8.510 7.406 -3.238
48 HG12 VAL 7 2HG1 VAL 7 -6.954 6.719 -2.772
49 HG13 VAL 7 3HG1 VAL 7 -8.231 5.671 -3.392
50 HG21 VAL 7 3HG2 VAL 7 -7.666 8.961 -4.714
51 HG22 VAL 7 1HG2 VAL 7 -6.705 8.528 -6.128
52 HG23 VAL 7 2HG2 VAL 7 -5.965 8.536 -4.527
53 H LYS 8 H LYS 8 -4.516 4.014 -4.591
54 HA LYS 8 HA LYS 8 -6.606 1.964 -4.953
55 HB2 LYS 8 2HB LYS 8 -4.148 1.985 -5.991
56 HB3 LYS 8 1HB LYS 8 -3.725 1.287 -4.436
57 HG2 LYS 8 2HG LYS 8 -4.192 -0.618 -5.682
58 HG3 LYS 8 1HG LYS 8 -5.764 -0.322 -4.935
59 HD2 LYS 8 2HD LYS 8 -6.513 0.852 -6.979
60 HD3 LYS 8 1HD LYS 8 -4.933 0.587 -7.714
61 HE2 LYS 8 2HE LYS 8 -5.255 -1.818 -7.671
62 HE3 LYS 8 1HE LYS 8 -6.762 -1.637 -6.766
63 HZ1 LYS 8 3HZ LYS 8 -6.231 -0.672 -9.524
64 HZ2 LYS 8 1HZ LYS 8 -7.657 -0.376 -8.654
65 HZ3 LYS 8 2HZ LYS 8 -7.241 -1.966 -9.082
66 H THR 9 H THR 9 -7.375 0.777 -3.286
67 HA THR 9 HA THR 9 -5.931 0.620 -0.769
68 HB THR 9 HB THR 9 -7.290 2.807 -0.781
69 HG1 THR 9 1HG THR 9 -6.485 1.689 1.083
70 HG21 THR 9 3HG2 THR 9 -9.638 2.676 -0.434
71 HG22 THR 9 1HG2 THR 9 -9.580 0.928 -0.198
72 HG23 THR 9 2HG2 THR 9 -9.318 1.612 -1.803
73 H TYR 10 H TYR 10 -6.638 -1.015 0.577
74 HA TYR 10 HA TYR 10 -8.933 -2.655 -0.258
75 HB2 TYR 10 2HB TYR 10 -6.306 -3.968 0.379
76 HB3 TYR 10 1HB TYR 10 -7.736 -4.673 -0.346
77 HD1 TYR 10 1HD TYR 10 -8.529 -3.187 -2.539
78 HD2 TYR 10 2HD TYR 10 -4.506 -3.718 -1.105
79 HE1 TYR 10 1HE TYR 10 -7.652 -2.739 -4.815
80 HE2 TYR 10 2HE TYR 10 -3.645 -3.275 -3.382
81 HH TYR 10 HH TYR 10 -5.744 -3.088 -6.142
82 H ASP 11 H ASP 11 -10.146 -2.544 1.545
83 HA ASP 11 HA ASP 11 -9.156 -2.111 4.147
84 HB2 ASP 11 2HB ASP 11 -11.780 -3.176 3.111
85 HB3 ASP 11 1HB ASP 11 -11.468 -2.936 4.830
86 H LEU 12 H LEU 12 -7.599 -3.538 4.813
87 HA LEU 12 HA LEU 12 -7.805 -6.372 4.496
88 HB2 LEU 12 2HB LEU 12 -5.891 -4.439 5.522
89 HB3 LEU 12 1HB LEU 12 -6.029 -5.782 6.650
90 HG LEU 12 HG LEU 12 -5.597 -7.364 4.778
91 HD11 LEU 12 1HD1 LEU 12 -4.549 -6.206 2.691
92 HD12 LEU 12 2HD1 LEU 12 -5.439 -4.779 3.225
93 HD13 LEU 12 3HD1 LEU 12 -6.304 -6.257 2.806
94 HD21 LEU 12 3HD2 LEU 12 -3.672 -6.820 6.042
95 HD22 LEU 12 1HD2 LEU 12 -3.633 -5.166 5.436
96 HD23 LEU 12 2HD2 LEU 12 -3.163 -6.499 4.384
97 H GLN 13 H GLN 13 -8.098 -7.938 6.155
98 HA GLN 13 HA GLN 13 -10.308 -7.361 7.869
99 HB2 GLN 13 2HB GLN 13 -10.002 -9.687 8.659
100 HB3 GLN 13 1HB GLN 13 -10.047 -9.573 6.899
101 HG2 GLN 13 2HG GLN 13 -8.210 -10.979 7.307
102 HG3 GLN 13 1HG GLN 13 -7.460 -9.408 7.047
103 HE21 GLN 13 1HE2 GLN 13 -9.150 -10.596 9.990
104 HE22 GLN 13 2HE2 GLN 13 -7.794 -10.443 11.009
105 H ASP 14 H ASP 14 -6.942 -7.008 8.196
106 HA ASP 14 HA ASP 14 -6.879 -7.286 11.091
107 HB2 ASP 14 2HB ASP 14 -4.918 -7.909 9.744
108 HB3 ASP 14 1HB ASP 14 -4.792 -6.249 9.159
109 H GLY 15 H GLY 15 -8.414 -5.136 9.384
110 HA2 GLY 15 2HA GLY 15 -9.258 -3.066 10.049
111 HA3 GLY 15 1HA GLY 15 -8.042 -3.007 11.324
112 H SER 16 H SER 16 -5.944 -3.687 9.242
113 HA SER 16 HA SER 16 -5.324 -0.946 8.525
114 HB2 SER 16 2HB SER 16 -3.833 -3.515 7.935
115 HB3 SER 16 1HB SER 16 -3.211 -1.881 7.707
116 HG SER 16 HG SER 16 -4.269 -2.427 10.201
117 H LYS 17 H LYS 17 -4.024 -1.165 6.137
118 HA LYS 17 HA LYS 17 -5.635 -2.467 4.143
119 HB2 LYS 17 2HB LYS 17 -6.376 -0.362 3.030
120 HB3 LYS 17 1HB LYS 17 -7.134 -0.619 4.602
121 HG2 LYS 17 2HG LYS 17 -5.524 0.904 5.653
122 HG3 LYS 17 1HG LYS 17 -4.699 1.119 4.115
123 HD2 LYS 17 2HD LYS 17 -6.225 3.007 4.573
124 HD3 LYS 17 1HD LYS 17 -6.719 2.115 3.137
125 HE2 LYS 17 2HE LYS 17 -8.519 2.763 4.944
126 HE3 LYS 17 1HE LYS 17 -8.574 1.167 4.200
127 HZ1 LYS 17 3HZ LYS 17 -6.944 1.508 6.606
128 HZ2 LYS 17 1HZ LYS 17 -7.829 0.160 6.081
129 HZ3 LYS 17 2HZ LYS 17 -8.632 1.477 6.792
130 H VAL 18 H VAL 18 -4.663 -2.471 2.126
131 HA VAL 18 HA VAL 18 -1.901 -1.420 2.061
132 HB VAL 18 HB VAL 18 -2.437 -3.212 -0.159
133 HG11 VAL 18 1HG1 VAL 18 -0.831 -3.715 2.351
134 HG12 VAL 18 2HG1 VAL 18 -0.254 -2.769 0.989
135 HG13 VAL 18 3HG1 VAL 18 -0.613 -4.478 0.779
136 HG21 VAL 18 3HG2 VAL 18 -3.060 -5.246 0.986
137 HG22 VAL 18 1HG2 VAL 18 -4.287 -4.034 1.332
138 HG23 VAL 18 2HG2 VAL 18 -3.072 -4.419 2.545
139 H HIS 19 H HIS 19 -1.383 0.194 0.734
140 HA HIS 19 HA HIS 19 -3.245 0.893 -1.478
141 HB2 HIS 19 2HB HIS 19 -3.006 3.163 -1.019
142 HB3 HIS 19 1HB HIS 19 -2.947 2.499 0.608
143 HD1 HIS 19 1HD HIS 19 -1.251 4.865 -1.378
144 HD2 HIS 19 2HD HIS 19 0.069 1.873 1.209
145 HE1 HIS 19 1HE HIS 19 1.127 5.461 -0.746
146 HE2 HIS 19 2HE HIS 19 1.945 3.644 0.824
147 H VAL 20 H VAL 20 -2.385 0.457 -3.372
148 HA VAL 20 HA VAL 20 0.504 0.149 -3.618
149 HB VAL 20 HB VAL 20 0.074 -1.316 -5.334
150 HG11 VAL 20 1HG1 VAL 20 -2.729 -1.356 -4.260
151 HG12 VAL 20 2HG1 VAL 20 -1.399 -1.762 -3.213
152 HG13 VAL 20 3HG1 VAL 20 -1.687 -2.712 -4.670
153 HG21 VAL 20 3HG2 VAL 20 -2.201 0.537 -6.037
154 HG22 VAL 20 1HG2 VAL 20 -2.139 -1.095 -6.708
155 HG23 VAL 20 2HG2 VAL 20 -0.831 0.041 -7.029
156 H PHE 21 H PHE 21 1.756 1.082 -5.228
157 HA PHE 21 HA PHE 21 0.936 3.802 -5.954
158 HB2 PHE 21 2HB PHE 21 3.580 2.335 -6.040
159 HB3 PHE 21 1HB PHE 21 3.360 3.981 -6.632
160 HD1 PHE 21 2HD PHE 21 2.870 1.832 -3.608
161 HD2 PHE 21 1HD PHE 21 3.443 5.810 -5.136
162 HE1 PHE 21 2HE PHE 21 3.101 2.691 -1.294
163 HE2 PHE 21 1HE PHE 21 3.673 6.665 -2.820
164 HZ PHE 21 HZ PHE 21 3.502 5.106 -0.899
165 H LYS 22 H LYS 22 2.483 4.224 -8.189
166 HA LYS 22 HA LYS 22 0.847 3.037 -10.243
167 HB2 LYS 22 2HB LYS 22 1.700 5.415 -10.270
168 HB3 LYS 22 1HB LYS 22 3.305 4.760 -10.605
169 HG2 LYS 22 2HG LYS 22 2.516 3.726 -12.654
170 HG3 LYS 22 1HG LYS 22 0.853 4.185 -12.291
171 HD2 LYS 22 2HD LYS 22 1.447 6.558 -12.443
172 HD3 LYS 22 1HD LYS 22 3.133 6.134 -12.739
173 HE2 LYS 22 2HE LYS 22 2.029 6.627 -14.865
174 HE3 LYS 22 1HE LYS 22 2.435 4.912 -14.794
175 HZ1 LYS 22 3HZ LYS 22 0.248 4.319 -14.431
176 HZ2 LYS 22 1HZ LYS 22 0.087 5.600 -15.530
177 HZ3 LYS 22 2HZ LYS 22 -0.200 5.861 -13.877
178 H ASP 23 H ASP 23 3.791 2.250 -8.710
179 HA ASP 23 HA ASP 23 4.987 0.839 -10.925
180 HB2 ASP 23 2HB ASP 23 5.592 0.770 -7.958
181 HB3 ASP 23 1HB ASP 23 6.581 0.023 -9.217
182 H GLY 24 H GLY 24 2.353 0.224 -9.012
183 HA2 GLY 24 2HA GLY 24 0.987 -1.666 -9.042
184 HA3 GLY 24 1HA GLY 24 2.292 -2.574 -9.799
185 H LYS 25 H LYS 25 3.882 -1.174 -7.395
186 HA LYS 25 HA LYS 25 3.849 -3.538 -5.730
187 HB2 LYS 25 2HB LYS 25 5.280 -0.876 -5.622
188 HB3 LYS 25 1HB LYS 25 5.421 -2.051 -4.321
189 HG2 LYS 25 2HG LYS 25 6.167 -3.755 -5.986
190 HG3 LYS 25 1HG LYS 25 6.127 -2.507 -7.230
191 HD2 LYS 25 2HD LYS 25 7.715 -1.159 -5.779
192 HD3 LYS 25 1HD LYS 25 7.891 -2.599 -4.773
193 HE2 LYS 25 2HE LYS 25 8.738 -3.877 -6.654
194 HE3 LYS 25 1HE LYS 25 8.419 -2.539 -7.757
195 HZ1 LYS 25 3HZ LYS 25 10.655 -2.973 -6.050
196 HZ2 LYS 25 1HZ LYS 25 9.944 -1.462 -5.750
197 HZ3 LYS 25 2HZ LYS 25 10.467 -1.857 -7.318
198 H MET 26 H MET 26 3.080 -3.714 -3.633
199 HA MET 26 HA MET 26 0.848 -1.974 -2.959
200 HB2 MET 26 2HB MET 26 1.913 -4.573 -1.863
201 HB3 MET 26 1HB MET 26 0.656 -3.672 -1.019
202 HG2 MET 26 2HG MET 26 -0.857 -3.877 -2.814
203 HG3 MET 26 1HG MET 26 0.403 -4.349 -3.949
204 HE1 MET 26 3HE MET 26 -1.543 -5.767 -4.495
205 HE2 MET 26 1HE MET 26 -1.732 -7.426 -3.909
206 HE3 MET 26 2HE MET 26 -0.277 -6.958 -4.783
207 H GLY 27 H GLY 27 0.779 -2.052 -0.239
208 HA2 GLY 27 2HA GLY 27 3.160 -1.350 1.114
209 HA3 GLY 27 1HA GLY 27 2.382 0.122 0.545
210 H MET 28 H MET 28 2.547 -2.089 3.065
211 HA MET 28 HA MET 28 -0.085 -2.213 4.045
212 HB2 MET 28 2HB MET 28 2.518 -2.101 5.586
213 HB3 MET 28 1HB MET 28 0.964 -2.536 6.278
214 HG2 MET 28 2HG MET 28 2.420 -4.018 4.075
215 HG3 MET 28 1HG MET 28 2.258 -4.551 5.742
216 HE1 MET 28 3HE MET 28 -0.001 -4.542 6.906
217 HE2 MET 28 1HE MET 28 -1.449 -5.270 6.203
218 HE3 MET 28 2HE MET 28 -1.163 -3.541 6.030
219 H GLU 29 H GLU 29 -1.087 -1.046 5.755
220 HA GLU 29 HA GLU 29 -0.009 1.495 6.611
221 HB2 GLU 29 2HB GLU 29 -1.000 2.049 4.388
222 HB3 GLU 29 1HB GLU 29 -2.557 1.470 4.978
223 HG2 GLU 29 2HG GLU 29 -2.659 3.170 6.659
224 HG3 GLU 29 1HG GLU 29 -0.977 3.623 6.393
225 H ASN 30 H ASN 30 -0.306 1.035 8.730
226 HA ASN 30 HA ASN 30 -2.748 -0.233 9.667
227 HB2 ASN 30 2HB ASN 30 -1.696 -0.170 11.860
228 HB3 ASN 30 1HB ASN 30 -0.551 -0.778 10.666
229 HD21 ASN 30 1HD2 ASN 30 1.303 -0.066 11.935
230 HD22 ASN 30 2HD2 ASN 30 1.695 1.584 12.076
231 H LYS 31 H LYS 31 -4.191 0.688 11.187
232 HA LYS 31 HA LYS 31 -4.987 3.328 10.603
233 HB2 LYS 31 2HB LYS 31 -6.716 3.019 12.194
234 HB3 LYS 31 1HB LYS 31 -6.435 1.426 11.494
235 HG2 LYS 31 2HG LYS 31 -5.406 2.429 14.176
236 HG3 LYS 31 1HG LYS 31 -6.641 1.205 13.909
237 HD2 LYS 31 2HD LYS 31 -4.866 -0.113 12.622
238 HD3 LYS 31 1HD LYS 31 -3.687 1.013 13.297
239 HE2 LYS 31 2HE LYS 31 -5.601 -0.710 14.899
240 HE3 LYS 31 1HE LYS 31 -3.873 -1.001 14.704
241 HZ1 LYS 31 3HZ LYS 31 -3.785 0.184 16.602
242 HZ2 LYS 31 1HZ LYS 31 -5.251 0.986 16.318
243 HZ3 LYS 31 2HZ LYS 31 -3.835 1.509 15.542
244 H PHE 32 H PHE 32 -2.392 2.312 12.385
245 HA PHE 32 HA PHE 32 -2.510 4.283 14.497
246 HB2 PHE 32 2HB PHE 32 -1.293 1.984 14.508
247 HB3 PHE 32 1HB PHE 32 -0.012 2.828 13.635
248 HD1 PHE 32 1HD PHE 32 -2.186 3.180 16.671
249 HD2 PHE 32 2HD PHE 32 1.626 3.986 14.861
250 HE1 PHE 32 1HE PHE 32 -1.365 4.121 18.814
251 HE2 PHE 32 2HE PHE 32 2.447 4.925 17.005
252 HZ PHE 32 HZ PHE 32 0.950 4.992 18.981
253 H GLY 33 H GLY 33 -2.397 4.862 11.420
254 HA2 GLY 33 2HA GLY 33 -1.682 6.661 10.167
255 HA3 GLY 33 1HA GLY 33 -1.025 7.349 11.651
256 H LYS 34 H LYS 34 0.070 4.197 11.073
257 HA LYS 34 HA LYS 34 2.533 5.136 9.716
258 HB2 LYS 34 2HB LYS 34 2.455 3.221 12.060
259 HB3 LYS 34 1HB LYS 34 3.890 3.813 11.231
260 HG2 LYS 34 2HG LYS 34 1.914 5.647 12.615
261 HG3 LYS 34 1HG LYS 34 3.330 4.984 13.424
262 HD2 LYS 34 2HD LYS 34 4.696 5.969 11.466
263 HD3 LYS 34 1HD LYS 34 3.241 6.884 11.075
264 HE2 LYS 34 2HE LYS 34 3.225 7.825 13.360
265 HE3 LYS 34 1HE LYS 34 4.696 6.929 13.733
266 HZ1 LYS 34 3HZ LYS 34 4.378 9.033 11.662
267 HZ2 LYS 34 1HZ LYS 34 5.780 8.104 11.877
268 HZ3 LYS 34 2HZ LYS 34 5.263 9.156 13.106
269 H SER 35 H SER 35 3.892 3.113 9.106
270 HA SER 35 HA SER 35 2.124 1.360 7.562
271 HB2 SER 35 2HB SER 35 3.897 2.253 6.271
272 HB3 SER 35 1HB SER 35 5.086 1.920 7.526
273 HG SER 35 HG SER 35 3.684 0.086 5.882
274 H MET 36 H MET 36 3.121 -0.961 7.289
275 HA MET 36 HA MET 36 4.045 -2.066 9.857
276 HB2 MET 36 2HB MET 36 1.389 -2.550 8.565
277 HB3 MET 36 1HB MET 36 2.207 -3.953 9.250
278 HG2 MET 36 2HG MET 36 1.732 -1.376 10.770
279 HG3 MET 36 1HG MET 36 0.658 -2.775 10.850
280 HE1 MET 36 3HE MET 36 2.291 -3.049 14.269
281 HE2 MET 36 1HE MET 36 0.870 -2.654 13.293
282 HE3 MET 36 2HE MET 36 2.171 -1.480 13.476
283 H ASN 37 H ASN 37 5.713 -3.343 9.459
284 HA ASN 37 HA ASN 37 6.573 -3.984 6.848
285 HB2 ASN 37 2HB ASN 37 8.145 -3.773 8.689
286 HB3 ASN 37 1HB ASN 37 7.405 -5.144 9.513
287 HD21 ASN 37 1HD2 ASN 37 7.502 -5.495 6.083
288 HD22 ASN 37 2HD2 ASN 37 8.849 -6.533 6.011
289 H MET 38 H MET 38 5.962 -5.523 5.507
290 HA MET 38 HA MET 38 4.955 -8.084 6.570
291 HB2 MET 38 2HB MET 38 2.973 -6.765 5.947
292 HB3 MET 38 1HB MET 38 3.643 -6.521 4.328
293 HG2 MET 38 2HG MET 38 3.522 -8.863 3.833
294 HG3 MET 38 1HG MET 38 3.229 -9.270 5.510
295 HE1 MET 38 3HE MET 38 1.299 -8.146 6.834
296 HE2 MET 38 1HE MET 38 0.874 -9.807 6.393
297 HE3 MET 38 2HE MET 38 -0.326 -8.520 6.260
298 HA PRO 39 HA PRO 39 8.004 -9.143 3.391
299 HB2 PRO 39 2HB PRO 39 8.205 -11.808 3.853
300 HB3 PRO 39 1HB PRO 39 8.898 -10.607 4.965
301 HG2 PRO 39 2HG PRO 39 6.340 -12.138 5.191
302 HG3 PRO 39 1HG PRO 39 7.544 -11.764 6.441
303 HD2 PRO 39 2HD PRO 39 5.199 -10.343 6.112
304 HD3 PRO 39 1HD PRO 39 6.662 -9.658 6.837
305 H GLU 40 H GLU 40 7.769 -9.663 1.272
306 HA GLU 40 HA GLU 40 5.347 -10.031 0.044
307 HB2 GLU 40 2HB GLU 40 6.593 -10.801 -1.928
308 HB3 GLU 40 1HB GLU 40 7.406 -9.435 -1.162
309 HG2 GLU 40 2HG GLU 40 8.773 -11.202 0.127
310 HG3 GLU 40 1HG GLU 40 8.156 -12.359 -1.055
311 H GLY 41 H GLY 41 3.927 -11.639 -0.140
312 HA2 GLY 41 2HA GLY 41 3.635 -14.039 -0.750
313 HA3 GLY 41 1HA GLY 41 4.797 -14.405 0.521
314 H LYS 42 H LYS 42 3.563 -12.190 2.197
315 HA LYS 42 HA LYS 42 1.722 -13.859 3.608
316 HB2 LYS 42 2HB LYS 42 2.861 -11.130 3.941
317 HB3 LYS 42 1HB LYS 42 1.315 -11.408 4.732
318 HG2 LYS 42 2HG LYS 42 3.520 -13.440 5.060
319 HG3 LYS 42 1HG LYS 42 3.568 -11.956 6.005
320 HD2 LYS 42 2HD LYS 42 1.534 -12.427 7.096
321 HD3 LYS 42 1HD LYS 42 1.073 -13.643 5.903
322 HE2 LYS 42 2HE LYS 42 1.818 -14.734 7.973
323 HE3 LYS 42 1HE LYS 42 2.951 -15.076 6.667
324 HZ1 LYS 42 3HZ LYS 42 3.299 -12.886 8.639
325 HZ2 LYS 42 1HZ LYS 42 4.423 -13.403 7.477
326 HZ3 LYS 42 2HZ LYS 42 4.023 -14.417 8.780
327 H VAL 43 H VAL 43 -0.039 -14.384 2.509
328 HA VAL 43 HA VAL 43 -1.510 -12.746 0.754
329 HB VAL 43 HB VAL 43 -2.660 -15.019 2.374
330 HG11 VAL 43 1HG1 VAL 43 -3.977 -15.363 0.306
331 HG12 VAL 43 2HG1 VAL 43 -3.174 -13.976 -0.428
332 HG13 VAL 43 3HG1 VAL 43 -4.227 -13.747 0.967
333 HG21 VAL 43 3HG2 VAL 43 -0.774 -15.053 0.011
334 HG22 VAL 43 1HG2 VAL 43 -1.841 -16.409 0.371
335 HG23 VAL 43 2HG2 VAL 43 -0.618 -15.915 1.540
336 H MET 44 H MET 44 -2.836 -11.089 1.136
337 HA MET 44 HA MET 44 -3.879 -10.694 3.887
338 HB2 MET 44 2HB MET 44 -3.707 -8.639 1.683
339 HB3 MET 44 1HB MET 44 -4.043 -8.364 3.368
340 HG2 MET 44 2HG MET 44 -1.817 -8.781 4.008
341 HG3 MET 44 1HG MET 44 -1.445 -9.619 2.505
342 HE1 MET 44 3HE MET 44 -1.516 -8.743 0.355
343 HE2 MET 44 1HE MET 44 -0.855 -7.174 -0.111
344 HE3 MET 44 2HE MET 44 -2.584 -7.366 0.127
345 H GLU 45 H GLU 45 -6.064 -10.603 4.211
346 HA GLU 45 HA GLU 45 -7.788 -11.105 1.846
347 HB2 GLU 45 2HB GLU 45 -7.752 -12.849 3.623
348 HB3 GLU 45 1HB GLU 45 -8.357 -11.649 4.769
349 HG2 GLU 45 2HG GLU 45 -10.373 -11.330 3.436
350 HG3 GLU 45 1HG GLU 45 -9.759 -12.426 2.195
351 H THR 46 H THR 46 -9.046 -9.497 1.184
352 HA THR 46 HA THR 46 -9.375 -7.108 2.775
353 HB THR 46 HB THR 46 -10.402 -6.167 0.857
354 HG1 THR 46 1HG THR 46 -11.888 -7.531 0.166
355 HG21 THR 46 3HG2 THR 46 -8.448 -8.233 -0.182
356 HG22 THR 46 1HG2 THR 46 -7.973 -6.757 0.651
357 HG23 THR 46 2HG2 THR 46 -8.809 -6.665 -0.900
358 H ARG 47 H ARG 47 -11.571 -6.143 3.079
359 HA ARG 47 HA ARG 47 -13.183 -7.736 4.694
360 HB2 ARG 47 2HB ARG 47 -14.867 -5.948 4.501
361 HB3 ARG 47 1HB ARG 47 -13.249 -5.282 4.744
362 HG2 ARG 47 2HG ARG 47 -13.052 -4.961 2.277
363 HG3 ARG 47 1HG ARG 47 -14.715 -5.523 2.100
364 HD2 ARG 47 2HD ARG 47 -15.580 -3.667 3.314
365 HD3 ARG 47 1HD ARG 47 -13.985 -3.216 3.909
366 HE ARG 47 HE ARG 47 -13.970 -3.118 1.086
367 HH11 ARG 47 1HH2 ARG 47 -15.332 -1.544 3.851
368 HH12 ARG 47 2HH2 ARG 47 -15.459 0.003 3.080
369 HH21 ARG 47 1HH1 ARG 47 -14.133 -1.094 0.068
370 HH22 ARG 47 2HH1 ARG 47 -14.780 0.257 0.938
371 H ASP 48 H ASP 48 -13.339 -7.131 1.230
372 HA ASP 48 HA ASP 48 -15.866 -8.495 0.892
373 HB2 ASP 48 2HB ASP 48 -15.133 -6.668 -0.621
374 HB3 ASP 48 1HB ASP 48 -13.807 -7.692 -1.179
375 H GLY 49 H GLY 49 -12.796 -9.541 1.557
376 HA2 GLY 49 2HA GLY 49 -12.000 -11.721 1.700
377 HA3 GLY 49 1HA GLY 49 -13.435 -12.269 0.836
378 H THR 50 H THR 50 -11.327 -9.715 -0.333
379 HA THR 50 HA THR 50 -10.848 -11.213 -2.788
380 HB THR 50 HB THR 50 -9.922 -8.444 -1.985
381 HG1 THR 50 1HG THR 50 -11.983 -8.984 -3.792
382 HG21 THR 50 3HG2 THR 50 -8.594 -9.401 -3.797
383 HG22 THR 50 1HG2 THR 50 -9.663 -8.155 -4.439
384 HG23 THR 50 2HG2 THR 50 -10.062 -9.859 -4.658
385 H LYS 51 H LYS 51 -9.007 -12.243 -3.310
386 HA LYS 51 HA LYS 51 -6.911 -12.456 -1.307
387 HB2 LYS 51 2HB LYS 51 -7.769 -14.423 -2.604
388 HB3 LYS 51 1HB LYS 51 -7.034 -13.726 -4.052
389 HG2 LYS 51 2HG LYS 51 -4.828 -13.717 -2.865
390 HG3 LYS 51 1HG LYS 51 -5.592 -14.547 -1.511
391 HD2 LYS 51 2HD LYS 51 -5.518 -15.593 -4.358
392 HD3 LYS 51 1HD LYS 51 -4.436 -16.116 -3.070
393 HE2 LYS 51 2HE LYS 51 -6.657 -16.617 -1.760
394 HE3 LYS 51 1HE LYS 51 -7.392 -16.597 -3.365
395 HZ1 LYS 51 3HZ LYS 51 -6.369 -18.488 -3.958
396 HZ2 LYS 51 1HZ LYS 51 -6.270 -18.750 -2.284
397 HZ3 LYS 51 2HZ LYS 51 -4.935 -18.117 -3.124
398 H ILE 52 H ILE 52 -5.294 -11.078 -1.214
399 HA ILE 52 HA ILE 52 -4.092 -10.044 -3.714
400 HB ILE 52 HB ILE 52 -3.710 -7.886 -2.266
401 HG12 ILE 52 2HG1 ILE 52 -6.231 -8.965 -0.995
402 HG13 ILE 52 1HG1 ILE 52 -4.658 -9.022 -0.228
403 HG21 ILE 52 1HG2 ILE 52 -5.773 -6.920 -3.108
404 HG22 ILE 52 2HG2 ILE 52 -6.505 -8.518 -3.249
405 HG23 ILE 52 3HG2 ILE 52 -5.168 -8.064 -4.310
406 HD11 ILE 52 3HD1 ILE 52 -5.646 -7.032 0.607
407 HD12 ILE 52 1HD1 ILE 52 -6.297 -6.607 -0.973
408 HD13 ILE 52 2HD1 ILE 52 -4.568 -6.468 -0.667
409 H ILE 53 H ILE 53 -1.990 -10.468 -3.776
410 HA ILE 53 HA ILE 53 -0.623 -11.419 -1.364
411 HB ILE 53 HB ILE 53 0.594 -11.243 -4.117
412 HG12 ILE 53 2HG1 ILE 53 -1.562 -12.272 -4.469
413 HG13 ILE 53 1HG1 ILE 53 -0.340 -13.543 -4.497
414 HG21 ILE 53 1HG2 ILE 53 0.906 -13.156 -1.784
415 HG22 ILE 53 2HG2 ILE 53 2.049 -11.901 -2.256
416 HG23 ILE 53 3HG2 ILE 53 1.765 -13.280 -3.319
417 HD11 ILE 53 3HD1 ILE 53 -2.127 -14.372 -3.139
418 HD12 ILE 53 1HD1 ILE 53 -2.252 -12.851 -2.257
419 HD13 ILE 53 2HD1 ILE 53 -0.853 -13.897 -2.019
420 H MET 54 H MET 54 1.030 -10.406 -0.375
421 HA MET 54 HA MET 54 1.350 -7.601 -0.717
422 HB2 MET 54 2HB MET 54 1.694 -8.836 1.438
423 HB3 MET 54 1HB MET 54 3.182 -9.505 0.765
424 HG2 MET 54 2HG MET 54 3.870 -7.593 2.013
425 HG3 MET 54 1HG MET 54 3.897 -7.078 0.336
426 HE1 MET 54 3HE MET 54 3.362 -4.762 -0.026
427 HE2 MET 54 1HE MET 54 4.059 -4.694 1.598
428 HE3 MET 54 2HE MET 54 2.626 -3.744 1.209
429 H LYS 55 H LYS 55 2.183 -6.835 -2.561
430 HA LYS 55 HA LYS 55 4.486 -8.161 -3.827
431 HB2 LYS 55 2HB LYS 55 2.582 -5.988 -4.713
432 HB3 LYS 55 1HB LYS 55 4.029 -6.417 -5.631
433 HG2 LYS 55 2HG LYS 55 3.255 -8.700 -5.875
434 HG3 LYS 55 1HG LYS 55 1.863 -8.379 -4.842
435 HD2 LYS 55 2HD LYS 55 1.230 -6.556 -6.536
436 HD3 LYS 55 1HD LYS 55 2.424 -7.294 -7.605
437 HE2 LYS 55 2HE LYS 55 1.247 -9.459 -7.423
438 HE3 LYS 55 1HE LYS 55 0.045 -8.713 -6.370
439 HZ1 LYS 55 3HZ LYS 55 0.581 -7.474 -8.969
440 HZ2 LYS 55 1HZ LYS 55 -0.859 -7.530 -8.074
441 HZ3 LYS 55 2HZ LYS 55 -0.342 -8.901 -8.935
442 H GLY 56 H GLY 56 3.490 -5.009 -2.564
443 HA2 GLY 56 2HA GLY 56 6.170 -3.907 -2.909
444 HA3 GLY 56 1HA GLY 56 4.737 -3.048 -2.367
445 H ASN 57 H ASN 57 7.101 -5.493 -1.292
446 HA ASN 57 HA ASN 57 6.397 -5.235 1.472
447 HB2 ASN 57 2HB ASN 57 7.550 -7.239 0.583
448 HB3 ASN 57 1HB ASN 57 8.973 -6.252 0.245
449 HD21 ASN 57 1HD2 ASN 57 7.266 -5.273 3.077
450 HD22 ASN 57 2HD2 ASN 57 8.304 -5.995 4.218
451 H GLU 58 H GLU 58 8.116 -3.310 -0.722
452 HA GLU 58 HA GLU 58 9.896 -2.065 1.189
453 HB2 GLU 58 2HB GLU 58 9.103 -1.207 -1.607
454 HB3 GLU 58 1HB GLU 58 10.427 -0.534 -0.655
455 HG2 GLU 58 2HG GLU 58 11.559 -2.692 -0.623
456 HG3 GLU 58 1HG GLU 58 10.202 -3.449 -1.457
457 H ILE 59 H ILE 59 7.601 -1.918 2.432
458 HA ILE 59 HA ILE 59 5.716 0.009 1.951
459 HB ILE 59 HB ILE 59 5.712 0.282 4.521
460 HG12 ILE 59 2HG1 ILE 59 7.684 -2.009 4.286
461 HG13 ILE 59 1HG1 ILE 59 8.167 -0.357 4.674
462 HG21 ILE 59 1HG2 ILE 59 4.196 -1.254 3.418
463 HG22 ILE 59 2HG2 ILE 59 4.902 -2.088 4.801
464 HG23 ILE 59 3HG2 ILE 59 5.491 -2.427 3.173
465 HD11 ILE 59 3HD1 ILE 59 7.740 -1.959 6.652
466 HD12 ILE 59 1HD1 ILE 59 6.029 -1.782 6.263
467 HD13 ILE 59 2HD1 ILE 59 6.980 -0.370 6.723
468 H PHE 60 H PHE 60 9.045 0.539 2.320
469 HA PHE 60 HA PHE 60 9.297 2.948 3.630
470 HB2 PHE 60 2HB PHE 60 10.699 1.981 1.131
471 HB3 PHE 60 1HB PHE 60 11.197 3.404 2.046
472 HD1 PHE 60 2HD PHE 60 11.917 3.165 4.437
473 HD2 PHE 60 1HD PHE 60 11.171 -0.232 1.916
474 HE1 PHE 60 2HE PHE 60 13.155 1.716 6.023
475 HE2 PHE 60 1HE PHE 60 12.410 -1.682 3.502
476 HZ PHE 60 HZ PHE 60 13.401 -0.708 5.555
477 H ARG 61 H ARG 61 7.875 2.316 0.499
478 HA ARG 61 HA ARG 61 7.927 4.887 -0.609
479 HB2 ARG 61 2HB ARG 61 5.723 2.827 -0.868
480 HB3 ARG 61 1HB ARG 61 6.042 4.161 -1.975
481 HG2 ARG 61 2HG ARG 61 8.012 1.938 -1.357
482 HG3 ARG 61 1HG ARG 61 6.973 1.980 -2.779
483 HD2 ARG 61 2HD ARG 61 8.044 4.355 -3.155
484 HD3 ARG 61 1HD ARG 61 9.310 3.743 -2.094
485 HE ARG 61 HE ARG 61 8.754 1.850 -4.137
486 HH11 ARG 61 1HH2 ARG 61 10.202 4.936 -3.545
487 HH12 ARG 61 2HH2 ARG 61 11.340 4.805 -4.844
488 HH21 ARG 61 1HH1 ARG 61 10.243 1.670 -5.843
489 HH22 ARG 61 2HH1 ARG 61 11.363 2.957 -6.144
490 H LEU 62 H LEU 62 5.413 3.369 1.431
491 HA LEU 62 HA LEU 62 3.686 5.574 1.522
492 HB2 LEU 62 2HB LEU 62 2.943 3.399 2.283
493 HB3 LEU 62 1HB LEU 62 4.175 3.370 3.539
494 HG LEU 62 HG LEU 62 3.108 5.178 4.733
495 HD11 LEU 62 1HD1 LEU 62 1.447 5.406 2.221
496 HD12 LEU 62 2HD1 LEU 62 2.334 6.670 3.075
497 HD13 LEU 62 3HD1 LEU 62 0.845 6.025 3.761
498 HD21 LEU 62 3HD2 LEU 62 2.142 2.796 4.830
499 HD22 LEU 62 1HD2 LEU 62 0.843 3.404 3.805
500 HD23 LEU 62 2HD2 LEU 62 1.099 4.095 5.407
501 H ASP 63 H ASP 63 6.231 4.587 3.817
502 HA ASP 63 HA ASP 63 5.960 6.818 5.536
503 HB2 ASP 63 2HB ASP 63 8.398 5.099 5.022
504 HB3 ASP 63 1HB ASP 63 8.156 6.160 6.408
505 H GLU 64 H GLU 64 6.204 8.864 4.907
506 HA GLU 64 HA GLU 64 8.683 9.835 3.917
507 HB2 GLU 64 2HB GLU 64 7.539 8.760 1.854
508 HB3 GLU 64 1HB GLU 64 6.448 10.141 1.916
509 HG2 GLU 64 2HG GLU 64 8.173 10.835 0.452
510 HG3 GLU 64 1HG GLU 64 8.589 11.590 1.988
511 H ALA 65 H ALA 65 6.761 11.865 2.378
512 HA ALA 65 HA ALA 65 5.217 13.165 4.346
513 HB1 ALA 65 1HB ALA 65 8.069 14.108 4.062
514 HB2 ALA 65 2HB ALA 65 7.197 13.702 5.538
515 HB3 ALA 65 3HB ALA 65 6.783 15.164 4.646
516 H LEU 66 H LEU 66 7.533 14.066 1.775
517 HA LEU 66 HA LEU 66 5.636 15.947 0.633
518 HB2 LEU 66 2HB LEU 66 7.519 16.068 -1.167
519 HB3 LEU 66 1HB LEU 66 7.829 16.735 0.433
520 HG LEU 66 HG LEU 66 8.495 13.835 0.014
521 HD11 LEU 66 1HD1 LEU 66 9.384 14.928 -2.024
522 HD12 LEU 66 2HD1 LEU 66 10.679 14.382 -0.960
523 HD13 LEU 66 3HD1 LEU 66 10.245 16.091 -1.015
524 HD21 LEU 66 3HD2 LEU 66 10.184 15.965 1.338
525 HD22 LEU 66 1HD2 LEU 66 10.108 14.238 1.685
526 HD23 LEU 66 2HD2 LEU 66 8.782 15.294 2.167
527 H ARG 67 H ARG 67 4.040 14.119 0.345
528 HA ARG 67 HA ARG 67 4.514 12.156 -1.682
529 HB2 ARG 67 2HB ARG 67 2.096 11.727 -1.513
530 HB3 ARG 67 1HB ARG 67 2.841 11.813 0.083
531 HG2 ARG 67 2HG ARG 67 2.162 14.245 0.175
532 HG3 ARG 67 1HG ARG 67 1.245 13.980 -1.307
533 HD2 ARG 67 2HD ARG 67 0.845 12.327 1.197
534 HD3 ARG 67 1HD ARG 67 -0.093 13.773 0.839
535 HE ARG 67 HE ARG 67 -1.192 12.608 -0.877
536 HH11 ARG 67 1HH2 ARG 67 1.414 10.778 0.487
537 HH12 ARG 67 2HH2 ARG 67 0.944 9.292 -0.267
538 HH21 ARG 67 1HH1 ARG 67 -1.810 10.662 -1.866
539 HH22 ARG 67 2HH1 ARG 67 -0.878 9.226 -1.597
540 H LYS 68 H LYS 68 4.135 12.224 -3.832
541 HA LYS 68 HA LYS 68 2.402 14.061 -5.120
542 HB2 LYS 68 2HB LYS 68 4.104 15.445 -6.264
543 HB3 LYS 68 1HB LYS 68 4.109 15.707 -4.520
544 HG2 LYS 68 2HG LYS 68 5.946 13.916 -4.415
545 HG3 LYS 68 1HG LYS 68 6.066 14.097 -6.165
546 HD2 LYS 68 2HD LYS 68 6.336 16.372 -4.177
547 HD3 LYS 68 1HD LYS 68 7.692 15.542 -4.943
548 HE2 LYS 68 2HE LYS 68 6.575 16.148 -7.184
549 HE3 LYS 68 1HE LYS 68 5.583 17.265 -6.247
550 HZ1 LYS 68 3HZ LYS 68 8.355 17.460 -5.587
551 HZ2 LYS 68 1HZ LYS 68 7.267 18.678 -6.048
552 HZ3 LYS 68 2HZ LYS 68 8.073 17.766 -7.234
553 H GLY 69 H GLY 69 2.525 13.891 -7.480
554 HA2 GLY 69 2HA GLY 69 4.185 12.425 -9.050
555 HA3 GLY 69 1HA GLY 69 3.184 11.196 -8.283
556 H HIS 70 H HIS 70 2.980 11.250 -10.916
557 HA HIS 70 HA HIS 70 0.241 11.846 -11.395
558 HB2 HIS 70 2HB HIS 70 1.040 14.148 -11.566
559 HB3 HIS 70 1HB HIS 70 2.269 13.656 -12.732
560 HD2 HIS 70 2HD HIS 70 1.362 13.515 -15.364
561 HE1 HIS 70 1HE HIS 70 -2.753 13.998 -14.556
562 HE2 HIS 70 2HE HIS 70 -1.014 13.830 -16.398
563 H SER 71 H SER 71 3.163 11.961 -13.444
564 HA SER 71 HA SER 71 2.871 9.312 -14.431
565 HB2 SER 71 2HB SER 71 0.880 10.415 -15.502
566 HB3 SER 71 1HB SER 71 1.998 11.478 -16.353
567 HG SER 71 HG SER 71 2.810 8.936 -16.581
568 H GLU 72 H GLU 72 4.166 12.529 -14.645
569 HA GLU 72 HA GLU 72 6.124 12.129 -16.635
570 HB2 GLU 72 2HB GLU 72 5.405 14.336 -15.614
571 HB3 GLU 72 1HB GLU 72 6.413 13.927 -14.225
572 HG2 GLU 72 2HG GLU 72 7.776 15.257 -15.682
573 HG3 GLU 72 1HG GLU 72 8.329 13.593 -15.859
574 H GLY 73 H GLY 73 6.587 12.193 -13.091
575 HA2 GLY 73 2HA GLY 73 8.120 11.140 -11.738
576 HA3 GLY 73 1HA GLY 73 8.049 9.813 -12.895
577 H GLY 74 H GLY 74 9.604 9.656 -14.521
578 HA2 GLY 74 2HA GLY 74 11.522 11.618 -15.158
579 HA3 GLY 74 1HA GLY 74 12.193 10.561 -13.918
580 H1 HOH 201 H2 HOH 77 -2.762 13.017 -10.363
581 H2 HOH 201 H1 HOH 77 -2.122 12.215 -11.477
Start of MODEL 19
1 H1 VAL 1 1H VAL 1 2.415 3.322 -16.874
2 H2 VAL 1 2H VAL 1 3.992 2.702 -16.999
3 HA VAL 1 HA VAL 1 2.779 2.382 -14.798
4 HB VAL 1 HB VAL 1 5.484 3.754 -14.767
5 HG11 VAL 1 2HG1 VAL 1 4.581 3.329 -12.545
6 HG12 VAL 1 3HG1 VAL 1 5.862 2.160 -12.871
7 HG13 VAL 1 1HG1 VAL 1 4.170 1.674 -12.991
8 HG21 VAL 1 1HG2 VAL 1 6.304 1.345 -15.023
9 HG22 VAL 1 2HG2 VAL 1 5.608 2.076 -16.470
10 HG23 VAL 1 3HG2 VAL 1 4.659 0.938 -15.513
11 H ASP 2 H ASP 2 1.059 4.101 -14.915
12 HA ASP 2 HA ASP 2 1.346 5.913 -12.755
13 HB2 ASP 2 2HB ASP 2 0.991 8.012 -14.195
14 HB3 ASP 2 1HB ASP 2 2.620 7.343 -14.136
15 H MET 3 H MET 3 -0.411 7.106 -15.477
16 HA MET 3 HA MET 3 -2.889 7.161 -14.239
17 HB2 MET 3 2HB MET 3 -2.301 6.913 -17.199
18 HB3 MET 3 1HB MET 3 -3.836 7.430 -16.502
19 HG2 MET 3 2HG MET 3 -1.202 8.820 -15.955
20 HG3 MET 3 1HG MET 3 -2.331 9.329 -17.212
21 HE1 MET 3 3HE MET 3 -5.206 10.941 -15.579
22 HE2 MET 3 1HE MET 3 -5.036 9.463 -16.538
23 HE3 MET 3 2HE MET 3 -4.082 10.890 -16.936
24 H SER 4 H SER 4 -1.287 4.533 -15.879
25 HA SER 4 HA SER 4 -3.419 2.853 -16.487
26 HB2 SER 4 2HB SER 4 -0.690 2.074 -15.434
27 HB3 SER 4 1HB SER 4 -1.814 1.001 -16.265
28 HG SER 4 HG SER 4 -1.315 1.912 -18.107
29 H ASN 5 H ASN 5 -2.012 3.659 -13.397
30 HA ASN 5 HA ASN 5 -4.222 2.416 -12.011
31 HB2 ASN 5 2HB ASN 5 -1.413 1.340 -11.713
32 HB3 ASN 5 1HB ASN 5 -2.695 1.047 -10.541
33 HD21 ASN 5 1HD2 ASN 5 -1.597 0.303 -13.821
34 HD22 ASN 5 2HD2 ASN 5 -2.724 -0.934 -14.104
35 H VAL 6 H VAL 6 -4.763 4.133 -10.812
36 HA VAL 6 HA VAL 6 -2.682 5.374 -9.101
37 HB VAL 6 HB VAL 6 -3.833 7.545 -9.411
38 HG11 VAL 6 1HG1 VAL 6 -3.014 7.957 -11.700
39 HG12 VAL 6 2HG1 VAL 6 -2.945 6.219 -11.990
40 HG13 VAL 6 3HG1 VAL 6 -1.875 6.957 -10.800
41 HG21 VAL 6 3HG2 VAL 6 -5.425 5.958 -11.448
42 HG22 VAL 6 1HG2 VAL 6 -5.427 7.718 -11.346
43 HG23 VAL 6 2HG2 VAL 6 -6.056 6.756 -10.008
44 H VAL 7 H VAL 7 -3.317 5.905 -7.039
45 HA VAL 7 HA VAL 7 -4.527 5.763 -5.094
46 HB VAL 7 HB VAL 7 -6.994 5.886 -6.831
47 HG11 VAL 7 1HG1 VAL 7 -7.397 5.488 -4.458
48 HG12 VAL 7 2HG1 VAL 7 -7.851 7.146 -4.850
49 HG13 VAL 7 3HG1 VAL 7 -6.328 6.821 -4.022
50 HG21 VAL 7 3HG2 VAL 7 -6.754 8.371 -6.612
51 HG22 VAL 7 1HG2 VAL 7 -5.481 7.641 -7.591
52 HG23 VAL 7 2HG2 VAL 7 -5.148 8.120 -5.925
53 H LYS 8 H LYS 8 -5.301 4.168 -3.779
54 HA LYS 8 HA LYS 8 -6.900 1.989 -4.653
55 HB2 LYS 8 2HB LYS 8 -4.664 1.464 -5.751
56 HB3 LYS 8 1HB LYS 8 -4.016 1.258 -4.127
57 HG2 LYS 8 2HG LYS 8 -4.649 -0.935 -4.581
58 HG3 LYS 8 1HG LYS 8 -6.123 -0.340 -3.825
59 HD2 LYS 8 2HD LYS 8 -6.982 -1.332 -5.756
60 HD3 LYS 8 1HD LYS 8 -6.785 0.333 -6.296
61 HE2 LYS 8 2HE LYS 8 -4.656 -0.217 -7.358
62 HE3 LYS 8 1HE LYS 8 -4.730 -1.860 -6.719
63 HZ1 LYS 8 3HZ LYS 8 -5.834 -0.883 -9.085
64 HZ2 LYS 8 1HZ LYS 8 -7.123 -1.302 -8.066
65 HZ3 LYS 8 2HZ LYS 8 -5.938 -2.456 -8.451
66 H THR 9 H THR 9 -7.671 0.822 -2.932
67 HA THR 9 HA THR 9 -6.347 0.938 -0.342
68 HB THR 9 HB THR 9 -9.145 2.050 -0.627
69 HG1 THR 9 1HG THR 9 -7.399 3.842 0.224
70 HG21 THR 9 3HG2 THR 9 -8.786 2.734 1.703
71 HG22 THR 9 1HG2 THR 9 -7.166 2.037 1.669
72 HG23 THR 9 2HG2 THR 9 -8.581 0.991 1.537
73 H TYR 10 H TYR 10 -6.370 -1.158 0.157
74 HA TYR 10 HA TYR 10 -8.790 -2.768 -0.405
75 HB2 TYR 10 2HB TYR 10 -5.908 -3.515 0.112
76 HB3 TYR 10 1HB TYR 10 -7.211 -4.695 0.135
77 HD1 TYR 10 2HD TYR 10 -8.891 -4.459 -1.975
78 HD2 TYR 10 1HD TYR 10 -4.759 -3.261 -1.921
79 HE1 TYR 10 2HE TYR 10 -8.811 -4.611 -4.447
80 HE2 TYR 10 1HE TYR 10 -4.687 -3.415 -4.391
81 HH TYR 10 HH TYR 10 -7.254 -4.846 -6.224
82 H ASP 11 H ASP 11 -10.157 -2.769 1.275
83 HA ASP 11 HA ASP 11 -9.381 -2.241 3.954
84 HB2 ASP 11 2HB ASP 11 -11.923 -3.630 3.133
85 HB3 ASP 11 1HB ASP 11 -11.641 -2.575 4.517
86 H LEU 12 H LEU 12 -7.857 -3.648 4.699
87 HA LEU 12 HA LEU 12 -8.065 -6.498 4.424
88 HB2 LEU 12 2HB LEU 12 -6.172 -4.543 5.489
89 HB3 LEU 12 1HB LEU 12 -6.300 -5.933 6.561
90 HG LEU 12 HG LEU 12 -5.688 -7.455 4.794
91 HD11 LEU 12 1HD1 LEU 12 -4.964 -6.163 2.525
92 HD12 LEU 12 2HD1 LEU 12 -6.318 -5.147 3.021
93 HD13 LEU 12 3HD1 LEU 12 -6.556 -6.873 2.757
94 HD21 LEU 12 3HD2 LEU 12 -3.465 -6.206 3.981
95 HD22 LEU 12 1HD2 LEU 12 -3.677 -6.696 5.660
96 HD23 LEU 12 2HD2 LEU 12 -3.963 -5.023 5.183
97 H GLN 13 H GLN 13 -8.184 -7.983 6.269
98 HA GLN 13 HA GLN 13 -10.486 -7.355 7.898
99 HB2 GLN 13 2HB GLN 13 -10.261 -9.671 8.693
100 HB3 GLN 13 1HB GLN 13 -10.189 -9.599 6.931
101 HG2 GLN 13 2HG GLN 13 -7.684 -9.578 7.095
102 HG3 GLN 13 1HG GLN 13 -7.841 -9.836 8.834
103 HE21 GLN 13 1HE2 GLN 13 -9.858 -11.296 6.250
104 HE22 GLN 13 2HE2 GLN 13 -9.410 -12.901 6.601
105 H ASP 14 H ASP 14 -7.093 -7.113 8.234
106 HA ASP 14 HA ASP 14 -7.044 -7.340 11.124
107 HB2 ASP 14 2HB ASP 14 -4.965 -6.376 9.145
108 HB3 ASP 14 1HB ASP 14 -4.685 -6.602 10.874
109 H GLY 15 H GLY 15 -8.588 -5.207 9.429
110 HA2 GLY 15 2HA GLY 15 -9.392 -3.106 9.993
111 HA3 GLY 15 1HA GLY 15 -8.275 -3.086 11.359
112 H SER 16 H SER 16 -6.264 -3.908 9.042
113 HA SER 16 HA SER 16 -5.256 -1.219 8.684
114 HB2 SER 16 2HB SER 16 -3.408 -2.358 7.485
115 HB3 SER 16 1HB SER 16 -3.689 -3.043 9.085
116 HG SER 16 HG SER 16 -4.679 -4.041 6.612
117 H LYS 17 H LYS 17 -4.251 -0.969 6.279
118 HA LYS 17 HA LYS 17 -6.178 -1.695 4.211
119 HB2 LYS 17 2HB LYS 17 -5.663 1.183 5.000
120 HB3 LYS 17 1HB LYS 17 -6.490 0.679 3.525
121 HG2 LYS 17 2HG LYS 17 -8.097 -0.612 5.026
122 HG3 LYS 17 1HG LYS 17 -7.376 0.253 6.379
123 HD2 LYS 17 2HD LYS 17 -7.953 2.407 5.309
124 HD3 LYS 17 1HD LYS 17 -8.700 1.532 3.972
125 HE2 LYS 17 2HE LYS 17 -9.548 1.201 6.860
126 HE3 LYS 17 1HE LYS 17 -10.328 2.316 5.738
127 HZ1 LYS 17 3HZ LYS 17 -10.783 0.436 4.271
128 HZ2 LYS 17 1HZ LYS 17 -11.498 0.222 5.794
129 HZ3 LYS 17 2HZ LYS 17 -10.079 -0.624 5.396
130 H VAL 18 H VAL 18 -5.034 -2.224 2.469
131 HA VAL 18 HA VAL 18 -2.236 -1.538 2.303
132 HB VAL 18 HB VAL 18 -3.706 -2.776 0.002
133 HG11 VAL 18 1HG1 VAL 18 -1.071 -3.513 1.275
134 HG12 VAL 18 2HG1 VAL 18 -1.218 -2.273 0.032
135 HG13 VAL 18 3HG1 VAL 18 -1.650 -3.943 -0.333
136 HG21 VAL 18 3HG2 VAL 18 -3.598 -4.985 1.048
137 HG22 VAL 18 1HG2 VAL 18 -4.610 -3.912 2.013
138 HG23 VAL 18 2HG2 VAL 18 -2.964 -4.266 2.532
139 H HIS 19 H HIS 19 -1.249 -0.394 0.555
140 HA HIS 19 HA HIS 19 -2.981 1.305 -1.109
141 HB2 HIS 19 2HB HIS 19 -2.693 2.918 0.530
142 HB3 HIS 19 1HB HIS 19 -1.195 2.208 1.111
143 HD1 HIS 19 1HD HIS 19 -2.544 4.546 -1.512
144 HD2 HIS 19 2HD HIS 19 1.151 3.160 -0.159
145 HE1 HIS 19 1HE HIS 19 -0.787 6.005 -2.609
146 HE2 HIS 19 2HE HIS 19 1.471 5.172 -1.797
147 H VAL 20 H VAL 20 -2.279 0.967 -3.149
148 HA VAL 20 HA VAL 20 0.489 0.141 -3.568
149 HB VAL 20 HB VAL 20 -0.112 -0.735 -5.632
150 HG11 VAL 20 1HG1 VAL 20 -1.342 -2.147 -4.249
151 HG12 VAL 20 2HG1 VAL 20 -2.570 -1.622 -5.380
152 HG13 VAL 20 3HG1 VAL 20 -2.481 -0.899 -3.778
153 HG21 VAL 20 3HG2 VAL 20 -2.302 0.014 -6.783
154 HG22 VAL 20 1HG2 VAL 20 -0.933 1.124 -6.804
155 HG23 VAL 20 2HG2 VAL 20 -2.258 1.382 -5.669
156 H PHE 21 H PHE 21 1.818 1.092 -5.215
157 HA PHE 21 HA PHE 21 1.460 4.023 -5.371
158 HB2 PHE 21 2HB PHE 21 3.894 2.249 -5.649
159 HB3 PHE 21 1HB PHE 21 3.908 3.986 -5.953
160 HD1 PHE 21 2HD PHE 21 3.297 1.385 -3.376
161 HD2 PHE 21 1HD PHE 21 3.877 5.569 -4.155
162 HE1 PHE 21 2HE PHE 21 3.523 1.807 -0.942
163 HE2 PHE 21 1HE PHE 21 4.103 5.991 -1.722
164 HZ PHE 21 HZ PHE 21 3.926 4.109 -0.118
165 H LYS 22 H LYS 22 3.149 4.566 -7.483
166 HA LYS 22 HA LYS 22 1.438 4.070 -9.721
167 HB2 LYS 22 2HB LYS 22 3.178 5.298 -11.001
168 HB3 LYS 22 1HB LYS 22 2.664 6.165 -9.554
169 HG2 LYS 22 2HG LYS 22 4.628 5.173 -8.340
170 HG3 LYS 22 1HG LYS 22 5.175 4.499 -9.875
171 HD2 LYS 22 2HD LYS 22 5.456 6.680 -10.833
172 HD3 LYS 22 1HD LYS 22 4.628 7.449 -9.480
173 HE2 LYS 22 2HE LYS 22 7.012 7.758 -9.178
174 HE3 LYS 22 1HE LYS 22 6.448 6.604 -7.970
175 HZ1 LYS 22 3HZ LYS 22 8.542 6.058 -9.336
176 HZ2 LYS 22 1HZ LYS 22 7.453 5.662 -10.574
177 HZ3 LYS 22 2HZ LYS 22 7.386 4.838 -9.090
178 H ASP 23 H ASP 23 4.289 2.561 -8.427
179 HA ASP 23 HA ASP 23 4.967 1.138 -10.849
180 HB2 ASP 23 2HB ASP 23 5.866 0.664 -7.996
181 HB3 ASP 23 1HB ASP 23 6.597 -0.027 -9.447
182 H GLY 24 H GLY 24 2.298 0.905 -9.169
183 HA2 GLY 24 2HA GLY 24 0.687 -0.737 -9.002
184 HA3 GLY 24 1HA GLY 24 1.754 -1.798 -9.919
185 H LYS 25 H LYS 25 3.780 -0.922 -7.646
186 HA LYS 25 HA LYS 25 3.603 -3.331 -6.143
187 HB2 LYS 25 2HB LYS 25 5.202 -0.796 -6.019
188 HB3 LYS 25 1HB LYS 25 5.208 -1.825 -4.595
189 HG2 LYS 25 2HG LYS 25 5.868 -3.755 -6.086
190 HG3 LYS 25 1HG LYS 25 6.046 -2.596 -7.404
191 HD2 LYS 25 2HD LYS 25 7.499 -2.386 -4.751
192 HD3 LYS 25 1HD LYS 25 8.196 -3.108 -6.199
193 HE2 LYS 25 2HE LYS 25 7.581 -0.852 -7.351
194 HE3 LYS 25 1HE LYS 25 7.445 -0.231 -5.707
195 HZ1 LYS 25 3HZ LYS 25 9.714 -1.129 -5.311
196 HZ2 LYS 25 1HZ LYS 25 9.654 0.138 -6.437
197 HZ3 LYS 25 2HZ LYS 25 9.823 -1.468 -6.972
198 H MET 26 H MET 26 2.862 -3.695 -4.069
199 HA MET 26 HA MET 26 0.686 -2.030 -3.182
200 HB2 MET 26 2HB MET 26 1.746 -4.724 -2.485
201 HB3 MET 26 1HB MET 26 0.831 -3.887 -1.234
202 HG2 MET 26 2HG MET 26 -1.095 -3.720 -2.599
203 HG3 MET 26 1HG MET 26 -0.196 -4.141 -4.059
204 HE1 MET 26 3HE MET 26 -0.043 -6.640 -4.958
205 HE2 MET 26 1HE MET 26 -1.597 -5.793 -4.903
206 HE3 MET 26 2HE MET 26 -1.499 -7.496 -4.457
207 H GLY 27 H GLY 27 0.500 -1.798 -0.696
208 HA2 GLY 27 2HA GLY 27 3.014 -1.031 0.605
209 HA3 GLY 27 1HA GLY 27 1.855 0.265 0.301
210 H MET 28 H MET 28 2.883 -1.715 2.651
211 HA MET 28 HA MET 28 0.278 -2.432 3.768
212 HB2 MET 28 2HB MET 28 2.308 -3.945 3.813
213 HB3 MET 28 1HB MET 28 3.006 -2.838 4.984
214 HG2 MET 28 2HG MET 28 1.918 -4.593 6.215
215 HG3 MET 28 1HG MET 28 0.951 -3.135 6.389
216 HE1 MET 28 3HE MET 28 -1.784 -3.570 6.307
217 HE2 MET 28 1HE MET 28 -0.687 -4.499 7.339
218 HE3 MET 28 2HE MET 28 -1.982 -5.313 6.467
219 H GLU 29 H GLU 29 -0.395 -0.165 4.028
220 HA GLU 29 HA GLU 29 0.935 1.287 6.231
221 HB2 GLU 29 2HB GLU 29 0.407 2.498 4.110
222 HB3 GLU 29 1HB GLU 29 -1.305 2.200 4.411
223 HG2 GLU 29 2HG GLU 29 -1.200 3.436 6.506
224 HG3 GLU 29 1HG GLU 29 0.543 3.639 6.335
225 H ASN 30 H ASN 30 0.231 0.491 8.150
226 HA ASN 30 HA ASN 30 -2.373 -0.566 8.586
227 HB2 ASN 30 2HB ASN 30 -1.738 -0.430 11.006
228 HB3 ASN 30 1HB ASN 30 -0.559 -1.277 10.004
229 HD21 ASN 30 1HD2 ASN 30 -1.176 2.204 10.778
230 HD22 ASN 30 2HD2 ASN 30 0.446 2.543 11.172
231 H LYS 31 H LYS 31 -3.965 0.301 10.106
232 HA LYS 31 HA LYS 31 -4.618 3.023 9.461
233 HB2 LYS 31 2HB LYS 31 -6.601 2.618 10.923
234 HB3 LYS 31 1HB LYS 31 -6.410 1.424 9.641
235 HG2 LYS 31 2HG LYS 31 -6.688 -0.092 11.349
236 HG3 LYS 31 1HG LYS 31 -4.978 0.204 11.637
237 HD2 LYS 31 2HD LYS 31 -5.881 0.541 13.768
238 HD3 LYS 31 1HD LYS 31 -5.847 2.186 13.140
239 HE2 LYS 31 2HE LYS 31 -8.205 2.042 12.519
240 HE3 LYS 31 1HE LYS 31 -8.261 0.352 13.015
241 HZ1 LYS 31 3HZ LYS 31 -7.286 1.527 15.212
242 HZ2 LYS 31 1HZ LYS 31 -8.932 1.208 14.955
243 HZ3 LYS 31 2HZ LYS 31 -8.305 2.753 14.625
244 H PHE 32 H PHE 32 -2.508 1.760 11.656
245 HA PHE 32 HA PHE 32 -3.105 3.481 13.906
246 HB2 PHE 32 2HB PHE 32 -0.771 1.680 13.231
247 HB3 PHE 32 1HB PHE 32 -0.835 2.664 14.696
248 HD1 PHE 32 1HD PHE 32 -3.139 2.491 16.035
249 HD2 PHE 32 2HD PHE 32 -1.623 -0.501 13.351
250 HE1 PHE 32 1HE PHE 32 -4.552 0.782 17.141
251 HE2 PHE 32 2HE PHE 32 -3.037 -2.211 14.458
252 HZ PHE 32 HZ PHE 32 -4.502 -1.569 16.354
253 H GLY 33 H GLY 33 -2.321 4.390 11.009
254 HA2 GLY 33 2HA GLY 33 -1.325 6.273 10.130
255 HA3 GLY 33 1HA GLY 33 -1.077 6.822 11.787
256 H LYS 34 H LYS 34 0.143 3.733 10.787
257 HA LYS 34 HA LYS 34 2.873 4.799 10.426
258 HB2 LYS 34 2HB LYS 34 2.034 2.668 12.404
259 HB3 LYS 34 1HB LYS 34 3.705 2.943 11.910
260 HG2 LYS 34 2HG LYS 34 3.536 5.293 12.676
261 HG3 LYS 34 1HG LYS 34 1.883 4.987 13.211
262 HD2 LYS 34 2HD LYS 34 2.744 3.191 14.719
263 HD3 LYS 34 1HD LYS 34 4.387 3.629 14.247
264 HE2 LYS 34 2HE LYS 34 4.045 5.908 15.103
265 HE3 LYS 34 1HE LYS 34 2.386 5.503 15.545
266 HZ1 LYS 34 3HZ LYS 34 4.835 4.905 16.910
267 HZ2 LYS 34 1HZ LYS 34 3.857 3.536 16.701
268 HZ3 LYS 34 2HZ LYS 34 3.241 4.907 17.493
269 H SER 35 H SER 35 4.371 3.011 9.687
270 HA SER 35 HA SER 35 2.990 1.418 7.624
271 HB2 SER 35 2HB SER 35 4.852 2.980 6.992
272 HB3 SER 35 1HB SER 35 5.948 1.973 7.934
273 HG SER 35 HG SER 35 4.630 1.457 5.528
274 H MET 36 H MET 36 2.726 -0.704 7.890
275 HA MET 36 HA MET 36 4.220 -2.090 10.020
276 HB2 MET 36 2HB MET 36 1.591 -2.109 9.583
277 HB3 MET 36 1HB MET 36 2.012 -3.390 8.450
278 HG2 MET 36 2HG MET 36 2.538 -3.305 11.429
279 HG3 MET 36 1HG MET 36 1.551 -4.463 10.537
280 HE1 MET 36 3HE MET 36 4.634 -6.460 11.932
281 HE2 MET 36 1HE MET 36 2.875 -6.275 11.949
282 HE3 MET 36 2HE MET 36 3.903 -5.033 12.659
283 H ASN 37 H ASN 37 6.067 -3.021 9.370
284 HA ASN 37 HA ASN 37 6.638 -3.623 6.647
285 HB2 ASN 37 2HB ASN 37 8.383 -3.059 8.305
286 HB3 ASN 37 1HB ASN 37 8.072 -4.589 9.125
287 HD21 ASN 37 1HD2 ASN 37 7.958 -6.493 7.241
288 HD22 ASN 37 2HD2 ASN 37 9.325 -6.492 6.228
289 H MET 38 H MET 38 4.984 -5.010 5.926
290 HA MET 38 HA MET 38 4.760 -7.657 7.151
291 HB2 MET 38 2HB MET 38 2.678 -6.698 6.495
292 HB3 MET 38 1HB MET 38 3.283 -6.289 4.889
293 HG2 MET 38 2HG MET 38 3.428 -8.640 4.304
294 HG3 MET 38 1HG MET 38 3.056 -9.112 5.953
295 HE1 MET 38 3HE MET 38 0.833 -9.560 6.849
296 HE2 MET 38 1HE MET 38 -0.640 -8.686 6.399
297 HE3 MET 38 2HE MET 38 0.725 -7.818 7.098
298 HA PRO 39 HA PRO 39 7.893 -8.946 4.151
299 HB2 PRO 39 2HB PRO 39 7.983 -11.613 4.719
300 HB3 PRO 39 1HB PRO 39 8.696 -10.385 5.787
301 HG2 PRO 39 2HG PRO 39 6.067 -11.790 6.016
302 HG3 PRO 39 1HG PRO 39 7.264 -11.430 7.276
303 HD2 PRO 39 2HD PRO 39 5.018 -9.916 6.904
304 HD3 PRO 39 1HD PRO 39 6.531 -9.238 7.529
305 H GLU 40 H GLU 40 7.734 -9.463 2.039
306 HA GLU 40 HA GLU 40 5.383 -9.869 0.695
307 HB2 GLU 40 2HB GLU 40 6.756 -10.744 -1.179
308 HB3 GLU 40 1HB GLU 40 7.452 -9.292 -0.457
309 HG2 GLU 40 2HG GLU 40 8.861 -10.836 0.997
310 HG3 GLU 40 1HG GLU 40 8.318 -12.159 -0.037
311 H GLY 41 H GLY 41 4.020 -11.510 0.344
312 HA2 GLY 41 2HA GLY 41 3.685 -13.882 -0.169
313 HA3 GLY 41 1HA GLY 41 4.865 -14.261 1.082
314 H LYS 42 H LYS 42 3.603 -11.991 2.728
315 HA LYS 42 HA LYS 42 1.811 -13.674 4.197
316 HB2 LYS 42 2HB LYS 42 2.903 -10.921 4.468
317 HB3 LYS 42 1HB LYS 42 1.360 -11.204 5.261
318 HG2 LYS 42 2HG LYS 42 3.622 -13.167 5.632
319 HG3 LYS 42 1HG LYS 42 3.588 -11.681 6.572
320 HD2 LYS 42 2HD LYS 42 1.583 -12.242 7.655
321 HD3 LYS 42 1HD LYS 42 1.145 -13.436 6.432
322 HE2 LYS 42 2HE LYS 42 3.427 -13.684 8.415
323 HE3 LYS 42 1HE LYS 42 1.897 -14.557 8.484
324 HZ1 LYS 42 3HZ LYS 42 3.994 -14.768 6.400
325 HZ2 LYS 42 1HZ LYS 42 2.449 -15.451 6.243
326 HZ3 LYS 42 2HZ LYS 42 3.487 -15.976 7.480
327 H VAL 43 H VAL 43 0.266 -14.256 2.731
328 HA VAL 43 HA VAL 43 -1.240 -12.692 1.040
329 HB VAL 43 HB VAL 43 -2.409 -14.981 2.614
330 HG11 VAL 43 1HG1 VAL 43 -2.770 -14.034 -0.246
331 HG12 VAL 43 2HG1 VAL 43 -3.896 -13.722 1.073
332 HG13 VAL 43 3HG1 VAL 43 -3.626 -15.374 0.517
333 HG21 VAL 43 3HG2 VAL 43 -1.431 -16.369 0.692
334 HG22 VAL 43 1HG2 VAL 43 -0.283 -15.807 1.906
335 HG23 VAL 43 2HG2 VAL 43 -0.397 -14.981 0.353
336 H MET 44 H MET 44 -2.683 -11.129 1.274
337 HA MET 44 HA MET 44 -3.926 -10.695 3.935
338 HB2 MET 44 2HB MET 44 -3.694 -8.638 1.737
339 HB3 MET 44 1HB MET 44 -4.030 -8.380 3.437
340 HG2 MET 44 2HG MET 44 -1.778 -8.881 4.049
341 HG3 MET 44 1HG MET 44 -1.408 -9.526 2.453
342 HE1 MET 44 3HE MET 44 -1.511 -8.410 0.415
343 HE2 MET 44 1HE MET 44 -0.940 -6.764 0.131
344 HE3 MET 44 2HE MET 44 -2.655 -7.075 0.365
345 H GLU 45 H GLU 45 -6.157 -10.588 4.039
346 HA GLU 45 HA GLU 45 -7.638 -11.023 1.500
347 HB2 GLU 45 2HB GLU 45 -7.596 -13.086 2.741
348 HB3 GLU 45 1HB GLU 45 -8.044 -12.258 4.233
349 HG2 GLU 45 2HG GLU 45 -9.942 -13.463 3.121
350 HG3 GLU 45 1HG GLU 45 -10.244 -11.746 3.367
351 H THR 46 H THR 46 -9.045 -9.466 1.051
352 HA THR 46 HA THR 46 -9.743 -7.487 3.043
353 HB THR 46 HB THR 46 -10.803 -6.301 1.256
354 HG1 THR 46 1HG THR 46 -10.458 -8.628 -0.311
355 HG21 THR 46 3HG2 THR 46 -8.420 -7.753 0.079
356 HG22 THR 46 1HG2 THR 46 -8.297 -6.440 1.249
357 HG23 THR 46 2HG2 THR 46 -8.994 -6.139 -0.343
358 H ARG 47 H ARG 47 -11.941 -6.923 3.606
359 HA ARG 47 HA ARG 47 -13.483 -9.107 4.445
360 HB2 ARG 47 2HB ARG 47 -15.281 -7.435 4.855
361 HB3 ARG 47 1HB ARG 47 -13.725 -6.988 5.552
362 HG2 ARG 47 2HG ARG 47 -13.332 -5.317 3.954
363 HG3 ARG 47 1HG ARG 47 -14.449 -6.022 2.787
364 HD2 ARG 47 2HD ARG 47 -15.455 -4.024 3.753
365 HD3 ARG 47 1HD ARG 47 -16.340 -5.447 4.287
366 HE ARG 47 HE ARG 47 -15.512 -5.119 6.464
367 HH11 ARG 47 1HH2 ARG 47 -14.117 -2.921 4.176
368 HH12 ARG 47 2HH2 ARG 47 -13.431 -1.888 5.384
369 HH21 ARG 47 1HH1 ARG 47 -14.613 -3.766 8.047
370 HH22 ARG 47 2HH1 ARG 47 -13.711 -2.365 7.572
371 H ASP 48 H ASP 48 -13.436 -7.365 1.438
372 HA ASP 48 HA ASP 48 -15.989 -8.223 0.483
373 HB2 ASP 48 2HB ASP 48 -14.809 -6.278 -0.468
374 HB3 ASP 48 1HB ASP 48 -13.537 -7.347 -1.065
375 H GLY 49 H GLY 49 -13.245 -9.918 1.201
376 HA2 GLY 49 2HA GLY 49 -12.804 -12.179 0.913
377 HA3 GLY 49 1HA GLY 49 -14.171 -12.272 -0.199
378 H THR 50 H THR 50 -11.392 -10.075 -0.385
379 HA THR 50 HA THR 50 -10.683 -11.291 -3.003
380 HB THR 50 HB THR 50 -10.019 -8.503 -2.039
381 HG1 THR 50 1HG THR 50 -12.362 -9.480 -2.731
382 HG21 THR 50 3HG2 THR 50 -9.983 -9.851 -4.750
383 HG22 THR 50 1HG2 THR 50 -8.576 -9.363 -3.806
384 HG23 THR 50 2HG2 THR 50 -9.659 -8.140 -4.470
385 H LYS 51 H LYS 51 -8.929 -12.523 -2.902
386 HA LYS 51 HA LYS 51 -7.033 -12.269 -0.730
387 HB2 LYS 51 2HB LYS 51 -7.868 -14.429 -2.003
388 HB3 LYS 51 1HB LYS 51 -6.567 -14.036 -3.122
389 HG2 LYS 51 2HG LYS 51 -5.443 -15.401 -1.596
390 HG3 LYS 51 1HG LYS 51 -5.132 -13.811 -0.913
391 HD2 LYS 51 2HD LYS 51 -5.875 -14.958 0.983
392 HD3 LYS 51 1HD LYS 51 -7.387 -14.263 0.411
393 HE2 LYS 51 2HE LYS 51 -7.629 -16.664 0.977
394 HE3 LYS 51 1HE LYS 51 -7.946 -16.363 -0.728
395 HZ1 LYS 51 3HZ LYS 51 -6.075 -17.426 -1.366
396 HZ2 LYS 51 1HZ LYS 51 -6.312 -18.255 0.094
397 HZ3 LYS 51 2HZ LYS 51 -5.197 -16.976 0.016
398 H ILE 52 H ILE 52 -5.488 -10.811 -0.751
399 HA ILE 52 HA ILE 52 -4.103 -10.177 -3.300
400 HB ILE 52 HB ILE 52 -3.772 -7.855 -2.042
401 HG12 ILE 52 2HG1 ILE 52 -6.471 -8.721 -0.982
402 HG13 ILE 52 1HG1 ILE 52 -5.012 -8.794 -0.017
403 HG21 ILE 52 1HG2 ILE 52 -6.426 -8.589 -3.293
404 HG22 ILE 52 2HG2 ILE 52 -4.963 -8.209 -4.205
405 HG23 ILE 52 3HG2 ILE 52 -5.721 -6.976 -3.196
406 HD11 ILE 52 3HD1 ILE 52 -6.287 -6.348 -1.241
407 HD12 ILE 52 1HD1 ILE 52 -4.671 -6.334 -0.539
408 HD13 ILE 52 2HD1 ILE 52 -6.066 -6.697 0.474
409 H ILE 53 H ILE 53 -2.000 -10.557 -3.235
410 HA ILE 53 HA ILE 53 -0.724 -11.281 -0.711
411 HB ILE 53 HB ILE 53 0.395 -11.308 -3.520
412 HG12 ILE 53 2HG1 ILE 53 -0.774 -13.587 -1.892
413 HG13 ILE 53 1HG1 ILE 53 -1.648 -12.744 -3.173
414 HG21 ILE 53 1HG2 ILE 53 1.283 -12.584 -0.916
415 HG22 ILE 53 2HG2 ILE 53 2.129 -11.320 -1.807
416 HG23 ILE 53 3HG2 ILE 53 1.992 -12.938 -2.493
417 HD11 ILE 53 3HD1 ILE 53 0.956 -14.267 -3.489
418 HD12 ILE 53 1HD1 ILE 53 0.160 -13.354 -4.772
419 HD13 ILE 53 2HD1 ILE 53 -0.628 -14.773 -4.081
420 H MET 54 H MET 54 1.053 -10.277 0.187
421 HA MET 54 HA MET 54 1.263 -7.453 -0.239
422 HB2 MET 54 2HB MET 54 1.618 -8.598 1.971
423 HB3 MET 54 1HB MET 54 3.128 -9.255 1.332
424 HG2 MET 54 2HG MET 54 3.774 -7.288 2.495
425 HG3 MET 54 1HG MET 54 3.767 -6.818 0.803
426 HE1 MET 54 3HE MET 54 2.212 -3.551 1.292
427 HE2 MET 54 1HE MET 54 3.048 -4.674 0.213
428 HE3 MET 54 2HE MET 54 3.747 -4.266 1.777
429 H LYS 55 H LYS 55 1.779 -7.411 -2.494
430 HA LYS 55 HA LYS 55 4.187 -8.564 -3.523
431 HB2 LYS 55 2HB LYS 55 2.104 -7.892 -4.847
432 HB3 LYS 55 1HB LYS 55 2.666 -6.230 -4.692
433 HG2 LYS 55 2HG LYS 55 3.644 -6.809 -6.722
434 HG3 LYS 55 1HG LYS 55 4.941 -7.225 -5.610
435 HD2 LYS 55 2HD LYS 55 4.821 -9.169 -6.898
436 HD3 LYS 55 1HD LYS 55 3.758 -9.592 -5.560
437 HE2 LYS 55 2HE LYS 55 1.791 -8.988 -6.876
438 HE3 LYS 55 1HE LYS 55 2.813 -8.415 -8.193
439 HZ1 LYS 55 3HZ LYS 55 3.019 -10.466 -8.958
440 HZ2 LYS 55 1HZ LYS 55 1.866 -10.972 -7.822
441 HZ3 LYS 55 2HZ LYS 55 3.520 -11.056 -7.445
442 H GLY 56 H GLY 56 3.277 -5.153 -3.205
443 HA2 GLY 56 2HA GLY 56 5.952 -4.204 -3.387
444 HA3 GLY 56 1HA GLY 56 4.540 -3.260 -2.945
445 H ASN 57 H ASN 57 6.729 -5.732 -1.563
446 HA ASN 57 HA ASN 57 6.053 -5.084 1.138
447 HB2 ASN 57 2HB ASN 57 7.003 -7.258 0.627
448 HB3 ASN 57 1HB ASN 57 8.463 -6.507 -0.020
449 HD21 ASN 57 1HD2 ASN 57 6.859 -5.235 2.876
450 HD22 ASN 57 2HD2 ASN 57 8.083 -5.700 3.966
451 H GLU 58 H GLU 58 7.643 -3.358 -1.185
452 HA GLU 58 HA GLU 58 9.697 -2.163 0.482
453 HB2 GLU 58 2HB GLU 58 8.656 -1.363 -2.248
454 HB3 GLU 58 1HB GLU 58 10.093 -0.708 -1.462
455 HG2 GLU 58 2HG GLU 58 11.118 -2.938 -1.431
456 HG3 GLU 58 1HG GLU 58 9.673 -3.627 -2.168
457 H ILE 59 H ILE 59 7.714 -1.794 2.038
458 HA ILE 59 HA ILE 59 5.850 0.227 1.622
459 HB ILE 59 HB ILE 59 5.876 0.460 4.116
460 HG12 ILE 59 2HG1 ILE 59 8.031 -1.670 3.992
461 HG13 ILE 59 1HG1 ILE 59 8.385 0.036 4.274
462 HG21 ILE 59 1HG2 ILE 59 5.998 -2.425 3.203
463 HG22 ILE 59 2HG2 ILE 59 4.640 -1.357 2.844
464 HG23 ILE 59 3HG2 ILE 59 5.032 -1.756 4.517
465 HD11 ILE 59 3HD1 ILE 59 8.071 -1.514 6.340
466 HD12 ILE 59 1HD1 ILE 59 6.350 -1.403 5.972
467 HD13 ILE 59 2HD1 ILE 59 7.268 0.056 6.344
468 H PHE 60 H PHE 60 9.250 0.453 1.970
469 HA PHE 60 HA PHE 60 9.695 2.908 3.138
470 HB2 PHE 60 2HB PHE 60 11.079 1.742 0.710
471 HB3 PHE 60 1HB PHE 60 11.702 3.064 1.700
472 HD1 PHE 60 1HD PHE 60 12.465 2.673 4.001
473 HD2 PHE 60 2HD PHE 60 11.020 -0.544 1.550
474 HE1 PHE 60 1HE PHE 60 13.422 1.030 5.592
475 HE2 PHE 60 2HE PHE 60 11.977 -2.187 3.140
476 HZ PHE 60 HZ PHE 60 13.179 -1.400 5.162
477 H ARG 61 H ARG 61 8.300 2.203 0.019
478 HA ARG 61 HA ARG 61 8.646 4.596 -1.334
479 HB2 ARG 61 2HB ARG 61 6.187 2.831 -1.306
480 HB3 ARG 61 1HB ARG 61 6.567 4.033 -2.536
481 HG2 ARG 61 2HG ARG 61 8.563 1.863 -1.889
482 HG3 ARG 61 1HG ARG 61 7.204 1.516 -2.954
483 HD2 ARG 61 2HD ARG 61 9.293 3.676 -3.360
484 HD3 ARG 61 1HD ARG 61 9.126 2.192 -4.291
485 HE ARG 61 HE ARG 61 6.693 3.621 -4.415
486 HH11 ARG 61 1HH2 ARG 61 9.993 3.777 -5.444
487 HH12 ARG 61 2HH2 ARG 61 9.649 4.688 -6.876
488 HH21 ARG 61 1HH1 ARG 61 6.233 4.815 -6.292
489 HH22 ARG 61 2HH1 ARG 61 7.519 5.276 -7.356
490 H LEU 62 H LEU 62 6.465 3.860 1.328
491 HA LEU 62 HA LEU 62 4.645 5.937 1.163
492 HB2 LEU 62 2HB LEU 62 5.999 4.814 3.625
493 HB3 LEU 62 1HB LEU 62 4.580 5.856 3.665
494 HG LEU 62 HG LEU 62 4.548 3.332 2.006
495 HD11 LEU 62 1HD1 LEU 62 3.674 2.084 3.910
496 HD12 LEU 62 2HD1 LEU 62 3.832 3.501 4.948
497 HD13 LEU 62 3HD1 LEU 62 5.272 2.709 4.312
498 HD21 LEU 62 3HD2 LEU 62 2.672 4.866 1.707
499 HD22 LEU 62 1HD2 LEU 62 2.438 4.978 3.450
500 HD23 LEU 62 2HD2 LEU 62 2.109 3.465 2.610
501 H ASP 63 H ASP 63 8.027 6.027 2.055
502 HA ASP 63 HA ASP 63 7.976 8.691 3.126
503 HB2 ASP 63 2HB ASP 63 10.289 7.033 2.091
504 HB3 ASP 63 1HB ASP 63 10.432 8.527 3.017
505 H GLU 64 H GLU 64 9.220 10.486 2.141
506 HA GLU 64 HA GLU 64 8.240 11.138 -0.419
507 HB2 GLU 64 2HB GLU 64 9.006 12.744 1.394
508 HB3 GLU 64 1HB GLU 64 10.659 12.385 0.892
509 HG2 GLU 64 2HG GLU 64 9.992 14.350 -0.312
510 HG3 GLU 64 1HG GLU 64 9.964 13.017 -1.466
511 H ALA 65 H ALA 65 8.928 10.614 -2.391
512 HA ALA 65 HA ALA 65 11.673 10.358 -3.103
513 HB1 ALA 65 1HB ALA 65 11.642 7.939 -3.664
514 HB2 ALA 65 2HB ALA 65 10.081 7.795 -2.855
515 HB3 ALA 65 3HB ALA 65 11.517 8.230 -1.929
516 H LEU 66 H LEU 66 10.221 11.974 -4.378
517 HA LEU 66 HA LEU 66 8.527 10.892 -6.421
518 HB2 LEU 66 2HB LEU 66 9.856 13.595 -6.526
519 HB3 LEU 66 1HB LEU 66 8.292 13.111 -7.182
520 HG LEU 66 HG LEU 66 9.016 13.340 -4.247
521 HD11 LEU 66 1HD1 LEU 66 8.635 15.506 -5.296
522 HD12 LEU 66 2HD1 LEU 66 7.239 15.101 -4.296
523 HD13 LEU 66 3HD1 LEU 66 7.155 14.916 -6.049
524 HD21 LEU 66 3HD2 LEU 66 6.555 12.311 -5.677
525 HD22 LEU 66 1HD2 LEU 66 6.487 12.907 -4.017
526 HD23 LEU 66 2HD2 LEU 66 7.494 11.515 -4.414
527 H ARG 67 H ARG 67 10.898 9.473 -6.483
528 HA ARG 67 HA ARG 67 12.827 10.418 -8.310
529 HB2 ARG 67 2HB ARG 67 13.437 8.024 -8.564
530 HB3 ARG 67 1HB ARG 67 13.266 8.498 -6.874
531 HG2 ARG 67 2HG ARG 67 10.916 7.628 -6.922
532 HG3 ARG 67 1HG ARG 67 11.215 7.032 -8.557
533 HD2 ARG 67 2HD ARG 67 12.833 6.253 -6.114
534 HD3 ARG 67 1HD ARG 67 11.548 5.274 -6.819
535 HE ARG 67 HE ARG 67 13.429 5.908 -8.832
536 HH11 ARG 67 1HH2 ARG 67 13.077 4.066 -5.924
537 HH12 ARG 67 2HH2 ARG 67 14.222 2.854 -6.389
538 HH21 ARG 67 1HH1 ARG 67 14.932 4.321 -9.450
539 HH22 ARG 67 2HH1 ARG 67 15.272 2.998 -8.384
540 H LYS 68 H LYS 68 13.105 10.050 -10.521
541 HA LYS 68 HA LYS 68 10.737 10.130 -12.096
542 HB2 LYS 68 2HB LYS 68 13.625 9.716 -12.902
543 HB3 LYS 68 1HB LYS 68 12.302 10.051 -14.020
544 HG2 LYS 68 2HG LYS 68 11.845 12.140 -12.589
545 HG3 LYS 68 1HG LYS 68 13.429 11.851 -11.871
546 HD2 LYS 68 2HD LYS 68 12.824 12.330 -14.803
547 HD3 LYS 68 1HD LYS 68 13.700 13.405 -13.714
548 HE2 LYS 68 2HE LYS 68 15.414 12.298 -14.897
549 HE3 LYS 68 1HE LYS 68 15.324 11.410 -13.376
550 HZ1 LYS 68 3HZ LYS 68 13.516 10.429 -15.381
551 HZ2 LYS 68 1HZ LYS 68 14.622 9.584 -14.412
552 HZ3 LYS 68 2HZ LYS 68 15.146 10.321 -15.849
553 H GLY 69 H GLY 69 9.629 8.189 -11.502
554 HA2 GLY 69 2HA GLY 69 10.775 5.600 -11.952
555 HA3 GLY 69 1HA GLY 69 9.075 5.950 -11.650
556 H HIS 70 H HIS 70 8.651 4.315 -13.296
557 HA HIS 70 HA HIS 70 8.112 3.636 -15.425
558 HB2 HIS 70 2HB HIS 70 6.730 5.697 -15.265
559 HB3 HIS 70 1HB HIS 70 8.064 6.614 -15.965
560 HD2 HIS 70 2HD HIS 70 8.705 5.805 -18.713
561 HE1 HIS 70 1HE HIS 70 4.960 3.955 -19.332
562 HE2 HIS 70 2HE HIS 70 7.065 4.796 -20.477
563 H SER 71 H SER 71 9.969 2.606 -16.090
564 HA SER 71 HA SER 71 11.395 3.766 -18.264
565 HB2 SER 71 2HB SER 71 13.650 3.744 -17.214
566 HB3 SER 71 1HB SER 71 12.589 4.972 -16.527
567 HG SER 71 HG SER 71 13.869 3.166 -15.211
568 H GLU 72 H GLU 72 12.138 1.455 -15.640
569 HA GLU 72 HA GLU 72 12.725 -0.766 -15.700
570 HB2 GLU 72 2HB GLU 72 10.957 -0.831 -18.156
571 HB3 GLU 72 1HB GLU 72 11.378 -2.191 -17.115
572 HG2 GLU 72 2HG GLU 72 10.258 -1.060 -15.212
573 HG3 GLU 72 1HG GLU 72 9.797 0.260 -16.285
574 H GLY 73 H GLY 73 14.927 -0.235 -16.221
575 HA2 GLY 73 2HA GLY 73 15.961 -1.643 -18.428
576 HA3 GLY 73 1HA GLY 73 15.942 0.072 -18.825
577 H GLY 74 H GLY 74 17.164 -2.319 -16.531
578 HA2 GLY 74 2HA GLY 74 19.069 -2.368 -15.241
579 HA3 GLY 74 1HA GLY 74 19.735 -1.185 -16.365
580 H1 HOH 201 H2 HOH 77 5.399 7.212 -18.207
581 H2 HOH 201 H1 HOH 77 5.409 7.556 -16.732
Start of MODEL 20
1 H1 VAL 1 1H VAL 1 -1.641 16.779 -13.722
2 H2 VAL 1 2H VAL 1 -3.242 16.953 -14.260
3 HA VAL 1 HA VAL 1 -2.394 15.556 -11.781
4 HB VAL 1 HB VAL 1 -3.903 18.164 -12.126
5 HG11 VAL 1 2HG1 VAL 1 -3.371 18.356 -9.678
6 HG12 VAL 1 3HG1 VAL 1 -2.743 16.710 -9.730
7 HG13 VAL 1 1HG1 VAL 1 -4.450 17.013 -10.058
8 HG21 VAL 1 1HG2 VAL 1 -1.781 19.187 -11.251
9 HG22 VAL 1 2HG2 VAL 1 -1.605 18.487 -12.859
10 HG23 VAL 1 3HG2 VAL 1 -0.994 17.623 -11.447
11 H ASP 2 H ASP 2 -3.671 13.742 -12.081
12 HA ASP 2 HA ASP 2 -6.397 13.918 -11.396
13 HB2 ASP 2 2HB ASP 2 -7.282 13.007 -13.631
14 HB3 ASP 2 1HB ASP 2 -6.915 14.730 -13.554
15 H MET 3 H MET 3 -3.753 12.135 -12.828
16 HA MET 3 HA MET 3 -4.923 9.536 -12.503
17 HB2 MET 3 2HB MET 3 -3.055 10.135 -14.108
18 HB3 MET 3 1HB MET 3 -1.981 10.190 -12.711
19 HG2 MET 3 2HG MET 3 -1.805 7.977 -13.632
20 HG3 MET 3 1HG MET 3 -2.756 7.841 -12.153
21 HE1 MET 3 3HE MET 3 -4.021 5.708 -12.552
22 HE2 MET 3 1HE MET 3 -2.852 5.504 -13.863
23 HE3 MET 3 2HE MET 3 -4.561 5.174 -14.140
24 H SER 4 H SER 4 -2.461 11.385 -10.706
25 HA SER 4 HA SER 4 -2.246 9.409 -8.629
26 HB2 SER 4 2HB SER 4 -0.370 10.900 -9.174
27 HB3 SER 4 1HB SER 4 -1.333 12.296 -8.700
28 HG SER 4 HG SER 4 -1.295 10.323 -6.812
29 H ASN 5 H ASN 5 -4.659 11.528 -9.394
30 HA ASN 5 HA ASN 5 -5.389 12.750 -6.990
31 HB2 ASN 5 2HB ASN 5 -6.468 13.232 -9.152
32 HB3 ASN 5 1HB ASN 5 -7.208 11.633 -9.136
33 HD21 ASN 5 1HD2 ASN 5 -7.805 14.846 -8.338
34 HD22 ASN 5 2HD2 ASN 5 -9.050 14.602 -7.208
35 H VAL 6 H VAL 6 -7.264 10.019 -8.255
36 HA VAL 6 HA VAL 6 -8.007 9.195 -5.607
37 HB VAL 6 HB VAL 6 -9.569 8.932 -7.458
38 HG11 VAL 6 1HG1 VAL 6 -7.745 6.804 -8.591
39 HG12 VAL 6 2HG1 VAL 6 -7.659 8.481 -9.131
40 HG13 VAL 6 3HG1 VAL 6 -9.146 7.561 -9.347
41 HG21 VAL 6 3HG2 VAL 6 -9.511 7.289 -5.518
42 HG22 VAL 6 1HG2 VAL 6 -8.632 6.189 -6.580
43 HG23 VAL 6 2HG2 VAL 6 -10.275 6.683 -6.987
44 H VAL 7 H VAL 7 -6.939 7.872 -4.298
45 HA VAL 7 HA VAL 7 -4.601 6.413 -5.297
46 HB VAL 7 HB VAL 7 -4.131 6.029 -2.901
47 HG11 VAL 7 1HG1 VAL 7 -3.896 8.486 -2.289
48 HG12 VAL 7 2HG1 VAL 7 -4.767 8.856 -3.778
49 HG13 VAL 7 3HG1 VAL 7 -3.210 8.033 -3.849
50 HG21 VAL 7 3HG2 VAL 7 -6.436 5.902 -2.081
51 HG22 VAL 7 1HG2 VAL 7 -6.710 7.585 -2.524
52 HG23 VAL 7 2HG2 VAL 7 -5.579 7.189 -1.232
53 H LYS 8 H LYS 8 -4.284 4.220 -4.048
54 HA LYS 8 HA LYS 8 -6.648 2.567 -4.663
55 HB2 LYS 8 2HB LYS 8 -4.276 2.153 -5.632
56 HB3 LYS 8 1HB LYS 8 -3.884 1.530 -4.032
57 HG2 LYS 8 2HG LYS 8 -4.589 -0.416 -5.095
58 HG3 LYS 8 1HG LYS 8 -6.103 0.118 -4.364
59 HD2 LYS 8 2HD LYS 8 -6.802 1.138 -6.477
60 HD3 LYS 8 1HD LYS 8 -5.249 0.740 -7.212
61 HE2 LYS 8 2HE LYS 8 -6.974 -0.900 -7.855
62 HE3 LYS 8 1HE LYS 8 -5.706 -1.660 -6.890
63 HZ1 LYS 8 3HZ LYS 8 -8.023 -2.236 -6.225
64 HZ2 LYS 8 1HZ LYS 8 -8.237 -0.624 -5.741
65 HZ3 LYS 8 2HZ LYS 8 -7.072 -1.594 -4.972
66 H THR 9 H THR 9 -7.376 0.964 -3.185
67 HA THR 9 HA THR 9 -6.310 0.956 -0.473
68 HB THR 9 HB THR 9 -9.173 1.796 -0.963
69 HG1 THR 9 1HG THR 9 -7.749 3.626 0.294
70 HG21 THR 9 3HG2 THR 9 -8.828 0.563 1.122
71 HG22 THR 9 1HG2 THR 9 -9.096 2.270 1.476
72 HG23 THR 9 2HG2 THR 9 -7.464 1.604 1.534
73 H TYR 10 H TYR 10 -6.872 -0.841 0.703
74 HA TYR 10 HA TYR 10 -8.827 -2.735 -0.410
75 HB2 TYR 10 2HB TYR 10 -5.906 -3.323 0.093
76 HB3 TYR 10 1HB TYR 10 -7.126 -4.590 0.042
77 HD1 TYR 10 2HD TYR 10 -8.810 -4.348 -2.063
78 HD2 TYR 10 1HD TYR 10 -4.773 -2.880 -1.913
79 HE1 TYR 10 2HE TYR 10 -8.715 -4.356 -4.538
80 HE2 TYR 10 1HE TYR 10 -4.683 -2.883 -4.391
81 HH TYR 10 HH TYR 10 -6.451 -4.527 -6.287
82 H ASP 11 H ASP 11 -10.192 -2.522 1.313
83 HA ASP 11 HA ASP 11 -9.465 -2.252 4.002
84 HB2 ASP 11 2HB ASP 11 -11.961 -3.364 2.719
85 HB3 ASP 11 1HB ASP 11 -11.797 -3.085 4.451
86 H LEU 12 H LEU 12 -7.945 -3.674 4.723
87 HA LEU 12 HA LEU 12 -8.122 -6.516 4.314
88 HB2 LEU 12 2HB LEU 12 -6.240 -4.598 5.430
89 HB3 LEU 12 1HB LEU 12 -6.385 -5.983 6.501
90 HG LEU 12 HG LEU 12 -5.732 -7.510 4.756
91 HD11 LEU 12 1HD1 LEU 12 -6.363 -5.226 2.952
92 HD12 LEU 12 2HD1 LEU 12 -6.577 -6.959 2.701
93 HD13 LEU 12 3HD1 LEU 12 -4.992 -6.234 2.485
94 HD21 LEU 12 3HD2 LEU 12 -4.036 -5.083 5.217
95 HD22 LEU 12 1HD2 LEU 12 -3.523 -6.171 3.933
96 HD23 LEU 12 2HD2 LEU 12 -3.709 -6.777 5.574
97 H GLN 13 H GLN 13 -8.333 -8.089 6.042
98 HA GLN 13 HA GLN 13 -10.606 -7.484 7.716
99 HB2 GLN 13 2HB GLN 13 -8.936 -9.963 7.288
100 HB3 GLN 13 1HB GLN 13 -10.258 -9.896 8.457
101 HG2 GLN 13 2HG GLN 13 -11.834 -9.294 6.685
102 HG3 GLN 13 1HG GLN 13 -10.526 -9.264 5.503
103 HE21 GLN 13 1HE2 GLN 13 -10.755 -11.700 8.085
104 HE22 GLN 13 2HE2 GLN 13 -11.057 -13.012 7.045
105 H ASP 14 H ASP 14 -7.230 -7.270 8.071
106 HA ASP 14 HA ASP 14 -7.194 -7.748 10.941
107 HB2 ASP 14 2HB ASP 14 -4.817 -6.982 10.743
108 HB3 ASP 14 1HB ASP 14 -5.215 -8.355 9.707
109 H GLY 15 H GLY 15 -8.633 -5.433 9.346
110 HA2 GLY 15 2HA GLY 15 -9.457 -3.409 10.166
111 HA3 GLY 15 1HA GLY 15 -8.256 -3.467 11.455
112 H SER 16 H SER 16 -6.319 -4.088 9.046
113 HA SER 16 HA SER 16 -5.530 -1.299 8.695
114 HB2 SER 16 2HB SER 16 -3.946 -3.281 9.192
115 HB3 SER 16 1HB SER 16 -4.137 -3.684 7.485
116 HG SER 16 HG SER 16 -3.273 -1.731 6.936
117 H LYS 17 H LYS 17 -4.518 -0.943 6.352
118 HA LYS 17 HA LYS 17 -6.269 -1.965 4.235
119 HB2 LYS 17 2HB LYS 17 -5.925 1.017 4.565
120 HB3 LYS 17 1HB LYS 17 -7.043 0.151 3.511
121 HG2 LYS 17 2HG LYS 17 -8.187 -0.751 5.546
122 HG3 LYS 17 1HG LYS 17 -7.122 0.241 6.533
123 HD2 LYS 17 2HD LYS 17 -8.995 1.629 6.349
124 HD3 LYS 17 1HD LYS 17 -7.987 2.218 5.029
125 HE2 LYS 17 2HE LYS 17 -9.243 0.889 3.417
126 HE3 LYS 17 1HE LYS 17 -10.174 0.137 4.711
127 HZ1 LYS 17 3HZ LYS 17 -10.132 3.067 4.380
128 HZ2 LYS 17 1HZ LYS 17 -11.283 2.102 5.167
129 HZ3 LYS 17 2HZ LYS 17 -11.196 2.103 3.470
130 H VAL 18 H VAL 18 -5.112 -2.334 2.463
131 HA VAL 18 HA VAL 18 -2.327 -1.519 2.388
132 HB VAL 18 HB VAL 18 -3.612 -2.854 0.032
133 HG11 VAL 18 1HG1 VAL 18 -1.066 -3.487 1.530
134 HG12 VAL 18 2HG1 VAL 18 -1.152 -2.302 0.226
135 HG13 VAL 18 3HG1 VAL 18 -1.512 -3.998 -0.099
136 HG21 VAL 18 3HG2 VAL 18 -3.065 -4.271 2.650
137 HG22 VAL 18 1HG2 VAL 18 -3.514 -5.045 1.127
138 HG23 VAL 18 2HG2 VAL 18 -4.659 -3.990 1.952
139 H HIS 19 H HIS 19 -1.380 -0.428 0.572
140 HA HIS 19 HA HIS 19 -3.158 1.198 -1.111
141 HB2 HIS 19 2HB HIS 19 -2.867 2.911 0.414
142 HB3 HIS 19 1HB HIS 19 -1.417 2.188 1.097
143 HD1 HIS 19 1HD HIS 19 -2.531 4.221 -1.914
144 HD2 HIS 19 2HD HIS 19 0.971 3.229 0.122
145 HE1 HIS 19 1HE HIS 19 -0.689 5.637 -2.927
146 HE2 HIS 19 2HE HIS 19 1.451 5.045 -1.697
147 H VAL 20 H VAL 20 -2.491 0.798 -3.114
148 HA VAL 20 HA VAL 20 0.346 0.130 -3.559
149 HB VAL 20 HB VAL 20 -0.298 -1.344 -5.202
150 HG11 VAL 20 1HG1 VAL 20 -1.579 -1.678 -2.909
151 HG12 VAL 20 2HG1 VAL 20 -1.953 -2.702 -4.293
152 HG13 VAL 20 3HG1 VAL 20 -2.991 -1.348 -3.886
153 HG21 VAL 20 3HG2 VAL 20 -1.336 -0.023 -6.832
154 HG22 VAL 20 1HG2 VAL 20 -2.562 0.569 -5.713
155 HG23 VAL 20 2HG2 VAL 20 -2.653 -1.080 -6.327
156 H PHE 21 H PHE 21 1.575 1.144 -5.065
157 HA PHE 21 HA PHE 21 0.726 3.815 -5.830
158 HB2 PHE 21 2HB PHE 21 3.327 2.315 -6.203
159 HB3 PHE 21 1HB PHE 21 3.071 3.998 -6.661
160 HD1 PHE 21 1HD PHE 21 3.089 1.630 -3.794
161 HD2 PHE 21 2HD PHE 21 3.069 5.746 -5.028
162 HE1 PHE 21 1HE PHE 21 3.543 2.333 -1.460
163 HE2 PHE 21 2HE PHE 21 3.522 6.448 -2.693
164 HZ PHE 21 HZ PHE 21 3.759 4.741 -0.910
165 H LYS 22 H LYS 22 1.897 4.354 -8.153
166 HA LYS 22 HA LYS 22 0.150 3.151 -10.080
167 HB2 LYS 22 2HB LYS 22 2.492 5.038 -10.429
168 HB3 LYS 22 1HB LYS 22 1.347 4.600 -11.697
169 HG2 LYS 22 2HG LYS 22 -0.491 5.577 -10.463
170 HG3 LYS 22 1HG LYS 22 0.540 5.854 -9.060
171 HD2 LYS 22 2HD LYS 22 1.944 7.387 -10.415
172 HD3 LYS 22 1HD LYS 22 0.859 7.145 -11.786
173 HE2 LYS 22 2HE LYS 22 0.197 9.189 -10.679
174 HE3 LYS 22 1HE LYS 22 -1.031 7.970 -10.335
175 HZ1 LYS 22 3HZ LYS 22 -0.294 9.263 -8.368
176 HZ2 LYS 22 1HZ LYS 22 1.247 8.574 -8.533
177 HZ3 LYS 22 2HZ LYS 22 -0.092 7.584 -8.200
178 H ASP 23 H ASP 23 3.278 2.431 -8.882
179 HA ASP 23 HA ASP 23 4.239 1.051 -11.225
180 HB2 ASP 23 2HB ASP 23 5.180 0.957 -8.347
181 HB3 ASP 23 1HB ASP 23 6.036 0.269 -9.726
182 H GLY 24 H GLY 24 1.794 0.400 -9.152
183 HA2 GLY 24 2HA GLY 24 0.467 -1.512 -9.062
184 HA3 GLY 24 1HA GLY 24 1.742 -2.414 -9.871
185 H LYS 25 H LYS 25 3.587 -1.101 -7.702
186 HA LYS 25 HA LYS 25 3.690 -3.368 -5.985
187 HB2 LYS 25 2HB LYS 25 4.876 -0.589 -5.808
188 HB3 LYS 25 1HB LYS 25 5.197 -1.830 -4.603
189 HG2 LYS 25 2HG LYS 25 5.602 -2.509 -7.507
190 HG3 LYS 25 1HG LYS 25 6.816 -1.526 -6.692
191 HD2 LYS 25 2HD LYS 25 7.208 -3.236 -5.041
192 HD3 LYS 25 1HD LYS 25 5.834 -4.183 -5.612
193 HE2 LYS 25 2HE LYS 25 8.332 -3.556 -7.212
194 HE3 LYS 25 1HE LYS 25 7.947 -5.110 -6.473
195 HZ1 LYS 25 3HZ LYS 25 7.307 -5.198 -8.745
196 HZ2 LYS 25 1HZ LYS 25 6.459 -3.734 -8.638
197 HZ3 LYS 25 2HZ LYS 25 5.881 -5.110 -7.826
198 H MET 26 H MET 26 2.966 -3.631 -3.875
199 HA MET 26 HA MET 26 0.640 -2.055 -3.148
200 HB2 MET 26 2HB MET 26 1.808 -4.674 -2.335
201 HB3 MET 26 1HB MET 26 0.847 -3.835 -1.118
202 HG2 MET 26 2HG MET 26 -1.080 -3.843 -2.462
203 HG3 MET 26 1HG MET 26 -0.174 -4.190 -3.934
204 HE1 MET 26 3HE MET 26 -1.176 -7.659 -4.340
205 HE2 MET 26 1HE MET 26 0.136 -6.594 -4.869
206 HE3 MET 26 2HE MET 26 -1.514 -5.979 -4.754
207 H GLY 27 H GLY 27 0.480 -1.896 -0.555
208 HA2 GLY 27 2HA GLY 27 2.927 -0.938 0.688
209 HA3 GLY 27 1HA GLY 27 1.750 0.320 0.318
210 H MET 28 H MET 28 2.798 -1.632 2.720
211 HA MET 28 HA MET 28 0.185 -2.196 3.922
212 HB2 MET 28 2HB MET 28 2.208 -3.793 3.916
213 HB3 MET 28 1HB MET 28 2.887 -2.739 5.150
214 HG2 MET 28 2HG MET 28 1.712 -4.508 6.280
215 HG3 MET 28 1HG MET 28 0.766 -3.037 6.465
216 HE1 MET 28 3HE MET 28 -2.062 -5.371 6.438
217 HE2 MET 28 1HE MET 28 -2.008 -3.605 6.368
218 HE3 MET 28 2HE MET 28 -0.832 -4.491 7.334
219 H GLU 29 H GLU 29 -0.512 -0.048 4.366
220 HA GLU 29 HA GLU 29 1.061 1.429 6.401
221 HB2 GLU 29 2HB GLU 29 -0.671 3.276 5.752
222 HB3 GLU 29 1HB GLU 29 0.654 2.920 4.646
223 HG2 GLU 29 2HG GLU 29 -0.755 1.563 3.255
224 HG3 GLU 29 1HG GLU 29 -2.063 1.607 4.434
225 H ASN 30 H ASN 30 0.454 0.895 8.404
226 HA ASN 30 HA ASN 30 -2.133 -0.144 9.041
227 HB2 ASN 30 2HB ASN 30 -1.358 -0.050 11.367
228 HB3 ASN 30 1HB ASN 30 -0.127 -0.761 10.320
229 HD21 ASN 30 1HD2 ASN 30 -1.065 2.587 11.319
230 HD22 ASN 30 2HD2 ASN 30 0.533 3.086 11.630
231 H LYS 31 H LYS 31 -3.853 0.830 10.049
232 HA LYS 31 HA LYS 31 -4.316 3.560 9.520
233 HB2 LYS 31 2HB LYS 31 -6.431 3.264 10.539
234 HB3 LYS 31 1HB LYS 31 -6.047 1.705 9.809
235 HG2 LYS 31 2HG LYS 31 -5.772 2.451 12.744
236 HG3 LYS 31 1HG LYS 31 -6.924 1.321 12.041
237 HD2 LYS 31 2HD LYS 31 -4.915 -0.011 11.202
238 HD3 LYS 31 1HD LYS 31 -3.926 1.002 12.255
239 HE2 LYS 31 2HE LYS 31 -5.325 0.328 14.189
240 HE3 LYS 31 1HE LYS 31 -6.255 -0.730 13.127
241 HZ1 LYS 31 3HZ LYS 31 -4.485 -2.146 12.838
242 HZ2 LYS 31 1HZ LYS 31 -4.280 -1.688 14.457
243 HZ3 LYS 31 2HZ LYS 31 -3.326 -0.976 13.246
244 H PHE 32 H PHE 32 -2.328 2.272 11.820
245 HA PHE 32 HA PHE 32 -2.966 4.062 14.002
246 HB2 PHE 32 2HB PHE 32 -1.838 1.710 14.110
247 HB3 PHE 32 1HB PHE 32 -0.352 2.583 13.728
248 HD1 PHE 32 1HD PHE 32 -3.276 2.644 16.069
249 HD2 PHE 32 2HD PHE 32 0.860 3.636 15.453
250 HE1 PHE 32 1HE PHE 32 -3.088 3.340 18.443
251 HE2 PHE 32 2HE PHE 32 1.046 4.331 17.827
252 HZ PHE 32 HZ PHE 32 -0.928 4.184 19.321
253 H GLY 33 H GLY 33 -2.079 4.951 11.162
254 HA2 GLY 33 2HA GLY 33 -1.037 6.841 10.344
255 HA3 GLY 33 1HA GLY 33 -0.691 7.299 12.011
256 H LYS 34 H LYS 34 0.310 4.170 11.006
257 HA LYS 34 HA LYS 34 3.063 5.065 10.429
258 HB2 LYS 34 2HB LYS 34 2.264 3.039 12.533
259 HB3 LYS 34 1HB LYS 34 3.912 3.265 11.947
260 HG2 LYS 34 2HG LYS 34 3.812 5.647 12.645
261 HG3 LYS 34 1HG LYS 34 2.192 5.374 13.287
262 HD2 LYS 34 2HD LYS 34 3.195 3.538 14.730
263 HD3 LYS 34 1HD LYS 34 4.782 4.125 14.231
264 HE2 LYS 34 2HE LYS 34 2.657 5.817 15.579
265 HE3 LYS 34 1HE LYS 34 4.056 5.119 16.393
266 HZ1 LYS 34 3HZ LYS 34 3.901 7.384 14.595
267 HZ2 LYS 34 1HZ LYS 34 5.215 6.344 14.326
268 HZ3 LYS 34 2HZ LYS 34 5.000 7.063 15.851
269 H SER 35 H SER 35 4.383 2.882 9.988
270 HA SER 35 HA SER 35 2.821 1.403 7.949
271 HB2 SER 35 2HB SER 35 4.863 2.766 7.268
272 HB3 SER 35 1HB SER 35 5.827 1.589 8.155
273 HG SER 35 HG SER 35 4.294 0.115 6.747
274 H MET 36 H MET 36 3.675 -0.858 7.553
275 HA MET 36 HA MET 36 4.649 -2.212 9.978
276 HB2 MET 36 2HB MET 36 1.996 -2.694 8.624
277 HB3 MET 36 1HB MET 36 2.808 -3.985 9.511
278 HG2 MET 36 2HG MET 36 2.236 -1.260 10.705
279 HG3 MET 36 1HG MET 36 1.150 -2.642 10.875
280 HE1 MET 36 3HE MET 36 2.338 -1.121 13.385
281 HE2 MET 36 1HE MET 36 2.616 -2.546 14.395
282 HE3 MET 36 2HE MET 36 1.198 -2.464 13.352
283 H ASN 37 H ASN 37 6.396 -3.236 9.284
284 HA ASN 37 HA ASN 37 6.898 -3.918 6.580
285 HB2 ASN 37 2HB ASN 37 8.739 -3.523 8.098
286 HB3 ASN 37 1HB ASN 37 8.215 -4.842 9.142
287 HD21 ASN 37 1HD2 ASN 37 7.693 -5.675 5.884
288 HD22 ASN 37 2HD2 ASN 37 9.107 -6.592 5.645
289 H MET 38 H MET 38 5.147 -5.166 5.844
290 HA MET 38 HA MET 38 4.648 -7.759 7.104
291 HB2 MET 38 2HB MET 38 2.687 -6.570 6.429
292 HB3 MET 38 1HB MET 38 3.321 -6.320 4.801
293 HG2 MET 38 2HG MET 38 3.169 -8.663 4.305
294 HG3 MET 38 1HG MET 38 2.883 -9.061 5.992
295 HE1 MET 38 3HE MET 38 -0.730 -8.493 6.652
296 HE2 MET 38 1HE MET 38 0.795 -7.888 7.318
297 HE3 MET 38 2HE MET 38 0.640 -9.585 6.868
298 HA PRO 39 HA PRO 39 7.890 -9.567 4.447
299 HB2 PRO 39 2HB PRO 39 6.125 -11.955 4.935
300 HB3 PRO 39 1HB PRO 39 7.899 -11.839 4.979
301 HG2 PRO 39 2HG PRO 39 6.482 -11.873 7.227
302 HG3 PRO 39 1HG PRO 39 7.913 -10.839 7.064
303 HD2 PRO 39 2HD PRO 39 5.033 -10.058 7.089
304 HD3 PRO 39 1HD PRO 39 6.455 -9.123 7.578
305 H GLU 40 H GLU 40 8.008 -10.339 2.292
306 HA GLU 40 HA GLU 40 5.753 -9.645 0.639
307 HB2 GLU 40 2HB GLU 40 8.059 -9.135 -0.059
308 HB3 GLU 40 1HB GLU 40 8.427 -10.861 -0.087
309 HG2 GLU 40 2HG GLU 40 6.841 -11.250 -1.851
310 HG3 GLU 40 1HG GLU 40 6.214 -9.606 -1.727
311 H GLY 41 H GLY 41 4.191 -11.212 1.335
312 HA2 GLY 41 2HA GLY 41 3.602 -13.290 -0.249
313 HA3 GLY 41 1HA GLY 41 4.738 -14.038 0.868
314 H LYS 42 H LYS 42 3.568 -11.901 2.862
315 HA LYS 42 HA LYS 42 1.809 -13.706 4.181
316 HB2 LYS 42 2HB LYS 42 2.811 -10.942 4.619
317 HB3 LYS 42 1HB LYS 42 1.293 -11.332 5.420
318 HG2 LYS 42 2HG LYS 42 3.589 -13.276 5.633
319 HG3 LYS 42 1HG LYS 42 3.619 -11.816 6.617
320 HD2 LYS 42 2HD LYS 42 1.642 -12.385 7.763
321 HD3 LYS 42 1HD LYS 42 1.173 -13.576 6.548
322 HE2 LYS 42 2HE LYS 42 3.087 -14.995 7.204
323 HE3 LYS 42 1HE LYS 42 3.550 -13.806 8.423
324 HZ1 LYS 42 3HZ LYS 42 2.214 -14.925 9.781
325 HZ2 LYS 42 1HZ LYS 42 1.505 -15.806 8.516
326 HZ3 LYS 42 2HZ LYS 42 0.912 -14.264 8.914
327 H VAL 43 H VAL 43 0.364 -14.178 2.488
328 HA VAL 43 HA VAL 43 -1.240 -12.661 0.956
329 HB VAL 43 HB VAL 43 -2.313 -14.958 2.589
330 HG11 VAL 43 1HG1 VAL 43 -3.988 -13.743 1.269
331 HG12 VAL 43 2HG1 VAL 43 -3.680 -15.322 0.546
332 HG13 VAL 43 3HG1 VAL 43 -2.973 -13.873 -0.166
333 HG21 VAL 43 3HG2 VAL 43 -1.507 -16.306 0.579
334 HG22 VAL 43 1HG2 VAL 43 -0.237 -15.711 1.648
335 HG23 VAL 43 2HG2 VAL 43 -0.561 -14.890 0.120
336 H MET 44 H MET 44 -2.708 -11.099 1.176
337 HA MET 44 HA MET 44 -3.918 -10.648 3.855
338 HB2 MET 44 2HB MET 44 -3.690 -8.591 1.663
339 HB3 MET 44 1HB MET 44 -4.047 -8.333 3.354
340 HG2 MET 44 2HG MET 44 -1.793 -8.830 3.987
341 HG3 MET 44 1HG MET 44 -1.407 -9.448 2.382
342 HE1 MET 44 3HE MET 44 -2.628 -7.052 0.298
343 HE2 MET 44 1HE MET 44 -1.387 -8.308 0.366
344 HE3 MET 44 2HE MET 44 -0.933 -6.626 0.113
345 H GLU 45 H GLU 45 -6.128 -10.641 3.979
346 HA GLU 45 HA GLU 45 -7.626 -11.081 1.444
347 HB2 GLU 45 2HB GLU 45 -7.524 -13.028 3.018
348 HB3 GLU 45 1HB GLU 45 -8.371 -12.043 4.214
349 HG2 GLU 45 2HG GLU 45 -10.274 -11.781 2.719
350 HG3 GLU 45 1HG GLU 45 -9.419 -12.629 1.429
351 H THR 46 H THR 46 -8.983 -9.514 0.896
352 HA THR 46 HA THR 46 -9.635 -7.403 2.762
353 HB THR 46 HB THR 46 -10.730 -6.341 0.892
354 HG1 THR 46 1HG THR 46 -11.580 -7.499 -0.619
355 HG21 THR 46 3HG2 THR 46 -8.874 -6.202 -0.641
356 HG22 THR 46 1HG2 THR 46 -8.283 -7.787 -0.148
357 HG23 THR 46 2HG2 THR 46 -8.214 -6.431 0.977
358 H ARG 47 H ARG 47 -11.861 -6.703 3.165
359 HA ARG 47 HA ARG 47 -13.452 -8.693 4.293
360 HB2 ARG 47 2HB ARG 47 -15.243 -6.978 4.349
361 HB3 ARG 47 1HB ARG 47 -13.693 -6.372 4.939
362 HG2 ARG 47 2HG ARG 47 -13.243 -5.328 2.771
363 HG3 ARG 47 1HG ARG 47 -14.748 -5.981 2.122
364 HD2 ARG 47 2HD ARG 47 -15.287 -3.762 2.742
365 HD3 ARG 47 1HD ARG 47 -15.915 -4.754 4.053
366 HE ARG 47 HE ARG 47 -13.309 -4.032 4.754
367 HH11 ARG 47 1HH2 ARG 47 -16.359 -2.544 4.074
368 HH12 ARG 47 2HH2 ARG 47 -16.090 -1.194 5.127
369 HH21 ARG 47 1HH1 ARG 47 -12.951 -2.266 6.136
370 HH22 ARG 47 2HH1 ARG 47 -14.161 -1.037 6.294
371 H ASP 48 H ASP 48 -13.397 -7.405 1.038
372 HA ASP 48 HA ASP 48 -15.868 -8.640 0.225
373 HB2 ASP 48 2HB ASP 48 -14.990 -6.624 -0.899
374 HB3 ASP 48 1HB ASP 48 -13.589 -7.549 -1.446
375 H GLY 49 H GLY 49 -12.889 -9.860 0.999
376 HA2 GLY 49 2HA GLY 49 -12.160 -12.066 0.884
377 HA3 GLY 49 1HA GLY 49 -13.482 -12.419 -0.227
378 H THR 50 H THR 50 -11.267 -9.749 -0.737
379 HA THR 50 HA THR 50 -10.457 -10.911 -3.292
380 HB THR 50 HB THR 50 -9.508 -8.284 -2.152
381 HG1 THR 50 1HG THR 50 -11.652 -8.208 -3.837
382 HG21 THR 50 3HG2 THR 50 -8.440 -9.124 -4.211
383 HG22 THR 50 1HG2 THR 50 -9.403 -7.681 -4.536
384 HG23 THR 50 2HG2 THR 50 -10.026 -9.273 -4.969
385 H LYS 51 H LYS 51 -8.758 -12.226 -3.389
386 HA LYS 51 HA LYS 51 -6.813 -12.361 -1.270
387 HB2 LYS 51 2HB LYS 51 -7.454 -14.401 -2.419
388 HB3 LYS 51 1HB LYS 51 -6.946 -13.727 -3.970
389 HG2 LYS 51 2HG LYS 51 -4.644 -13.708 -3.310
390 HG3 LYS 51 1HG LYS 51 -5.057 -14.038 -1.626
391 HD2 LYS 51 2HD LYS 51 -5.913 -16.255 -2.251
392 HD3 LYS 51 1HD LYS 51 -5.543 -15.931 -3.946
393 HE2 LYS 51 2HE LYS 51 -3.513 -16.007 -1.694
394 HE3 LYS 51 1HE LYS 51 -3.764 -17.283 -2.885
395 HZ1 LYS 51 3HZ LYS 51 -2.807 -14.520 -3.369
396 HZ2 LYS 51 1HZ LYS 51 -3.299 -15.559 -4.615
397 HZ3 LYS 51 2HZ LYS 51 -1.970 -15.974 -3.642
398 H ILE 52 H ILE 52 -5.372 -10.777 -1.074
399 HA ILE 52 HA ILE 52 -3.842 -9.943 -3.474
400 HB ILE 52 HB ILE 52 -3.652 -7.689 -2.143
401 HG12 ILE 52 2HG1 ILE 52 -6.334 -8.659 -1.132
402 HG13 ILE 52 1HG1 ILE 52 -4.877 -8.728 -0.163
403 HG21 ILE 52 1HG2 ILE 52 -4.824 -8.007 -4.325
404 HG22 ILE 52 2HG2 ILE 52 -5.617 -6.824 -3.282
405 HG23 ILE 52 3HG2 ILE 52 -6.281 -8.452 -3.433
406 HD11 ILE 52 3HD1 ILE 52 -6.220 -6.277 -1.298
407 HD12 ILE 52 1HD1 ILE 52 -4.596 -6.237 -0.620
408 HD13 ILE 52 2HD1 ILE 52 -5.964 -6.668 0.400
409 H ILE 53 H ILE 53 -1.790 -10.455 -3.271
410 HA ILE 53 HA ILE 53 -0.675 -11.149 -0.661
411 HB ILE 53 HB ILE 53 0.589 -11.325 -3.401
412 HG12 ILE 53 2HG1 ILE 53 -0.778 -13.493 -1.774
413 HG13 ILE 53 1HG1 ILE 53 -1.534 -12.659 -3.135
414 HG21 ILE 53 1HG2 ILE 53 2.209 -11.354 -1.568
415 HG22 ILE 53 2HG2 ILE 53 2.057 -12.976 -2.242
416 HG23 ILE 53 3HG2 ILE 53 1.263 -12.575 -0.719
417 HD11 ILE 53 3HD1 ILE 53 -0.569 -14.739 -3.942
418 HD12 ILE 53 1HD1 ILE 53 0.989 -14.338 -3.220
419 HD13 ILE 53 2HD1 ILE 53 0.377 -13.393 -4.579
420 H MET 54 H MET 54 0.890 -10.069 0.398
421 HA MET 54 HA MET 54 1.287 -7.323 -0.090
422 HB2 MET 54 2HB MET 54 1.594 -8.493 2.118
423 HB3 MET 54 1HB MET 54 3.106 -9.155 1.494
424 HG2 MET 54 2HG MET 54 3.745 -7.190 2.669
425 HG3 MET 54 1HG MET 54 3.768 -6.727 0.979
426 HE1 MET 54 3HE MET 54 3.754 -4.178 1.917
427 HE2 MET 54 1HE MET 54 2.222 -3.450 1.415
428 HE3 MET 54 2HE MET 54 3.055 -4.583 0.352
429 H LYS 55 H LYS 55 1.803 -7.392 -2.376
430 HA LYS 55 HA LYS 55 4.231 -8.553 -3.338
431 HB2 LYS 55 2HB LYS 55 2.196 -7.948 -4.728
432 HB3 LYS 55 1HB LYS 55 2.697 -6.262 -4.580
433 HG2 LYS 55 2HG LYS 55 4.942 -6.939 -5.504
434 HG3 LYS 55 1HG LYS 55 4.265 -8.530 -5.838
435 HD2 LYS 55 2HD LYS 55 3.244 -5.893 -6.939
436 HD3 LYS 55 1HD LYS 55 4.142 -7.111 -7.843
437 HE2 LYS 55 2HE LYS 55 1.328 -7.251 -6.779
438 HE3 LYS 55 1HE LYS 55 1.912 -7.583 -8.407
439 HZ1 LYS 55 3HZ LYS 55 2.190 -9.249 -5.982
440 HZ2 LYS 55 1HZ LYS 55 3.194 -9.475 -7.330
441 HZ3 LYS 55 2HZ LYS 55 1.514 -9.667 -7.484
442 H GLY 56 H GLY 56 3.318 -5.130 -3.119
443 HA2 GLY 56 2HA GLY 56 6.000 -4.191 -3.273
444 HA3 GLY 56 1HA GLY 56 4.583 -3.230 -2.865
445 H ASN 57 H ASN 57 6.374 -5.932 -1.336
446 HA ASN 57 HA ASN 57 5.792 -5.229 1.306
447 HB2 ASN 57 2HB ASN 57 6.746 -7.393 0.784
448 HB3 ASN 57 1HB ASN 57 8.218 -6.639 0.167
449 HD21 ASN 57 1HD2 ASN 57 6.552 -5.461 3.074
450 HD22 ASN 57 2HD2 ASN 57 7.770 -5.931 4.168
451 H GLU 58 H GLU 58 7.617 -3.551 -0.960
452 HA GLU 58 HA GLU 58 9.547 -2.381 0.840
453 HB2 GLU 58 2HB GLU 58 8.680 -1.448 -1.906
454 HB3 GLU 58 1HB GLU 58 10.143 -0.970 -1.044
455 HG2 GLU 58 2HG GLU 58 10.952 -3.285 -1.088
456 HG3 GLU 58 1HG GLU 58 9.474 -3.802 -1.897
457 H ILE 59 H ILE 59 7.937 -1.746 2.478
458 HA ILE 59 HA ILE 59 6.021 0.305 1.903
459 HB ILE 59 HB ILE 59 5.942 0.486 4.432
460 HG12 ILE 59 2HG1 ILE 59 7.803 -1.904 4.274
461 HG13 ILE 59 1HG1 ILE 59 8.344 -0.279 4.704
462 HG21 ILE 59 1HG2 ILE 59 4.386 -0.962 3.284
463 HG22 ILE 59 2HG2 ILE 59 5.003 -1.845 4.680
464 HG23 ILE 59 3HG2 ILE 59 5.622 -2.202 3.067
465 HD11 ILE 59 3HD1 ILE 59 6.126 -1.741 6.162
466 HD12 ILE 59 1HD1 ILE 59 6.915 -0.240 6.647
467 HD13 ILE 59 2HD1 ILE 59 7.812 -1.758 6.683
468 H PHE 60 H PHE 60 9.380 0.308 2.287
469 HA PHE 60 HA PHE 60 9.885 2.702 3.645
470 HB2 PHE 60 2HB PHE 60 11.412 1.426 1.364
471 HB3 PHE 60 1HB PHE 60 12.027 2.725 2.386
472 HD1 PHE 60 1HD PHE 60 11.085 -0.832 2.249
473 HD2 PHE 60 2HD PHE 60 12.591 2.333 4.731
474 HE1 PHE 60 1HE PHE 60 11.787 -2.497 3.947
475 HE2 PHE 60 2HE PHE 60 13.293 0.667 6.430
476 HZ PHE 60 HZ PHE 60 12.890 -1.749 6.038
477 H ARG 61 H ARG 61 8.777 2.110 0.385
478 HA ARG 61 HA ARG 61 9.401 4.577 -0.801
479 HB2 ARG 61 2HB ARG 61 7.241 2.531 -1.281
480 HB3 ARG 61 1HB ARG 61 7.272 4.033 -2.205
481 HG2 ARG 61 2HG ARG 61 8.482 2.142 -3.329
482 HG3 ARG 61 1HG ARG 61 9.500 3.550 -3.031
483 HD2 ARG 61 2HD ARG 61 10.555 2.517 -1.162
484 HD3 ARG 61 1HD ARG 61 9.345 1.238 -1.092
485 HE ARG 61 HE ARG 61 10.414 0.878 -3.550
486 HH11 ARG 61 1HH2 ARG 61 11.782 1.357 -0.408
487 HH12 ARG 61 2HH2 ARG 61 13.202 0.418 -0.731
488 HH21 ARG 61 1HH1 ARG 61 12.272 -0.355 -3.981
489 HH22 ARG 61 2HH1 ARG 61 13.479 -0.552 -2.755
490 H LEU 62 H LEU 62 6.432 3.558 0.902
491 HA LEU 62 HA LEU 62 5.010 5.944 0.672
492 HB2 LEU 62 2HB LEU 62 4.411 3.572 1.726
493 HB3 LEU 62 1HB LEU 62 4.846 4.375 3.230
494 HG LEU 62 HG LEU 62 2.735 5.265 1.243
495 HD11 LEU 62 1HD1 LEU 62 1.247 4.937 3.242
496 HD12 LEU 62 2HD1 LEU 62 2.627 4.247 4.096
497 HD13 LEU 62 3HD1 LEU 62 1.987 3.445 2.662
498 HD21 LEU 62 3HD2 LEU 62 3.933 6.617 3.667
499 HD22 LEU 62 1HD2 LEU 62 2.297 6.993 3.126
500 HD23 LEU 62 2HD2 LEU 62 3.666 7.285 2.058
501 H ASP 63 H ASP 63 7.184 4.900 3.306
502 HA ASP 63 HA ASP 63 7.089 7.517 4.558
503 HB2 ASP 63 2HB ASP 63 8.672 6.533 6.168
504 HB3 ASP 63 1HB ASP 63 7.257 5.507 5.947
505 H GLU 64 H GLU 64 8.060 7.467 1.840
506 HA GLU 64 HA GLU 64 10.383 9.077 2.148
507 HB2 GLU 64 2HB GLU 64 11.361 6.777 2.473
508 HB3 GLU 64 1HB GLU 64 10.880 6.409 0.817
509 HG2 GLU 64 2HG GLU 64 12.208 8.360 0.029
510 HG3 GLU 64 1HG GLU 64 12.744 8.636 1.686
511 H ALA 65 H ALA 65 8.904 10.386 0.921
512 HA ALA 65 HA ALA 65 7.931 11.217 -1.002
513 HB1 ALA 65 1HB ALA 65 9.455 11.481 -2.799
514 HB2 ALA 65 2HB ALA 65 10.318 9.999 -2.390
515 HB3 ALA 65 3HB ALA 65 10.458 11.419 -1.351
516 H LEU 66 H LEU 66 8.065 10.346 -3.659
517 HA LEU 66 HA LEU 66 7.340 7.585 -3.893
518 HB2 LEU 66 2HB LEU 66 4.924 8.292 -4.695
519 HB3 LEU 66 1HB LEU 66 5.242 8.016 -2.984
520 HG LEU 66 HG LEU 66 5.545 10.404 -2.602
521 HD11 LEU 66 1HD1 LEU 66 6.552 11.188 -4.605
522 HD12 LEU 66 2HD1 LEU 66 4.962 11.950 -4.580
523 HD13 LEU 66 3HD1 LEU 66 5.251 10.544 -5.607
524 HD21 LEU 66 3HD2 LEU 66 3.269 9.694 -2.406
525 HD22 LEU 66 1HD2 LEU 66 3.067 9.624 -4.156
526 HD23 LEU 66 2HD2 LEU 66 3.226 11.184 -3.349
527 H ARG 67 H ARG 67 6.164 7.296 -6.145
528 HA ARG 67 HA ARG 67 7.887 8.614 -8.088
529 HB2 ARG 67 2HB ARG 67 7.440 6.161 -8.169
530 HB3 ARG 67 1HB ARG 67 5.748 6.515 -8.522
531 HG2 ARG 67 2HG ARG 67 6.318 7.600 -10.588
532 HG3 ARG 67 1HG ARG 67 8.039 7.572 -10.197
533 HD2 ARG 67 2HD ARG 67 7.948 5.073 -10.202
534 HD3 ARG 67 1HD ARG 67 6.272 5.169 -10.736
535 HE ARG 67 HE ARG 67 7.752 6.695 -12.531
536 HH11 ARG 67 1HH2 ARG 67 7.612 3.428 -11.395
537 HH12 ARG 67 2HH2 ARG 67 8.162 2.740 -12.886
538 HH21 ARG 67 1HH1 ARG 67 8.472 5.799 -14.490
539 HH22 ARG 67 2HH1 ARG 67 8.648 4.082 -14.639
540 H LYS 68 H LYS 68 7.314 10.470 -9.006
541 HA LYS 68 HA LYS 68 4.595 11.434 -8.919
542 HB2 LYS 68 2HB LYS 68 7.035 12.567 -10.315
543 HB3 LYS 68 1HB LYS 68 5.508 13.411 -10.066
544 HG2 LYS 68 2HG LYS 68 6.940 12.252 -7.682
545 HG3 LYS 68 1HG LYS 68 7.523 13.763 -8.372
546 HD2 LYS 68 2HD LYS 68 4.581 13.467 -7.787
547 HD3 LYS 68 1HD LYS 68 5.691 13.799 -6.461
548 HE2 LYS 68 2HE LYS 68 5.401 15.468 -8.979
549 HE3 LYS 68 1HE LYS 68 4.796 15.897 -7.381
550 HZ1 LYS 68 3HZ LYS 68 7.614 15.607 -8.241
551 HZ2 LYS 68 1HZ LYS 68 7.162 15.658 -6.607
552 HZ3 LYS 68 2HZ LYS 68 6.844 16.988 -7.616
553 H GLY 69 H GLY 69 3.495 9.823 -10.149
554 HA2 GLY 69 2HA GLY 69 4.127 9.038 -12.765
555 HA3 GLY 69 1HA GLY 69 2.512 9.010 -12.063
556 H HIS 70 H HIS 70 1.037 10.302 -12.959
557 HA HIS 70 HA HIS 70 0.086 11.901 -14.308
558 HB2 HIS 70 2HB HIS 70 0.986 13.387 -12.552
559 HB3 HIS 70 1HB HIS 70 2.504 13.508 -13.445
560 HD2 HIS 70 2HD HIS 70 2.455 15.876 -14.847
561 HE1 HIS 70 1HE HIS 70 -1.633 15.889 -15.899
562 HE2 HIS 70 2HE HIS 70 0.563 17.143 -16.126
563 H SER 71 H SER 71 0.881 10.256 -16.002
564 HA SER 71 HA SER 71 1.864 11.704 -18.239
565 HB2 SER 71 2HB SER 71 4.045 11.481 -17.277
566 HB3 SER 71 1HB SER 71 3.767 9.787 -16.886
567 HG SER 71 HG SER 71 3.536 10.677 -19.542
568 H GLU 72 H GLU 72 2.652 9.851 -19.960
569 HA GLU 72 HA GLU 72 0.320 8.415 -20.592
570 HB2 GLU 72 2HB GLU 72 3.155 7.936 -21.543
571 HB3 GLU 72 1HB GLU 72 1.692 7.319 -22.314
572 HG2 GLU 72 2HG GLU 72 0.906 9.669 -22.610
573 HG3 GLU 72 1HG GLU 72 2.439 10.234 -21.950
574 H GLY 73 H GLY 73 3.265 7.471 -18.893
575 HA2 GLY 73 2HA GLY 73 2.012 5.386 -17.460
576 HA3 GLY 73 1HA GLY 73 2.889 4.696 -18.823
577 H GLY 74 H GLY 74 5.112 4.634 -18.795
578 HA2 GLY 74 2HA GLY 74 6.797 6.125 -17.103
579 HA3 GLY 74 1HA GLY 74 6.429 4.596 -16.311
580 H1 HOH 201 H2 HOH 77 -3.219 12.371 -15.975
581 H2 HOH 201 H1 HOH 77 -2.279 11.895 -14.888
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